A0A077ZB43_TRITR Loading...

Zinc metalloproteinase

AlphaFold DB , UniProt , Accession A0A077ZB43, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 565 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	40.2	Very low	48	Very low	209 Å²	209	88.7 Å²	88.7	100%	1.03	44%	0.441	S	S	*	.				0	-52.3	0	-119.6	172.1	85.6	0	0	112.7	M3 A4 M5	M1-M3 PolarHBondContact O-N 3.48Å; M1-A4 PolarHBondContact O-N 3.3Å; M1-M5 PolarHBondContact O-N 3.35Å; M1-M5 VanDerWaalsContact O-N 3.13Å
2	H	45.4	Very low	48.1	Very low	158 Å²	158	87.1 Å²	87.1	73%	0.731	44%	0.435	S	S	*	.	H	α-helix	trans	-57.7	-44.1	-179.3	-81.9	-118.8	0	0	0	114.1	M5 I6	H2-M5 PolarHBondContact O-N 2.89Å; H2-I6 VanDerWaalsContact O-CG1 3.25Å; H2-I6 WeakPolarHBondContact O-CG1 3.44Å; H2-I6 PolarHBondContact O-N 2.92Å
3	M	46.5	Very low	48.2	Very low	86 Å²	86	83.4 Å²	83.4	42%	0.424	43%	0.432	S	S	.	.	H	α-helix	trans	-63.6	-46.2	179.5	-79.9	-72	139.1	0	0	113.2	M1 M5 I6 Q7 P63	M1-M3 PolarHBondContact O-N 3.48Å; M3-M5 VanDerWaalsContact C-N 3.28Å; M3-M5 PolarHBondContact O-N 2.92Å; M3-I6 HydrophobicContact CE-CD1 4.16Å; M3-I6 PolarHBondContact O-N 2.95Å; M3-Q7 WeakPolarHBondContact O-CB 3.17Å; M3-Q7 WeakPolarHBondContact O-CG 3.38Å; M3-Q7 PolarHBondContact O-N 3.22Å; M3-P63 HydrophobicContact CE-CG 3.91Å; M3-P63 HydrophobicContact SD-CG 4.09Å
4	A	44.2	Very low	48	Very low	27 Å²	27	78.4 Å²	78.4	22%	0.223	41%	0.41	C	S	.	.	H	α-helix	trans	-61.6	-36.9	176.2	0	0	0	0	0	112.2	M1 Q7 K8 L54	M1-A4 PolarHBondContact O-N 3.3Å; A4-Q7 PolarHBondContact O-N 3.1Å; A4-K8 WeakPolarHBondContact O-CB 3.06Å; A4-K8 PolarHBondContact O-N 3.08Å; A4-L54 HydrophobicContact CB-CD2 4.44Å
5	M	52.9	Low	47.7	Very low	129 Å²	129	73.9 Å²	73.9	64%	0.635	39%	0.385	S	S	*	.	H	α-helix	trans	-67.5	-42	175.5	-168.7	174.6	-176.9	0	0	112.1	M1 H2 M3 K8 I9	M1-M5 PolarHBondContact O-N 3.35Å; M1-M5 VanDerWaalsContact O-N 3.13Å; H2-M5 PolarHBondContact O-N 2.89Å; M3-M5 VanDerWaalsContact C-N 3.28Å; M3-M5 PolarHBondContact O-N 2.92Å; M5-K8 PolarHBondContact O-N 3.22Å; M5-I9 HydrophobicContact CG-CD1 4.46Å; M5-I9 WeakPolarHBondContact O-CG1 3.01Å; M5-I9 PolarHBondContact O-N 3.49Å
6	I	48.6	Very low	47.5	Very low	73 Å²	73	78.3 Å²	78.3	37%	0.374	40%	0.403	S	S	.	.	H	α-helix	trans	-63.6	-45.3	174.7	-68.8	165.9	0	0	0	110.4	H2 M3 K8 I9 L10	H2-I6 VanDerWaalsContact O-CG1 3.25Å; H2-I6 WeakPolarHBondContact O-CG1 3.44Å; H2-I6 PolarHBondContact O-N 2.92Å; M3-I6 HydrophobicContact CE-CD1 4.16Å; M3-I6 PolarHBondContact O-N 2.95Å; I6-K8 VanDerWaalsContact C-N 3.31Å; I6-K8 PolarHBondContact O-N 3.15Å; I6-I9 PolarHBondContact O-N 2.79Å; I6-L10 HydrophobicContact CG2-CD1 3.58Å; I6-L10 HydrophobicContact CG2-CG 4.31Å; I6-L10 WeakPolarHBondContact O-CB 3.27Å; I6-L10 VanDerWaalsContact O-CG 3.23Å; I6-L10 WeakPolarHBondContact O-CG 3.4Å; I6-L10 PolarHBondContact O-N 3.02Å
7	Q	48.3	Very low	47.2	Very low	7 Å²	7	84.5 Å²	84.5	3%	0.033	42%	0.42	C	S	.	.	H	α-helix	trans	-57.7	-45.2	174.5	-74.4	179.8	-64.5	0	0	110.9	M3 A4 L10 W11 L59 W66	M3-Q7 WeakPolarHBondContact O-CB 3.17Å; M3-Q7 WeakPolarHBondContact O-CG 3.38Å; M3-Q7 PolarHBondContact O-N 3.22Å; A4-Q7 PolarHBondContact O-N 3.1Å; Q7-L10 PolarHBondContact O-N 3.09Å; Q7-W11 WeakPolarHBondContact O-CB 3.44Å; Q7-W11 PolarHBondContact O-N 3.33Å; Q7-L59 PolarHBondContact NE2-O 2.03Å; Q7-W66 HydrophobicContact CB-CE3 4.41Å; Q7-W66 HydrophobicContact CB-CH2 4.41Å; Q7-W66 HydrophobicContact CB-CZ3 4.01Å; Q7-W66 HydrophobicContact CG-CE3 3.92Å; Q7-W66 HydrophobicContact CG-CZ3 3.98Å; Q7-W66 WeakPolarHBondContact O-CH2 3.47Å
8	K	50.6	Low	46.8	Very low	82 Å²	82	82.2 Å²	82.2	36%	0.357	41%	0.41	S	S	.	.	H	α-helix	trans	-59.2	-48.8	177.3	-179.4	167.5	175.7	157.7	0	112.7	A4 M5 I6 L10 W11 D12 D52	A4-K8 WeakPolarHBondContact O-CB 3.06Å; A4-K8 PolarHBondContact O-N 3.08Å; M5-K8 PolarHBondContact O-N 3.22Å; I6-K8 VanDerWaalsContact C-N 3.31Å; I6-K8 PolarHBondContact O-N 3.15Å; K8-L10 VanDerWaalsContact C-N 3.33Å; K8-L10 PolarHBondContact O-N 3.39Å; K8-W11 WeakPolarHBondContact O-CB 3.21Å; K8-W11 PolarHBondContact O-N 2.67Å; K8-W11 VanDerWaalsContact O-N 3.14Å; K8-D12 PolarHBondContact O-N 3.12Å; K8-D52 IonicContact NZ-OD2 2.91Å; K8-D52 PolarHBondContact NZ-OD2 3.37Å
9	I	53.5	Low	46.5	Very low	110 Å²	110	87.1 Å²	87.1	56%	0.564	42%	0.423	S	S	*	.	H	α-helix	trans	-59.2	-46.6	178.2	-68.1	165.9	0	0	0	110.8	M5 I6 W11	M5-I9 HydrophobicContact CG-CD1 4.46Å; M5-I9 WeakPolarHBondContact O-CG1 3.01Å; M5-I9 PolarHBondContact O-N 3.49Å; I6-I9 PolarHBondContact O-N 2.79Å; I9-W11 VanDerWaalsContact C-N 3.27Å; I9-W11 PolarHBondContact O-N 2.75Å
10	L	48.2	Very low	46	Very low	81 Å²	81	87.7 Å²	87.7	42%	0.424	44%	0.443	S	S	.	.	H	α-helix	trans	-69.1	-29.9	-179.9	-64.9	169.4	0	0	0	111.5	I6 Q7 K8 W66	I6-L10 HydrophobicContact CG2-CD1 3.58Å; I6-L10 HydrophobicContact CG2-CG 4.31Å; I6-L10 WeakPolarHBondContact O-CB 3.27Å; I6-L10 VanDerWaalsContact O-CG 3.23Å; I6-L10 WeakPolarHBondContact O-CG 3.4Å; I6-L10 PolarHBondContact O-N 3.02Å; Q7-L10 PolarHBondContact O-N 3.09Å; K8-L10 VanDerWaalsContact C-N 3.33Å; K8-L10 PolarHBondContact O-N 3.39Å; L10-W66 HydrophobicContact CB-CH2 4.22Å; L10-W66 HydrophobicContact CB-CZ2 3.16Å; L10-W66 VanDerWaalsContact CB-NE1 3.33Å; L10-W66 HydrophobicContact CD1-CD2 4.36Å; L10-W66 HydrophobicContact CD1-CG 4.26Å; L10-W66 HydrophobicContact CD1-CZ2 4.39Å; L10-W66 HydrophobicContact CG-CZ2 4.37Å
11	W	49.6	Very low	45.7	Very low	14 Å²	14	86.1 Å²	86.1	5%	0.053	44%	0.443	C	S	.	.	H	α-helix	trans	-72.1	-43.1	177.6	-168.9	-132.1	0	0	0	111.9	Q7 K8 I9 G13 A14 K15 L18 F55 W66 M70 D217	Q7-W11 WeakPolarHBondContact O-CB 3.44Å; Q7-W11 PolarHBondContact O-N 3.33Å; K8-W11 WeakPolarHBondContact O-CB 3.21Å; K8-W11 PolarHBondContact O-N 2.67Å; K8-W11 VanDerWaalsContact O-N 3.14Å; I9-W11 VanDerWaalsContact C-N 3.27Å; I9-W11 PolarHBondContact O-N 2.75Å; W11-G13 PolarHBondContact O-N 2.9Å; W11-A14 HydrophobicContact CE3-CB 4.01Å; W11-A14 HydrophobicContact CZ3-CB 3.96Å; W11-A14 WeakPolarHBondContact O-CA 3.38Å; W11-A14 WeakPolarHBondContact O-CB 3.44Å; W11-A14 PolarHBondContact O-N 3.49Å; W11-K15 HydrophobicContact CZ2-CG 4.24Å; W11-K15 WeakPolarHBondContact O-CG 3.26Å; W11-K15 PolarHBondContact O-N 3.41Å; W11-L18 HydrophobicContact CH2-CD1 4.02Å; W11-L18 HydrophobicContact CZ2-CD1 4.46Å; W11-F55 HydrophobicContact CE3-CD2 4.03Å; W11-F55 HydrophobicContact CE3-CE2 4.15Å; W11-F55 HydrophobicContact CZ3-CD2 4.1Å; W11-F55 AromaticContact CZ3-CE2 3.76Å; W11-F55 HydrophobicContact CZ3-CE2 3.76Å; W11-W66 HydrophobicContact CB-CH2 3.95Å; W11-W66 HydrophobicContact CE3-CH2 4.01Å; W11-M70 HydrophobicContact CE3-CE 3.66Å; W11-M70 HydrophobicContact CZ3-CE 3.85Å; W11-D217 HydrophobicContact CD2-CB 4.48Å; W11-D217 HydrophobicContact CH2-CB 3.26Å; W11-D217 VanDerWaalsContact CZ2-CA 3.48Å; W11-D217 HydrophobicContact CZ2-CB 3.02Å; W11-D217 WeakPolarHBondContact CZ2-OD1 3.32Å; W11-D217 HydrophobicContact CZ3-CB 4.02Å; W11-D217 VanDerWaalsContact NE1-CG 3.29Å; W11-D217 PolarHBondContact NE1-OD1 3.36Å; W11-D217 PolarHBondContact NE1-OD2 3.13Å
12	D	49	Very low	45.6	Very low	69 Å²	69	81.8 Å²	81.8	37%	0.369	43%	0.432	S	S	.	.	H	α-helix	trans	-58.5	-36.4	178.7	-71.2	-24.8	0	0	0	111.4	K8 A14 K15	K8-D12 PolarHBondContact O-N 3.12Å; D12-A14 VanDerWaalsContact C-N 3.34Å; D12-A14 PolarHBondContact O-N 3.3Å; D12-K15 WeakPolarHBondContact OD1-CE 3.4Å; D12-K15 IonicContact OD1-NZ 2.75Å; D12-K15 PolarHBondContact OD1-NZ 3.21Å
13	G	49.5	Very low	45.3	Very low	39 Å²	39	80.8 Å²	80.8	40%	0.402	43%	0.428	S	S	.	.	H	α-helix	trans	-70.8	-21	172.4	0	0	0	0	0	115.5	W11	W11-G13 PolarHBondContact O-N 2.9Å
14	A	45.2	Very low	45.1	Very low	14 Å²	14	80.7 Å²	80.7	12%	0.116	43%	0.432	C	S	.	.	H	α-helix	trans	-86.3	-32.9	176	0	0	0	0	0	112.4	W11 D12 E16 R17 M70	W11-A14 HydrophobicContact CE3-CB 4.01Å; W11-A14 HydrophobicContact CZ3-CB 3.96Å; W11-A14 WeakPolarHBondContact O-CA 3.38Å; W11-A14 WeakPolarHBondContact O-CB 3.44Å; W11-A14 PolarHBondContact O-N 3.49Å; D12-A14 VanDerWaalsContact C-N 3.34Å; D12-A14 PolarHBondContact O-N 3.3Å; A14-E16 VanDerWaalsContact C-N 3.28Å; A14-E16 PolarHBondContact O-N 3.39Å; A14-R17 PolarHBondContact O-N 2.92Å; A14-M70 HydrophobicContact CB-CE 3.86Å; A14-M70 HydrophobicContact CB-SD 4.29Å
15	K	44.5	Very low	45.1	Very low	10 Å²	10	87.9 Å²	87.9	4%	0.043	47%	0.466	C	S	.	.	H	α-helix	trans	-56.3	-37.6	-179.8	-74.1	177.7	-167.7	165	0	113.3	W11 D12 R17 L18 N214	W11-K15 HydrophobicContact CZ2-CG 4.24Å; W11-K15 WeakPolarHBondContact O-CG 3.26Å; W11-K15 PolarHBondContact O-N 3.41Å; D12-K15 WeakPolarHBondContact OD1-CE 3.4Å; D12-K15 IonicContact OD1-NZ 2.75Å; D12-K15 PolarHBondContact OD1-NZ 3.21Å; K15-R17 PolarHBondContact O-N 2.78Å; K15-L18 PolarHBondContact O-N 2.81Å; K15-N214 WeakPolarHBondContact CE-OD1 2.71Å; K15-N214 PolarHBondContact NZ-OD1 3.41Å
16	E	43.4	Very low	45.3	Very low	144 Å²	144	82.5 Å²	82.5	67%	0.673	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-62.7	-25	-179.8	-67.5	-171.5	155.3	0	0	112.8	A14	A14-E16 VanDerWaalsContact C-N 3.28Å; A14-E16 PolarHBondContact O-N 3.39Å
17	R	43.3	Very low	45.7	Very low	184 Å²	184	83.4 Å²	83.4	69%	0.694	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-89.7	-10.6	-172.2	-55.1	-176	-167.3	-158.6	-1.7	114.8	A14 K15	A14-R17 PolarHBondContact O-N 2.92Å; K15-R17 PolarHBondContact O-N 2.78Å
18	L	39.8	Very low	45.9	Very low	44 Å²	44	83.4 Å²	83.4	23%	0.23	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-93.7	10.4	-174.1	-75.8	165	0	0	0	113.6	W11 K15 A20 Y216 T220	W11-L18 HydrophobicContact CH2-CD1 4.02Å; W11-L18 HydrophobicContact CZ2-CD1 4.46Å; K15-L18 PolarHBondContact O-N 2.81Å; L18-A20 VanDerWaalsContact C-N 3.28Å; L18-A20 PolarHBondContact O-N 2.76Å; L18-A20 VanDerWaalsContact O-N 3.09Å; L18-Y216 HydrophobicContact CB-CD2 3.55Å; L18-Y216 HydrophobicContact CB-CE2 4.27Å; L18-Y216 WeakPolarHBondContact O-CE2 3.46Å; L18-T220 HydrophobicContact CD2-CG2 4.28Å
19	R	40.9	Very low	46.3	Very low	174 Å²	174	82.7 Å²	82.7	66%	0.657	45%	0.452	S	S	*	.			trans	-70.1	2.9	-170.7	-86.2	-178	177.7	169.7	1.2	117.5	L213	R19-L213 HydrophobicContact CG-CD2 4.02Å
20	A	36.5	Very low	46.5	Very low	99 Å²	99	79.5 Å²	79.5	82%	0.818	43%	0.434	S	S	*	.			trans	-128.6	95	-177.8	0	0	0	0	0	113.1	L18	L18-A20 VanDerWaalsContact C-N 3.28Å; L18-A20 PolarHBondContact O-N 2.76Å; L18-A20 VanDerWaalsContact O-N 3.09Å
21	A	39.2	Very low	47.1	Very low	55 Å²	55	75.8 Å²	75.8	46%	0.455	42%	0.415	S	S	.	.			trans	-153.9	142.2	165.9	0	0	0	0	0	112.3	Y208	A21-Y208 HydrophobicContact CB-CD2 3.74Å; A21-Y208 HydrophobicContact CB-CE2 3.6Å; A21-Y208 HydrophobicContact CB-CG 4.42Å
22	C	39	Very low	47.2	Very low	119 Å²	119	79.3 Å²	79.3	80%	0.804	43%	0.434	S	S	*	.			trans	-49.9	154.9	-161.6	-70.8	0	0	0	0	119.1
23	E	37.7	Very low	47.6	Very low	136 Å²	136	78.7 Å²	78.7	64%	0.636	44%	0.435	S	S	*	.			trans	-76.9	130.6	175.8	-61.7	172.1	163.1	0	0	112.2	R209	E23-R209 IonicContact OE1-CZ 2.76Å; E23-R209 IonicContact OE1-NH1 3.64Å; E23-R209 PolarHBondContact OE1-NH1 2.77Å; E23-R209 IonicContact OE1-NH2 3.9Å; E23-R209 PolarHBondContact OE1-NH2 3.36Å
24	T	43	Very low	48.3	Very low	85 Å²	85	77.1 Å²	77.1	52%	0.521	42%	0.418	S	S	.	.			trans	-137.5	125.1	147	5.9	0	0	0	0	105.5	I26	T24-I26 PolarHBondContact O-N 3.34Å
25	L	44.9	Very low	49.3	Very low	177 Å²	177	78.3 Å²	78.3	93%	0.927	42%	0.423	S	S	*	.			trans	-68.2	104.4	168	-80.1	164.2	0	0	0	106.6
26	I	57.4	Low	50.2	Low	16 Å²	16	86.3 Å²	86.3	8%	0.082	46%	0.458	C	S	.	.			trans	-79.6	122.8	177.1	-67.3	169.3	0	0	0	107.7	T24 A28 A205 A254 V257	T24-I26 PolarHBondContact O-N 3.34Å; I26-A28 PolarHBondContact O-N 3.02Å; I26-A205 HydrophobicContact CD1-CB 4.05Å; I26-A205 HydrophobicContact CG1-CB 4.11Å; I26-A254 HydrophobicContact CG2-CB 3.86Å; I26-V257 HydrophobicContact CB-CG2 4.29Å; I26-V257 HydrophobicContact CD1-CG2 4.04Å; I26-V257 HydrophobicContact CG1-CG2 4.02Å; I26-V257 HydrophobicContact CG2-CB 3.99Å; I26-V257 HydrophobicContact CG2-CG1 3.44Å; I26-V257 VanDerWaalsContact CG2-CG1 3.44Å; I26-V257 HydrophobicContact CG2-CG2 3.34Å
27	D	56.5	Low	51.3	Low	92 Å²	92	83.7 Å²	83.7	49%	0.492	46%	0.456	S	S	.	.			trans	-61.4	105.3	172.2	179.4	10.4	0	0	0	109.5	S29 Q30	D27-S29 PolarHBondContact O-N 2.9Å; D27-S29 WeakPolarHBondContact OD1-CB 3.35Å; D27-S29 PolarHBondContact OD1-N 3.14Å; D27-S29 PolarHBondContact OD1-OG 3.43Å; D27-S29 PolarHBondContact OD2-OG 3.31Å; D27-Q30 PolarHBondContact O-N 3.35Å
28	A	53	Low	52.7	Low	7 Å²	7	75.1 Å²	75.1	6%	0.058	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-70.9	-14.2	-178.4	0	0	0	0	0	113.4	I26 Q30 V31 I32 N252	I26-A28 PolarHBondContact O-N 3.02Å; A28-Q30 PolarHBondContact O-N 2.79Å; A28-V31 PolarHBondContact O-N 2.99Å; A28-I32 WeakPolarHBondContact O-CG1 3.47Å; A28-I32 PolarHBondContact O-N 2.98Å; A28-N252 HydrophobicContact CB-CB 4.08Å; A28-N252 WeakPolarHBondContact CB-O 3.34Å
29	S	57.9	Low	54.5	Low	67 Å²	67	75.3 Å²	75.3	47%	0.469	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-51	-31.1	176.4	79	0	0	0	0	111.6	D27 V31	D27-S29 PolarHBondContact O-N 2.9Å; D27-S29 WeakPolarHBondContact OD1-CB 3.35Å; D27-S29 PolarHBondContact OD1-N 3.14Å; D27-S29 PolarHBondContact OD1-OG 3.43Å; D27-S29 PolarHBondContact OD2-OG 3.31Å; S29-V31 PolarHBondContact O-N 3.42Å
30	Q	58.9	Low	56	Low	43 Å²	43	69 Å²	69	20%	0.201	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-66.8	-18	177.1	-63.4	-171.3	16.8	0	0	114.8	D27 A28 P261 Q264	D27-Q30 PolarHBondContact O-N 3.35Å; A28-Q30 PolarHBondContact O-N 2.79Å; Q30-P261 VanDerWaalsContact NE2-CG 3.34Å; Q30-Q264 HydrophobicContact CB-CG 4.09Å
31	V	60.2	Low	57.9	Low	4 Å²	4	67.9 Å²	67.9	2%	0.024	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	-7.1	-171.1	-166.4	0	0	0	0	112.2	A28 S29 S33 I34 R246 A254 V257	A28-V31 PolarHBondContact O-N 2.99Å; S29-V31 PolarHBondContact O-N 3.42Å; V31-S33 PolarHBondContact O-N 2.88Å; V31-S33 VanDerWaalsContact O-N 3.08Å; V31-I34 HydrophobicContact CB-CD1 4.42Å; V31-I34 HydrophobicContact CG1-CB 4.42Å; V31-I34 HydrophobicContact CG1-CD1 3.48Å; V31-I34 VanDerWaalsContact CG1-CD1 3.48Å; V31-I34 HydrophobicContact CG1-CG1 3.96Å; V31-I34 PolarHBondContact O-N 3.24Å; V31-I34 VanDerWaalsContact O-N 3.09Å; V31-R246 HydrophobicContact CG1-CG 4.08Å; V31-A254 HydrophobicContact CB-CB 3.91Å; V31-A254 HydrophobicContact CG1-CB 4.15Å; V31-A254 HydrophobicContact CG2-CB 3.4Å; V31-V257 HydrophobicContact CG2-CG1 3.57Å
32	I	50.6	Low	59.8	Low	87 Å²	87	65.6 Å²	65.6	45%	0.446	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-31.2	-177	-76.9	168.9	0	0	0	112.5	A28 R246	A28-I32 WeakPolarHBondContact O-CG1 3.47Å; A28-I32 PolarHBondContact O-N 2.98Å; I32-R246 PolarHBondContact O-NH1 3.45Å
33	S	58.6	Low	61.9	Low	56 Å²	56	63.7 Å²	63.7	39%	0.392	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-0.4	-177.1	56.9	0	0	0	0	115.3	V31 T35 W265	V31-S33 PolarHBondContact O-N 2.88Å; V31-S33 VanDerWaalsContact O-N 3.08Å; S33-T35 PolarHBondContact O-N 3.44Å; S33-W265 VanDerWaalsContact OG-CH2 3.25Å; S33-W265 WeakPolarHBondContact OG-CH2 3.25Å
34	I	64.5	Low	64.1	Low	6 Å²	6	57.4 Å²	57.4	3%	0.031	32%	0.321	C	S	.	.			trans	-72	121.5	179.7	-60.7	-167.7	0	0	0	110.4	V31 R246 W265 R383	V31-I34 HydrophobicContact CB-CD1 4.42Å; V31-I34 HydrophobicContact CG1-CB 4.42Å; V31-I34 HydrophobicContact CG1-CD1 3.48Å; V31-I34 VanDerWaalsContact CG1-CD1 3.48Å; V31-I34 HydrophobicContact CG1-CG1 3.96Å; V31-I34 PolarHBondContact O-N 3.24Å; V31-I34 VanDerWaalsContact O-N 3.09Å; I34-R246 PolarHBondContact O-NH1 3.24Å; I34-W265 HydrophobicContact CG1-CH2 4.2Å; I34-W265 HydrophobicContact CG1-CZ3 4.36Å; I34-R383 HydrophobicContact CG2-CG 4.02Å
35	T	65.4	Low	66.3	Low	39 Å²	39	53.4 Å²	53.4	24%	0.239	30%	0.297	C	S	.	.			trans	-65.2	148	176.6	-172.2	0	0	0	0	112.2	S33 S37 P38 E382 R383	S33-T35 PolarHBondContact O-N 3.44Å; T35-S37 VanDerWaalsContact C-N 3.32Å; T35-S37 PolarHBondContact OG1-N 3.2Å; T35-P38 HydrophobicContact CG2-CB 3.95Å; T35-E382 HydrophobicContact CG2-CB 3.31Å; T35-E382 HydrophobicContact CG2-CG 4.07Å; T35-R383 HydrophobicContact CG2-CG 4.42Å; T35-R383 PolarHBondContact O-NE 2.93Å; T35-R383 PolarHBondContact O-NH2 2.78Å
36	K	62.7	Low	68.3	Low	179 Å²	179	45.5 Å²	45.5	78%	0.778	26%	0.256	S	S	*	.	S	Bend	trans	-77.9	-16.6	171	-71.4	-173.5	177.6	-178	0	113.1
37	S	67.5	Low	69.5	Low	88 Å²	88	48.1 Å²	48.1	62%	0.615	27%	0.268	S	S	*	.	S	Bend	trans	-134.6	73.6	-174.1	-60.8	0	0	0	0	110.2	T35	T35-S37 VanDerWaalsContact C-N 3.32Å; T35-S37 PolarHBondContact OG1-N 3.2Å
38	P	73.2	Confident	71	Confident	4 Å²	4	44.3 Å²	44.3	3%	0.026	25%	0.247	C	C	.	.			trans	-63.9	152.5	-179.2	25.1	-31.5	0	0	0	112.3	T35 Q42 R43 E47 E382 R383	T35-P38 HydrophobicContact CG2-CB 3.95Å; P38-Q42 HydrophobicContact CB-CB 3.79Å; P38-R43 HydrophobicContact CB-CG 4.48Å; P38-R43 HydrophobicContact CG-CG 3.82Å; P38-R43 PolarHBondContact O-NE 3.44Å; P38-E47 WeakPolarHBondContact CG-OE2 3.5Å; P38-E382 WeakPolarHBondContact CA-OE2 3.49Å; P38-R383 HydrophobicContact CB-CG 4Å
39	S	76.1	Confident	72.7	Confident	49 Å²	49	44.1 Å²	44.1	34%	0.343	25%	0.245	S	C	.	.			trans	-52	155.2	164.7	65.3	0	0	0	0	111.1	D41 Q42 R43 E382	S39-D41 WeakPolarHBondContact CB-OD1 3.36Å; S39-D41 PolarHBondContact O-N 3.07Å; S39-D41 VanDerWaalsContact O-N 3.16Å; S39-D41 PolarHBondContact OG-OD1 3.27Å; S39-Q42 CarbonylContact O-C 3.56Å; S39-Q42 WeakPolarHBondContact O-CA 3.16Å; S39-Q42 PolarHBondContact O-N 3.49Å; S39-Q42 WeakPolarHBondContact OG-CG 3.46Å; S39-R43 PolarHBondContact O-N 2Å; S39-R43 VanDerWaalsContact O-N 3.1Å; S39-E382 PolarHBondContact N-OE2 3.49Å
40	A	74	Confident	73.8	Confident	42 Å²	42	41.9 Å²	41.9	35%	0.347	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-59.1	-33.2	-170.9	0	0	0	0	0	113.6	Q42 T177	A40-Q42 VanDerWaalsContact C-N 3.28Å; A40-Q42 PolarHBondContact O-N 2.02Å; A40-T177 HydrophobicContact CB-CG2 4.43Å; A40-T177 WeakPolarHBondContact O-CG2 3.42Å
41	D	74.8	Confident	74.6	Confident	74 Å²	74	41 Å²	41	40%	0.396	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-74.6	-13.7	175.8	61.5	-44.9	0	0	0	114.1	S39	S39-D41 WeakPolarHBondContact CB-OD1 3.36Å; S39-D41 PolarHBondContact O-N 3.07Å; S39-D41 VanDerWaalsContact O-N 3.16Å; S39-D41 PolarHBondContact OG-OD1 3.27Å
42	Q	80.3	Confident	75.2	Confident	7 Å²	7	42.7 Å²	42.7	3%	0.033	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-108.3	-1.6	176.3	-63	-158.1	-26.6	0	0	113.8	P38 S39 A40 E381 T384	P38-Q42 HydrophobicContact CB-CB 3.79Å; S39-Q42 CarbonylContact O-C 3.56Å; S39-Q42 WeakPolarHBondContact O-CA 3.16Å; S39-Q42 PolarHBondContact O-N 3.49Å; S39-Q42 WeakPolarHBondContact OG-CG 3.46Å; A40-Q42 VanDerWaalsContact C-N 3.28Å; A40-Q42 PolarHBondContact O-N 2.02Å; Q42-E381 PolarHBondContact NE2-OE2 3.06Å; Q42-T384 PolarHBondContact NE2-O 3.39Å
43	R	82.5	Confident	76.4	Confident	79 Å²	79	44.7 Å²	44.7	30%	0.298	24%	0.241	S	C	.	.			trans	-70.9	148.1	173.3	-76.8	177.1	-168.2	-166.1	3.1	111.1	P38 S39 E47	P38-R43 HydrophobicContact CB-CG 4.48Å; P38-R43 HydrophobicContact CG-CG 3.82Å; P38-R43 PolarHBondContact O-NE 3.44Å; S39-R43 PolarHBondContact O-N 2Å; S39-R43 VanDerWaalsContact O-N 3.1Å; R43-E47 WeakPolarHBondContact CA-OE2 3.23Å
44	T	85	Confident	77.6	Confident	5 Å²	5	42.2 Å²	42.2	3%	0.031	22%	0.224	C	C	.	.			trans	-107.3	160.1	169.2	71.8	0	0	0	0	112	V46 E47 I48 A243	T44-V46 PolarHBondContact O-N 3.48Å; T44-E47 PolarHBondContact N-OE2 2.86Å; T44-E47 WeakPolarHBondContact O-CB 3.49Å; T44-E47 PolarHBondContact O-N 3.38Å; T44-I48 WeakPolarHBondContact O-CG1 3.44Å; T44-I48 PolarHBondContact O-N 2.74Å; T44-A243 HydrophobicContact CG2-CB 3.76Å
45	E	88.4	Confident	78.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-51.4	-39.1	172.4	62.2	-65.5	143.7	0	0	113.1	E47 I48 N49 D58 R270	E45-E47 VanDerWaalsContact C-N 3.28Å; E45-E47 PolarHBondContact O-N 2.75Å; E45-I48 PolarHBondContact O-N 3.19Å; E45-I48 VanDerWaalsContact O-N 3.17Å; E45-N49 WeakPolarHBondContact O-CB 3.43Å; E45-N49 VanDerWaalsContact O-CG 3.26Å; E45-N49 PolarHBondContact O-N 3.02Å; E45-N49 PolarHBondContact O-ND2 3.12Å; E45-D58 HydrophobicContact CB-CB 3.79Å; E45-D58 HydrophobicContact CG-CB 3.67Å; E45-R270 VanDerWaalsContact CD-NH2 3.34Å; E45-R270 IonicContact OE1-NH2 3.61Å; E45-R270 PolarHBondContact OE1-NH2 2.84Å; E45-R270 IonicContact OE2-CZ 2.95Å; E45-R270 IonicContact OE2-NE 3.15Å; E45-R270 PolarHBondContact OE2-NE 3.16Å; E45-R270 IonicContact OE2-NH2 3.68Å; E45-R270 PolarHBondContact OE2-NH2 3.35Å
46	V	85.8	Confident	79.5	Confident	11 Å²	11	40.7 Å²	40.7	7%	0.067	21%	0.213	C	C	.	.	H	α-helix	trans	-61.5	-36.3	177.3	179.5	0	0	0	0	111.9	T44 G50 F215 L218	T44-V46 PolarHBondContact O-N 3.48Å; V46-G50 CarbonylContact O-C 3.51Å; V46-G50 VanDerWaalsContact O-CA 3.23Å; V46-G50 WeakPolarHBondContact O-CA 3.34Å; V46-G50 PolarHBondContact O-N 3.36Å; V46-F215 HydrophobicContact CG1-CE1 4.05Å; V46-L218 HydrophobicContact CB-CD2 4.49Å; V46-L218 HydrophobicContact CG1-CD2 3.99Å; V46-L218 HydrophobicContact CG2-CD1 3.58Å; V46-L218 HydrophobicContact CG2-CD2 3.76Å; V46-L218 HydrophobicContact CG2-CG 4.33Å
47	E	84.2	Confident	80.7	Confident	72 Å²	72	32.2 Å²	32.2	34%	0.336	18%	0.177	S	C	.	.	H	α-helix	trans	-76	-28.6	179	-58.3	-176.3	121.1	0	0	112.7	P38 R43 T44 E45 R383	P38-E47 WeakPolarHBondContact CG-OE2 3.5Å; R43-E47 WeakPolarHBondContact CA-OE2 3.23Å; T44-E47 PolarHBondContact N-OE2 2.86Å; T44-E47 WeakPolarHBondContact O-CB 3.49Å; T44-E47 PolarHBondContact O-N 3.38Å; E45-E47 VanDerWaalsContact C-N 3.28Å; E45-E47 PolarHBondContact O-N 2.75Å; E47-R383 IonicContact OE1-CZ 2.63Å; E47-R383 IonicContact OE1-NE 2.68Å; E47-R383 IonicContact OE1-NH1 2.84Å; E47-R383 PolarHBondContact OE1-NH1 2.81Å; E47-R383 IonicContact OE1-NH2 2.62Å; E47-R383 PolarHBondContact OE1-NH2 3.41Å; E47-R383 IonicContact OE2-CZ 2.99Å; E47-R383 IonicContact OE2-NH1 3.93Å; E47-R383 PolarHBondContact OE2-NH1 2.84Å
48	I	86.4	Confident	81.9	Confident	12 Å²	12	28 Å²	28	6%	0.062	15%	0.148	C	C	.	.	H	α-helix	trans	-78	-46.7	178.8	-66.9	166	0	0	0	110.4	T44 E45 C155 Q174 C175 L180	T44-I48 WeakPolarHBondContact O-CG1 3.44Å; T44-I48 PolarHBondContact O-N 2.74Å; E45-I48 PolarHBondContact O-N 3.19Å; E45-I48 VanDerWaalsContact O-N 3.17Å; I48-C155 HydrophobicContact CB-CB 4.43Å; I48-C155 HydrophobicContact CD1-CB 4.32Å; I48-C155 HydrophobicContact CG2-CB 3.95Å; I48-Q174 HydrophobicContact CD1-CB 4.28Å; I48-Q174 HydrophobicContact CD1-CG 4.41Å; I48-Q174 VanDerWaalsContact CD1-O 3.25Å; I48-Q174 WeakPolarHBondContact CD1-O 3.06Å; I48-Q174 HydrophobicContact CG1-CB 4.16Å; I48-Q174 HydrophobicContact CG1-CG 4.13Å; I48-Q174 HydrophobicContact CG2-CG 4.05Å; I48-C175 HydrophobicContact CD1-CB 4.02Å; I48-L180 HydrophobicContact CD1-CD1 3.82Å
49	N	88.8	Confident	82.8	Confident	3 Å²	3	27.8 Å²	27.8	2%	0.016	15%	0.146	C	C	.	.	H	α-helix	trans	-84.3	-32.5	-174.1	-63.3	-22.9	0	0	0	112.4	E45 R53 G57 D58 M154 C155	E45-N49 WeakPolarHBondContact O-CB 3.43Å; E45-N49 VanDerWaalsContact O-CG 3.26Å; E45-N49 PolarHBondContact O-N 3.02Å; E45-N49 PolarHBondContact O-ND2 3.12Å; N49-R53 WeakPolarHBondContact O-CD 3.31Å; N49-R53 PolarHBondContact O-NE 2.8Å; N49-G57 VanDerWaalsContact CB-O 3.31Å; N49-G57 WeakPolarHBondContact CB-O 3.44Å; N49-G57 PolarHBondContact ND2-O 3.37Å; N49-D58 WeakPolarHBondContact ND2-CB 2.98Å; N49-M154 VanDerWaalsContact OD1-CA 3.28Å; N49-M154 WeakPolarHBondContact OD1-CA 3.44Å; N49-C155 PolarHBondContact ND2-O 2.95Å; N49-C155 PolarHBondContact OD1-N 3.2Å; N49-C155 PolarHBondContact OD1-O 2.88Å
50	G	82.9	Confident	83.4	Confident	19 Å²	19	26.3 Å²	26.3	20%	0.196	13%	0.134	C	C	.	.			trans	82.1	158.1	-159.4	0	0	0	0	0	111.7	V46 D52	V46-G50 CarbonylContact O-C 3.51Å; V46-G50 VanDerWaalsContact O-CA 3.23Å; V46-G50 WeakPolarHBondContact O-CA 3.34Å; V46-G50 PolarHBondContact O-N 3.36Å; G50-D52 PolarHBondContact O-N 2.73Å
51	P	75	Confident	83.9	Confident	26 Å²	26	24.5 Å²	24.5	17%	0.169	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-17.3	-171.1	33.4	-39.4	0	0	0	114.2	N214 F215	P51-N214 HydrophobicContact CB-CB 4.25Å; P51-N214 HydrophobicContact CG-CB 3.97Å; P51-F215 HydrophobicContact CB-CD1 3.92Å; P51-F215 HydrophobicContact CB-CD2 4.05Å; P51-F215 HydrophobicContact CB-CE1 3.75Å; P51-F215 HydrophobicContact CB-CE2 3.88Å; P51-F215 HydrophobicContact CB-CG 4.08Å; P51-F215 HydrophobicContact CB-CZ 3.73Å; P51-F215 HydrophobicContact CG-CD2 4.19Å; P51-F215 HydrophobicContact CG-CE1 4.17Å; P51-F215 HydrophobicContact CG-CE2 3.63Å; P51-F215 HydrophobicContact CG-CZ 3.62Å
52	D	71.7	Confident	84.4	Confident	39 Å²	39	22 Å²	22	21%	0.209	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	0.8	-167.6	73.6	-44	0	0	0	114.8	K8 G50 N214	K8-D52 IonicContact NZ-OD2 2.91Å; K8-D52 PolarHBondContact NZ-OD2 3.37Å; G50-D52 PolarHBondContact O-N 2.73Å; D52-N214 HydrophobicContact CB-CB 4.35Å
53	R	76.8	Confident	84.2	Confident	129 Å²	129	25.5 Å²	25.5	49%	0.487	13%	0.13	S	C	.	.	S	Bend	trans	-92.9	-34	-172.4	-65.1	-163.4	-178.1	161.9	-5.1	114.3	N49	N49-R53 WeakPolarHBondContact O-CD 3.31Å; N49-R53 PolarHBondContact O-NE 2.8Å
54	L	84.5	Confident	84	Confident	4 Å²	4	26.6 Å²	26.6	2%	0.021	14%	0.137	C	C	.	.	S	Bend	trans	-135.7	151.9	-172.4	-64.7	174.5	0	0	0	109	A4 M56 G57 L60 M154 S156	A4-L54 HydrophobicContact CB-CD2 4.44Å; L54-M56 PolarHBondContact O-N 2.68Å; L54-G57 PolarHBondContact O-N 3.3Å; L54-G57 VanDerWaalsContact O-N 3.13Å; L54-L60 HydrophobicContact CD2-CD2 3.54Å; L54-L60 HydrophobicContact CD2-CG 4.2Å; L54-M154 HydrophobicContact CD1-CG 3.82Å; L54-M154 HydrophobicContact CD1-SD 3.95Å; L54-M154 HydrophobicContact CD2-SD 4.21Å; L54-M154 HydrophobicContact CG-SD 4.46Å; L54-S156 VanDerWaalsContact CD1-CB 3.45Å
55	F	82.5	Confident	83.9	Confident	11 Å²	11	26.5 Å²	26.5	5%	0.048	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-63.6	129	-179.8	-178.1	-107.2	0	0	0	109.8	W11 G57 D58 L59 L61 W66 L69	W11-F55 HydrophobicContact CE3-CD2 4.03Å; W11-F55 HydrophobicContact CE3-CE2 4.15Å; W11-F55 HydrophobicContact CZ3-CD2 4.1Å; W11-F55 AromaticContact CZ3-CE2 3.76Å; W11-F55 HydrophobicContact CZ3-CE2 3.76Å; F55-G57 PolarHBondContact O-N 2.69Å; F55-G57 VanDerWaalsContact O-N 3.12Å; F55-D58 PolarHBondContact O-N 2.02Å; F55-L59 HydrophobicContact CB-CB 4.23Å; F55-L59 HydrophobicContact CD1-CB 4.18Å; F55-L59 HydrophobicContact CD1-CD1 3.93Å; F55-L59 HydrophobicContact CE1-CD1 4.39Å; F55-L59 PolarHBondContact N-O 3.5Å; F55-L59 WeakPolarHBondContact O-CB 3.46Å; F55-L59 WeakPolarHBondContact O-CG 3.43Å; F55-L59 PolarHBondContact O-N 3.05Å; F55-L61 HydrophobicContact CB-CD1 3.7Å; F55-L61 HydrophobicContact CB-CG 4.17Å; F55-L61 HydrophobicContact CD1-CD1 3.45Å; F55-L61 VanDerWaalsContact CD1-CD1 3.45Å; F55-L61 HydrophobicContact CD1-CD2 4.31Å; F55-L61 HydrophobicContact CD1-CG 4.15Å; F55-L61 HydrophobicContact CD2-CD1 4.09Å; F55-L61 HydrophobicContact CE1-CD1 4.05Å; F55-L61 HydrophobicContact CG-CD1 3.47Å; F55-L61 VanDerWaalsContact CG-CD1 3.47Å; F55-L61 HydrophobicContact CG-CG 4.33Å; F55-W66 HydrophobicContact CB-CZ3 4.16Å; F55-W66 HydrophobicContact CD2-CH2 4.4Å; F55-W66 AromaticContact CD2-CZ3 3.93Å; F55-W66 HydrophobicContact CD2-CZ3 3.93Å; F55-W66 HydrophobicContact CG-CZ3 4.31Å; F55-L69 HydrophobicContact CD1-CD1 4.38Å; F55-L69 HydrophobicContact CE1-CD1 3.79Å; F55-L69 HydrophobicContact CZ-CD1 4.03Å
56	M	86.4	Confident	83.2	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	25.8	-177.6	-61.7	178.5	156.7	0	0	113.7	L54 L59 H193 N196 D217 L218 L222	L54-M56 PolarHBondContact O-N 2.68Å; M56-L59 HydrophobicContact CB-CD1 4.18Å; M56-L59 HydrophobicContact CB-CG 4.47Å; M56-L59 HydrophobicContact SD-CD1 4.17Å; M56-H193 PolarHBondContact O-CE1 3.25Å; M56-H193 VanDerWaalsContact O-CE1 3.31Å; M56-N196 HydrophobicContact CE-CB 4.19Å; M56-N196 WeakPolarHBondContact CE-OD1 3.11Å; M56-N196 PolarHBondContact SD-OD1 3.05Å; M56-D217 WeakPolarHBondContact CE-O 3.4Å; M56-D217 HydrophobicContact CG-CB 4.01Å; M56-D217 PolarHBondContact N-OD2 3.49Å; M56-L218 WeakPolarHBondContact O-CD1 3.49Å; M56-L222 HydrophobicContact CE-CD1 4.03Å; M56-L222 HydrophobicContact CE-CD2 3.56Å; M56-L222 HydrophobicContact CE-CG 3.72Å; M56-L222 HydrophobicContact SD-CD1 4.18Å
57	G	87.1	Confident	82.5	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.01	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.3	-31.5	176.1	0	0	0	0	0	115	N49 L54 F55	N49-G57 VanDerWaalsContact CB-O 3.31Å; N49-G57 WeakPolarHBondContact CB-O 3.44Å; N49-G57 PolarHBondContact ND2-O 3.37Å; L54-G57 PolarHBondContact O-N 3.3Å; L54-G57 VanDerWaalsContact O-N 3.13Å; F55-G57 PolarHBondContact O-N 2.69Å; F55-G57 VanDerWaalsContact O-N 3.12Å
58	D	93.6	Very high	81.8	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-149.8	1.7	-172.3	77.8	-29	0	0	0	116.1	E45 N49 F55 C155 S156 S157 H183 Q184 H187 H193	E45-D58 HydrophobicContact CB-CB 3.79Å; E45-D58 HydrophobicContact CG-CB 3.67Å; N49-D58 WeakPolarHBondContact ND2-CB 2.98Å; F55-D58 PolarHBondContact O-N 2.02Å; D58-C155 WeakPolarHBondContact CB-O 3.28Å; D58-S156 VanDerWaalsContact O-CA 3.28Å; D58-S156 WeakPolarHBondContact O-CA 3.23Å; D58-S156 WeakPolarHBondContact O-CB 3.35Å; D58-S157 PolarHBondContact O-N 3.32Å; D58-H183 IonicContact OD2-CD2 3.51Å; D58-H183 IonicContact OD2-NE2 3.57Å; D58-H183 PolarHBondContact OD2-NE2 3.47Å; D58-Q184 PolarHBondContact OD2-NE2 3.07Å; D58-H187 IonicContact OD1-NE2 3.87Å; D58-H187 IonicContact OD2-CD2 2.66Å; D58-H187 PolarHBondContact OD2-CD2 2.99Å; D58-H187 VanDerWaalsContact OD2-CD2 3.24Å; D58-H187 IonicContact OD2-NE2 2.61Å; D58-H187 PolarHBondContact OD2-NE2 3.41Å; D58-H187 VanDerWaalsContact OD2-NE2 3.15Å; D58-H193 IonicContact OD1-CE1 3.66Å; D58-H193 PolarHBondContact OD1-CE1 3.15Å; D58-H193 IonicContact OD1-NE2 3.42Å; D58-H193 PolarHBondContact OD1-NE2 3.31Å
59	L	91.2	Very high	80.9	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	121.3	-176.9	-53.7	-177.8	0	0	0	112.4	Q7 F55 M56 L61 V159 H187 L192	Q7-L59 PolarHBondContact NE2-O 2.03Å; F55-L59 HydrophobicContact CB-CB 4.23Å; F55-L59 HydrophobicContact CD1-CB 4.18Å; F55-L59 HydrophobicContact CD1-CD1 3.93Å; F55-L59 HydrophobicContact CE1-CD1 4.39Å; F55-L59 PolarHBondContact N-O 3.5Å; F55-L59 WeakPolarHBondContact O-CB 3.46Å; F55-L59 WeakPolarHBondContact O-CG 3.43Å; F55-L59 PolarHBondContact O-N 3.05Å; M56-L59 HydrophobicContact CB-CD1 4.18Å; M56-L59 HydrophobicContact CB-CG 4.47Å; M56-L59 HydrophobicContact SD-CD1 4.17Å; L59-L61 HydrophobicContact CB-CD2 4.41Å; L59-V159 HydrophobicContact CB-CG2 4.39Å; L59-V159 HydrophobicContact CD1-CG2 3.99Å; L59-V159 HydrophobicContact CD2-CG2 3.64Å; L59-V159 HydrophobicContact CG-CG2 4.23Å; L59-H187 HydrophobicContact CD2-CB 4.34Å; L59-H187 VanDerWaalsContact CD2-CE1 3.43Å; L59-H187 WeakPolarHBondContact CD2-CE1 3.41Å; L59-H187 WeakPolarHBondContact CD2-ND1 2.98Å; L59-L192 HydrophobicContact CD1-CD2 3.77Å
60	L	90.6	Very high	79.8	Confident	17 Å²	17	29 Å²	29	9%	0.089	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	124.5	161.5	-68.8	168.8	0	0	0	108.7	L54 S157 F158	L54-L60 HydrophobicContact CD2-CD2 3.54Å; L54-L60 HydrophobicContact CD2-CG 4.2Å; L60-S157 PolarHBondContact N-O 2.91Å; L60-F158 HydrophobicContact CB-CD1 3.85Å; L60-F158 HydrophobicContact CB-CD2 4.08Å; L60-F158 HydrophobicContact CB-CE1 3.83Å; L60-F158 HydrophobicContact CB-CE2 4.07Å; L60-F158 HydrophobicContact CB-CG 3.99Å; L60-F158 HydrophobicContact CB-CZ 3.95Å; L60-F158 HydrophobicContact CD1-CD2 4.26Å; L60-F158 HydrophobicContact CD1-CE2 3.96Å; L60-F158 HydrophobicContact CD1-CZ 4.39Å; L60-F158 WeakPolarHBondContact O-CA 3.41Å; L60-F158 VanDerWaalsContact O-CD1 3.23Å; L60-F158 WeakPolarHBondContact O-CD1 3.41Å
61	L	83.6	Confident	78.7	Confident	4 Å²	4	34.8 Å²	34.8	2%	0.021	17%	0.172	C	C	.	.			trans	-110.9	138.3	179.6	-60.8	175.1	0	0	0	109.4	F55 L59 Q65 W66 L69 F95	F55-L61 HydrophobicContact CB-CD1 3.7Å; F55-L61 HydrophobicContact CB-CG 4.17Å; F55-L61 HydrophobicContact CD1-CD1 3.45Å; F55-L61 VanDerWaalsContact CD1-CD1 3.45Å; F55-L61 HydrophobicContact CD1-CD2 4.31Å; F55-L61 HydrophobicContact CD1-CG 4.15Å; F55-L61 HydrophobicContact CD2-CD1 4.09Å; F55-L61 HydrophobicContact CE1-CD1 4.05Å; F55-L61 HydrophobicContact CG-CD1 3.47Å; F55-L61 VanDerWaalsContact CG-CD1 3.47Å; F55-L61 HydrophobicContact CG-CG 4.33Å; L59-L61 HydrophobicContact CB-CD2 4.41Å; L61-Q65 HydrophobicContact CB-CB 4.11Å; L61-Q65 HydrophobicContact CD2-CB 4.17Å; L61-W66 HydrophobicContact CB-CB 4.38Å; L61-W66 HydrophobicContact CB-CE3 4.28Å; L61-W66 HydrophobicContact CD1-CE3 3.48Å; L61-W66 VanDerWaalsContact CD1-CE3 3.48Å; L61-W66 HydrophobicContact CD1-CZ3 3.96Å; L61-W66 HydrophobicContact CG-CE3 4.44Å; L61-L69 HydrophobicContact CD1-CD1 3.38Å; L61-L69 HydrophobicContact CD2-CD1 3.92Å; L61-L69 HydrophobicContact CG-CD1 4.29Å; L61-F95 HydrophobicContact CD2-CE1 4.31Å
62	T	84.4	Confident	77.6	Confident	23 Å²	23	34.8 Å²	34.8	14%	0.141	17%	0.171	C	C	.	.			trans	-65.5	157.2	165.6	71.8	0	0	0	0	109.7	F64 Q65 W66 F158 V162	T62-F64 PolarHBondContact O-N 3.42Å; T62-F64 PolarHBondContact OG1-N 3.45Å; T62-Q65 PolarHBondContact O-N 3.47Å; T62-Q65 VanDerWaalsContact O-N 3.1Å; T62-Q65 WeakPolarHBondContact OG1-CB 3.01Å; T62-Q65 VanDerWaalsContact OG1-CG 3.3Å; T62-Q65 WeakPolarHBondContact OG1-CG 3.36Å; T62-Q65 PolarHBondContact OG1-N 3.29Å; T62-W66 WeakPolarHBondContact O-CB 3.45Å; T62-W66 PolarHBondContact O-N 3.4Å; T62-F158 HydrophobicContact CG2-CD1 4.18Å; T62-F158 HydrophobicContact CG2-CE1 4.25Å; T62-V162 HydrophobicContact CG2-CB 4.27Å; T62-V162 HydrophobicContact CG2-CG1 3.47Å; T62-V162 VanDerWaalsContact CG2-CG1 3.47Å; T62-V162 HydrophobicContact CG2-CG2 3.95Å
63	P	77.5	Confident	76.3	Confident	80 Å²	80	37 Å²	37	52%	0.519	19%	0.189	S	C	.	.	H	α-helix	trans	-52.8	-38	172.2	-28.7	36.2	0	0	0	112.8	M3 V67	M3-P63 HydrophobicContact CE-CG 3.91Å; M3-P63 HydrophobicContact SD-CG 4.09Å; P63-V67 WeakPolarHBondContact O-CB 2.82Å; P63-V67 WeakPolarHBondContact O-CG2 3.24Å; P63-V67 PolarHBondContact O-N 3.22Å
64	F	78.6	Confident	74.3	Confident	102 Å²	102	37.4 Å²	37.4	45%	0.447	20%	0.197	S	C	.	.	H	α-helix	trans	-65.2	-47	176.2	177.6	-105.6	0	0	0	112.4	T62 V67 T68	T62-F64 PolarHBondContact O-N 3.42Å; T62-F64 PolarHBondContact OG1-N 3.45Å; F64-V67 PolarHBondContact O-N 3.29Å; F64-T68 WeakPolarHBondContact O-CB 3.38Å; F64-T68 PolarHBondContact O-N 3.36Å; F64-T68 PolarHBondContact O-OG1 3.27Å
65	Q	82.2	Confident	72.2	Confident	2 Å²	2	44 Å²	44	1%	0.009	22%	0.221	C	C	.	.	H	α-helix	trans	-59.9	-47.4	176.1	-77.4	169.4	-13.7	0	0	111.2	L61 T62 V67 T68 L69 P94 F95 V159	L61-Q65 HydrophobicContact CB-CB 4.11Å; L61-Q65 HydrophobicContact CD2-CB 4.17Å; T62-Q65 PolarHBondContact O-N 3.47Å; T62-Q65 VanDerWaalsContact O-N 3.1Å; T62-Q65 WeakPolarHBondContact OG1-CB 3.01Å; T62-Q65 VanDerWaalsContact OG1-CG 3.3Å; T62-Q65 WeakPolarHBondContact OG1-CG 3.36Å; T62-Q65 PolarHBondContact OG1-N 3.29Å; Q65-V67 PolarHBondContact O-N 2.96Å; Q65-T68 PolarHBondContact O-N 2.76Å; Q65-L69 WeakPolarHBondContact O-CB 3.5Å; Q65-L69 VanDerWaalsContact O-CG 3.28Å; Q65-L69 WeakPolarHBondContact O-CG 3Å; Q65-L69 PolarHBondContact O-N 3.21Å; Q65-P94 HydrophobicContact CG-CB 4.37Å; Q65-P94 WeakPolarHBondContact CG-O 3.14Å; Q65-P94 PolarHBondContact NE2-O 2.89Å; Q65-F95 HydrophobicContact CB-CE1 4.38Å; Q65-F95 HydrophobicContact CG-CD1 4.14Å; Q65-F95 HydrophobicContact CG-CE1 3.97Å; Q65-V159 PolarHBondContact NE2-O 2.81Å
66	W	73.5	Confident	69.9	Low	15 Å²	15	48.7 Å²	48.7	6%	0.057	25%	0.253	C	S	.	.	H	α-helix	trans	-57	-52.5	177.5	-175.4	-88.1	0	0	0	111.8	Q7 L10 W11 F55 L61 T62 T68 L69 M70	Q7-W66 HydrophobicContact CB-CE3 4.41Å; Q7-W66 HydrophobicContact CB-CH2 4.41Å; Q7-W66 HydrophobicContact CB-CZ3 4.01Å; Q7-W66 HydrophobicContact CG-CE3 3.92Å; Q7-W66 HydrophobicContact CG-CZ3 3.98Å; Q7-W66 WeakPolarHBondContact O-CH2 3.47Å; L10-W66 HydrophobicContact CB-CH2 4.22Å; L10-W66 HydrophobicContact CB-CZ2 3.16Å; L10-W66 VanDerWaalsContact CB-NE1 3.33Å; L10-W66 HydrophobicContact CD1-CD2 4.36Å; L10-W66 HydrophobicContact CD1-CG 4.26Å; L10-W66 HydrophobicContact CD1-CZ2 4.39Å; L10-W66 HydrophobicContact CG-CZ2 4.37Å; W11-W66 HydrophobicContact CB-CH2 3.95Å; W11-W66 HydrophobicContact CE3-CH2 4.01Å; F55-W66 HydrophobicContact CB-CZ3 4.16Å; F55-W66 HydrophobicContact CD2-CH2 4.4Å; F55-W66 AromaticContact CD2-CZ3 3.93Å; F55-W66 HydrophobicContact CD2-CZ3 3.93Å; F55-W66 HydrophobicContact CG-CZ3 4.31Å; L61-W66 HydrophobicContact CB-CB 4.38Å; L61-W66 HydrophobicContact CB-CE3 4.28Å; L61-W66 HydrophobicContact CD1-CE3 3.48Å; L61-W66 VanDerWaalsContact CD1-CE3 3.48Å; L61-W66 HydrophobicContact CD1-CZ3 3.96Å; L61-W66 HydrophobicContact CG-CE3 4.44Å; T62-W66 WeakPolarHBondContact O-CB 3.45Å; T62-W66 PolarHBondContact O-N 3.4Å; W66-T68 VanDerWaalsContact C-N 3.27Å; W66-T68 PolarHBondContact O-N 3.27Å; W66-L69 PolarHBondContact O-N 3.02Å; W66-M70 HydrophobicContact CD2-CE 4.4Å; W66-M70 HydrophobicContact CD2-CG 4.37Å; W66-M70 HydrophobicContact CG-CG 4.43Å; W66-M70 HydrophobicContact CH2-CE 3.47Å; W66-M70 VanDerWaalsContact CH2-CE 3.47Å; W66-M70 HydrophobicContact CZ2-CE 3.04Å; W66-M70 HydrophobicContact CZ2-CG 4.23Å; W66-M70 HydrophobicContact CZ2-SD 4.45Å; W66-M70 HydrophobicContact CZ3-CE 4.3Å; W66-M70 WeakPolarHBondContact O-CB 2.97Å; W66-M70 WeakPolarHBondContact O-CG 3.48Å; W66-M70 PolarHBondContact O-N 3.35Å
67	V	70.6	Confident	67.6	Low	63 Å²	63	53.5 Å²	53.5	38%	0.382	29%	0.293	S	S	.	.	H	α-helix	trans	-60.4	-39.3	178.6	168.8	0	0	0	0	110.9	P63 F64 Q65 M70 K71	P63-V67 WeakPolarHBondContact O-CB 2.82Å; P63-V67 WeakPolarHBondContact O-CG2 3.24Å; P63-V67 PolarHBondContact O-N 3.22Å; F64-V67 PolarHBondContact O-N 3.29Å; Q65-V67 PolarHBondContact O-N 2.96Å; V67-M70 PolarHBondContact O-N 2.86Å; V67-K71 HydrophobicContact CG1-CD 3.57Å; V67-K71 HydrophobicContact CG1-CG 3.96Å; V67-K71 WeakPolarHBondContact O-CB 3.31Å; V67-K71 WeakPolarHBondContact O-CG 3.16Å; V67-K71 PolarHBondContact O-N 3.5Å
68	T	70.3	Confident	65.1	Low	24 Å²	24	59.7 Å²	59.7	15%	0.147	33%	0.331	C	S	.	.	H	α-helix	trans	-66.5	-43.3	178.7	-58.1	0	0	0	0	111.6	F64 Q65 W66 N72 P94	F64-T68 WeakPolarHBondContact O-CB 3.38Å; F64-T68 PolarHBondContact O-N 3.36Å; F64-T68 PolarHBondContact O-OG1 3.27Å; Q65-T68 PolarHBondContact O-N 2.76Å; W66-T68 VanDerWaalsContact C-N 3.27Å; W66-T68 PolarHBondContact O-N 3.27Å; T68-N72 VanDerWaalsContact O-CB 3.31Å; T68-N72 WeakPolarHBondContact O-CB 3.38Å; T68-N72 PolarHBondContact O-N 2.84Å; T68-N72 PolarHBondContact O-ND2 3.19Å; T68-P94 HydrophobicContact CG2-CB 3.8Å; T68-P94 HydrophobicContact CG2-CG 3.86Å
69	L	68.3	Low	62.3	Low	12 Å²	12	64.5 Å²	64.5	6%	0.063	36%	0.364	C	S	.	.	H	α-helix	trans	-63.8	-44.9	175.5	-71.2	168.5	0	0	0	111.3	F55 L61 Q65 W66 N72 S73 F95 L222 L226	F55-L69 HydrophobicContact CD1-CD1 4.38Å; F55-L69 HydrophobicContact CE1-CD1 3.79Å; F55-L69 HydrophobicContact CZ-CD1 4.03Å; L61-L69 HydrophobicContact CD1-CD1 3.38Å; L61-L69 HydrophobicContact CD2-CD1 3.92Å; L61-L69 HydrophobicContact CG-CD1 4.29Å; Q65-L69 WeakPolarHBondContact O-CB 3.5Å; Q65-L69 VanDerWaalsContact O-CG 3.28Å; Q65-L69 WeakPolarHBondContact O-CG 3Å; Q65-L69 PolarHBondContact O-N 3.21Å; W66-L69 PolarHBondContact O-N 3.02Å; L69-N72 PolarHBondContact O-N 3.26Å; L69-S73 PolarHBondContact O-N 3.26Å; L69-F95 HydrophobicContact CD1-CZ 4.15Å; L69-F95 HydrophobicContact CD2-CE2 4.5Å; L69-F95 HydrophobicContact CD2-CZ 4.09Å; L69-F95 HydrophobicContact CG-CZ 4.32Å; L69-L222 HydrophobicContact CD2-CD2 4.07Å; L69-L226 HydrophobicContact CD2-CD1 3.53Å; L69-L226 HydrophobicContact CD2-CD2 4.25Å; L69-L226 HydrophobicContact CD2-CG 4.46Å
70	M	65	Low	59.5	Low	38 Å²	38	70.5 Å²	70.5	19%	0.187	41%	0.407	C	S	.	.	H	α-helix	trans	-75.4	-40.3	-176.4	-69	-52.8	-174.4	0	0	114.1	W11 A14 W66 V67 N72 S73	W11-M70 HydrophobicContact CE3-CE 3.66Å; W11-M70 HydrophobicContact CZ3-CE 3.85Å; A14-M70 HydrophobicContact CB-CE 3.86Å; A14-M70 HydrophobicContact CB-SD 4.29Å; W66-M70 HydrophobicContact CD2-CE 4.4Å; W66-M70 HydrophobicContact CD2-CG 4.37Å; W66-M70 HydrophobicContact CG-CG 4.43Å; W66-M70 HydrophobicContact CH2-CE 3.47Å; W66-M70 VanDerWaalsContact CH2-CE 3.47Å; W66-M70 HydrophobicContact CZ2-CE 3.04Å; W66-M70 HydrophobicContact CZ2-CG 4.23Å; W66-M70 HydrophobicContact CZ2-SD 4.45Å; W66-M70 HydrophobicContact CZ3-CE 4.3Å; W66-M70 WeakPolarHBondContact O-CB 2.97Å; W66-M70 WeakPolarHBondContact O-CG 3.48Å; W66-M70 PolarHBondContact O-N 3.35Å; V67-M70 PolarHBondContact O-N 2.86Å; M70-N72 PolarHBondContact O-N 3.35Å; M70-S73 PolarHBondContact O-N 2.94Å
71	K	60.4	Low	56.8	Low	140 Å²	140	78.7 Å²	78.7	61%	0.609	44%	0.441	S	S	*	.	H	α-helix	trans	-58.1	-31	173	-79.2	180	174.8	175.8	0	111.4	V67	V67-K71 HydrophobicContact CG1-CD 3.57Å; V67-K71 HydrophobicContact CG1-CG 3.96Å; V67-K71 WeakPolarHBondContact O-CB 3.31Å; V67-K71 WeakPolarHBondContact O-CG 3.16Å; V67-K71 PolarHBondContact O-N 3.5Å
72	N	50.2	Low	54.3	Low	25 Å²	25	87.5 Å²	87.5	13%	0.134	49%	0.487	C	S	.	.	H	α-helix	trans	-94.2	-16.8	-175	-67.2	-24.5	0	0	0	113.9	T68 L69 M70 Q74 R75	T68-N72 VanDerWaalsContact O-CB 3.31Å; T68-N72 WeakPolarHBondContact O-CB 3.38Å; T68-N72 PolarHBondContact O-N 2.84Å; T68-N72 PolarHBondContact O-ND2 3.19Å; L69-N72 PolarHBondContact O-N 3.26Å; M70-N72 PolarHBondContact O-N 3.35Å; N72-Q74 PolarHBondContact O-N 3.1Å; N72-R75 PolarHBondContact O-N 3.43Å
73	S	44.5	Very low	51.7	Low	85 Å²	85	96.7 Å²	96.7	59%	0.594	52%	0.519	S	S	*	.	H	α-helix	trans	-69.6	-15.5	168.4	-171.9	0	0	0	0	113.1	L69 M70 R75	L69-S73 PolarHBondContact O-N 3.26Å; M70-S73 PolarHBondContact O-N 2.94Å; S73-R75 VanDerWaalsContact C-N 3.29Å; S73-R75 PolarHBondContact O-N 2.86Å
74	Q	36.4	Very low	49.6	Very low	138 Å²	138	104.4 Å²	104.4	65%	0.645	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	5.2	177.9	-63.8	-179.2	1.5	0	0	113.6	N72	N72-Q74 PolarHBondContact O-N 3.1Å
75	R	38.8	Very low	47.5	Very low	142 Å²	142	106.9 Å²	106.9	54%	0.536	55%	0.554	S	S	.	*	S	Bend	trans	-104	117.4	-179	-69	-176.2	177.6	179.8	0.7	111.7	N72 S73	N72-R75 PolarHBondContact O-N 3.43Å; S73-R75 VanDerWaalsContact C-N 3.29Å; S73-R75 PolarHBondContact O-N 2.86Å
76	P	34.9	Very low	44.9	Very low	110 Å²	110	115.7 Å²	115.7	71%	0.714	59%	0.593	S	S	*	*			trans	-65.3	144	-178.8	23.5	-30.3	0	0	0	112.8	T78	P76-T78 PolarHBondContact O-N 3.18Å
77	A	37.4	Very low	43.1	Very low	103 Å²	103	119.8 Å²	119.8	85%	0.851	61%	0.608	S	S	*	*	S	Bend	trans	-76.3	6.1	-172.8	0	0	0	0	0	115.3	S79	A77-S79 PolarHBondContact O-N 3.09Å
78	T	34.6	Very low	41.4	Very low	130 Å²	130	122.8 Å²	122.8	80%	0.798	62%	0.616	S	S	*	*			trans	-98	71.9	-173.4	56.5	0	0	0	0	111.7	P76	P76-T78 PolarHBondContact O-N 3.18Å
79	S	35.9	Very low	39.3	Very low	101 Å²	101	129.2 Å²	129.2	71%	0.706	66%	0.655	S	S	*	*			trans	-139.4	94.3	157.1	75.9	0	0	0	0	109.8	A77 K81	A77-S79 PolarHBondContact O-N 3.09Å; S79-K81 PolarHBondContact O-N 2.81Å
80	S	31.4	Very low	37.5	Very low	127 Å²	127	132.2 Å²	132.2	89%	0.888	69%	0.689	S	S	*	*			trans	-65.6	79.5	168.2	51.9	0	0	0	0	110.2
81	K	35.3	Very low	36.5	Very low	189 Å²	189	136.7 Å²	136.7	82%	0.822	71%	0.71	S	S	*	*			trans	-162.4	88.6	154.5	-105.1	173.1	-170.1	178.5	0	106.2	S79 R83	S79-K81 PolarHBondContact O-N 2.81Å; K81-R83 PolarHBondContact O-N 3.32Å
82	L	30.7	Very low	36	Very low	188 Å²	188	134 Å²	134	98%	0.984	70%	0.702	S	S	*	*			trans	-63.3	73	168.6	-90.6	136.2	0	0	0	109.2
83	R	29.9	Very low	36.6	Very low	216 Å²	216	134.4 Å²	134.4	82%	0.815	71%	0.706	S	S	*	*			trans	-103	112.9	162.5	-143.4	177.9	81.7	169.6	4.1	105.9	K81 I85	K81-R83 PolarHBondContact O-N 3.32Å; R83-I85 WeakPolarHBondContact O-CG1 3.15Å; R83-I85 PolarHBondContact O-N 3.21Å
84	R	32.3	Very low	37.9	Very low	242 Å²	242	130.9 Å²	130.9	91%	0.913	68%	0.681	S	S	*	*			trans	-37.2	97.1	175.3	-159.8	177.5	-167.3	167.5	2.9	109.4	K86	R84-K86 PolarHBondContact O-N 3.44Å
85	I	34.1	Very low	40.1	Very low	154 Å²	154	125.4 Å²	125.4	79%	0.79	66%	0.655	S	S	*	*			trans	-73.7	101	177.9	-61.2	-178.5	0	0	0	104.9	R83 R87	R83-I85 WeakPolarHBondContact O-CG1 3.15Å; R83-I85 PolarHBondContact O-N 3.21Å; I85-R87 PolarHBondContact O-N 2.63Å
86	K	28.8	Very low	42.3	Very low	187 Å²	187	123.7 Å²	123.7	81%	0.813	65%	0.649	S	S	*	*			trans	-53.3	131.8	166.6	-70.5	-177.8	174.7	-176.6	0	107.1	R84 K88	R84-K86 PolarHBondContact O-N 3.44Å; K86-K88 PolarHBondContact O-N 3.47Å
87	R	36.5	Very low	44.9	Very low	101 Å²	101	121.1 Å²	121.1	38%	0.381	63%	0.632	S	S	.	*			trans	-45.5	142.4	167.3	-74.4	-176.2	177.9	130.9	3.3	108.4	I85 V89 D225	I85-R87 PolarHBondContact O-N 2.63Å; R87-V89 PolarHBondContact O-N 3.4Å; R87-D225 PolarHBondContact NH2-O 2.94Å
88	K	33.2	Very low	47.5	Very low	126 Å²	126	116.8 Å²	116.8	55%	0.548	59%	0.593	S	S	.	*			trans	-50.6	120.6	163.1	-95.8	-173	174.4	-177.1	0	105.6	K86 G90 E91	K86-K88 PolarHBondContact O-N 3.47Å; K88-G90 PolarHBondContact O-N 3.12Å; K88-E91 PolarHBondContact O-N 3.22Å; K88-E91 VanDerWaalsContact O-N 3.11Å
89	V	27.6	Very low	50.1	Low	159 Å²	159	117.8 Å²	117.8	96%	0.964	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.5	112.2	176.3	171.2	0	0	0	0	106.6	R87	R87-V89 PolarHBondContact O-N 3.4Å
90	G	28.9	Very low	52.6	Low	76 Å²	76	115.7 Å²	115.7	78%	0.784	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	117.3	-13.2	-179.7	0	0	0	0	0	117.1	K88	K88-G90 PolarHBondContact O-N 3.12Å
91	E	45.7	Very low	55.5	Low	131 Å²	131	111.4 Å²	111.4	61%	0.612	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-83	120.1	170	-80.3	179.9	-168.2	0	0	110.5	K88	K88-E91 PolarHBondContact O-N 3.22Å; K88-E91 VanDerWaalsContact O-N 3.11Å
92	D	48.9	Very low	58.3	Low	85 Å²	85	107 Å²	107	46%	0.455	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-61	134	178	-76.1	-42.2	0	0	0	110.6	R96	D92-R96 IonicContact OD1-NH2 3.37Å; D92-R96 IonicContact OD2-CZ 3.49Å; D92-R96 VanDerWaalsContact OD2-CZ 3.31Å; D92-R96 IonicContact OD2-NH1 2.96Å; D92-R96 IonicContact OD2-NH2 2.68Å; D92-R96 PolarHBondContact OD2-NH2 3.46Å
93	P	63.7	Low	61.5	Low	32 Å²	32	98 Å²	98	21%	0.208	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-50.2	136.6	169.4	6.6	-14.6	0	0	0	110.4	F95 R96	P93-F95 PolarHBondContact O-N 2.92Å; P93-R96 HydrophobicContact CG-CG 4.3Å; P93-R96 WeakPolarHBondContact O-CG 2.99Å
94	P	71.1	Confident	64.6	Low	11 Å²	11	89.1 Å²	89.1	7%	0.071	46%	0.461	C	S	.	.	S	Bend	trans	-58.5	-33	173.4	21.4	-30.1	0	0	0	111.6	Q65 T68 L226	Q65-P94 HydrophobicContact CG-CB 4.37Å; Q65-P94 WeakPolarHBondContact CG-O 3.14Å; Q65-P94 PolarHBondContact NE2-O 2.89Å; T68-P94 HydrophobicContact CG2-CB 3.8Å; T68-P94 HydrophobicContact CG2-CG 3.86Å; P94-L226 HydrophobicContact CG-CD2 3.62Å
95	F	83.3	Confident	67.8	Low	24 Å²	24	78.4 Å²	78.4	11%	0.105	42%	0.421	C	S	.	.	S	Bend	trans	-112.5	97.1	178.7	-48.4	-60.3	0	0	0	108.6	L61 Q65 L69 P93 V159 L192 L226	L61-F95 HydrophobicContact CD2-CE1 4.31Å; Q65-F95 HydrophobicContact CB-CE1 4.38Å; Q65-F95 HydrophobicContact CG-CD1 4.14Å; Q65-F95 HydrophobicContact CG-CE1 3.97Å; L69-F95 HydrophobicContact CD1-CZ 4.15Å; L69-F95 HydrophobicContact CD2-CE2 4.5Å; L69-F95 HydrophobicContact CD2-CZ 4.09Å; L69-F95 HydrophobicContact CG-CZ 4.32Å; P93-F95 PolarHBondContact O-N 2.92Å; F95-V159 HydrophobicContact CB-CG1 4.15Å; F95-V159 HydrophobicContact CD1-CB 3.59Å; F95-V159 HydrophobicContact CD1-CG1 3.4Å; F95-V159 VanDerWaalsContact CD1-CG1 3.4Å; F95-V159 HydrophobicContact CE1-CB 3.85Å; F95-V159 HydrophobicContact CE1-CG1 3.92Å; F95-V159 HydrophobicContact CE1-CG2 4.43Å; F95-V159 HydrophobicContact CG-CB 4.48Å; F95-V159 HydrophobicContact CG-CG1 3.82Å; F95-L192 HydrophobicContact CD2-CD1 3.97Å; F95-L192 HydrophobicContact CE2-CD1 3.67Å; F95-L192 HydrophobicContact CZ-CD1 4.19Å; F95-L192 HydrophobicContact CZ-CD2 4.38Å; F95-L226 HydrophobicContact CE2-CB 4.29Å; F95-L226 HydrophobicContact CE2-CD2 4.2Å
96	R	84.6	Confident	70.8	Confident	106 Å²	106	74 Å²	74	40%	0.4	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-83.5	133.2	-179.9	-61.8	-175.9	-168.2	-178.4	5	109.6	D92 P93 G160 K161	D92-R96 IonicContact OD1-NH2 3.37Å; D92-R96 IonicContact OD2-CZ 3.49Å; D92-R96 VanDerWaalsContact OD2-CZ 3.31Å; D92-R96 IonicContact OD2-NH1 2.96Å; D92-R96 IonicContact OD2-NH2 2.68Å; D92-R96 PolarHBondContact OD2-NH2 3.46Å; P93-R96 HydrophobicContact CG-CG 4.3Å; P93-R96 WeakPolarHBondContact O-CG 2.99Å; R96-G160 CarbonylContact O-C 3.59Å; R96-G160 WeakPolarHBondContact O-CA 3.46Å; R96-K161 HydrophobicContact CB-CB 4.5Å; R96-K161 PolarHBondContact O-N 2.84Å
97	P	88.4	Confident	74	Confident	55 Å²	55	66.9 Å²	66.9	36%	0.357	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-67.9	157.3	168.2	29.5	-32.9	0	0	0	110.3	L284 Y285	P97-L284 HydrophobicContact CB-CD1 4.49Å; P97-L284 HydrophobicContact CB-CD2 4.42Å; P97-L284 HydrophobicContact CB-CG 4.34Å; P97-Y285 WeakPolarHBondContact CA-OH 3.48Å; P97-Y285 HydrophobicContact CB-CD1 4.46Å; P97-Y285 HydrophobicContact CB-CE1 3.56Å
98	W	93.5	Very high	76.8	Confident	13 Å²	13	64.7 Å²	64.7	5%	0.049	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-60	147.1	165.7	-65.2	86.7	0	0	0	111.5	I103 E144 I146 K161 Q166 A188 Y285	W98-I103 HydrophobicContact CB-CD1 3.92Å; W98-I103 HydrophobicContact CB-CG1 3.86Å; W98-I103 HydrophobicContact CD2-CD1 4.07Å; W98-I103 HydrophobicContact CD2-CG1 3.92Å; W98-I103 HydrophobicContact CD2-CG2 3.88Å; W98-I103 HydrophobicContact CE3-CG1 4.3Å; W98-I103 HydrophobicContact CE3-CG2 3.95Å; W98-I103 HydrophobicContact CG-CD1 3.55Å; W98-I103 HydrophobicContact CG-CG1 3.7Å; W98-I103 HydrophobicContact CG-CG2 4.49Å; W98-I103 HydrophobicContact CH2-CG2 4.18Å; W98-I103 HydrophobicContact CZ2-CG2 4.09Å; W98-I103 HydrophobicContact CZ3-CG2 4.1Å; W98-E144 HydrophobicContact CZ3-CG 4.08Å; W98-I146 HydrophobicContact CH2-CG1 4.06Å; W98-I146 HydrophobicContact CZ2-CD1 4.14Å; W98-I146 HydrophobicContact CZ2-CG1 3.72Å; W98-K161 HydrophobicContact CD2-CB 4.01Å; W98-K161 HydrophobicContact CD2-CG 4.23Å; W98-K161 HydrophobicContact CE3-CB 4.34Å; W98-K161 HydrophobicContact CE3-CD 4.25Å; W98-K161 HydrophobicContact CE3-CG 4.03Å; W98-K161 HydrophobicContact CG-CB 4.23Å; W98-K161 HydrophobicContact CZ3-CG 4.26Å; W98-Q166 HydrophobicContact CH2-CG 4.32Å; W98-Q166 HydrophobicContact CZ2-CG 4.23Å; W98-A188 PolarHBondContact NE1-O 3.09Å; W98-Y285 HydrophobicContact CB-CE1 4.01Å; W98-Y285 PolarHBondContact N-OH 2.99Å; W98-Y285 WeakPolarHBondContact O-CE1 3.35Å
99	E	89.5	Confident	79.7	Confident	151 Å²	151	64.6 Å²	64.6	71%	0.706	37%	0.374	S	S	*	.	S	Bend	trans	-81.7	120.5	175.7	-73.6	163.9	-133.1	0	0	109.6	K161	E99-K161 VanDerWaalsContact CD-NZ 3.29Å; E99-K161 IonicContact OE1-NZ 3.29Å; E99-K161 PolarHBondContact OE1-NZ 3.11Å; E99-K161 IonicContact OE2-NZ 3.55Å
100	G	87.9	Confident	82.9	Confident	56 Å²	56	59.5 Å²	59.5	58%	0.577	35%	0.346	S	S	*	.	S	Bend	trans	75.9	-165.3	-178.3	0	0	0	0	0	113.8
101	S	91	Very high	86	Confident	37 Å²	37	57 Å²	57	26%	0.259	31%	0.314	S	S	.	.	S	Bend	trans	-103.5	-5.5	-174.6	51.7	0	0	0	0	114	L132 K133	S101-L132 CarbonylContact O-C 3.56Å; S101-L132 WeakPolarHBondContact O-CA 3.33Å; S101-K133 PolarHBondContact O-N 3.49Å
102	L	95.3	Very high	88.4	Confident	96 Å²	96	57.8 Å²	57.8	50%	0.503	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	120.5	179.6	-171.6	153.7	0	0	0	109.9	K133 K135	L102-K133 WeakPolarHBondContact CA-O 3.34Å; L102-K135 HydrophobicContact CD1-CD 4.2Å; L102-K135 HydrophobicContact CG-CB 4.42Å
103	I	96.4	Very high	90.6	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	112.8	176.6	-59.6	170.7	0	0	0	107.9	W98 L132 K133 L134 K135 I146 L189	W98-I103 HydrophobicContact CB-CD1 3.92Å; W98-I103 HydrophobicContact CB-CG1 3.86Å; W98-I103 HydrophobicContact CD2-CD1 4.07Å; W98-I103 HydrophobicContact CD2-CG1 3.92Å; W98-I103 HydrophobicContact CD2-CG2 3.88Å; W98-I103 HydrophobicContact CE3-CG1 4.3Å; W98-I103 HydrophobicContact CE3-CG2 3.95Å; W98-I103 HydrophobicContact CG-CD1 3.55Å; W98-I103 HydrophobicContact CG-CG1 3.7Å; W98-I103 HydrophobicContact CG-CG2 4.49Å; W98-I103 HydrophobicContact CH2-CG2 4.18Å; W98-I103 HydrophobicContact CZ2-CG2 4.09Å; W98-I103 HydrophobicContact CZ3-CG2 4.1Å; I103-L132 HydrophobicContact CD1-CD1 4.33Å; I103-L132 HydrophobicContact CD1-CD2 4.47Å; I103-K133 PolarHBondContact N-O 3.01Å; I103-L134 HydrophobicContact CB-CG 4.21Å; I103-L134 CarbonylContact O-C 2.95Å; I103-L134 VanDerWaalsContact O-CA 3.27Å; I103-L134 WeakPolarHBondContact O-CA 3.47Å; I103-K135 PolarHBondContact O-N 2.71Å; I103-I146 HydrophobicContact CG2-CD1 3.77Å; I103-I146 HydrophobicContact CG2-CG1 4.12Å; I103-L189 HydrophobicContact CD1-CD2 3.37Å
104	P	96.9	Very high	92.1	Very high	29 Å²	29	59.3 Å²	59.3	19%	0.188	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	140.3	179.4	31.8	-34.6	0	0	0	110.2	K135 H137 F142 E144 G145 I146	P104-K135 WeakPolarHBondContact CA-O 3.16Å; P104-H137 HydrophobicContact CB-CB 4.41Å; P104-F142 HydrophobicContact CB-CE2 4.07Å; P104-F142 HydrophobicContact CG-CE2 4.37Å; P104-E144 WeakPolarHBondContact CG-O 3.14Å; P104-G145 CarbonylContact O-C 3.51Å; P104-G145 WeakPolarHBondContact O-CA 3.12Å; P104-I146 PolarHBondContact O-N 3Å
105	Y	97.7	Very high	93.3	Very high	18 Å²	18	58.8 Å²	58.8	7%	0.071	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	160.3	173.8	80	-92.3	0	0	0	113	F107 I123 L134 K135 E136 H137 I146 F148	Y105-F107 HydrophobicContact CD2-CZ 4.42Å; Y105-F107 HydrophobicContact CE2-CD2 4.23Å; Y105-F107 HydrophobicContact CE2-CE1 4.01Å; Y105-F107 AromaticContact CE2-CE2 3.62Å; Y105-F107 HydrophobicContact CE2-CE2 3.62Å; Y105-F107 AromaticContact CE2-CZ 3.5Å; Y105-F107 HydrophobicContact CE2-CZ 3.5Å; Y105-I123 HydrophobicContact CD1-CD1 4.03Å; Y105-I123 HydrophobicContact CD2-CD1 4.29Å; Y105-I123 HydrophobicContact CE1-CD1 3.66Å; Y105-I123 HydrophobicContact CE2-CD1 3.98Å; Y105-I123 HydrophobicContact CG-CD1 4.31Å; Y105-L134 HydrophobicContact CD1-CB 3.98Å; Y105-L134 HydrophobicContact CE1-CB 4.3Å; Y105-L134 WeakPolarHBondContact CE1-O 3.49Å; Y105-K135 WeakPolarHBondContact CD1-O 3.38Å; Y105-K135 VanDerWaalsContact CE1-C 3.44Å; Y105-K135 PolarHBondContact N-O 3.2Å; Y105-E136 HydrophobicContact CE1-CB 3.98Å; Y105-E136 HydrophobicContact CE2-CB 3.97Å; Y105-E136 HydrophobicContact CE2-CG 3.99Å; Y105-E136 CarbonylContact O-C 3.54Å; Y105-E136 WeakPolarHBondContact O-CA 3.37Å; Y105-H137 PolarHBondContact O-N 3.48Å; Y105-I146 CarbonylContact C-O 3.54Å; Y105-I146 WeakPolarHBondContact CA-O 3.24Å; Y105-I146 WeakPolarHBondContact CB-O 3.11Å; Y105-F148 AromaticContact CD2-CD2 3.82Å; Y105-F148 HydrophobicContact CD2-CD2 3.82Å; Y105-F148 AromaticContact CD2-CE2 3.67Å; Y105-F148 HydrophobicContact CD2-CE2 3.67Å; Y105-F148 HydrophobicContact CE2-CE2 4.46Å; Y105-F148 HydrophobicContact CG-CD2 4.4Å; Y105-F148 AromaticContact CG-CE2 3.88Å; Y105-F148 HydrophobicContact CG-CE2 3.88Å
106	R	97	Very high	94	Very high	60 Å²	60	62.3 Å²	62.3	23%	0.226	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	155.5	170.9	-73.5	-168.4	174.7	174.4	2.5	111.4	H137 G140 F142 I146 L147 F148	R106-H137 HydrophobicContact CG-CB 4.04Å; R106-H137 WeakPolarHBondContact CG-O 3.03Å; R106-H137 PolarHBondContact NE-O 3.01Å; R106-H137 PolarHBondContact NH2-CD2 3.11Å; R106-H137 PolarHBondContact NH2-NE2 3.36Å; R106-H137 VanDerWaalsContact NH2-NE2 3.13Å; R106-G140 PolarHBondContact NH2-O 3.17Å; R106-F142 HydrophobicContact CB-CD1 4.41Å; R106-F142 HydrophobicContact CB-CE1 3.95Å; R106-F142 HydrophobicContact CB-CZ 4.15Å; R106-F142 HydrophobicContact CG-CD1 4.04Å; R106-F142 HydrophobicContact CG-CD2 4.22Å; R106-F142 HydrophobicContact CG-CE1 3.92Å; R106-F142 HydrophobicContact CG-CE2 4.11Å; R106-F142 HydrophobicContact CG-CG 4.17Å; R106-F142 HydrophobicContact CG-CZ 3.96Å; R106-I146 PolarHBondContact N-O 2.98Å; R106-L147 HydrophobicContact CB-CD1 3.79Å; R106-F148 PolarHBondContact O-N 3.21Å
107	F	96.5	Very high	94.6	Very high	39 Å²	39	60 Å²	60	17%	0.171	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	129.1	165.2	-61.2	-61.4	0	0	0	109.5	Y105 L111 R116 V119 V120 E136 F148	Y105-F107 HydrophobicContact CD2-CZ 4.42Å; Y105-F107 HydrophobicContact CE2-CD2 4.23Å; Y105-F107 HydrophobicContact CE2-CE1 4.01Å; Y105-F107 AromaticContact CE2-CE2 3.62Å; Y105-F107 HydrophobicContact CE2-CE2 3.62Å; Y105-F107 AromaticContact CE2-CZ 3.5Å; Y105-F107 HydrophobicContact CE2-CZ 3.5Å; F107-L111 HydrophobicContact CB-CD2 4.48Å; F107-L111 HydrophobicContact CD1-CD2 3.41Å; F107-L111 VanDerWaalsContact CD1-CD2 3.41Å; F107-L111 HydrophobicContact CE1-CD2 3.97Å; F107-L111 HydrophobicContact CG-CD2 4.28Å; F107-R116 HydrophobicContact CD1-CG 4.25Å; F107-R116 HydrophobicContact CD2-CG 4.26Å; F107-R116 HydrophobicContact CE1-CG 3.94Å; F107-R116 HydrophobicContact CE2-CG 3.96Å; F107-R116 HydrophobicContact CG-CG 4.38Å; F107-R116 HydrophobicContact CZ-CG 3.79Å; F107-V119 HydrophobicContact CE1-CB 3.94Å; F107-V119 HydrophobicContact CE1-CG1 3.62Å; F107-V119 HydrophobicContact CZ-CG1 4.22Å; F107-V120 HydrophobicContact CE2-CG2 4.5Å; F107-V120 HydrophobicContact CZ-CG2 3.86Å; F107-E136 WeakPolarHBondContact CD2-OE1 3.41Å; F107-F148 HydrophobicContact CD1-CB 4.06Å; F107-F148 HydrophobicContact CD1-CD2 4.32Å; F107-F148 HydrophobicContact CD1-CG 4.5Å; F107-F148 HydrophobicContact CE1-CD2 4.24Å
108	D	95.1	Very high	95	Very high	55 Å²	55	57.6 Å²	57.6	29%	0.294	31%	0.312	S	S	.	.			trans	-73.8	149.1	167	-175.9	-97.3	0	0	0	110.6	S110 L111 L147 F148 V149	D108-S110 PolarHBondContact O-N 2.55Å; D108-S110 WeakPolarHBondContact OD1-CB 3.49Å; D108-S110 PolarHBondContact OD1-N 2.86Å; D108-S110 PolarHBondContact OD1-OG 2.9Å; D108-L111 WeakPolarHBondContact O-CB 3.15Å; D108-L111 PolarHBondContact O-N 3.11Å; D108-L147 HydrophobicContact CB-CD1 4.12Å; D108-L147 HydrophobicContact CB-CG 4.29Å; D108-F148 WeakPolarHBondContact CB-O 3.44Å; D108-F148 PolarHBondContact N-O 3.07Å; D108-V149 HydrophobicContact CB-CB 4.34Å; D108-V149 HydrophobicContact CB-CG1 3.8Å
109	S	94.3	Very high	95.2	Very high	123 Å²	123	57 Å²	57	86%	0.86	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.5	179.2	63.3	0	0	0	0	114.4	L111	S109-L111 VanDerWaalsContact C-N 3.32Å
110	S	94.8	Very high	95.6	Very high	52 Å²	52	53 Å²	53	36%	0.364	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-20.5	176.4	62	0	0	0	0	114.3	D108 R112 E150	D108-S110 PolarHBondContact O-N 2.55Å; D108-S110 WeakPolarHBondContact OD1-CB 3.49Å; D108-S110 PolarHBondContact OD1-N 2.86Å; D108-S110 PolarHBondContact OD1-OG 2.9Å; S110-R112 PolarHBondContact O-N 2.83Å; S110-E150 WeakPolarHBondContact O-CB 3.23Å; S110-E150 PolarHBondContact OG-N 2.76Å; S110-E150 VanDerWaalsContact OG-N 3.12Å
111	L	94.8	Very high	96.1	Very high	24 Å²	24	56 Å²	56	13%	0.126	29%	0.293	C	S	.	.			trans	-68.6	122.2	-171.8	-159.9	71.4	0	0	0	111.5	F107 D108 S109 R116 V119 F148 E150 I170	F107-L111 HydrophobicContact CB-CD2 4.48Å; F107-L111 HydrophobicContact CD1-CD2 3.41Å; F107-L111 VanDerWaalsContact CD1-CD2 3.41Å; F107-L111 HydrophobicContact CE1-CD2 3.97Å; F107-L111 HydrophobicContact CG-CD2 4.28Å; D108-L111 WeakPolarHBondContact O-CB 3.15Å; D108-L111 PolarHBondContact O-N 3.11Å; S109-L111 VanDerWaalsContact C-N 3.32Å; L111-R116 HydrophobicContact CD2-CB 4.14Å; L111-V119 HydrophobicContact CD2-CG2 4.37Å; L111-F148 HydrophobicContact CD2-CB 4.13Å; L111-E150 HydrophobicContact CD1-CB 4.46Å; L111-I170 HydrophobicContact CD1-CB 4.25Å
112	R	95.5	Very high	96.5	Very high	148 Å²	148	54.3 Å²	54.3	56%	0.558	28%	0.281	S	S	*	.			trans	-70.3	153.7	176.3	-68	173.8	179.2	-93.1	-0.2	111	S110 G114 S115 R116 E150 W172	S110-R112 PolarHBondContact O-N 2.83Å; R112-G114 VanDerWaalsContact C-N 3.31Å; R112-G114 PolarHBondContact O-N 3.35Å; R112-S115 WeakPolarHBondContact O-CA 3.39Å; R112-S115 WeakPolarHBondContact O-CB 3.31Å; R112-S115 PolarHBondContact O-N 3.38Å; R112-R116 PolarHBondContact O-N 2.93Å; R112-E150 PolarHBondContact N-OE2 2.77Å; R112-W172 HydrophobicContact CB-CD2 4.48Å
113	E	95.7	Very high	96.7	Very high	123 Å²	123	49.9 Å²	49.9	58%	0.575	26%	0.258	S	S	*	.	H	α-helix	trans	-56.9	-42.8	-177	-175.5	54.7	-150.7	0	0	112.8	S115 R116 V117	E113-S115 VanDerWaalsContact C-N 3.34Å; E113-S115 PolarHBondContact O-N 3.13Å; E113-R116 WeakPolarHBondContact O-CB 3.28Å; E113-R116 PolarHBondContact O-N 3.13Å; E113-R116 VanDerWaalsContact O-N 3.16Å; E113-V117 WeakPolarHBondContact O-CG2 3.42Å; E113-V117 PolarHBondContact O-N 3.37Å
114	G	94.8	Very high	96.7	Very high	26 Å²	26	57.1 Å²	57.1	27%	0.268	29%	0.285	S	S	.	.	H	α-helix	trans	-64.6	-36.6	176.6	0	0	0	0	0	113.5	R112 V117 A118	R112-G114 VanDerWaalsContact C-N 3.31Å; R112-G114 PolarHBondContact O-N 3.35Å; G114-V117 PolarHBondContact O-N 2.72Å; G114-A118 PolarHBondContact O-N 2.89Å
115	S	96.6	Very high	96.8	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.1	-43.2	171.9	-57.7	0	0	0	0	110.6	R112 E113 V117 A118 V119 E150	R112-S115 WeakPolarHBondContact O-CA 3.39Å; R112-S115 WeakPolarHBondContact O-CB 3.31Å; R112-S115 PolarHBondContact O-N 3.38Å; E113-S115 VanDerWaalsContact C-N 3.34Å; E113-S115 PolarHBondContact O-N 3.13Å; S115-V117 PolarHBondContact O-N 3.12Å; S115-A118 PolarHBondContact O-N 2.62Å; S115-V119 VanDerWaalsContact O-CG2 3.3Å; S115-V119 WeakPolarHBondContact O-CG2 3.35Å; S115-V119 PolarHBondContact O-N 3.05Å; S115-E150 PolarHBondContact OG-OE2 2.68Å
116	R	97	Very high	96.8	Very high	97 Å²	97	56.4 Å²	56.4	37%	0.366	28%	0.28	S	S	.	.	H	α-helix	trans	-59.2	-46.5	175.7	-170.2	-176.4	-172	-179.2	3.5	111.7	F107 L111 R112 E113 A118 V119 V120 E136	F107-R116 HydrophobicContact CD1-CG 4.25Å; F107-R116 HydrophobicContact CD2-CG 4.26Å; F107-R116 HydrophobicContact CE1-CG 3.94Å; F107-R116 HydrophobicContact CE2-CG 3.96Å; F107-R116 HydrophobicContact CG-CG 4.38Å; F107-R116 HydrophobicContact CZ-CG 3.79Å; L111-R116 HydrophobicContact CD2-CB 4.14Å; R112-R116 PolarHBondContact O-N 2.93Å; E113-R116 WeakPolarHBondContact O-CB 3.28Å; E113-R116 PolarHBondContact O-N 3.13Å; E113-R116 VanDerWaalsContact O-N 3.16Å; R116-A118 VanDerWaalsContact C-N 3.33Å; R116-A118 PolarHBondContact O-N 3.35Å; R116-V119 PolarHBondContact O-N 2.87Å; R116-V120 WeakPolarHBondContact O-CG2 3.35Å; R116-V120 PolarHBondContact O-N 2.81Å; R116-E136 IonicContact NH2-OE1 2.94Å
117	V	97.4	Very high	96.9	Very high	58 Å²	58	56 Å²	56	35%	0.352	28%	0.281	S	S	.	.	H	α-helix	trans	-59.4	-43.7	176.5	171.2	0	0	0	0	111.1	E113 G114 S115 V120 K121	E113-V117 WeakPolarHBondContact O-CG2 3.42Å; E113-V117 PolarHBondContact O-N 3.37Å; G114-V117 PolarHBondContact O-N 2.72Å; S115-V117 PolarHBondContact O-N 3.12Å; V117-V120 PolarHBondContact O-N 2.57Å; V117-K121 HydrophobicContact CG1-CD 4.17Å; V117-K121 WeakPolarHBondContact O-CG 3.06Å; V117-K121 PolarHBondContact O-N 3.47Å; V117-K121 VanDerWaalsContact O-N 3.1Å
118	A	97.3	Very high	96.9	Very high	5 Å²	5	58 Å²	58	4%	0.041	29%	0.291	C	S	.	.	H	α-helix	trans	-62.3	-43.5	176.4	0	0	0	0	0	111.9	G114 S115 R116 K121 A122 A176 V181	G114-A118 PolarHBondContact O-N 2.89Å; S115-A118 PolarHBondContact O-N 2.62Å; R116-A118 VanDerWaalsContact C-N 3.33Å; R116-A118 PolarHBondContact O-N 3.35Å; A118-K121 PolarHBondContact O-N 3.3Å; A118-A122 WeakPolarHBondContact O-CB 3.46Å; A118-A122 PolarHBondContact O-N 2.86Å; A118-A176 WeakPolarHBondContact CB-O 3.3Å; A118-V181 HydrophobicContact CB-CG2 4.05Å
119	V	98.2	Very high	97	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.9	-49.5	176.2	174.7	0	0	0	0	111.9	F107 L111 S115 R116 K121 A122 I123 F148 I170 V181	F107-V119 HydrophobicContact CE1-CB 3.94Å; F107-V119 HydrophobicContact CE1-CG1 3.62Å; F107-V119 HydrophobicContact CZ-CG1 4.22Å; L111-V119 HydrophobicContact CD2-CG2 4.37Å; S115-V119 VanDerWaalsContact O-CG2 3.3Å; S115-V119 WeakPolarHBondContact O-CG2 3.35Å; S115-V119 PolarHBondContact O-N 3.05Å; R116-V119 PolarHBondContact O-N 2.87Å; V119-K121 VanDerWaalsContact C-N 3.29Å; V119-K121 PolarHBondContact O-N 2.82Å; V119-A122 PolarHBondContact O-N 2.92Å; V119-A122 VanDerWaalsContact O-N 3.17Å; V119-I123 HydrophobicContact CG1-CD1 3.67Å; V119-I123 HydrophobicContact CG1-CG1 4.18Å; V119-I123 WeakPolarHBondContact O-CB 3.38Å; V119-I123 VanDerWaalsContact O-CG1 3.32Å; V119-I123 WeakPolarHBondContact O-CG1 3.2Å; V119-I123 PolarHBondContact O-N 3.17Å; V119-F148 HydrophobicContact CB-CD1 4.42Å; V119-F148 HydrophobicContact CG1-CD1 3.72Å; V119-F148 HydrophobicContact CG1-CD2 3.8Å; V119-F148 HydrophobicContact CG1-CE1 3.57Å; V119-F148 HydrophobicContact CG1-CE2 3.65Å; V119-F148 HydrophobicContact CG1-CG 3.83Å; V119-F148 HydrophobicContact CG1-CZ 3.53Å; V119-F148 HydrophobicContact CG2-CB 4.48Å; V119-F148 HydrophobicContact CG2-CD1 3.72Å; V119-F148 HydrophobicContact CG2-CE1 4.12Å; V119-F148 HydrophobicContact CG2-CG 4.14Å; V119-I170 HydrophobicContact CG2-CG1 4.37Å; V119-V181 HydrophobicContact CB-CG1 4.22Å; V119-V181 HydrophobicContact CG2-CG1 3.78Å; V119-V181 HydrophobicContact CG2-CG2 4.48Å
120	V	98.3	Very high	97.2	Very high	68 Å²	68	50.8 Å²	50.8	41%	0.412	24%	0.243	S	C	.	.	H	α-helix	trans	-60	-41.9	-179.9	171.8	0	0	0	0	111.1	F107 R116 V117 R124	F107-V120 HydrophobicContact CE2-CG2 4.5Å; F107-V120 HydrophobicContact CZ-CG2 3.86Å; R116-V120 WeakPolarHBondContact O-CG2 3.35Å; R116-V120 PolarHBondContact O-N 2.81Å; V117-V120 PolarHBondContact O-N 2.57Å; V120-R124 WeakPolarHBondContact O-CB 3.45Å; V120-R124 PolarHBondContact O-N 2.95Å
121	K	98.2	Very high	97.2	Very high	119 Å²	119	48.7 Å²	48.7	52%	0.517	23%	0.228	S	C	.	.	H	α-helix	trans	-65.5	-41.6	176.1	-72.5	178.5	179.5	-178.3	0	112.3	V117 A118 V119 R124 L125 V178	V117-K121 HydrophobicContact CG1-CD 4.17Å; V117-K121 WeakPolarHBondContact O-CG 3.06Å; V117-K121 PolarHBondContact O-N 3.47Å; V117-K121 VanDerWaalsContact O-N 3.1Å; A118-K121 PolarHBondContact O-N 3.3Å; V119-K121 VanDerWaalsContact C-N 3.29Å; V119-K121 PolarHBondContact O-N 2.82Å; K121-R124 WeakPolarHBondContact O-CB 3.44Å; K121-R124 PolarHBondContact O-N 3.36Å; K121-L125 PolarHBondContact O-N 2.76Å; K121-L125 VanDerWaalsContact O-N 3.15Å; K121-V178 HydrophobicContact CB-CG1 4.08Å; K121-V178 HydrophobicContact CB-CG2 3.74Å; K121-V178 HydrophobicContact CD-CG2 3.89Å; K121-V178 HydrophobicContact CG-CG2 4.48Å
122	A	98.4	Very high	97.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.7	-40.9	177.7	0	0	0	0	0	112.4	A118 V119 R124 L125 W126 V178 V181 A182 I185	A118-A122 WeakPolarHBondContact O-CB 3.46Å; A118-A122 PolarHBondContact O-N 2.86Å; V119-A122 PolarHBondContact O-N 2.92Å; V119-A122 VanDerWaalsContact O-N 3.17Å; A122-R124 VanDerWaalsContact C-N 3.29Å; A122-R124 PolarHBondContact O-N 3.25Å; A122-L125 WeakPolarHBondContact O-CB 3.33Å; A122-L125 PolarHBondContact O-N 2.77Å; A122-W126 PolarHBondContact O-N 2.86Å; A122-V178 HydrophobicContact CB-CG1 4.4Å; A122-V178 WeakPolarHBondContact CB-O 3.45Å; A122-V181 HydrophobicContact CB-CB 3.75Å; A122-V181 HydrophobicContact CB-CG1 3.7Å; A122-A182 HydrophobicContact CB-CB 4.04Å; A122-I185 HydrophobicContact CB-CD1 3.93Å
123	I	98.6	Very high	97.4	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-57.6	-45.9	171.7	-73	173.3	0	0	0	110.1	Y105 V119 L125 W126 Q127 L134 F148 I185	Y105-I123 HydrophobicContact CD1-CD1 4.03Å; Y105-I123 HydrophobicContact CD2-CD1 4.29Å; Y105-I123 HydrophobicContact CE1-CD1 3.66Å; Y105-I123 HydrophobicContact CE2-CD1 3.98Å; Y105-I123 HydrophobicContact CG-CD1 4.31Å; V119-I123 HydrophobicContact CG1-CD1 3.67Å; V119-I123 HydrophobicContact CG1-CG1 4.18Å; V119-I123 WeakPolarHBondContact O-CB 3.38Å; V119-I123 VanDerWaalsContact O-CG1 3.32Å; V119-I123 WeakPolarHBondContact O-CG1 3.2Å; V119-I123 PolarHBondContact O-N 3.17Å; I123-L125 VanDerWaalsContact C-N 3.31Å; I123-L125 PolarHBondContact O-N 3.49Å; I123-W126 PolarHBondContact O-N 3.35Å; I123-W126 VanDerWaalsContact O-N 3.16Å; I123-Q127 HydrophobicContact CG2-CG 4.04Å; I123-Q127 WeakPolarHBondContact O-CG 3.44Å; I123-Q127 PolarHBondContact O-N 3.33Å; I123-L134 HydrophobicContact CD1-CD2 4.44Å; I123-L134 HydrophobicContact CG1-CB 4.43Å; I123-L134 HydrophobicContact CG1-CD2 3.95Å; I123-L134 HydrophobicContact CG2-CB 3.77Å; I123-F148 HydrophobicContact CD1-CE2 4.03Å; I123-F148 HydrophobicContact CD1-CZ 4.15Å; I123-F148 HydrophobicContact CG1-CZ 4.47Å; I123-I185 HydrophobicContact CG1-CD1 3.79Å
124	R	98.3	Very high	97.5	Very high	151 Å²	151	38.7 Å²	38.7	57%	0.57	19%	0.186	S	C	*	.	H	α-helix	trans	-57.4	-42.7	179.1	-175.8	175.3	176	-179.9	-3.2	112.2	V120 K121 A122 W126 Q127 E128	V120-R124 WeakPolarHBondContact O-CB 3.45Å; V120-R124 PolarHBondContact O-N 2.95Å; K121-R124 WeakPolarHBondContact O-CB 3.44Å; K121-R124 PolarHBondContact O-N 3.36Å; A122-R124 VanDerWaalsContact C-N 3.29Å; A122-R124 PolarHBondContact O-N 3.25Å; R124-W126 VanDerWaalsContact C-N 3.35Å; R124-W126 PolarHBondContact O-N 3.34Å; R124-Q127 PolarHBondContact O-N 3.07Å; R124-E128 HydrophobicContact CG-CG 4.06Å; R124-E128 IonicContact CZ-OE1 3.85Å; R124-E128 VanDerWaalsContact CZ-OE1 3.25Å; R124-E128 IonicContact NE-OE1 3.73Å; R124-E128 PolarHBondContact NE-OE1 3.43Å; R124-E128 IonicContact NE-OE2 3.77Å; R124-E128 IonicContact NH2-OE1 3.05Å; R124-E128 PolarHBondContact NH2-OE1 2.73Å; R124-E128 WeakPolarHBondContact O-CB 3.35Å; R124-E128 WeakPolarHBondContact O-CG 3.22Å; R124-E128 PolarHBondContact O-N 3.33Å
125	L	98.1	Very high	97.5	Very high	32 Å²	32	43.8 Å²	43.8	17%	0.168	20%	0.201	C	C	.	.	H	α-helix	trans	-55.3	-47.6	175.1	-69.1	177.3	0	0	0	112.3	K121 A122 I123 N129 V178 A182 K272	K121-L125 PolarHBondContact O-N 2.76Å; K121-L125 VanDerWaalsContact O-N 3.15Å; A122-L125 WeakPolarHBondContact O-CB 3.33Å; A122-L125 PolarHBondContact O-N 2.77Å; I123-L125 VanDerWaalsContact C-N 3.31Å; I123-L125 PolarHBondContact O-N 3.49Å; L125-N129 PolarHBondContact O-N 3.22Å; L125-N129 PolarHBondContact O-ND2 3.21Å; L125-V178 HydrophobicContact CD1-CG1 3.51Å; L125-V178 HydrophobicContact CG-CG1 4.34Å; L125-A182 HydrophobicContact CD1-CB 4.42Å; L125-K272 HydrophobicContact CD1-CB 3.83Å
126	W	98.4	Very high	97.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66	-43	177.7	-71	111.3	0	0	0	112.3	A122 I123 R124 N129 T130 A182 I185 L189 L191 P273 D277 Y278 V281	A122-W126 PolarHBondContact O-N 2.86Å; I123-W126 PolarHBondContact O-N 3.35Å; I123-W126 VanDerWaalsContact O-N 3.16Å; R124-W126 VanDerWaalsContact C-N 3.35Å; R124-W126 PolarHBondContact O-N 3.34Å; W126-N129 PolarHBondContact O-N 3.42Å; W126-T130 HydrophobicContact CE3-CG2 4.12Å; W126-T130 WeakPolarHBondContact O-CB 3.18Å; W126-T130 WeakPolarHBondContact O-CG2 3.47Å; W126-T130 PolarHBondContact O-N 2.91Å; W126-T130 PolarHBondContact O-OG1 2.93Å; W126-A182 WeakPolarHBondContact CZ2-O 3.49Å; W126-A182 PolarHBondContact NE1-O 3.19Å; W126-I185 HydrophobicContact CG-CG2 4.11Å; W126-L189 HydrophobicContact CD2-CD1 3.85Å; W126-L189 HydrophobicContact CE3-CD1 3.91Å; W126-L189 HydrophobicContact CG-CD1 4.26Å; W126-L189 HydrophobicContact CZ3-CD1 4.34Å; W126-L191 HydrophobicContact CH2-CD1 3.7Å; W126-L191 HydrophobicContact CZ2-CD1 4.44Å; W126-L191 HydrophobicContact CZ3-CD1 4.49Å; W126-P273 HydrophobicContact CD2-CG 4.39Å; W126-P273 HydrophobicContact CH2-CB 3.86Å; W126-P273 HydrophobicContact CH2-CG 3.87Å; W126-P273 HydrophobicContact CZ2-CB 4.06Å; W126-P273 HydrophobicContact CZ2-CG 3.54Å; W126-P273 HydrophobicContact CZ3-CB 4.32Å; W126-P273 HydrophobicContact CZ3-CG 4.41Å; W126-D277 HydrophobicContact CH2-CB 4.35Å; W126-Y278 HydrophobicContact CD2-CE1 4.39Å; W126-Y278 AromaticContact CE3-CD1 3.76Å; W126-Y278 HydrophobicContact CE3-CD1 3.76Å; W126-Y278 AromaticContact CE3-CE1 3.89Å; W126-Y278 HydrophobicContact CE3-CE1 3.89Å; W126-Y278 AromaticContact CZ3-CD1 3.74Å; W126-Y278 HydrophobicContact CZ3-CD1 3.74Å; W126-Y278 HydrophobicContact CZ3-CE1 4.09Å; W126-V281 HydrophobicContact CE3-CG2 4.3Å; W126-V281 HydrophobicContact CH2-CG2 4.11Å; W126-V281 HydrophobicContact CZ3-CB 4.21Å; W126-V281 HydrophobicContact CZ3-CG2 3.55Å
127	Q	97.7	Very high	97.3	Very high	52 Å²	52	45.2 Å²	45.2	24%	0.243	21%	0.211	C	C	.	.	H	α-helix	trans	-71.3	-30.8	-177.3	-65.4	-170.8	127.9	0	0	114.3	I123 R124 N129 T130 K133 L134 N305	I123-Q127 HydrophobicContact CG2-CG 4.04Å; I123-Q127 WeakPolarHBondContact O-CG 3.44Å; I123-Q127 PolarHBondContact O-N 3.33Å; R124-Q127 PolarHBondContact O-N 3.07Å; Q127-N129 VanDerWaalsContact C-N 3.34Å; Q127-T130 VanDerWaalsContact O-O 3.05Å; Q127-K133 PolarHBondContact O-NZ 2.65Å; Q127-L134 PolarHBondContact OE1-O 3.32Å; Q127-L134 VanDerWaalsContact OE1-O 3.09Å; Q127-N305 PolarHBondContact O-ND2 2.86Å
128	E	97	Very high	96.6	Very high	82 Å²	82	46.1 Å²	46.1	38%	0.383	22%	0.22	S	C	.	.	H	α-helix	trans	-76.1	-24.9	177.2	-73.9	178.2	158.6	0	0	112.2	R124 N305 R311	R124-E128 HydrophobicContact CG-CG 4.06Å; R124-E128 IonicContact CZ-OE1 3.85Å; R124-E128 VanDerWaalsContact CZ-OE1 3.25Å; R124-E128 IonicContact NE-OE1 3.73Å; R124-E128 PolarHBondContact NE-OE1 3.43Å; R124-E128 IonicContact NE-OE2 3.77Å; R124-E128 IonicContact NH2-OE1 3.05Å; R124-E128 PolarHBondContact NH2-OE1 2.73Å; R124-E128 WeakPolarHBondContact O-CB 3.35Å; R124-E128 WeakPolarHBondContact O-CG 3.22Å; R124-E128 PolarHBondContact O-N 3.33Å; E128-N305 PolarHBondContact O-ND2 3.08Å; E128-N305 VanDerWaalsContact O-ND2 3.09Å; E128-R311 PolarHBondContact O-NH1 3.09Å; E128-R311 PolarHBondContact O-NH2 2.78Å
129	N	97.7	Very high	95.8	Very high	26 Å²	26	53.9 Å²	53.9	14%	0.139	26%	0.255	C	S	.	.	H	α-helix	trans	-109.8	-4.8	-175.3	-63.6	-83.3	0	0	0	114.6	L125 W126 Q127 Y278 N282 R311	L125-N129 PolarHBondContact O-N 3.22Å; L125-N129 PolarHBondContact O-ND2 3.21Å; W126-N129 PolarHBondContact O-N 3.42Å; Q127-N129 VanDerWaalsContact C-N 3.34Å; N129-Y278 HydrophobicContact CB-CD1 3.36Å; N129-Y278 HydrophobicContact CB-CD2 3.63Å; N129-Y278 HydrophobicContact CB-CE1 3.53Å; N129-Y278 HydrophobicContact CB-CE2 3.8Å; N129-Y278 HydrophobicContact CB-CG 3.41Å; N129-Y278 VanDerWaalsContact CB-CG 3.41Å; N129-N282 PolarHBondContact O-ND2 2.89Å; N129-R311 PolarHBondContact OD1-NE 3.33Å; N129-R311 VanDerWaalsContact OD1-NE 3.09Å; N129-R311 PolarHBondContact OD1-NH2 2.84Å
130	T	97.5	Very high	95.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.285	C	S	.	.	S	Bend	trans	-137.5	168.1	178.1	76	0	0	0	0	111.8	W126 Q127 L132 Y278 V281 N282 N305	W126-T130 HydrophobicContact CE3-CG2 4.12Å; W126-T130 WeakPolarHBondContact O-CB 3.18Å; W126-T130 WeakPolarHBondContact O-CG2 3.47Å; W126-T130 PolarHBondContact O-N 2.91Å; W126-T130 PolarHBondContact O-OG1 2.93Å; Q127-T130 VanDerWaalsContact O-O 3.05Å; T130-L132 PolarHBondContact O-N 3.25Å; T130-L132 WeakPolarHBondContact OG1-CB 3.22Å; T130-L132 PolarHBondContact OG1-N 3.12Å; T130-Y278 HydrophobicContact CG2-CD1 4.18Å; T130-V281 HydrophobicContact CG2-CB 4.14Å; T130-V281 HydrophobicContact CG2-CG1 3.79Å; T130-N282 WeakPolarHBondContact CA-OD1 3.22Å; T130-N282 WeakPolarHBondContact CB-OD1 3.26Å; T130-N305 PolarHBondContact O-ND2 3.24Å; T130-N305 PolarHBondContact O-OD1 2.88Å
131	C	95.7	Very high	94.5	Very high	7 Å²	7	61.5 Å²	61.5	5%	0.047	30%	0.303	C	S	.	.	S	Bend	trans	-76.4	-9.9	173.9	75.4	0	0	0	0	112.9	C286 K289 V304	C131-C286 HydrophobicContact CB-CB 3.72Å; C131-C286 WeakPolarHBondContact CB-SG 3.43Å; C131-C286 PolarHBondContact N-SG 3.13Å; C131-C286 VanDerWaalsContact SG-CA 3.54Å; C131-C286 WeakPolarHBondContact SG-CB 3.11Å; C131-C286 CovalentContact SG-SG 2.02Å; C131-C286 PolarHBondContact SG-SG 3.32Å; C131-K289 HydrophobicContact CB-CD 4.21Å; C131-K289 HydrophobicContact CB-CG 3.87Å; C131-V304 HydrophobicContact CB-CB 4.24Å; C131-V304 HydrophobicContact CB-CG2 4.07Å; C131-V304 VanDerWaalsContact N-CG2 3.32Å
132	L	97.1	Very high	94.2	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.284	C	S	.	.			trans	-67.5	141.2	-178.8	-62.3	178.7	0	0	0	110.7	S101 I103 T130 L134 L189 V281 Y285	S101-L132 CarbonylContact O-C 3.56Å; S101-L132 WeakPolarHBondContact O-CA 3.33Å; I103-L132 HydrophobicContact CD1-CD1 4.33Å; I103-L132 HydrophobicContact CD1-CD2 4.47Å; T130-L132 PolarHBondContact O-N 3.25Å; T130-L132 WeakPolarHBondContact OG1-CB 3.22Å; T130-L132 PolarHBondContact OG1-N 3.12Å; L132-L134 HydrophobicContact CB-CD1 4.39Å; L132-L189 HydrophobicContact CD1-CD1 3.83Å; L132-L189 HydrophobicContact CD1-CD2 3.54Å; L132-L189 HydrophobicContact CD1-CG 4.25Å; L132-V281 HydrophobicContact CD1-CG1 3.62Å; L132-V281 HydrophobicContact CG-CG1 4.41Å; L132-Y285 HydrophobicContact CD1-CD2 3.89Å; L132-Y285 HydrophobicContact CD1-CE2 4.17Å; L132-Y285 HydrophobicContact CD1-CG 4.19Å; L132-Y285 HydrophobicContact CD2-CD1 3.88Å; L132-Y285 HydrophobicContact CD2-CD2 4.3Å; L132-Y285 HydrophobicContact CD2-CG 3.74Å; L132-Y285 HydrophobicContact CG-CD2 4.44Å; L132-Y285 HydrophobicContact CG-CG 4.29Å
133	K	96.9	Very high	93.8	Very high	81 Å²	81	61.2 Å²	61.2	35%	0.352	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	107.2	175.2	-55.3	-59.2	166.7	-156.6	0	108.2	S101 L102 I103 Q127 N305	S101-K133 PolarHBondContact O-N 3.49Å; L102-K133 WeakPolarHBondContact CA-O 3.34Å; I103-K133 PolarHBondContact N-O 3.01Å; Q127-K133 PolarHBondContact O-NZ 2.65Å; K133-N305 PolarHBondContact NZ-OD1 2.79Å
134	L	97.2	Very high	93.5	Very high	5 Å²	5	63.7 Å²	63.7	3%	0.026	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	109.8	172.4	-78.8	75.4	0	0	0	107.1	I103 Y105 I123 Q127 L132 I146 I185	I103-L134 HydrophobicContact CB-CG 4.21Å; I103-L134 CarbonylContact O-C 2.95Å; I103-L134 VanDerWaalsContact O-CA 3.27Å; I103-L134 WeakPolarHBondContact O-CA 3.47Å; Y105-L134 HydrophobicContact CD1-CB 3.98Å; Y105-L134 HydrophobicContact CE1-CB 4.3Å; Y105-L134 WeakPolarHBondContact CE1-O 3.49Å; I123-L134 HydrophobicContact CD1-CD2 4.44Å; I123-L134 HydrophobicContact CG1-CB 4.43Å; I123-L134 HydrophobicContact CG1-CD2 3.95Å; I123-L134 HydrophobicContact CG2-CB 3.77Å; Q127-L134 PolarHBondContact OE1-O 3.32Å; Q127-L134 VanDerWaalsContact OE1-O 3.09Å; L132-L134 HydrophobicContact CB-CD1 4.39Å; L134-I146 HydrophobicContact CD2-CD1 4.45Å; L134-I185 HydrophobicContact CD2-CG2 4.07Å
135	K	96.2	Very high	93.4	Very high	133 Å²	133	56.5 Å²	56.5	58%	0.578	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	127.9	-172.7	-169.6	176.6	-179.1	-179.8	0	110.9	L102 I103 P104 Y105 H137	L102-K135 HydrophobicContact CD1-CD 4.2Å; L102-K135 HydrophobicContact CG-CB 4.42Å; I103-K135 PolarHBondContact O-N 2.71Å; P104-K135 WeakPolarHBondContact CA-O 3.16Å; Y105-K135 WeakPolarHBondContact CD1-O 3.38Å; Y105-K135 VanDerWaalsContact CE1-C 3.44Å; Y105-K135 PolarHBondContact N-O 3.2Å; K135-H137 PolarHBondContact O-N 3.39Å
136	E	96.6	Very high	93.4	Very high	75 Å²	75	55 Å²	55	35%	0.35	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	128.1	175.9	-167.2	172.5	173.2	0	0	109.4	Y105 F107 R116	Y105-E136 HydrophobicContact CE1-CB 3.98Å; Y105-E136 HydrophobicContact CE2-CB 3.97Å; Y105-E136 HydrophobicContact CE2-CG 3.99Å; Y105-E136 CarbonylContact O-C 3.54Å; Y105-E136 WeakPolarHBondContact O-CA 3.37Å; F107-E136 WeakPolarHBondContact CD2-OE1 3.41Å; R116-E136 IonicContact NH2-OE1 2.94Å
137	H	93.1	Very high	93.3	Very high	51 Å²	51	56.5 Å²	56.5	24%	0.236	30%	0.296	C	S	.	.			trans	-98.2	94.3	179.8	-173.8	157.7	0	0	0	109.1	P104 Y105 R106 K135 H139 Q141 F142	P104-H137 HydrophobicContact CB-CB 4.41Å; Y105-H137 PolarHBondContact O-N 3.48Å; R106-H137 HydrophobicContact CG-CB 4.04Å; R106-H137 WeakPolarHBondContact CG-O 3.03Å; R106-H137 PolarHBondContact NE-O 3.01Å; R106-H137 PolarHBondContact NH2-CD2 3.11Å; R106-H137 PolarHBondContact NH2-NE2 3.36Å; R106-H137 VanDerWaalsContact NH2-NE2 3.13Å; K135-H137 PolarHBondContact O-N 3.39Å; H137-H139 PolarHBondContact CD2-O 3.13Å; H137-H139 PolarHBondContact NE2-O 3.35Å; H137-Q141 PolarHBondContact CE1-O 3.48Å; H137-F142 HydrophobicContact CB-CD2 4.18Å; H137-F142 HydrophobicContact CB-CE2 4.26Å; H137-F142 AromaticContact CG-CD2 3.97Å; H137-F142 AromaticContact ND1-CD2 3.4Å; H137-F142 WeakPolarHBondContact ND1-CD2 3.43Å
138	S	82.6	Confident	93.4	Very high	78 Å²	78	54 Å²	54	55%	0.545	28%	0.284	S	S	.	.			trans	-80.3	-28.6	-172.1	-46.3	0	0	0	0	115.3
139	H	79.9	Confident	93.4	Very high	167 Å²	167	50.9 Å²	50.9	77%	0.773	27%	0.271	S	S	*	.	S	Bend	trans	-143.8	148	-172.7	-56.3	-69.5	0	0	0	112.5	H137	H137-H139 PolarHBondContact CD2-O 3.13Å; H137-H139 PolarHBondContact NE2-O 3.35Å
140	G	82.7	Confident	93.3	Very high	60 Å²	60	51.2 Å²	51.2	62%	0.619	27%	0.272	S	S	*	.	S	Bend	trans	99	-170.4	174.4	0	0	0	0	0	113.8	R106	R106-G140 PolarHBondContact NH2-O 3.17Å
141	Q	86.1	Confident	93	Very high	168 Å²	168	54 Å²	54	79%	0.785	29%	0.287	S	S	*	.			trans	-73.8	126.2	-179	-173.4	176.2	4	0	0	110.7	H137	H137-Q141 PolarHBondContact CE1-O 3.48Å
142	F	91.8	Very high	92.4	Very high	31 Å²	31	63.4 Å²	63.4	14%	0.136	32%	0.321	C	S	.	.			trans	-110.9	82.8	175.2	-172.7	-122.6	0	0	0	109	P104 R106 H137 E144 I146 L147 V165	P104-F142 HydrophobicContact CB-CE2 4.07Å; P104-F142 HydrophobicContact CG-CE2 4.37Å; R106-F142 HydrophobicContact CB-CD1 4.41Å; R106-F142 HydrophobicContact CB-CE1 3.95Å; R106-F142 HydrophobicContact CB-CZ 4.15Å; R106-F142 HydrophobicContact CG-CD1 4.04Å; R106-F142 HydrophobicContact CG-CD2 4.22Å; R106-F142 HydrophobicContact CG-CE1 3.92Å; R106-F142 HydrophobicContact CG-CE2 4.11Å; R106-F142 HydrophobicContact CG-CG 4.17Å; R106-F142 HydrophobicContact CG-CZ 3.96Å; H137-F142 HydrophobicContact CB-CD2 4.18Å; H137-F142 HydrophobicContact CB-CE2 4.26Å; H137-F142 AromaticContact CG-CD2 3.97Å; H137-F142 AromaticContact ND1-CD2 3.4Å; H137-F142 WeakPolarHBondContact ND1-CD2 3.43Å; F142-E144 WeakPolarHBondContact CE2-O 3.19Å; F142-I146 WeakPolarHBondContact CZ-O 3.11Å; F142-L147 HydrophobicContact CE1-CB 4.38Å; F142-V165 HydrophobicContact CD1-CB 4.44Å; F142-V165 HydrophobicContact CD1-CG1 4.02Å; F142-V165 HydrophobicContact CD1-CG2 3.5Å; F142-V165 VanDerWaalsContact CD1-CG2 3.5Å; F142-V165 HydrophobicContact CE1-CB 4.32Å; F142-V165 HydrophobicContact CE1-CG1 3.6Å; F142-V165 HydrophobicContact CE1-CG2 3.77Å; F142-V165 HydrophobicContact CG-CG2 4.13Å; F142-V165 WeakPolarHBondContact O-CG2 3.3Å
143	S	90	Very high	91.8	Very high	82 Å²	82	68.7 Å²	68.7	57%	0.573	35%	0.346	S	S	*	.			trans	-84.2	-27.3	180	47.6	0	0	0	0	112.7	H164 V165	S143-H164 WeakPolarHBondContact O-CA 3.34Å; S143-V165 PolarHBondContact O-N 2.79Å
144	E	93.4	Very high	91.5	Very high	56 Å²	56	66.7 Å²	66.7	26%	0.262	34%	0.338	S	S	.	.	S	Bend	trans	-146.2	142.2	-177.5	178.3	163.4	-114	0	0	110.5	W98 P104 F142 K161 G163	W98-E144 HydrophobicContact CZ3-CG 4.08Å; P104-E144 WeakPolarHBondContact CG-O 3.14Å; F142-E144 WeakPolarHBondContact CE2-O 3.19Å; E144-K161 WeakPolarHBondContact OE1-CE 3Å; E144-K161 IonicContact OE1-NZ 2.86Å; E144-K161 PolarHBondContact OE1-NZ 2.6Å; E144-K161 WeakPolarHBondContact OE2-CE 3.34Å; E144-K161 IonicContact OE2-NZ 3.01Å; E144-K161 PolarHBondContact OE2-NZ 2.89Å; E144-G163 WeakPolarHBondContact OE1-CA 3.43Å
145	G	95.9	Very high	91.3	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145.1	-173.5	-179	0	0	0	0	0	112.8	P104 V165 Q166	P104-G145 CarbonylContact O-C 3.51Å; P104-G145 WeakPolarHBondContact O-CA 3.12Å; G145-V165 WeakPolarHBondContact O-CA 3.35Å; G145-Q166 PolarHBondContact O-N 3.02Å
146	I	98	Very high	91.3	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	125.3	179.2	-63	173.2	0	0	0	109.9	W98 I103 P104 Y105 R106 L134 F142 F148 Q166 I168 A188	W98-I146 HydrophobicContact CH2-CG1 4.06Å; W98-I146 HydrophobicContact CZ2-CD1 4.14Å; W98-I146 HydrophobicContact CZ2-CG1 3.72Å; I103-I146 HydrophobicContact CG2-CD1 3.77Å; I103-I146 HydrophobicContact CG2-CG1 4.12Å; P104-I146 PolarHBondContact O-N 3Å; Y105-I146 CarbonylContact C-O 3.54Å; Y105-I146 WeakPolarHBondContact CA-O 3.24Å; Y105-I146 WeakPolarHBondContact CB-O 3.11Å; R106-I146 PolarHBondContact N-O 2.98Å; L134-I146 HydrophobicContact CD2-CD1 4.45Å; F142-I146 WeakPolarHBondContact CZ-O 3.11Å; I146-F148 HydrophobicContact CG2-CD2 4.12Å; I146-F148 HydrophobicContact CG2-CE1 4.22Å; I146-F148 HydrophobicContact CG2-CE2 3.74Å; I146-F148 HydrophobicContact CG2-CZ 3.79Å; I146-Q166 WeakPolarHBondContact CA-O 3.44Å; I146-Q166 HydrophobicContact CG1-CG 4.43Å; I146-I168 HydrophobicContact CD1-CD1 4.42Å; I146-I168 HydrophobicContact CG2-CB 4.37Å; I146-I168 HydrophobicContact CG2-CD1 3.57Å; I146-I168 HydrophobicContact CG2-CG1 3.81Å; I146-A188 HydrophobicContact CD1-CB 3.9Å
147	L	97.4	Very high	91.3	Very high	32 Å²	32	56.5 Å²	56.5	17%	0.168	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	115.2	170.2	-175.4	67.6	0	0	0	109.7	R106 D108 F142 V149 V165 Q166 N167 I168	R106-L147 HydrophobicContact CB-CD1 3.79Å; D108-L147 HydrophobicContact CB-CD1 4.12Å; D108-L147 HydrophobicContact CB-CG 4.29Å; F142-L147 HydrophobicContact CE1-CB 4.38Å; L147-V149 HydrophobicContact CD2-CG1 3.78Å; L147-V149 HydrophobicContact CG-CG1 3.73Å; L147-V165 HydrophobicContact CB-CG1 3.61Å; L147-V165 HydrophobicContact CD2-CG1 4.32Å; L147-Q166 PolarHBondContact N-O 3.26Å; L147-N167 CarbonylContact O-C 3.54Å; L147-N167 VanDerWaalsContact O-CA 3.27Å; L147-N167 WeakPolarHBondContact O-CA 3.28Å; L147-I168 PolarHBondContact O-N 3.41Å
148	F	98	Very high	91.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	118.7	173.3	-65.8	-83.6	0	0	0	109.5	Y105 R106 F107 D108 L111 V119 I123 I146 I168 V181 I185	Y105-F148 AromaticContact CD2-CD2 3.82Å; Y105-F148 HydrophobicContact CD2-CD2 3.82Å; Y105-F148 AromaticContact CD2-CE2 3.67Å; Y105-F148 HydrophobicContact CD2-CE2 3.67Å; Y105-F148 HydrophobicContact CE2-CE2 4.46Å; Y105-F148 HydrophobicContact CG-CD2 4.4Å; Y105-F148 AromaticContact CG-CE2 3.88Å; Y105-F148 HydrophobicContact CG-CE2 3.88Å; R106-F148 PolarHBondContact O-N 3.21Å; F107-F148 HydrophobicContact CD1-CB 4.06Å; F107-F148 HydrophobicContact CD1-CD2 4.32Å; F107-F148 HydrophobicContact CD1-CG 4.5Å; F107-F148 HydrophobicContact CE1-CD2 4.24Å; D108-F148 WeakPolarHBondContact CB-O 3.44Å; D108-F148 PolarHBondContact N-O 3.07Å; L111-F148 HydrophobicContact CD2-CB 4.13Å; V119-F148 HydrophobicContact CB-CD1 4.42Å; V119-F148 HydrophobicContact CG1-CD1 3.72Å; V119-F148 HydrophobicContact CG1-CD2 3.8Å; V119-F148 HydrophobicContact CG1-CE1 3.57Å; V119-F148 HydrophobicContact CG1-CE2 3.65Å; V119-F148 HydrophobicContact CG1-CG 3.83Å; V119-F148 HydrophobicContact CG1-CZ 3.53Å; V119-F148 HydrophobicContact CG2-CB 4.48Å; V119-F148 HydrophobicContact CG2-CD1 3.72Å; V119-F148 HydrophobicContact CG2-CE1 4.12Å; V119-F148 HydrophobicContact CG2-CG 4.14Å; I123-F148 HydrophobicContact CD1-CE2 4.03Å; I123-F148 HydrophobicContact CD1-CZ 4.15Å; I123-F148 HydrophobicContact CG1-CZ 4.47Å; I146-F148 HydrophobicContact CG2-CD2 4.12Å; I146-F148 HydrophobicContact CG2-CE1 4.22Å; I146-F148 HydrophobicContact CG2-CE2 3.74Å; I146-F148 HydrophobicContact CG2-CZ 3.79Å; F148-I168 HydrophobicContact CD1-CB 3.86Å; F148-I168 HydrophobicContact CD1-CD1 4.42Å; F148-I168 HydrophobicContact CD1-CG2 3.94Å; F148-I168 HydrophobicContact CE1-CB 4.03Å; F148-I168 HydrophobicContact CE1-CD1 3.73Å; F148-I168 HydrophobicContact CE1-CG1 4.43Å; F148-I168 HydrophobicContact CE1-CG2 4.04Å; F148-I168 HydrophobicContact CZ-CD1 4.17Å; F148-V181 HydrophobicContact CE1-CG1 4.48Å; F148-I185 HydrophobicContact CE1-CD1 4.3Å; F148-I185 HydrophobicContact CE1-CG1 4.08Å; F148-I185 HydrophobicContact CZ-CD1 4.15Å; F148-I185 HydrophobicContact CZ-CG1 4.1Å
149	V	97.3	Very high	91.8	Very high	16 Å²	16	51.9 Å²	51.9	10%	0.097	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	145.1	-175.8	-57.4	0	0	0	0	111.1	D108 L147 N167 I168 I170	D108-V149 HydrophobicContact CB-CB 4.34Å; D108-V149 HydrophobicContact CB-CG1 3.8Å; L147-V149 HydrophobicContact CD2-CG1 3.78Å; L147-V149 HydrophobicContact CG-CG1 3.73Å; V149-N167 HydrophobicContact CG1-CB 4.47Å; V149-N167 HydrophobicContact CG2-CB 4.08Å; V149-I168 PolarHBondContact N-O 3.01Å; V149-I170 PolarHBondContact O-N 2.87Å
150	E	95.5	Very high	92.4	Very high	33 Å²	33	43.9 Å²	43.9	15%	0.154	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	129.5	170.9	-164.5	70.6	-126.5	0	0	109.8	S110 L111 R112 S115 I170 W172	S110-E150 WeakPolarHBondContact O-CB 3.23Å; S110-E150 PolarHBondContact OG-N 2.76Å; S110-E150 VanDerWaalsContact OG-N 3.12Å; L111-E150 HydrophobicContact CD1-CB 4.46Å; R112-E150 PolarHBondContact N-OE2 2.77Å; S115-E150 PolarHBondContact OG-OE2 2.68Å; E150-I170 CarbonylContact C-O 3.44Å; E150-I170 WeakPolarHBondContact CA-O 3.47Å; E150-I170 VanDerWaalsContact OE1-O 3.07Å; E150-W172 WeakPolarHBondContact OE1-CA 3.35Å; E150-W172 WeakPolarHBondContact OE1-CB 3.46Å; E150-W172 PolarHBondContact OE1-N 2.9Å
151	N	91.7	Very high	93	Very high	59 Å²	59	42.1 Å²	42.1	32%	0.316	20%	0.2	S	C	.	.			trans	-136.3	116.6	174.3	-167.6	-50.4	0	0	0	110.2	H153 M154 I170 S171	N151-H153 PolarHBondContact O-N 3.4Å; N151-H153 PolarHBondContact OD1-N 3Å; N151-M154 HydrophobicContact CB-CB 3.96Å; N151-M154 VanDerWaalsContact CG-CB 3.49Å; N151-M154 WeakPolarHBondContact ND2-CE 3.48Å; N151-M154 PolarHBondContact O-N 3.37Å; N151-M154 WeakPolarHBondContact OD1-CB 3.31Å; N151-I170 PolarHBondContact N-O 2.74Å; N151-S171 WeakPolarHBondContact O-CA 3.4Å; N151-S171 WeakPolarHBondContact O-CB 3.5Å; N151-S171 PolarHBondContact O-OG 3.04Å
152	R	83.5	Confident	93.2	Very high	204 Å²	204	35.6 Å²	35.6	77%	0.77	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-32	-169.2	-68.5	-172.4	-174.9	-169.8	2.2	114.4	S171	R152-S171 PolarHBondContact O-OG 3.06Å
153	H	83.8	Confident	93.1	Very high	112 Å²	112	36.6 Å²	36.6	52%	0.519	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-138.1	29.4	-174.4	-53	-61.9	0	0	0	113.2	N151	N151-H153 PolarHBondContact O-N 3.4Å; N151-H153 PolarHBondContact OD1-N 3Å
154	M	90.1	Very high	93.2	Very high	38 Å²	38	37.3 Å²	37.3	19%	0.187	19%	0.185	C	C	.	.			trans	-141	126.1	-178.4	-158.5	162.1	72.5	0	0	112.2	N49 L54 N151 S169 I170 S171	N49-M154 VanDerWaalsContact OD1-CA 3.28Å; N49-M154 WeakPolarHBondContact OD1-CA 3.44Å; L54-M154 HydrophobicContact CD1-CG 3.82Å; L54-M154 HydrophobicContact CD1-SD 3.95Å; L54-M154 HydrophobicContact CD2-SD 4.21Å; L54-M154 HydrophobicContact CG-SD 4.46Å; N151-M154 HydrophobicContact CB-CB 3.96Å; N151-M154 VanDerWaalsContact CG-CB 3.49Å; N151-M154 WeakPolarHBondContact ND2-CE 3.48Å; N151-M154 PolarHBondContact O-N 3.37Å; N151-M154 WeakPolarHBondContact OD1-CB 3.31Å; M154-S169 WeakPolarHBondContact CE-OG 3.2Å; M154-S169 CarbonylContact O-C 3.49Å; M154-I170 CarbonylContact O-C 3.57Å; M154-S171 PolarHBondContact O-N 3.47Å
155	C	94.7	Very high	93.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.183	C	C	.	.			trans	-114.1	101.3	168.6	-162.4	0	0	0	0	106.3	I48 N49 D58 S169 C175	I48-C155 HydrophobicContact CB-CB 4.43Å; I48-C155 HydrophobicContact CD1-CB 4.32Å; I48-C155 HydrophobicContact CG2-CB 3.95Å; N49-C155 PolarHBondContact ND2-O 2.95Å; N49-C155 PolarHBondContact OD1-N 3.2Å; N49-C155 PolarHBondContact OD1-O 2.88Å; D58-C155 WeakPolarHBondContact CB-O 3.28Å; C155-S169 VanDerWaalsContact CA-O 3.29Å; C155-S169 WeakPolarHBondContact CA-O 3.47Å; C155-C175 VanDerWaalsContact CA-SG 3.54Å; C155-C175 HydrophobicContact CB-CB 3.57Å; C155-C175 WeakPolarHBondContact CB-SG 3.44Å; C155-C175 WeakPolarHBondContact SG-CB 3.31Å; C155-C175 CovalentContact SG-SG 2.04Å; C155-C175 PolarHBondContact SG-SG 3.07Å
156	S	95.7	Very high	93.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-156.5	154	-169.8	70.1	0	0	0	0	113.5	L54 D58 I168 S169	L54-S156 VanDerWaalsContact CD1-CB 3.45Å; D58-S156 VanDerWaalsContact O-CA 3.28Å; D58-S156 WeakPolarHBondContact O-CA 3.23Å; D58-S156 WeakPolarHBondContact O-CB 3.35Å; S156-I168 WeakPolarHBondContact O-CA 3.22Å; S156-S169 PolarHBondContact N-O 3.29Å; S156-S169 VanDerWaalsContact N-O 3.07Å; S156-S169 PolarHBondContact O-N 3.04Å; S156-S169 WeakPolarHBondContact OG-CB 3.34Å; S156-S169 PolarHBondContact OG-OG 3.48Å
157	S	97	Very high	93.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	159.5	174.2	-177.7	0	0	0	0	111.1	D58 L60 Q184 A188	D58-S157 PolarHBondContact O-N 3.32Å; L60-S157 PolarHBondContact N-O 2.91Å; S157-Q184 VanDerWaalsContact CB-O 3.28Å; S157-Q184 WeakPolarHBondContact CB-O 3.1Å; S157-Q184 PolarHBondContact OG-O 3.3Å; S157-A188 PolarHBondContact OG-N 3.38Å
158	F	94.5	Very high	93.3	Very high	31 Å²	31	37.9 Å²	37.9	14%	0.136	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	159.9	159	-72.2	-89	0	0	0	111.1	L60 T62 V162 Q166 H187 A188	L60-F158 HydrophobicContact CB-CD1 3.85Å; L60-F158 HydrophobicContact CB-CD2 4.08Å; L60-F158 HydrophobicContact CB-CE1 3.83Å; L60-F158 HydrophobicContact CB-CE2 4.07Å; L60-F158 HydrophobicContact CB-CG 3.99Å; L60-F158 HydrophobicContact CB-CZ 3.95Å; L60-F158 HydrophobicContact CD1-CD2 4.26Å; L60-F158 HydrophobicContact CD1-CE2 3.96Å; L60-F158 HydrophobicContact CD1-CZ 4.39Å; L60-F158 WeakPolarHBondContact O-CA 3.41Å; L60-F158 VanDerWaalsContact O-CD1 3.23Å; L60-F158 WeakPolarHBondContact O-CD1 3.41Å; T62-F158 HydrophobicContact CG2-CD1 4.18Å; T62-F158 HydrophobicContact CG2-CE1 4.25Å; F158-V162 HydrophobicContact CB-CG2 3.59Å; F158-V162 HydrophobicContact CD1-CG2 3.73Å; F158-V162 HydrophobicContact CD2-CG2 4.46Å; F158-V162 HydrophobicContact CG-CG2 3.68Å; F158-Q166 HydrophobicContact CD2-CB 3.89Å; F158-Q166 HydrophobicContact CE2-CB 4.46Å; F158-Q166 HydrophobicContact CG-CB 4.47Å; F158-H187 CarbonylContact O-C 3.6Å; F158-A188 WeakPolarHBondContact O-CA 3.44Å; F158-A188 PolarHBondContact O-N 3.01Å
159	V	91.8	Very high	93.3	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	-97.6	117	173.3	-173.1	0	0	0	0	110.5	L59 Q65 F95 H187 L192	L59-V159 HydrophobicContact CB-CG2 4.39Å; L59-V159 HydrophobicContact CD1-CG2 3.99Å; L59-V159 HydrophobicContact CD2-CG2 3.64Å; L59-V159 HydrophobicContact CG-CG2 4.23Å; Q65-V159 PolarHBondContact NE2-O 2.81Å; F95-V159 HydrophobicContact CB-CG1 4.15Å; F95-V159 HydrophobicContact CD1-CB 3.59Å; F95-V159 HydrophobicContact CD1-CG1 3.4Å; F95-V159 VanDerWaalsContact CD1-CG1 3.4Å; F95-V159 HydrophobicContact CE1-CB 3.85Å; F95-V159 HydrophobicContact CE1-CG1 3.92Å; F95-V159 HydrophobicContact CE1-CG2 4.43Å; F95-V159 HydrophobicContact CG-CB 4.48Å; F95-V159 HydrophobicContact CG-CG1 3.82Å; V159-H187 CarbonylContact C-O 3.59Å; V159-H187 VanDerWaalsContact CA-O 3.25Å; V159-H187 WeakPolarHBondContact CA-O 3.45Å; V159-L192 HydrophobicContact CB-CD2 4.48Å; V159-L192 HydrophobicContact CG1-CD2 3.91Å; V159-L192 HydrophobicContact CG1-CG 4.1Å; V159-L192 HydrophobicContact CG2-CD2 3.88Å
160	G	92.7	Very high	93.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	69.9	-170.7	-177.7	0	0	0	0	0	114	R96 Q166 H187 A188	R96-G160 CarbonylContact O-C 3.59Å; R96-G160 WeakPolarHBondContact O-CA 3.46Å; G160-Q166 PolarHBondContact O-NE2 2.91Å; G160-Q166 PolarHBondContact O-OE1 3Å; G160-H187 PolarHBondContact N-O 3.01Å; G160-A188 CarbonylContact C-O 3.57Å; G160-A188 VanDerWaalsContact CA-O 3.28Å; G160-A188 WeakPolarHBondContact CA-O 3.27Å
161	K	93.3	Very high	93.2	Very high	23 Å²	23	35.7 Å²	35.7	10%	0.1	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-72.7	125.8	176.4	-178.8	-175.7	178.5	177.7	0	110.4	R96 W98 E99 E144	R96-K161 HydrophobicContact CB-CB 4.5Å; R96-K161 PolarHBondContact O-N 2.84Å; W98-K161 HydrophobicContact CD2-CB 4.01Å; W98-K161 HydrophobicContact CD2-CG 4.23Å; W98-K161 HydrophobicContact CE3-CB 4.34Å; W98-K161 HydrophobicContact CE3-CD 4.25Å; W98-K161 HydrophobicContact CE3-CG 4.03Å; W98-K161 HydrophobicContact CG-CB 4.23Å; W98-K161 HydrophobicContact CZ3-CG 4.26Å; E99-K161 VanDerWaalsContact CD-NZ 3.29Å; E99-K161 IonicContact OE1-NZ 3.29Å; E99-K161 PolarHBondContact OE1-NZ 3.11Å; E99-K161 IonicContact OE2-NZ 3.55Å; E144-K161 WeakPolarHBondContact OE1-CE 3Å; E144-K161 IonicContact OE1-NZ 2.86Å; E144-K161 PolarHBondContact OE1-NZ 2.6Å; E144-K161 WeakPolarHBondContact OE2-CE 3.34Å; E144-K161 IonicContact OE2-NZ 3.01Å; E144-K161 PolarHBondContact OE2-NZ 2.89Å
162	V	90.9	Very high	93.2	Very high	30 Å²	30	38 Å²	38	18%	0.182	18%	0.184	C	C	.	.			trans	-94.8	-23.6	-178.2	176.9	0	0	0	0	113.6	T62 F158 H164 Q166	T62-V162 HydrophobicContact CG2-CB 4.27Å; T62-V162 HydrophobicContact CG2-CG1 3.47Å; T62-V162 VanDerWaalsContact CG2-CG1 3.47Å; T62-V162 HydrophobicContact CG2-CG2 3.95Å; F158-V162 HydrophobicContact CB-CG2 3.59Å; F158-V162 HydrophobicContact CD1-CG2 3.73Å; F158-V162 HydrophobicContact CD2-CG2 4.46Å; F158-V162 HydrophobicContact CG-CG2 3.68Å; V162-H164 VanDerWaalsContact CG1-NE2 3.35Å; V162-H164 WeakPolarHBondContact CG1-NE2 3.19Å; V162-Q166 HydrophobicContact CB-CB 4.4Å; V162-Q166 HydrophobicContact CG2-CB 4.27Å
163	G	90	Very high	93.5	Very high	52 Å²	52	31.9 Å²	31.9	54%	0.536	17%	0.171	S	C	.	.	S	Bend	trans	102.6	3.5	-178.9	0	0	0	0	0	115.1	E144	E144-G163 WeakPolarHBondContact OE1-CA 3.43Å
164	H	91.9	Very high	93.8	Very high	98 Å²	98	28.4 Å²	28.4	45%	0.454	16%	0.155	S	C	.	.	S	Bend	trans	-151.1	-178.6	174.7	57.9	71.4	0	0	0	109.4	S143 V162 Q166	S143-H164 WeakPolarHBondContact O-CA 3.34Å; V162-H164 VanDerWaalsContact CG1-NE2 3.35Å; V162-H164 WeakPolarHBondContact CG1-NE2 3.19Å; H164-Q166 PolarHBondContact O-N 2.55Å; H164-Q166 VanDerWaalsContact O-N 3.12Å
165	V	95.7	Very high	94	Very high	37 Å²	37	26.6 Å²	26.6	22%	0.224	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	119	170.9	179.5	0	0	0	0	109.8	F142 S143 G145 L147	F142-V165 HydrophobicContact CD1-CB 4.44Å; F142-V165 HydrophobicContact CD1-CG1 4.02Å; F142-V165 HydrophobicContact CD1-CG2 3.5Å; F142-V165 VanDerWaalsContact CD1-CG2 3.5Å; F142-V165 HydrophobicContact CE1-CB 4.32Å; F142-V165 HydrophobicContact CE1-CG1 3.6Å; F142-V165 HydrophobicContact CE1-CG2 3.77Å; F142-V165 HydrophobicContact CG-CG2 4.13Å; F142-V165 WeakPolarHBondContact O-CG2 3.3Å; S143-V165 PolarHBondContact O-N 2.79Å; G145-V165 WeakPolarHBondContact O-CA 3.35Å; L147-V165 HydrophobicContact CB-CG1 3.61Å; L147-V165 HydrophobicContact CD2-CG1 4.32Å
166	Q	96	Very high	94	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	134.8	-179.2	65.4	-172.5	72.4	0	0	110.6	W98 G145 I146 L147 F158 G160 V162 H164	W98-Q166 HydrophobicContact CH2-CG 4.32Å; W98-Q166 HydrophobicContact CZ2-CG 4.23Å; G145-Q166 PolarHBondContact O-N 3.02Å; I146-Q166 WeakPolarHBondContact CA-O 3.44Å; I146-Q166 HydrophobicContact CG1-CG 4.43Å; L147-Q166 PolarHBondContact N-O 3.26Å; F158-Q166 HydrophobicContact CD2-CB 3.89Å; F158-Q166 HydrophobicContact CE2-CB 4.46Å; F158-Q166 HydrophobicContact CG-CB 4.47Å; G160-Q166 PolarHBondContact O-NE2 2.91Å; G160-Q166 PolarHBondContact O-OE1 3Å; V162-Q166 HydrophobicContact CB-CB 4.4Å; V162-Q166 HydrophobicContact CG2-CB 4.27Å; H164-Q166 PolarHBondContact O-N 2.55Å; H164-Q166 VanDerWaalsContact O-N 3.12Å
167	N	96.8	Very high	93.9	Very high	61 Å²	61	28.4 Å²	28.4	33%	0.326	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	138.6	-175.5	-66.9	1.2	0	0	0	111.1	L147 V149	L147-N167 CarbonylContact O-C 3.54Å; L147-N167 VanDerWaalsContact O-CA 3.27Å; L147-N167 WeakPolarHBondContact O-CA 3.28Å; V149-N167 HydrophobicContact CG1-CB 4.47Å; V149-N167 HydrophobicContact CG2-CB 4.08Å
168	I	98.1	Very high	93.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	115.8	155.6	-66.8	-179.7	0	0	0	106.8	I146 L147 F148 V149 S156 I170 Q184 I185 A188	I146-I168 HydrophobicContact CD1-CD1 4.42Å; I146-I168 HydrophobicContact CG2-CB 4.37Å; I146-I168 HydrophobicContact CG2-CD1 3.57Å; I146-I168 HydrophobicContact CG2-CG1 3.81Å; L147-I168 PolarHBondContact O-N 3.41Å; F148-I168 HydrophobicContact CD1-CB 3.86Å; F148-I168 HydrophobicContact CD1-CD1 4.42Å; F148-I168 HydrophobicContact CD1-CG2 3.94Å; F148-I168 HydrophobicContact CE1-CB 4.03Å; F148-I168 HydrophobicContact CE1-CD1 3.73Å; F148-I168 HydrophobicContact CE1-CG1 4.43Å; F148-I168 HydrophobicContact CE1-CG2 4.04Å; F148-I168 HydrophobicContact CZ-CD1 4.17Å; V149-I168 PolarHBondContact N-O 3.01Å; S156-I168 WeakPolarHBondContact O-CA 3.22Å; I168-I170 HydrophobicContact CG2-CD1 3.71Å; I168-I170 HydrophobicContact CG2-CG1 4.38Å; I168-Q184 HydrophobicContact CG2-CB 3.74Å; I168-Q184 HydrophobicContact CG2-CG 4.48Å; I168-I185 HydrophobicContact CD1-CG1 4.08Å; I168-A188 HydrophobicContact CD1-CB 3.9Å
169	S	97.4	Very high	93.9	Very high	4 Å²	4	29.2 Å²	29.2	3%	0.028	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	125.5	-179.7	-60.9	0	0	0	0	109.9	M154 C155 S156	M154-S169 WeakPolarHBondContact CE-OG 3.2Å; M154-S169 CarbonylContact O-C 3.49Å; C155-S169 VanDerWaalsContact CA-O 3.29Å; C155-S169 WeakPolarHBondContact CA-O 3.47Å; S156-S169 PolarHBondContact N-O 3.29Å; S156-S169 VanDerWaalsContact N-O 3.07Å; S156-S169 PolarHBondContact O-N 3.04Å; S156-S169 WeakPolarHBondContact OG-CB 3.34Å; S156-S169 PolarHBondContact OG-OG 3.48Å
170	I	96.9	Very high	94.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	127.6	176.7	-53.8	-55.4	0	0	0	108.8	L111 V119 V149 E150 N151 M154 I168 C175 A176 V181	L111-I170 HydrophobicContact CD1-CB 4.25Å; V119-I170 HydrophobicContact CG2-CG1 4.37Å; V149-I170 PolarHBondContact O-N 2.87Å; E150-I170 CarbonylContact C-O 3.44Å; E150-I170 WeakPolarHBondContact CA-O 3.47Å; E150-I170 VanDerWaalsContact OE1-O 3.07Å; N151-I170 PolarHBondContact N-O 2.74Å; M154-I170 CarbonylContact O-C 3.57Å; I168-I170 HydrophobicContact CG2-CD1 3.71Å; I168-I170 HydrophobicContact CG2-CG1 4.38Å; I170-C175 HydrophobicContact CG2-CB 4.31Å; I170-A176 HydrophobicContact CG2-CB 4.16Å; I170-V181 HydrophobicContact CD1-CG1 4.27Å; I170-V181 HydrophobicContact CD1-CG2 3.89Å
171	S	93.9	Very high	94.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.166	C	C	.	.			trans	-99.1	112.8	175.4	176.1	0	0	0	0	111.7	N151 R152 M154 P173 Q174 C175	N151-S171 WeakPolarHBondContact O-CA 3.4Å; N151-S171 WeakPolarHBondContact O-CB 3.5Å; N151-S171 PolarHBondContact O-OG 3.04Å; R152-S171 PolarHBondContact O-OG 3.06Å; M154-S171 PolarHBondContact O-N 3.47Å; S171-P173 CarbonylContact O-C 3.54Å; S171-Q174 PolarHBondContact O-N 3.19Å; S171-Q174 VanDerWaalsContact OG-CG 3.24Å; S171-Q174 WeakPolarHBondContact OG-CG 3.34Å; S171-Q174 PolarHBondContact OG-NE2 2.04Å; S171-C175 WeakPolarHBondContact O-CB 3.28Å; S171-C175 PolarHBondContact O-N 2.92Å
172	W	92.6	Very high	94.6	Very high	106 Å²	106	28.1 Å²	28.1	40%	0.402	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	138.4	174.6	178.9	-94.4	0	0	0	112.5	R112 E150 A176	R112-W172 HydrophobicContact CB-CD2 4.48Å; E150-W172 WeakPolarHBondContact OE1-CA 3.35Å; E150-W172 WeakPolarHBondContact OE1-CB 3.46Å; E150-W172 PolarHBondContact OE1-N 2.9Å; W172-A176 HydrophobicContact CE3-CB 3.4Å; W172-A176 VanDerWaalsContact CE3-CB 3.4Å; W172-A176 HydrophobicContact CZ3-CB 3.7Å
173	P	90.8	Very high	94.9	Very high	76 Å²	76	26.7 Å²	26.7	49%	0.494	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	cis	-86.7	-7.3	-7.9	34	-34.6	0	0	0	113.4	S171 C175 A176	S171-P173 CarbonylContact O-C 3.54Å; P173-C175 PolarHBondContact O-N 2.91Å; P173-A176 PolarHBondContact O-N 3.24Å
174	Q	89.5	Confident	95.3	Very high	40 Å²	40	24.2 Å²	24.2	19%	0.187	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-29.5	-160.6	53.7	-169.3	20.8	0	0	116.4	I48 S171 L180	I48-Q174 HydrophobicContact CD1-CB 4.28Å; I48-Q174 HydrophobicContact CD1-CG 4.41Å; I48-Q174 VanDerWaalsContact CD1-O 3.25Å; I48-Q174 WeakPolarHBondContact CD1-O 3.06Å; I48-Q174 HydrophobicContact CG1-CB 4.16Å; I48-Q174 HydrophobicContact CG1-CG 4.13Å; I48-Q174 HydrophobicContact CG2-CG 4.05Å; S171-Q174 PolarHBondContact O-N 3.19Å; S171-Q174 VanDerWaalsContact OG-CG 3.24Å; S171-Q174 WeakPolarHBondContact OG-CG 3.34Å; S171-Q174 PolarHBondContact OG-NE2 2.04Å; Q174-L180 WeakPolarHBondContact O-CD1 3.45Å
175	C	93.4	Very high	95.6	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-9.6	173.8	177.8	0	0	0	0	111.9	I48 C155 I170 S171 P173 T177	I48-C175 HydrophobicContact CD1-CB 4.02Å; C155-C175 VanDerWaalsContact CA-SG 3.54Å; C155-C175 HydrophobicContact CB-CB 3.57Å; C155-C175 WeakPolarHBondContact CB-SG 3.44Å; C155-C175 WeakPolarHBondContact SG-CB 3.31Å; C155-C175 CovalentContact SG-SG 2.04Å; C155-C175 PolarHBondContact SG-SG 3.07Å; I170-C175 HydrophobicContact CG2-CB 4.31Å; S171-C175 WeakPolarHBondContact O-CB 3.28Å; S171-C175 PolarHBondContact O-N 2.92Å; P173-C175 PolarHBondContact O-N 2.91Å; C175-T177 PolarHBondContact O-N 2.95Å
176	A	94.7	Very high	95.7	Very high	15 Å²	15	17.8 Å²	17.8	12%	0.124	10%	0.095	C	C	.	.			trans	-80.4	43.5	-175.9	0	0	0	0	0	112.7	A118 I170 W172 P173	A118-A176 WeakPolarHBondContact CB-O 3.3Å; I170-A176 HydrophobicContact CG2-CB 4.16Å; W172-A176 HydrophobicContact CE3-CB 3.4Å; W172-A176 VanDerWaalsContact CE3-CB 3.4Å; W172-A176 HydrophobicContact CZ3-CB 3.7Å; P173-A176 PolarHBondContact O-N 3.24Å
177	T	94.6	Very high	95.8	Very high	23 Å²	23	17.7 Å²	17.7	14%	0.141	10%	0.095	C	C	.	.	S	Bend	trans	-108.6	151.3	173	71.6	0	0	0	0	109.9	A40 C175 G179 L180 V181	A40-T177 HydrophobicContact CB-CG2 4.43Å; A40-T177 WeakPolarHBondContact O-CG2 3.42Å; C175-T177 PolarHBondContact O-N 2.95Å; T177-G179 VanDerWaalsContact C-N 3.33Å; T177-G179 PolarHBondContact O-N 2.89Å; T177-L180 PolarHBondContact O-N 2.93Å; T177-L180 WeakPolarHBondContact OG1-CB 3.31Å; T177-L180 PolarHBondContact OG1-N 2.85Å; T177-V181 VanDerWaalsContact O-CG2 3.27Å; T177-V181 WeakPolarHBondContact O-CG2 3.28Å; T177-V181 PolarHBondContact O-N 2.8Å
178	V	95.9	Very high	95.8	Very high	46 Å²	46	14.8 Å²	14.8	28%	0.279	8%	0.079	S	C	.	.	H	α-helix	trans	-58.9	-43.8	-174.3	179.5	0	0	0	0	111.6	K121 A122 L125 A182	K121-V178 HydrophobicContact CB-CG1 4.08Å; K121-V178 HydrophobicContact CB-CG2 3.74Å; K121-V178 HydrophobicContact CD-CG2 3.89Å; K121-V178 HydrophobicContact CG-CG2 4.48Å; A122-V178 HydrophobicContact CB-CG1 4.4Å; A122-V178 WeakPolarHBondContact CB-O 3.45Å; L125-V178 HydrophobicContact CD1-CG1 3.51Å; L125-V178 HydrophobicContact CG-CG1 4.34Å; V178-A182 VanDerWaalsContact O-CB 3.23Å; V178-A182 WeakPolarHBondContact O-CB 3.38Å; V178-A182 PolarHBondContact O-N 3.13Å
179	G	95.8	Very high	95.7	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.01	8%	0.079	C	C	.	.	H	α-helix	trans	-75.6	-34	-178.2	0	0	0	0	0	114.3	T177 A182 H183 R270	T177-G179 VanDerWaalsContact C-N 3.33Å; T177-G179 PolarHBondContact O-N 2.89Å; G179-A182 PolarHBondContact O-N 2.75Å; G179-H183 WeakPolarHBondContact O-CB 3.46Å; G179-H183 PolarHBondContact O-N 2.9Å; G179-R270 WeakPolarHBondContact CA-O 3.33Å
180	L	95.7	Very high	95.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-66.6	-43.2	172.2	-78.8	169.9	0	0	0	111.1	I48 Q174 T177 A182 H183 Q184 R270	I48-L180 HydrophobicContact CD1-CD1 3.82Å; Q174-L180 WeakPolarHBondContact O-CD1 3.45Å; T177-L180 PolarHBondContact O-N 2.93Å; T177-L180 WeakPolarHBondContact OG1-CB 3.31Å; T177-L180 PolarHBondContact OG1-N 2.85Å; L180-A182 VanDerWaalsContact C-N 3.3Å; L180-A182 PolarHBondContact O-N 3.13Å; L180-H183 WeakPolarHBondContact O-CB 3.32Å; L180-H183 PolarHBondContact O-N 2.61Å; L180-Q184 WeakPolarHBondContact O-CG 3.4Å; L180-Q184 PolarHBondContact O-N 3.12Å; L180-R270 HydrophobicContact CD2-CG 4.15Å; L180-R270 HydrophobicContact CG-CB 4.47Å; L180-R270 HydrophobicContact CG-CG 4.44Å
181	V	97.8	Very high	95.3	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-64.8	-38.5	175.2	-177	0	0	0	0	110.8	A118 V119 A122 F148 I170 T177 H183 Q184 I185	A118-V181 HydrophobicContact CB-CG2 4.05Å; V119-V181 HydrophobicContact CB-CG1 4.22Å; V119-V181 HydrophobicContact CG2-CG1 3.78Å; V119-V181 HydrophobicContact CG2-CG2 4.48Å; A122-V181 HydrophobicContact CB-CB 3.75Å; A122-V181 HydrophobicContact CB-CG1 3.7Å; F148-V181 HydrophobicContact CE1-CG1 4.48Å; I170-V181 HydrophobicContact CD1-CG1 4.27Å; I170-V181 HydrophobicContact CD1-CG2 3.89Å; T177-V181 VanDerWaalsContact O-CG2 3.27Å; T177-V181 WeakPolarHBondContact O-CG2 3.28Å; T177-V181 PolarHBondContact O-N 2.8Å; V181-H183 VanDerWaalsContact C-N 3.33Å; V181-H183 PolarHBondContact O-N 3.39Å; V181-Q184 PolarHBondContact O-N 3.49Å; V181-I185 HydrophobicContact CG1-CD1 4.05Å; V181-I185 HydrophobicContact CG1-CG1 4.45Å; V181-I185 WeakPolarHBondContact O-CG1 3.4Å; V181-I185 PolarHBondContact O-N 3.29Å
182	A	98.2	Very high	95.2	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-63.8	-37.7	175.7	0	0	0	0	0	112.3	A122 L125 W126 V178 G179 L180 I185 G186 P273	A122-A182 HydrophobicContact CB-CB 4.04Å; L125-A182 HydrophobicContact CD1-CB 4.42Å; W126-A182 WeakPolarHBondContact CZ2-O 3.49Å; W126-A182 PolarHBondContact NE1-O 3.19Å; V178-A182 VanDerWaalsContact O-CB 3.23Å; V178-A182 WeakPolarHBondContact O-CB 3.38Å; V178-A182 PolarHBondContact O-N 3.13Å; G179-A182 PolarHBondContact O-N 2.75Å; L180-A182 VanDerWaalsContact C-N 3.3Å; L180-A182 PolarHBondContact O-N 3.13Å; A182-I185 PolarHBondContact O-N 2.76Å; A182-G186 PolarHBondContact O-N 3.32Å; A182-P273 HydrophobicContact CB-CG 3.95Å
183	H	97.9	Very high	95.2	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-59.8	-49	172.1	-179.8	109	0	0	0	111.6	D58 G179 L180 V181 I185 G186 H187 H193 V239	D58-H183 IonicContact OD2-CD2 3.51Å; D58-H183 IonicContact OD2-NE2 3.57Å; D58-H183 PolarHBondContact OD2-NE2 3.47Å; G179-H183 WeakPolarHBondContact O-CB 3.46Å; G179-H183 PolarHBondContact O-N 2.9Å; L180-H183 WeakPolarHBondContact O-CB 3.32Å; L180-H183 PolarHBondContact O-N 2.61Å; V181-H183 VanDerWaalsContact C-N 3.33Å; V181-H183 PolarHBondContact O-N 3.39Å; H183-I185 VanDerWaalsContact C-N 3.33Å; H183-I185 PolarHBondContact O-N 2.85Å; H183-G186 CarbonylContact O-C 3.57Å; H183-G186 VanDerWaalsContact O-CA 3.31Å; H183-G186 WeakPolarHBondContact O-CA 3.2Å; H183-G186 PolarHBondContact O-N 2.89Å; H183-H187 AromaticContact CD2-CD2 3.61Å; H183-H187 AromaticContact CD2-NE2 3.41Å; H183-H187 PolarHBondContact CD2-NE2 3.29Å; H183-H187 AromaticContact CE1-NE2 3.91Å; H183-H187 AromaticContact NE2-CD2 3.72Å; H183-H187 AromaticContact NE2-CE1 3.96Å; H183-H187 AromaticContact NE2-NE2 3.01Å; H183-H187 PolarHBondContact NE2-NE2 3.24Å; H183-H187 PolarHBondContact O-N 2.96Å; H183-H193 AromaticContact CE1-CD2 3.77Å; H183-H193 AromaticContact CE1-NE2 3.89Å; H183-H193 AromaticContact NE2-CD2 3.91Å; H183-H193 AromaticContact NE2-NE2 3.6Å; H183-V239 HydrophobicContact CB-CG2 4.16Å; H183-V239 PolarHBondContact CE1-O 2.78Å; H183-V239 PolarHBondContact ND1-O 2.82Å
184	Q	98	Very high	95.4	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-62.9	-39	177.4	-63.1	-52	-39.7	0	0	112.3	D58 S157 I168 L180 V181 G186 H187 A188	D58-Q184 PolarHBondContact OD2-NE2 3.07Å; S157-Q184 VanDerWaalsContact CB-O 3.28Å; S157-Q184 WeakPolarHBondContact CB-O 3.1Å; S157-Q184 PolarHBondContact OG-O 3.3Å; I168-Q184 HydrophobicContact CG2-CB 3.74Å; I168-Q184 HydrophobicContact CG2-CG 4.48Å; L180-Q184 WeakPolarHBondContact O-CG 3.4Å; L180-Q184 PolarHBondContact O-N 3.12Å; V181-Q184 PolarHBondContact O-N 3.49Å; Q184-G186 VanDerWaalsContact C-N 3.32Å; Q184-H187 PolarHBondContact O-N 2.94Å; Q184-A188 PolarHBondContact O-N 2.68Å; Q184-A188 VanDerWaalsContact O-N 3.11Å
185	I	98.4	Very high	95.5	Very high	0 Å²	0	7 Å²	7	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-62.9	-41.5	170.9	-66.4	166.6	0	0	0	110.1	A122 I123 W126 L134 F148 I168 V181 A182 H183 H187 A188 L189	A122-I185 HydrophobicContact CB-CD1 3.93Å; I123-I185 HydrophobicContact CG1-CD1 3.79Å; W126-I185 HydrophobicContact CG-CG2 4.11Å; L134-I185 HydrophobicContact CD2-CG2 4.07Å; F148-I185 HydrophobicContact CE1-CD1 4.3Å; F148-I185 HydrophobicContact CE1-CG1 4.08Å; F148-I185 HydrophobicContact CZ-CD1 4.15Å; F148-I185 HydrophobicContact CZ-CG1 4.1Å; I168-I185 HydrophobicContact CD1-CG1 4.08Å; V181-I185 HydrophobicContact CG1-CD1 4.05Å; V181-I185 HydrophobicContact CG1-CG1 4.45Å; V181-I185 WeakPolarHBondContact O-CG1 3.4Å; V181-I185 PolarHBondContact O-N 3.29Å; A182-I185 PolarHBondContact O-N 2.76Å; H183-I185 VanDerWaalsContact C-N 3.33Å; H183-I185 PolarHBondContact O-N 2.85Å; I185-H187 VanDerWaalsContact C-N 3.3Å; I185-H187 PolarHBondContact O-N 3.15Å; I185-A188 CarbonylContact O-C 3.59Å; I185-A188 WeakPolarHBondContact O-CA 3.12Å; I185-A188 WeakPolarHBondContact O-CB 3.29Å; I185-A188 PolarHBondContact O-N 3.29Å; I185-L189 HydrophobicContact CG2-CD1 4.14Å; I185-L189 HydrophobicContact CG2-CG 4.19Å; I185-L189 VanDerWaalsContact O-CG 3.31Å; I185-L189 WeakPolarHBondContact O-CG 3.4Å; I185-L189 PolarHBondContact O-N 3.43Å
186	G	98	Very high	95.2	Very high	0 Å²	0	7 Å²	7	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-52.5	-45.7	173.9	0	0	0	0	0	112.6	A182 H183 Q184 L189 G190 L191	A182-G186 PolarHBondContact O-N 3.32Å; H183-G186 CarbonylContact O-C 3.57Å; H183-G186 VanDerWaalsContact O-CA 3.31Å; H183-G186 WeakPolarHBondContact O-CA 3.2Å; H183-G186 PolarHBondContact O-N 2.89Å; Q184-G186 VanDerWaalsContact C-N 3.32Å; G186-L189 CarbonylContact O-C 3.6Å; G186-L189 WeakPolarHBondContact O-CA 3.34Å; G186-L189 WeakPolarHBondContact O-CB 3.36Å; G186-L189 PolarHBondContact O-N 2.91Å; G186-L189 VanDerWaalsContact O-N 3.14Å; G186-G190 PolarHBondContact O-N 3.12Å; G186-L191 VanDerWaalsContact O-CB 3.28Å; G186-L191 WeakPolarHBondContact O-CB 3.25Å; G186-L191 WeakPolarHBondContact O-CG 3.41Å; G186-L191 PolarHBondContact O-N 3.38Å
187	H	96.9	Very high	94.7	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-59.3	-48	171.5	-72.7	-42.6	0	0	0	112.7	D58 L59 F158 V159 G160 H183 Q184 I185 L189 G190 L191 H193 M240	D58-H187 IonicContact OD1-NE2 3.87Å; D58-H187 IonicContact OD2-CD2 2.66Å; D58-H187 PolarHBondContact OD2-CD2 2.99Å; D58-H187 VanDerWaalsContact OD2-CD2 3.24Å; D58-H187 IonicContact OD2-NE2 2.61Å; D58-H187 PolarHBondContact OD2-NE2 3.41Å; D58-H187 VanDerWaalsContact OD2-NE2 3.15Å; L59-H187 HydrophobicContact CD2-CB 4.34Å; L59-H187 VanDerWaalsContact CD2-CE1 3.43Å; L59-H187 WeakPolarHBondContact CD2-CE1 3.41Å; L59-H187 WeakPolarHBondContact CD2-ND1 2.98Å; F158-H187 CarbonylContact O-C 3.6Å; V159-H187 CarbonylContact C-O 3.59Å; V159-H187 VanDerWaalsContact CA-O 3.25Å; V159-H187 WeakPolarHBondContact CA-O 3.45Å; G160-H187 PolarHBondContact N-O 3.01Å; H183-H187 AromaticContact CD2-CD2 3.61Å; H183-H187 AromaticContact CD2-NE2 3.41Å; H183-H187 PolarHBondContact CD2-NE2 3.29Å; H183-H187 AromaticContact CE1-NE2 3.91Å; H183-H187 AromaticContact NE2-CD2 3.72Å; H183-H187 AromaticContact NE2-CE1 3.96Å; H183-H187 AromaticContact NE2-NE2 3.01Å; H183-H187 PolarHBondContact NE2-NE2 3.24Å; H183-H187 PolarHBondContact O-N 2.96Å; Q184-H187 PolarHBondContact O-N 2.94Å; I185-H187 VanDerWaalsContact C-N 3.3Å; I185-H187 PolarHBondContact O-N 3.15Å; H187-L189 PolarHBondContact O-N 3.22Å; H187-L189 VanDerWaalsContact O-N 3.17Å; H187-G190 WeakPolarHBondContact O-CA 3.39Å; H187-G190 PolarHBondContact O-N 2.86Å; H187-L191 WeakPolarHBondContact CA-O 3.48Å; H187-L191 PolarHBondContact ND1-O 3.49Å; H187-H193 AromaticContact CE1-CD2 3.91Å; H187-H193 AromaticContact CE1-NE2 3.76Å; H187-H193 AromaticContact NE2-CE1 3.98Å; H187-H193 AromaticContact NE2-NE2 3.52Å; H187-M240 WeakPolarHBondContact CE1-CE 3.3Å; H187-M240 WeakPolarHBondContact ND1-CE 3.33Å; H187-M240 WeakPolarHBondContact NE2-CE 3.02Å
188	A	97.3	Very high	93.9	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-59.4	-28.5	176.2	0	0	0	0	0	112.8	W98 I146 S157 F158 G160 I168 Q184 I185 G190	W98-A188 PolarHBondContact NE1-O 3.09Å; I146-A188 HydrophobicContact CD1-CB 3.9Å; S157-A188 PolarHBondContact OG-N 3.38Å; F158-A188 WeakPolarHBondContact O-CA 3.44Å; F158-A188 PolarHBondContact O-N 3.01Å; G160-A188 CarbonylContact C-O 3.57Å; G160-A188 VanDerWaalsContact CA-O 3.28Å; G160-A188 WeakPolarHBondContact CA-O 3.27Å; I168-A188 HydrophobicContact CD1-CB 3.9Å; Q184-A188 PolarHBondContact O-N 2.68Å; Q184-A188 VanDerWaalsContact O-N 3.11Å; I185-A188 CarbonylContact O-C 3.59Å; I185-A188 WeakPolarHBondContact O-CA 3.12Å; I185-A188 WeakPolarHBondContact O-CB 3.29Å; I185-A188 PolarHBondContact O-N 3.29Å; A188-G190 VanDerWaalsContact C-N 3.25Å; A188-G190 PolarHBondContact O-N 3.27Å
189	L	95.9	Very high	93.2	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-0.6	172.4	-61.3	-178.6	0	0	0	113.8	I103 W126 L132 I185 G186 H187 V281 Y285	I103-L189 HydrophobicContact CD1-CD2 3.37Å; W126-L189 HydrophobicContact CD2-CD1 3.85Å; W126-L189 HydrophobicContact CE3-CD1 3.91Å; W126-L189 HydrophobicContact CG-CD1 4.26Å; W126-L189 HydrophobicContact CZ3-CD1 4.34Å; L132-L189 HydrophobicContact CD1-CD1 3.83Å; L132-L189 HydrophobicContact CD1-CD2 3.54Å; L132-L189 HydrophobicContact CD1-CG 4.25Å; I185-L189 HydrophobicContact CG2-CD1 4.14Å; I185-L189 HydrophobicContact CG2-CG 4.19Å; I185-L189 VanDerWaalsContact O-CG 3.31Å; I185-L189 WeakPolarHBondContact O-CG 3.4Å; I185-L189 PolarHBondContact O-N 3.43Å; G186-L189 CarbonylContact O-C 3.6Å; G186-L189 WeakPolarHBondContact O-CA 3.34Å; G186-L189 WeakPolarHBondContact O-CB 3.36Å; G186-L189 PolarHBondContact O-N 2.91Å; G186-L189 VanDerWaalsContact O-N 3.14Å; H187-L189 PolarHBondContact O-N 3.22Å; H187-L189 VanDerWaalsContact O-N 3.17Å; L189-V281 HydrophobicContact CD1-CG1 4.16Å; L189-V281 HydrophobicContact CD1-CG2 4.34Å; L189-Y285 HydrophobicContact CB-CE2 4.34Å; L189-Y285 WeakPolarHBondContact O-CE2 3.13Å; L189-Y285 PolarHBondContact O-OH 3.29Å
190	G	92.3	Very high	92.7	Very high	21 Å²	21	9.6 Å²	9.6	22%	0.216	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.6	7.9	176.9	0	0	0	0	0	114.9	G186 H187 A188	G186-G190 PolarHBondContact O-N 3.12Å; H187-G190 WeakPolarHBondContact O-CA 3.39Å; H187-G190 PolarHBondContact O-N 2.86Å; A188-G190 VanDerWaalsContact C-N 3.25Å; A188-G190 PolarHBondContact O-N 3.27Å
191	L	93.3	Very high	92.1	Very high	8 Å²	8	14 Å²	14	4%	0.042	7%	0.074	C	C	.	.			trans	-73.3	140.9	172.6	-54.8	-174.3	0	0	0	110.3	W126 G186 H187 M240 L280 V281	W126-L191 HydrophobicContact CH2-CD1 3.7Å; W126-L191 HydrophobicContact CZ2-CD1 4.44Å; W126-L191 HydrophobicContact CZ3-CD1 4.49Å; G186-L191 VanDerWaalsContact O-CB 3.28Å; G186-L191 WeakPolarHBondContact O-CB 3.25Å; G186-L191 WeakPolarHBondContact O-CG 3.41Å; G186-L191 PolarHBondContact O-N 3.38Å; H187-L191 WeakPolarHBondContact CA-O 3.48Å; H187-L191 PolarHBondContact ND1-O 3.49Å; L191-M240 HydrophobicContact CB-CE 3.97Å; L191-M240 HydrophobicContact CB-CG 4.21Å; L191-M240 HydrophobicContact CB-SD 4.29Å; L191-M240 HydrophobicContact CD1-CG 4.17Å; L191-M240 HydrophobicContact CD1-SD 4.32Å; L191-L280 HydrophobicContact CD2-CD2 3.67Å; L191-L280 HydrophobicContact CD2-CG 3.81Å; L191-V281 HydrophobicContact CD1-CG2 3.9Å; L191-V281 HydrophobicContact CD2-CG2 3.93Å; L191-V281 HydrophobicContact CG-CG2 4.1Å
192	L	91.2	Very high	91.4	Very high	14 Å²	14	23.2 Å²	23.2	7%	0.073	11%	0.109	C	C	.	.			trans	-113	171.2	171.2	-74.7	164.9	0	0	0	108.5	L59 F95 V159 L222 L227	L59-L192 HydrophobicContact CD1-CD2 3.77Å; F95-L192 HydrophobicContact CD2-CD1 3.97Å; F95-L192 HydrophobicContact CE2-CD1 3.67Å; F95-L192 HydrophobicContact CZ-CD1 4.19Å; F95-L192 HydrophobicContact CZ-CD2 4.38Å; V159-L192 HydrophobicContact CB-CD2 4.48Å; V159-L192 HydrophobicContact CG1-CD2 3.91Å; V159-L192 HydrophobicContact CG1-CG 4.1Å; V159-L192 HydrophobicContact CG2-CD2 3.88Å; L192-L222 HydrophobicContact CB-CD1 4.46Å; L192-L222 HydrophobicContact CD1-CD1 3.81Å; L192-L222 HydrophobicContact CD2-CD1 4.35Å; L192-L222 HydrophobicContact CG-CD1 4.45Å; L192-L227 HydrophobicContact CB-CD2 3.49Å; L192-L227 VanDerWaalsContact CB-CD2 3.49Å; L192-L227 HydrophobicContact CD1-CD2 3.54Å; L192-L227 HydrophobicContact CD1-CG 4.27Å; L192-L227 HydrophobicContact CG-CD2 4.15Å
193	H	93.1	Very high	90.9	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	12%	0.121	C	C	.	.			trans	-69.4	141.8	-177.5	-56.1	113.5	0	0	0	113.7	M56 D58 H183 H187 Q195 N196 M240	M56-H193 PolarHBondContact O-CE1 3.25Å; M56-H193 VanDerWaalsContact O-CE1 3.31Å; D58-H193 IonicContact OD1-CE1 3.66Å; D58-H193 PolarHBondContact OD1-CE1 3.15Å; D58-H193 IonicContact OD1-NE2 3.42Å; D58-H193 PolarHBondContact OD1-NE2 3.31Å; H183-H193 AromaticContact CE1-CD2 3.77Å; H183-H193 AromaticContact CE1-NE2 3.89Å; H183-H193 AromaticContact NE2-CD2 3.91Å; H183-H193 AromaticContact NE2-NE2 3.6Å; H187-H193 AromaticContact CE1-CD2 3.91Å; H187-H193 AromaticContact CE1-NE2 3.76Å; H187-H193 AromaticContact NE2-CE1 3.98Å; H187-H193 AromaticContact NE2-NE2 3.52Å; H193-Q195 VanDerWaalsContact CB-NE2 3.25Å; H193-Q195 PolarHBondContact O-N 2.98Å; H193-N196 WeakPolarHBondContact CB-OD1 3.11Å; H193-N196 PolarHBondContact O-N 2.87Å; H193-N196 VanDerWaalsContact O-N 3.14Å; H193-M240 VanDerWaalsContact CA-O 3.25Å; H193-M240 WeakPolarHBondContact CA-O 3.36Å; H193-M240 WeakPolarHBondContact CB-O 3.2Å; H193-M240 PolarHBondContact CD2-O 2.8Å
194	E	95	Very high	90.3	Very high	18 Å²	18	26 Å²	26	8%	0.084	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-69.1	-35.8	-175.8	-168.6	67.1	-174.5	0	0	111.8	N196 R197 Y234 D235 M240 H241	E194-N196 PolarHBondContact O-N 2.95Å; E194-R197 WeakPolarHBondContact O-CG 3.48Å; E194-R197 PolarHBondContact O-N 3Å; E194-R197 VanDerWaalsContact O-N 3.16Å; E194-R197 WeakPolarHBondContact OE1-CD 3.39Å; E194-R197 IonicContact OE1-CZ 3.95Å; E194-R197 IonicContact OE1-NE 2.91Å; E194-R197 IonicContact OE1-NH1 3.88Å; E194-R197 WeakPolarHBondContact OE2-CD 3.42Å; E194-Y234 HydrophobicContact CG-CD1 4.42Å; E194-Y234 HydrophobicContact CG-CD2 4.46Å; E194-Y234 HydrophobicContact CG-CE1 4.06Å; E194-Y234 HydrophobicContact CG-CE2 4.07Å; E194-Y234 WeakPolarHBondContact O-CE2 3.4Å; E194-Y234 PolarHBondContact O-OH 2.78Å; E194-Y234 WeakPolarHBondContact OE1-CA 3.44Å; E194-D235 PolarHBondContact OE1-N 3.07Å; E194-M240 PolarHBondContact N-O 3.15Å; E194-H241 HydrophobicContact CB-CB 4.01Å
195	Q	91.1	Very high	89.6	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-68.6	-3.4	175	82.7	-73.6	-13.2	0	0	114.4	H193 R200 L218 Y234 M240 V242 I256	H193-Q195 VanDerWaalsContact CB-NE2 3.25Å; H193-Q195 PolarHBondContact O-N 2.98Å; Q195-R200 WeakPolarHBondContact O-CD 3.41Å; Q195-R200 PolarHBondContact O-NH1 3.07Å; Q195-L218 WeakPolarHBondContact CG-O 3.37Å; Q195-L218 PolarHBondContact NE2-O 3.16Å; Q195-Y234 WeakPolarHBondContact CA-OH 3.45Å; Q195-Y234 PolarHBondContact N-OH 3.31Å; Q195-M240 PolarHBondContact OE1-O 3.47Å; Q195-V242 HydrophobicContact CB-CG1 3.99Å; Q195-V242 HydrophobicContact CG-CB 4.13Å; Q195-V242 HydrophobicContact CG-CG1 3.63Å; Q195-I256 HydrophobicContact CB-CD1 4.09Å; Q195-I256 HydrophobicContact CG-CD1 4.44Å
196	N	88.1	Confident	88.8	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-98.2	0.3	175.4	-57.4	136.3	0	0	0	112.8	M56 H193 E194 L218 T220 R221 L222	M56-N196 HydrophobicContact CE-CB 4.19Å; M56-N196 WeakPolarHBondContact CE-OD1 3.11Å; M56-N196 PolarHBondContact SD-OD1 3.05Å; H193-N196 WeakPolarHBondContact CB-OD1 3.11Å; H193-N196 PolarHBondContact O-N 2.87Å; H193-N196 VanDerWaalsContact O-N 3.14Å; E194-N196 PolarHBondContact O-N 2.95Å; N196-L218 PolarHBondContact ND2-O 2.98Å; N196-T220 WeakPolarHBondContact CB-O 3.46Å; N196-T220 PolarHBondContact ND2-O 3.39Å; N196-R221 CarbonylContact O-C 3.5Å; N196-R221 WeakPolarHBondContact O-CA 3.43Å; N196-L222 HydrophobicContact CB-CD1 4.02Å; N196-L222 HydrophobicContact CB-CG 3.94Å; N196-L222 PolarHBondContact O-N 2.8Å
197	R	84.8	Confident	87.9	Confident	14 Å²	14	28.1 Å²	28.1	5%	0.053	14%	0.138	C	C	.	.	S	Bend	trans	-60	151.7	174.5	-65.8	173.9	57.1	127	-0.1	113.4	E194 D199 R200 L227 D229 L232 Y234	E194-R197 WeakPolarHBondContact O-CG 3.48Å; E194-R197 PolarHBondContact O-N 3Å; E194-R197 VanDerWaalsContact O-N 3.16Å; E194-R197 WeakPolarHBondContact OE1-CD 3.39Å; E194-R197 IonicContact OE1-CZ 3.95Å; E194-R197 IonicContact OE1-NE 2.91Å; E194-R197 IonicContact OE1-NH1 3.88Å; E194-R197 WeakPolarHBondContact OE2-CD 3.42Å; R197-D199 VanDerWaalsContact C-N 3.28Å; R197-D199 WeakPolarHBondContact CB-OD1 3.2Å; R197-D199 IonicContact CZ-OD1 3.8Å; R197-D199 IonicContact CZ-OD2 3.34Å; R197-D199 IonicContact NE-OD1 3.8Å; R197-D199 PolarHBondContact NE-OD1 3.44Å; R197-D199 IonicContact NE-OD2 3.34Å; R197-D199 IonicContact NH2-OD1 2.92Å; R197-D199 IonicContact NH2-OD2 2.87Å; R197-D199 PolarHBondContact NH2-OD2 2.7Å; R197-D199 PolarHBondContact O-N 2.74Å; R197-R200 WeakPolarHBondContact O-CB 3.39Å; R197-R200 WeakPolarHBondContact O-CG 3.46Å; R197-R200 PolarHBondContact O-N 3.13Å; R197-L227 HydrophobicContact CB-CD1 4.44Å; R197-L227 HydrophobicContact CG-CD1 4.22Å; R197-D229 IonicContact CZ-OD2 3.75Å; R197-D229 IonicContact NH2-OD2 2.82Å; R197-D229 PolarHBondContact NH2-OD2 2.93Å; R197-L232 PolarHBondContact NH1-O 3.42Å; R197-L232 PolarHBondContact NH2-O 3.13Å; R197-L232 VanDerWaalsContact NH2-O 3.09Å; R197-Y234 HydrophobicContact CB-CD2 4.28Å; R197-Y234 HydrophobicContact CB-CE2 4.1Å; R197-Y234 HydrophobicContact CG-CE2 4.41Å
198	L	77.9	Confident	87	Confident	73 Å²	73	29.8 Å²	29.8	38%	0.382	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-25.6	178.8	-80.3	-169.1	0	0	0	114	Q201 R221 L222 S224	L198-Q201 VanDerWaalsContact O-CD 3.26Å; L198-Q201 PolarHBondContact O-NE2 3.11Å; L198-Q201 PolarHBondContact O-OE1 2.96Å; L198-R221 HydrophobicContact CD2-CB 4.3Å; L198-L222 WeakPolarHBondContact CD2-O 3.33Å; L198-L222 WeakPolarHBondContact CG-O 3.25Å; L198-S224 VanDerWaalsContact CD1-N 3.34Å
199	D	79.9	Confident	85.9	Confident	41 Å²	41	38 Å²	38	22%	0.219	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-3	-179.2	58	-6.9	0	0	0	113.2	R197 Q201 R202	R197-D199 VanDerWaalsContact C-N 3.28Å; R197-D199 WeakPolarHBondContact CB-OD1 3.2Å; R197-D199 IonicContact CZ-OD1 3.8Å; R197-D199 IonicContact CZ-OD2 3.34Å; R197-D199 IonicContact NE-OD1 3.8Å; R197-D199 PolarHBondContact NE-OD1 3.44Å; R197-D199 IonicContact NE-OD2 3.34Å; R197-D199 IonicContact NH2-OD1 2.92Å; R197-D199 IonicContact NH2-OD2 2.87Å; R197-D199 PolarHBondContact NH2-OD2 2.7Å; R197-D199 PolarHBondContact O-N 2.74Å; D199-Q201 PolarHBondContact O-N 3.05Å; D199-R202 PolarHBondContact O-N 3.33Å
200	R	85.6	Confident	85	Confident	11 Å²	11	38.2 Å²	38.2	4%	0.042	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-50.5	-31.4	-175	78.5	176.7	-166.1	129.6	2	114.7	Q195 R197 R202 H203 V204 Y208 V219 R221 Y234	Q195-R200 WeakPolarHBondContact O-CD 3.41Å; Q195-R200 PolarHBondContact O-NH1 3.07Å; R197-R200 WeakPolarHBondContact O-CB 3.39Å; R197-R200 WeakPolarHBondContact O-CG 3.46Å; R197-R200 PolarHBondContact O-N 3.13Å; R200-R202 PolarHBondContact O-N 3.22Å; R200-H203 CarbonylContact O-C 3.44Å; R200-H203 WeakPolarHBondContact O-CA 3.32Å; R200-H203 PolarHBondContact O-N 2.61Å; R200-V204 HydrophobicContact CB-CG2 3.9Å; R200-V204 HydrophobicContact CG-CG2 4.2Å; R200-V204 WeakPolarHBondContact O-CG2 3.48Å; R200-V204 PolarHBondContact O-N 3.48Å; R200-Y208 PolarHBondContact NH2-OH 2.04Å; R200-Y208 VanDerWaalsContact NH2-OH 3.07Å; R200-V219 PolarHBondContact NH1-O 2.78Å; R200-V219 VanDerWaalsContact NH1-O 3.13Å; R200-V219 PolarHBondContact NH2-O 3.44Å; R200-R221 HydrophobicContact CG-CG 3.94Å; R200-Y234 HydrophobicContact CB-CE2 3.74Å
201	Q	82.6	Confident	84.2	Confident	94 Å²	94	37.2 Å²	37.2	44%	0.439	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-61.8	-14.6	-178.1	62.1	-80.4	-9.5	0	0	113.5	L198 D199	L198-Q201 VanDerWaalsContact O-CD 3.26Å; L198-Q201 PolarHBondContact O-NE2 3.11Å; L198-Q201 PolarHBondContact O-OE1 2.96Å; D199-Q201 PolarHBondContact O-N 3.05Å
202	R	84.1	Confident	83.4	Confident	193 Å²	193	39.7 Å²	39.7	73%	0.728	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-83.1	-14.2	172.9	-62.8	179.9	176.7	-179.7	-1.5	113.1	D199 R200	D199-R202 PolarHBondContact O-N 3.33Å; R200-R202 PolarHBondContact O-N 3.22Å
203	H	86.5	Confident	82.6	Confident	54 Å²	54	41.2 Å²	41.2	25%	0.25	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.9	-33.8	-169.3	-56.7	-77.9	0	0	0	112.6	R200 Y234 L236 A258 V259	R200-H203 CarbonylContact O-C 3.44Å; R200-H203 WeakPolarHBondContact O-CA 3.32Å; R200-H203 PolarHBondContact O-N 2.61Å; H203-Y234 HydrophobicContact CB-CD1 3.55Å; H203-Y234 HydrophobicContact CB-CD2 4.48Å; H203-Y234 HydrophobicContact CB-CE1 3.72Å; H203-Y234 HydrophobicContact CB-CG 3.98Å; H203-Y234 WeakPolarHBondContact CD2-CB 3.21Å; H203-Y234 AromaticContact CD2-CD1 3.9Å; H203-Y234 AromaticContact CD2-CD2 3.74Å; H203-Y234 AromaticContact CD2-CG 3.39Å; H203-Y234 AromaticContact CG-CD1 3.56Å; H203-Y234 AromaticContact CG-CG 3.56Å; H203-Y234 WeakPolarHBondContact NE2-CB 3.45Å; H203-Y234 AromaticContact NE2-CG 3.96Å; H203-L236 HydrophobicContact CB-CD2 4.27Å; H203-A258 CarbonylContact O-C 3.46Å; H203-A258 WeakPolarHBondContact O-CA 3.44Å; H203-V259 PolarHBondContact O-N 3.48Å
204	V	87.1	Confident	81.7	Confident	3 Å²	3	44 Å²	44	2%	0.018	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141.2	178.8	-63.2	0	0	0	0	112.1	R200 L236 I256 V257	R200-V204 HydrophobicContact CB-CG2 3.9Å; R200-V204 HydrophobicContact CG-CG2 4.2Å; R200-V204 WeakPolarHBondContact O-CG2 3.48Å; R200-V204 PolarHBondContact O-N 3.48Å; V204-L236 HydrophobicContact CG1-CD2 3.84Å; V204-I256 HydrophobicContact CB-CD1 4.16Å; V204-I256 HydrophobicContact CB-CG1 4.11Å; V204-I256 HydrophobicContact CG1-CD1 4.47Å; V204-I256 HydrophobicContact CG2-CD1 4.13Å; V204-V257 CarbonylContact C-O 3.45Å; V204-V257 WeakPolarHBondContact CA-O 3.43Å; V204-V257 WeakPolarHBondContact CB-O 3.28Å
205	A	82.4	Confident	80.9	Confident	19 Å²	19	44.7 Å²	44.7	16%	0.157	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	139	171.5	0	0	0	0	0	109.6	I26 I256 V257 V259	I26-A205 HydrophobicContact CD1-CB 4.05Å; I26-A205 HydrophobicContact CG1-CB 4.11Å; A205-I256 WeakPolarHBondContact O-CA 3.45Å; A205-V257 HydrophobicContact CB-CG2 4.03Å; A205-V257 PolarHBondContact N-O 3.06Å; A205-V257 PolarHBondContact O-N 2.94Å; A205-V259 HydrophobicContact CB-CG2 4.37Å
206	V	80.9	Confident	80.4	Confident	11 Å²	11	45.2 Å²	45.2	7%	0.067	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	124.6	178.7	170.8	0	0	0	0	110.5	Y208 L211 V219 G255 I256	V206-Y208 HydrophobicContact CB-CE2 4.28Å; V206-Y208 HydrophobicContact CG1-CD1 4.45Å; V206-Y208 HydrophobicContact CG1-CD2 3.92Å; V206-Y208 HydrophobicContact CG1-CE1 4.36Å; V206-Y208 HydrophobicContact CG1-CE2 3.8Å; V206-Y208 HydrophobicContact CG1-CG 4.25Å; V206-Y208 PolarHBondContact O-N 3.32Å; V206-L211 HydrophobicContact CG1-CD1 3.89Å; V206-V219 HydrophobicContact CG1-CB 3.91Å; V206-V219 HydrophobicContact CG1-CG1 4.19Å; V206-V219 HydrophobicContact CG1-CG2 3.79Å; V206-V219 HydrophobicContact CG2-CB 4.17Å; V206-V219 HydrophobicContact CG2-CG1 4.24Å; V206-G255 WeakPolarHBondContact CA-O 3.23Å; V206-I256 HydrophobicContact CG2-CB 4.09Å; V206-I256 HydrophobicContact CG2-CD1 3.9Å; V206-I256 HydrophobicContact CG2-CG1 3.82Å
207	S	80.7	Confident	79.7	Confident	16 Å²	16	45.3 Å²	45.3	11%	0.112	21%	0.208	C	C	.	.			trans	-96.8	89.1	173.6	176.5	0	0	0	0	109.9	R209 S210 L211 A254 G255	S207-R209 PolarHBondContact O-N 3.25Å; S207-R209 VanDerWaalsContact O-N 3.17Å; S207-S210 WeakPolarHBondContact CB-OG 3.28Å; S207-S210 PolarHBondContact O-N 2.71Å; S207-S210 PolarHBondContact O-OG 3.16Å; S207-S210 PolarHBondContact OG-N 2.9Å; S207-S210 PolarHBondContact OG-OG 3.42Å; S207-L211 PolarHBondContact O-N 2.57Å; S207-A254 WeakPolarHBondContact CB-O 3.38Å; S207-G255 PolarHBondContact N-O 3.27Å
208	Y	76.7	Confident	79.6	Confident	34 Å²	34	44.7 Å²	44.7	13%	0.133	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-56	-31.9	176.1	-71.1	-87.6	0	0	0	112.4	A21 R200 V206 S210 L211 Y216 V219	A21-Y208 HydrophobicContact CB-CD2 3.74Å; A21-Y208 HydrophobicContact CB-CE2 3.6Å; A21-Y208 HydrophobicContact CB-CG 4.42Å; R200-Y208 PolarHBondContact NH2-OH 2.04Å; R200-Y208 VanDerWaalsContact NH2-OH 3.07Å; V206-Y208 HydrophobicContact CB-CE2 4.28Å; V206-Y208 HydrophobicContact CG1-CD1 4.45Å; V206-Y208 HydrophobicContact CG1-CD2 3.92Å; V206-Y208 HydrophobicContact CG1-CE1 4.36Å; V206-Y208 HydrophobicContact CG1-CE2 3.8Å; V206-Y208 HydrophobicContact CG1-CG 4.25Å; V206-Y208 PolarHBondContact O-N 3.32Å; Y208-S210 VanDerWaalsContact C-N 3.3Å; Y208-S210 PolarHBondContact O-N 2.9Å; Y208-L211 PolarHBondContact O-N 2.93Å; Y208-L211 VanDerWaalsContact O-N 3.13Å; Y208-L211 VanDerWaalsContact O-O 3.07Å; Y208-Y216 HydrophobicContact CD1-CD1 4.26Å; Y208-Y216 HydrophobicContact CD1-CD2 4.32Å; Y208-Y216 HydrophobicContact CD1-CE1 4.13Å; Y208-Y216 HydrophobicContact CD1-CE2 4.16Å; Y208-Y216 HydrophobicContact CD1-CG 4.36Å; Y208-Y216 PolarHBondContact O-OH 3.06Å; Y208-V219 HydrophobicContact CD1-CG2 4.29Å; Y208-V219 HydrophobicContact CE1-CG2 3.7Å; Y208-V219 PolarHBondContact OH-O 3.33Å
209	R	75.1	Confident	79.8	Confident	172 Å²	172	41.2 Å²	41.2	65%	0.649	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-62.8	-36.7	176.5	-70.8	-172.8	176.1	164.8	6	112.7	E23 S207 L211 K249	E23-R209 IonicContact OE1-CZ 2.76Å; E23-R209 IonicContact OE1-NH1 3.64Å; E23-R209 PolarHBondContact OE1-NH1 2.77Å; E23-R209 IonicContact OE1-NH2 3.9Å; E23-R209 PolarHBondContact OE1-NH2 3.36Å; S207-R209 PolarHBondContact O-N 3.25Å; S207-R209 VanDerWaalsContact O-N 3.17Å; R209-L211 VanDerWaalsContact C-N 3.28Å; R209-K249 WeakPolarHBondContact O-CD 3.25Å; R209-K249 PolarHBondContact O-NZ 3.3Å
210	S	76.2	Confident	79.8	Confident	6 Å²	6	40.5 Å²	40.5	4%	0.042	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-79.4	-10.8	177.4	73.6	0	0	0	0	113.7	S207 Y208 S247 T248 K249 A254 G255	S207-S210 WeakPolarHBondContact CB-OG 3.28Å; S207-S210 PolarHBondContact O-N 2.71Å; S207-S210 PolarHBondContact O-OG 3.16Å; S207-S210 PolarHBondContact OG-N 2.9Å; S207-S210 PolarHBondContact OG-OG 3.42Å; Y208-S210 VanDerWaalsContact C-N 3.3Å; Y208-S210 PolarHBondContact O-N 2.9Å; S210-S247 CarbonylContact O-C 3.57Å; S210-S247 WeakPolarHBondContact O-CA 3.48Å; S210-S247 PolarHBondContact O-OG 2.98Å; S210-S247 VanDerWaalsContact O-OG 3.09Å; S210-T248 PolarHBondContact O-N 3.11Å; S210-T248 PolarHBondContact O-OG1 3.17Å; S210-K249 PolarHBondContact O-N 2.79Å; S210-A254 PolarHBondContact OG-O 2.96Å; S210-G255 WeakPolarHBondContact OG-CA 3.01Å
211	L	74.9	Confident	79.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	-98	134.6	-179.6	-66.7	177.1	0	0	0	111.5	V206 S207 Y208 R209 F215 Y216 V219 M245 T248 K249	V206-L211 HydrophobicContact CG1-CD1 3.89Å; S207-L211 PolarHBondContact O-N 2.57Å; Y208-L211 PolarHBondContact O-N 2.93Å; Y208-L211 VanDerWaalsContact O-N 3.13Å; Y208-L211 VanDerWaalsContact O-O 3.07Å; R209-L211 VanDerWaalsContact C-N 3.28Å; L211-F215 HydrophobicContact CB-CB 4.38Å; L211-F215 HydrophobicContact CD2-CB 4.19Å; L211-Y216 HydrophobicContact CB-CD1 4.27Å; L211-Y216 HydrophobicContact CB-CE1 4.01Å; L211-Y216 WeakPolarHBondContact O-CE1 3.45Å; L211-V219 HydrophobicContact CD1-CB 4.49Å; L211-V219 HydrophobicContact CD1-CG1 3.95Å; L211-V219 HydrophobicContact CD1-CG2 3.82Å; L211-M245 HydrophobicContact CD2-CE 4.46Å; L211-T248 VanDerWaalsContact CA-OG1 3.28Å; L211-T248 WeakPolarHBondContact CA-OG1 3.27Å; L211-K249 WeakPolarHBondContact O-CE 3.33Å; L211-K249 PolarHBondContact O-NZ 2.99Å
212	D	77.3	Confident	79.1	Confident	60 Å²	60	41.9 Å²	41.9	32%	0.321	19%	0.187	S	C	.	.			trans	-64.3	150.1	162.7	-75.5	-36.8	0	0	0	109.8	N214 F215 Y216 T248 K249	D212-N214 PolarHBondContact O-N 3.48Å; D212-F215 HydrophobicContact CB-CD2 4.06Å; D212-F215 HydrophobicContact CB-CE2 4.49Å; D212-F215 PolarHBondContact O-N 3.24Å; D212-Y216 WeakPolarHBondContact O-CD1 3.36Å; D212-T248 PolarHBondContact N-OG1 3.47Å; D212-T248 WeakPolarHBondContact OD2-CB 3.4Å; D212-K249 VanDerWaalsContact OD1-CG 3.31Å; D212-K249 WeakPolarHBondContact OD1-CG 3.43Å
213	L	75.5	Confident	78.3	Confident	45 Å²	45	36.4 Å²	36.4	24%	0.236	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-56.5	-25.9	-179.8	-67.3	168.8	0	0	0	112.6	R19 F215 Y216	R19-L213 HydrophobicContact CG-CD2 4.02Å; L213-F215 PolarHBondContact O-N 3.04Å; L213-Y216 HydrophobicContact CD2-CD2 3.9Å; L213-Y216 HydrophobicContact CD2-CE1 4.27Å; L213-Y216 HydrophobicContact CD2-CE2 3.56Å; L213-Y216 HydrophobicContact CD2-CG 4.44Å; L213-Y216 WeakPolarHBondContact O-CB 2.81Å; L213-Y216 PolarHBondContact O-N 3.22Å
214	N	73.3	Confident	77	Confident	61 Å²	61	37.6 Å²	37.6	33%	0.326	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-65	-19.6	175.9	-67.4	-25.7	0	0	0	113.7	K15 P51 D52 D212	K15-N214 WeakPolarHBondContact CE-OD1 2.71Å; K15-N214 PolarHBondContact NZ-OD1 3.41Å; P51-N214 HydrophobicContact CB-CB 4.25Å; P51-N214 HydrophobicContact CG-CB 3.97Å; D52-N214 HydrophobicContact CB-CB 4.35Å; D212-N214 PolarHBondContact O-N 3.48Å
215	F	77.7	Confident	75.7	Confident	31 Å²	31	40.1 Å²	40.1	14%	0.136	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-98.3	1.8	179.2	-69.6	-97.2	0	0	0	113	V46 P51 L211 D212 L213 L218 M245 T248	V46-F215 HydrophobicContact CG1-CE1 4.05Å; P51-F215 HydrophobicContact CB-CD1 3.92Å; P51-F215 HydrophobicContact CB-CD2 4.05Å; P51-F215 HydrophobicContact CB-CE1 3.75Å; P51-F215 HydrophobicContact CB-CE2 3.88Å; P51-F215 HydrophobicContact CB-CG 4.08Å; P51-F215 HydrophobicContact CB-CZ 3.73Å; P51-F215 HydrophobicContact CG-CD2 4.19Å; P51-F215 HydrophobicContact CG-CE1 4.17Å; P51-F215 HydrophobicContact CG-CE2 3.63Å; P51-F215 HydrophobicContact CG-CZ 3.62Å; L211-F215 HydrophobicContact CB-CB 4.38Å; L211-F215 HydrophobicContact CD2-CB 4.19Å; D212-F215 HydrophobicContact CB-CD2 4.06Å; D212-F215 HydrophobicContact CB-CE2 4.49Å; D212-F215 PolarHBondContact O-N 3.24Å; L213-F215 PolarHBondContact O-N 3.04Å; F215-L218 HydrophobicContact CD1-CD2 4.03Å; F215-L218 WeakPolarHBondContact O-CB 3.16Å; F215-L218 PolarHBondContact O-N 2.92Å; F215-M245 HydrophobicContact CD1-SD 3.96Å; F215-M245 HydrophobicContact CE1-SD 4.31Å; F215-T248 HydrophobicContact CD2-CG2 3.8Å; F215-T248 HydrophobicContact CE1-CG2 4.17Å; F215-T248 HydrophobicContact CE2-CG2 3.37Å; F215-T248 HydrophobicContact CG-CG2 4.35Å; F215-T248 HydrophobicContact CZ-CG2 3.58Å
216	Y	80.3	Confident	74.8	Confident	12 Å²	12	39.8 Å²	39.8	5%	0.047	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-36.6	-170.7	-84.8	28.2	0	0	0	112.7	L18 Y208 L211 D212 L213 V219 T220	L18-Y216 HydrophobicContact CB-CD2 3.55Å; L18-Y216 HydrophobicContact CB-CE2 4.27Å; L18-Y216 WeakPolarHBondContact O-CE2 3.46Å; Y208-Y216 HydrophobicContact CD1-CD1 4.26Å; Y208-Y216 HydrophobicContact CD1-CD2 4.32Å; Y208-Y216 HydrophobicContact CD1-CE1 4.13Å; Y208-Y216 HydrophobicContact CD1-CE2 4.16Å; Y208-Y216 HydrophobicContact CD1-CG 4.36Å; Y208-Y216 PolarHBondContact O-OH 3.06Å; L211-Y216 HydrophobicContact CB-CD1 4.27Å; L211-Y216 HydrophobicContact CB-CE1 4.01Å; L211-Y216 WeakPolarHBondContact O-CE1 3.45Å; D212-Y216 WeakPolarHBondContact O-CD1 3.36Å; L213-Y216 HydrophobicContact CD2-CD2 3.9Å; L213-Y216 HydrophobicContact CD2-CE1 4.27Å; L213-Y216 HydrophobicContact CD2-CE2 3.56Å; L213-Y216 HydrophobicContact CD2-CG 4.44Å; L213-Y216 WeakPolarHBondContact O-CB 2.81Å; L213-Y216 PolarHBondContact O-N 3.22Å; Y216-V219 WeakPolarHBondContact O-CG2 3.32Å; Y216-V219 PolarHBondContact O-N 3.43Å; Y216-T220 WeakPolarHBondContact O-CB 3.48Å; Y216-T220 PolarHBondContact O-N 2.77Å; Y216-T220 PolarHBondContact O-OG1 2.9Å
217	D	74.9	Confident	74	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-47.6	171.9	31.7	-7.2	0	0	0	111.1	W11 M56 V219 T220	W11-D217 HydrophobicContact CD2-CB 4.48Å; W11-D217 HydrophobicContact CH2-CB 3.26Å; W11-D217 VanDerWaalsContact CZ2-CA 3.48Å; W11-D217 HydrophobicContact CZ2-CB 3.02Å; W11-D217 WeakPolarHBondContact CZ2-OD1 3.32Å; W11-D217 HydrophobicContact CZ3-CB 4.02Å; W11-D217 VanDerWaalsContact NE1-CG 3.29Å; W11-D217 PolarHBondContact NE1-OD1 3.36Å; W11-D217 PolarHBondContact NE1-OD2 3.13Å; M56-D217 WeakPolarHBondContact CE-O 3.4Å; M56-D217 HydrophobicContact CG-CB 4.01Å; M56-D217 PolarHBondContact N-OD2 3.49Å; D217-V219 PolarHBondContact O-N 3.1Å; D217-T220 PolarHBondContact O-N 2.89Å
218	L	82.1	Confident	73.5	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-33.2	-175.5	-179.1	65	0	0	0	111.8	V46 M56 Q195 N196 F215 V242 M245	V46-L218 HydrophobicContact CB-CD2 4.49Å; V46-L218 HydrophobicContact CG1-CD2 3.99Å; V46-L218 HydrophobicContact CG2-CD1 3.58Å; V46-L218 HydrophobicContact CG2-CD2 3.76Å; V46-L218 HydrophobicContact CG2-CG 4.33Å; M56-L218 WeakPolarHBondContact O-CD1 3.49Å; Q195-L218 WeakPolarHBondContact CG-O 3.37Å; Q195-L218 PolarHBondContact NE2-O 3.16Å; N196-L218 PolarHBondContact ND2-O 2.98Å; F215-L218 HydrophobicContact CD1-CD2 4.03Å; F215-L218 WeakPolarHBondContact O-CB 3.16Å; F215-L218 PolarHBondContact O-N 2.92Å; L218-V242 HydrophobicContact CD1-CG2 4.19Å; L218-V242 HydrophobicContact CD2-CG2 4.14Å; L218-V242 HydrophobicContact CG-CG2 4.3Å; L218-M245 HydrophobicContact CD2-CE 3.71Å; L218-M245 HydrophobicContact CD2-SD 3.49Å; L218-M245 WeakPolarHBondContact CD2-SD 3.33Å; L218-M245 HydrophobicContact CG-CE 4.4Å
219	V	80.8	Confident	73.1	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	4.1	179	-58.8	0	0	0	0	114.1	R200 V206 Y208 L211 Y216 D217 M245	R200-V219 PolarHBondContact NH1-O 2.78Å; R200-V219 VanDerWaalsContact NH1-O 3.13Å; R200-V219 PolarHBondContact NH2-O 3.44Å; V206-V219 HydrophobicContact CG1-CB 3.91Å; V206-V219 HydrophobicContact CG1-CG1 4.19Å; V206-V219 HydrophobicContact CG1-CG2 3.79Å; V206-V219 HydrophobicContact CG2-CB 4.17Å; V206-V219 HydrophobicContact CG2-CG1 4.24Å; Y208-V219 HydrophobicContact CD1-CG2 4.29Å; Y208-V219 HydrophobicContact CE1-CG2 3.7Å; Y208-V219 PolarHBondContact OH-O 3.33Å; L211-V219 HydrophobicContact CD1-CB 4.49Å; L211-V219 HydrophobicContact CD1-CG1 3.95Å; L211-V219 HydrophobicContact CD1-CG2 3.82Å; Y216-V219 WeakPolarHBondContact O-CG2 3.32Å; Y216-V219 PolarHBondContact O-N 3.43Å; D217-V219 PolarHBondContact O-N 3.1Å; V219-M245 HydrophobicContact CG1-CE 3.73Å
220	T	81	Confident	73.3	Confident	26 Å²	26	41 Å²	41	16%	0.16	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-74.1	136.9	179.6	-72.5	0	0	0	0	110.2	L18 N196 Y216 D217	L18-T220 HydrophobicContact CD2-CG2 4.28Å; N196-T220 WeakPolarHBondContact CB-O 3.46Å; N196-T220 PolarHBondContact ND2-O 3.39Å; Y216-T220 WeakPolarHBondContact O-CB 3.48Å; Y216-T220 PolarHBondContact O-N 2.77Å; Y216-T220 PolarHBondContact O-OG1 2.9Å; D217-T220 PolarHBondContact O-N 2.89Å
221	R	80.8	Confident	73.4	Confident	121 Å²	121	44.9 Å²	44.9	46%	0.457	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-75.6	130.9	174.7	-68.4	179.5	-67.2	176.6	1.7	110.2	N196 L198 R200	N196-R221 CarbonylContact O-C 3.5Å; N196-R221 WeakPolarHBondContact O-CA 3.43Å; L198-R221 HydrophobicContact CD2-CB 4.3Å; R200-R221 HydrophobicContact CG-CG 3.94Å
222	L	73	Confident	73.9	Confident	12 Å²	12	45.6 Å²	45.6	6%	0.063	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-83.8	151.2	167.8	-63.6	173.6	0	0	0	109.5	M56 L69 L192 N196 L198 L226 L227	M56-L222 HydrophobicContact CE-CD1 4.03Å; M56-L222 HydrophobicContact CE-CD2 3.56Å; M56-L222 HydrophobicContact CE-CG 3.72Å; M56-L222 HydrophobicContact SD-CD1 4.18Å; L69-L222 HydrophobicContact CD2-CD2 4.07Å; L192-L222 HydrophobicContact CB-CD1 4.46Å; L192-L222 HydrophobicContact CD1-CD1 3.81Å; L192-L222 HydrophobicContact CD2-CD1 4.35Å; L192-L222 HydrophobicContact CG-CD1 4.45Å; N196-L222 HydrophobicContact CB-CD1 4.02Å; N196-L222 HydrophobicContact CB-CG 3.94Å; N196-L222 PolarHBondContact O-N 2.8Å; L198-L222 WeakPolarHBondContact CD2-O 3.33Å; L198-L222 WeakPolarHBondContact CG-O 3.25Å; L222-L226 HydrophobicContact CB-CD1 4.43Å; L222-L226 HydrophobicContact CD2-CD1 4.31Å; L222-L227 HydrophobicContact CB-CD1 3.74Å; L222-L227 HydrophobicContact CB-CG 4.1Å; L222-L227 HydrophobicContact CD1-CD1 4.4Å; L222-L227 HydrophobicContact CD1-CD2 4.38Å; L222-L227 HydrophobicContact CD1-CG 4.34Å
223	R	66.5	Low	74.6	Confident	78 Å²	78	44.2 Å²	44.2	29%	0.294	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-72.3	155.6	178.2	-60.3	168	52.8	98	8.8	111.4	D225 L226 L227	R223-D225 WeakPolarHBondContact CB-OD1 3.43Å; R223-D225 IonicContact CZ-OD1 3.58Å; R223-D225 IonicContact NE-OD1 3.3Å; R223-D225 PolarHBondContact NE-OD1 2.81Å; R223-D225 IonicContact NH2-OD1 2.63Å; R223-D225 PolarHBondContact O-N 3.35Å; R223-L226 HydrophobicContact CB-CD1 4.42Å; R223-L226 WeakPolarHBondContact O-CB 3.5Å; R223-L226 PolarHBondContact O-N 3.09Å; R223-L226 VanDerWaalsContact O-N 3.08Å; R223-L227 PolarHBondContact O-N 3.08Å
224	S	59.9	Low	75.4	Confident	80 Å²	80	42.6 Å²	42.6	56%	0.559	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-17.6	-179.1	44.9	0	0	0	0	114.4	L198 L226	L198-S224 VanDerWaalsContact CD1-N 3.34Å; S224-L226 VanDerWaalsContact C-N 3.26Å
225	D	60.4	Low	76.5	Confident	55 Å²	55	39.8 Å²	39.8	29%	0.294	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-13.5	175.4	56.9	-65	0	0	0	113.7	R87 R223	R87-D225 PolarHBondContact NH2-O 2.94Å; R223-D225 WeakPolarHBondContact CB-OD1 3.43Å; R223-D225 IonicContact CZ-OD1 3.58Å; R223-D225 IonicContact NE-OD1 3.3Å; R223-D225 PolarHBondContact NE-OD1 2.81Å; R223-D225 IonicContact NH2-OD1 2.63Å; R223-D225 PolarHBondContact O-N 3.35Å
226	L	62.6	Low	77.4	Confident	13 Å²	13	38.7 Å²	38.7	7%	0.068	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-31.9	179.5	-61.3	170.8	0	0	0	112.4	L69 P94 F95 L222 R223 S224	L69-L226 HydrophobicContact CD2-CD1 3.53Å; L69-L226 HydrophobicContact CD2-CD2 4.25Å; L69-L226 HydrophobicContact CD2-CG 4.46Å; P94-L226 HydrophobicContact CG-CD2 3.62Å; F95-L226 HydrophobicContact CE2-CB 4.29Å; F95-L226 HydrophobicContact CE2-CD2 4.2Å; L222-L226 HydrophobicContact CB-CD1 4.43Å; L222-L226 HydrophobicContact CD2-CD1 4.31Å; R223-L226 HydrophobicContact CB-CD1 4.42Å; R223-L226 WeakPolarHBondContact O-CB 3.5Å; R223-L226 PolarHBondContact O-N 3.09Å; R223-L226 VanDerWaalsContact O-N 3.08Å; S224-L226 VanDerWaalsContact C-N 3.26Å
227	L	64.4	Low	78.1	Confident	24 Å²	24	38.2 Å²	38.2	13%	0.126	20%	0.204	C	C	.	.			trans	-104.7	114	-179.6	-72.2	170	0	0	0	109.7	L192 R197 L222 R223	L192-L227 HydrophobicContact CB-CD2 3.49Å; L192-L227 VanDerWaalsContact CB-CD2 3.49Å; L192-L227 HydrophobicContact CD1-CD2 3.54Å; L192-L227 HydrophobicContact CD1-CG 4.27Å; L192-L227 HydrophobicContact CG-CD2 4.15Å; R197-L227 HydrophobicContact CB-CD1 4.44Å; R197-L227 HydrophobicContact CG-CD1 4.22Å; L222-L227 HydrophobicContact CB-CD1 3.74Å; L222-L227 HydrophobicContact CB-CG 4.1Å; L222-L227 HydrophobicContact CD1-CD1 4.4Å; L222-L227 HydrophobicContact CD1-CD2 4.38Å; L222-L227 HydrophobicContact CD1-CG 4.34Å; R223-L227 PolarHBondContact O-N 3.08Å
228	I	69	Low	79.2	Confident	89 Å²	89	38.1 Å²	38.1	46%	0.456	20%	0.204	S	C	.	.			trans	-97	109.7	169.8	-56.1	176.3	0	0	0	106.6	F230 L280	I228-F230 HydrophobicContact CB-CE2 4.49Å; I228-F230 HydrophobicContact CG2-CD1 4.36Å; I228-F230 HydrophobicContact CG2-CD2 3.75Å; I228-F230 HydrophobicContact CG2-CE1 4.15Å; I228-F230 HydrophobicContact CG2-CE2 3.52Å; I228-F230 HydrophobicContact CG2-CG 4.19Å; I228-F230 HydrophobicContact CG2-CZ 3.74Å; I228-L280 WeakPolarHBondContact O-CD1 3.48Å
229	D	69.9	Low	79.9	Confident	58 Å²	58	38 Å²	38	31%	0.31	20%	0.204	S	C	.	.			trans	-102.5	-7.2	179.9	56.8	24.1	0	0	0	113.4	R197 A231 L232	R197-D229 IonicContact CZ-OD2 3.75Å; R197-D229 IonicContact NH2-OD2 2.82Å; R197-D229 PolarHBondContact NH2-OD2 2.93Å; D229-A231 PolarHBondContact O-N 3.25Å; D229-A231 VanDerWaalsContact O-N 3.09Å; D229-A231 PolarHBondContact OD1-N 3.09Å; D229-L232 VanDerWaalsContact O-CB 3.24Å; D229-L232 WeakPolarHBondContact O-CB 3.36Å; D229-L232 VanDerWaalsContact O-CG 3.29Å; D229-L232 WeakPolarHBondContact O-CG 3.05Å; D229-L232 PolarHBondContact O-N 2.87Å
230	F	78.5	Confident	80.7	Confident	88 Å²	88	38.1 Å²	38.1	39%	0.386	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	30.5	-172.2	-61.5	-89.7	0	0	0	114.1	I228 L232 L280 L283 L284	I228-F230 HydrophobicContact CB-CE2 4.49Å; I228-F230 HydrophobicContact CG2-CD1 4.36Å; I228-F230 HydrophobicContact CG2-CD2 3.75Å; I228-F230 HydrophobicContact CG2-CE1 4.15Å; I228-F230 HydrophobicContact CG2-CE2 3.52Å; I228-F230 HydrophobicContact CG2-CG 4.19Å; I228-F230 HydrophobicContact CG2-CZ 3.74Å; F230-L232 PolarHBondContact O-N 3.46Å; F230-L280 HydrophobicContact CD2-CD1 3.49Å; F230-L280 VanDerWaalsContact CD2-CD1 3.49Å; F230-L280 HydrophobicContact CE2-CD1 3.9Å; F230-L283 HydrophobicContact CB-CD1 3.66Å; F230-L283 HydrophobicContact CD1-CB 4.23Å; F230-L283 HydrophobicContact CD2-CB 3.88Å; F230-L283 HydrophobicContact CD2-CD1 4.27Å; F230-L283 HydrophobicContact CE1-CB 4.33Å; F230-L283 HydrophobicContact CE2-CB 3.98Å; F230-L283 HydrophobicContact CG-CB 4Å; F230-L283 HydrophobicContact CG-CD1 3.97Å; F230-L283 HydrophobicContact CZ-CB 4.2Å; F230-L284 HydrophobicContact CE2-CB 4.34Å; F230-L284 HydrophobicContact CZ-CD1 4.29Å
231	A	78.8	Confident	81.4	Confident	86 Å²	86	36.9 Å²	36.9	71%	0.711	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	23.5	-173.3	0	0	0	0	0	114.4	D229	D229-A231 PolarHBondContact O-N 3.25Å; D229-A231 VanDerWaalsContact O-N 3.09Å; D229-A231 PolarHBondContact OD1-N 3.09Å
232	L	85.8	Confident	81.9	Confident	16 Å²	16	31.3 Å²	31.3	8%	0.084	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-65.9	144.7	167.1	-64.9	179.5	0	0	0	110	R197 D229 F230 L276 K279 L280 L283	R197-L232 PolarHBondContact NH1-O 3.42Å; R197-L232 PolarHBondContact NH2-O 3.13Å; R197-L232 VanDerWaalsContact NH2-O 3.09Å; D229-L232 VanDerWaalsContact O-CB 3.24Å; D229-L232 WeakPolarHBondContact O-CB 3.36Å; D229-L232 VanDerWaalsContact O-CG 3.29Å; D229-L232 WeakPolarHBondContact O-CG 3.05Å; D229-L232 PolarHBondContact O-N 2.87Å; F230-L232 PolarHBondContact O-N 3.46Å; L232-L276 HydrophobicContact CD1-CD2 4.49Å; L232-L276 HydrophobicContact CD2-CD2 4.24Å; L232-K279 HydrophobicContact CD1-CB 4.35Å; L232-K279 HydrophobicContact CD1-CG 4.28Å; L232-K279 HydrophobicContact CD2-CD 3.77Å; L232-K279 HydrophobicContact CD2-CG 4.16Å; L232-L280 HydrophobicContact CD1-CB 3.9Å; L232-L280 HydrophobicContact CD1-CD1 4.37Å; L232-L283 HydrophobicContact CD1-CD1 4.04Å; L232-L283 HydrophobicContact CD2-CD1 4.18Å; L232-L283 HydrophobicContact CG-CD1 4.2Å
233	P	90.7	Very high	82.5	Confident	31 Å²	31	30.9 Å²	30.9	20%	0.201	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-63.6	158.3	177.3	31.3	-37.4	0	0	0	110.7	D235 L276 S400	P233-D235 PolarHBondContact O-N 3.43Å; P233-L276 HydrophobicContact CG-CD1 3.74Å; P233-L276 HydrophobicContact CG-CD2 4.43Å; P233-S400 WeakPolarHBondContact CG-OG 3Å
234	Y	92.8	Very high	83.3	Confident	10 Å²	10	27.3 Å²	27.3	4%	0.039	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-65.1	125.2	173.8	-169.4	-79.8	0	0	0	110.5	E194 Q195 R197 R200 H203 L236 H241	E194-Y234 HydrophobicContact CG-CD1 4.42Å; E194-Y234 HydrophobicContact CG-CD2 4.46Å; E194-Y234 HydrophobicContact CG-CE1 4.06Å; E194-Y234 HydrophobicContact CG-CE2 4.07Å; E194-Y234 WeakPolarHBondContact O-CE2 3.4Å; E194-Y234 PolarHBondContact O-OH 2.78Å; E194-Y234 WeakPolarHBondContact OE1-CA 3.44Å; Q195-Y234 WeakPolarHBondContact CA-OH 3.45Å; Q195-Y234 PolarHBondContact N-OH 3.31Å; R197-Y234 HydrophobicContact CB-CD2 4.28Å; R197-Y234 HydrophobicContact CB-CE2 4.1Å; R197-Y234 HydrophobicContact CG-CE2 4.41Å; R200-Y234 HydrophobicContact CB-CE2 3.74Å; H203-Y234 HydrophobicContact CB-CD1 3.55Å; H203-Y234 HydrophobicContact CB-CD2 4.48Å; H203-Y234 HydrophobicContact CB-CE1 3.72Å; H203-Y234 HydrophobicContact CB-CG 3.98Å; H203-Y234 WeakPolarHBondContact CD2-CB 3.21Å; H203-Y234 AromaticContact CD2-CD1 3.9Å; H203-Y234 AromaticContact CD2-CD2 3.74Å; H203-Y234 AromaticContact CD2-CG 3.39Å; H203-Y234 AromaticContact CG-CD1 3.56Å; H203-Y234 AromaticContact CG-CG 3.56Å; H203-Y234 WeakPolarHBondContact NE2-CB 3.45Å; H203-Y234 AromaticContact NE2-CG 3.96Å; Y234-L236 HydrophobicContact CD1-CD2 4.27Å; Y234-L236 HydrophobicContact CD1-CG 4.02Å; Y234-L236 HydrophobicContact CE1-CD2 3.77Å; Y234-L236 HydrophobicContact CE1-CG 4.01Å; Y234-H241 AromaticContact CE1-CD2 3.66Å; Y234-H241 AromaticContact CE1-NE2 3.58Å; Y234-H241 AromaticContact CZ-CD2 3.84Å; Y234-H241 AromaticContact CZ-NE2 3.71Å; Y234-H241 PolarHBondContact OH-CD2 2.72Å; Y234-H241 VanDerWaalsContact OH-CD2 3.29Å; Y234-H241 PolarHBondContact OH-NE2 3.33Å
235	D	96.6	Very high	84.1	Confident	3 Å²	3	24.6 Å²	24.6	2%	0.016	14%	0.14	C	C	.	.			trans	-105.2	97.1	-176.6	-171.9	12.9	0	0	0	112.7	E194 P233 G237 S238 S274 L276 T401	E194-D235 PolarHBondContact OE1-N 3.07Å; P233-D235 PolarHBondContact O-N 3.43Å; D235-G237 PolarHBondContact O-N 3.01Å; D235-G237 VanDerWaalsContact O-N 3.13Å; D235-G237 PolarHBondContact OD1-N 3.41Å; D235-S238 VanDerWaalsContact O-CB 3.29Å; D235-S238 WeakPolarHBondContact O-CB 3.04Å; D235-S238 PolarHBondContact O-N 3.29Å; D235-S238 PolarHBondContact OD2-N 2.93Å; D235-S274 WeakPolarHBondContact OD2-CB 2.79Å; D235-S274 PolarHBondContact OD2-OG 3.4Å; D235-L276 HydrophobicContact CB-CB 4.19Å; D235-L276 HydrophobicContact CB-CD1 3.75Å; D235-T401 PolarHBondContact OD1-N 2.91Å; D235-T401 PolarHBondContact OD1-OG1 3.28Å
236	L	95.9	Very high	84.6	Confident	8 Å²	8	26 Å²	26	4%	0.042	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.2	175.9	-73.7	159.1	0	0	0	112.4	H203 V204 Y234 Y263 T266 I267	H203-L236 HydrophobicContact CB-CD2 4.27Å; V204-L236 HydrophobicContact CG1-CD2 3.84Å; Y234-L236 HydrophobicContact CD1-CD2 4.27Å; Y234-L236 HydrophobicContact CD1-CG 4.02Å; Y234-L236 HydrophobicContact CE1-CD2 3.77Å; Y234-L236 HydrophobicContact CE1-CG 4.01Å; L236-Y263 HydrophobicContact CB-CD1 4.28Å; L236-Y263 HydrophobicContact CB-CG 4.47Å; L236-Y263 HydrophobicContact CD1-CD1 3.84Å; L236-Y263 HydrophobicContact CD1-CD2 3.37Å; L236-Y263 HydrophobicContact CD1-CE1 4.32Å; L236-Y263 HydrophobicContact CD1-CE2 3.9Å; L236-Y263 HydrophobicContact CD1-CG 3.36Å; L236-Y263 HydrophobicContact CG-CG 4.48Å; L236-T266 HydrophobicContact CB-CG2 4.47Å; L236-I267 HydrophobicContact CB-CG2 3.84Å; L236-I267 HydrophobicContact CD2-CG2 3.41Å; L236-I267 VanDerWaalsContact CD2-CG2 3.41Å; L236-I267 HydrophobicContact CG-CG2 4.23Å; L236-I267 VanDerWaalsContact O-CA 3.28Å; L236-I267 WeakPolarHBondContact O-CA 3.33Å; L236-I267 WeakPolarHBondContact O-CG2 3.41Å
237	G	96.7	Very high	84.9	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.01	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	10.7	176.2	0	0	0	0	0	114.9	D235 Q269 T401	D235-G237 PolarHBondContact O-N 3.01Å; D235-G237 VanDerWaalsContact O-N 3.13Å; D235-G237 PolarHBondContact OD1-N 3.41Å; G237-Q269 WeakPolarHBondContact O-CG 3.38Å; G237-Q269 PolarHBondContact O-NE2 3.41Å; G237-T401 WeakPolarHBondContact CA-OG1 2.99Å
238	S	97.7	Very high	85.2	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.151	C	C	.	.			trans	-58.1	142	176	169	0	0	0	0	110.9	D235 M240 H241 D277	D235-S238 VanDerWaalsContact O-CB 3.29Å; D235-S238 WeakPolarHBondContact O-CB 3.04Å; D235-S238 PolarHBondContact O-N 3.29Å; D235-S238 PolarHBondContact OD2-N 2.93Å; S238-M240 PolarHBondContact O-N 3.05Å; S238-M240 WeakPolarHBondContact OG-CB 3.39Å; S238-M240 PolarHBondContact OG-N 3.22Å; S238-H241 WeakPolarHBondContact O-CB 3.26Å; S238-H241 PolarHBondContact O-N 3.28Å; S238-H241 VanDerWaalsContact O-N 3.08Å; S238-D277 WeakPolarHBondContact CB-OD1 3.1Å; S238-D277 PolarHBondContact OG-OD1 2.99Å; S238-D277 PolarHBondContact OG-OD2 2.93Å
239	V	97	Very high	85.2	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.8	171.6	78.1	0	0	0	0	110.9	H183 H241 R270 P273 D277	H183-V239 HydrophobicContact CB-CG2 4.16Å; H183-V239 PolarHBondContact CE1-O 2.78Å; H183-V239 PolarHBondContact ND1-O 2.82Å; V239-H241 VanDerWaalsContact C-N 3.31Å; V239-R270 PolarHBondContact O-NH1 2.95Å; V239-R270 VanDerWaalsContact O-NH1 3.15Å; V239-P273 HydrophobicContact CG1-CB 4.06Å; V239-P273 HydrophobicContact CG1-CG 4.19Å; V239-D277 WeakPolarHBondContact CG1-OD2 3.36Å; V239-D277 PolarHBondContact N-OD2 2.89Å
240	M	96.5	Very high	85	Confident	2 Å²	2	27.8 Å²	27.8	1%	0.01	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-1	177	-47.5	-53.6	-62.8	0	0	113.1	H187 L191 H193 E194 Q195 S238	H187-M240 WeakPolarHBondContact CE1-CE 3.3Å; H187-M240 WeakPolarHBondContact ND1-CE 3.33Å; H187-M240 WeakPolarHBondContact NE2-CE 3.02Å; L191-M240 HydrophobicContact CB-CE 3.97Å; L191-M240 HydrophobicContact CB-CG 4.21Å; L191-M240 HydrophobicContact CB-SD 4.29Å; L191-M240 HydrophobicContact CD1-CG 4.17Å; L191-M240 HydrophobicContact CD1-SD 4.32Å; H193-M240 VanDerWaalsContact CA-O 3.25Å; H193-M240 WeakPolarHBondContact CA-O 3.36Å; H193-M240 WeakPolarHBondContact CB-O 3.2Å; H193-M240 PolarHBondContact CD2-O 2.8Å; E194-M240 PolarHBondContact N-O 3.15Å; Q195-M240 PolarHBondContact OE1-O 3.47Å; S238-M240 PolarHBondContact O-N 3.05Å; S238-M240 WeakPolarHBondContact OG-CB 3.39Å; S238-M240 PolarHBondContact OG-N 3.22Å
241	H	95.9	Very high	84	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	-87.1	135.6	178.1	-163	-66.7	0	0	0	111.1	E194 Y234 S238 V239 R270	E194-H241 HydrophobicContact CB-CB 4.01Å; Y234-H241 AromaticContact CE1-CD2 3.66Å; Y234-H241 AromaticContact CE1-NE2 3.58Å; Y234-H241 AromaticContact CZ-CD2 3.84Å; Y234-H241 AromaticContact CZ-NE2 3.71Å; Y234-H241 PolarHBondContact OH-CD2 2.72Å; Y234-H241 VanDerWaalsContact OH-CD2 3.29Å; Y234-H241 PolarHBondContact OH-NE2 3.33Å; S238-H241 WeakPolarHBondContact O-CB 3.26Å; S238-H241 PolarHBondContact O-N 3.28Å; S238-H241 VanDerWaalsContact O-N 3.08Å; V239-H241 VanDerWaalsContact C-N 3.31Å; H241-R270 PolarHBondContact O-NH1 2.83Å; H241-R270 PolarHBondContact O-NH2 3.02Å
242	V	91.1	Very high	83.1	Confident	3 Å²	3	27.9 Å²	27.9	2%	0.018	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-64.3	150.1	174.3	74.7	0	0	0	0	112.1	Q195 L218 M245 I256 G268	Q195-V242 HydrophobicContact CB-CG1 3.99Å; Q195-V242 HydrophobicContact CG-CB 4.13Å; Q195-V242 HydrophobicContact CG-CG1 3.63Å; L218-V242 HydrophobicContact CD1-CG2 4.19Å; L218-V242 HydrophobicContact CD2-CG2 4.14Å; L218-V242 HydrophobicContact CG-CG2 4.3Å; V242-M245 HydrophobicContact CG2-SD 4.49Å; V242-I256 HydrophobicContact CG1-CD1 3.75Å; V242-I256 HydrophobicContact CG1-CG2 4.14Å; V242-G268 PolarHBondContact O-N 3.14Å
243	A	86.7	Confident	81.9	Confident	4 Å²	4	29.3 Å²	29.3	3%	0.033	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-72	159	168.1	0	0	0	0	0	112.4	T44 M245 G268	T44-A243 HydrophobicContact CG2-CB 3.76Å; A243-M245 PolarHBondContact O-N 3.34Å; A243-G268 VanDerWaalsContact CA-CA 3.42Å
244	S	82.6	Confident	80.9	Confident	3 Å²	3	27.9 Å²	27.9	2%	0.021	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-52.2	130.3	167.7	-61.2	0	0	0	0	110.9	Q264 I267	S244-Q264 PolarHBondContact OG-NE2 2.99Å; S244-I267 VanDerWaalsContact OG-CD1 3.25Å; S244-I267 WeakPolarHBondContact OG-CD1 3.5Å; S244-I267 WeakPolarHBondContact OG-CG1 3.41Å
245	M	76.6	Confident	80.2	Confident	22 Å²	22	27.4 Å²	27.4	11%	0.108	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	138.1	-178.9	-64	-173.1	-75.3	0	0	110.8	L211 F215 L218 V219 V242 A243 A254 G255 I256	L211-M245 HydrophobicContact CD2-CE 4.46Å; F215-M245 HydrophobicContact CD1-SD 3.96Å; F215-M245 HydrophobicContact CE1-SD 4.31Å; L218-M245 HydrophobicContact CD2-CE 3.71Å; L218-M245 HydrophobicContact CD2-SD 3.49Å; L218-M245 WeakPolarHBondContact CD2-SD 3.33Å; L218-M245 HydrophobicContact CG-CE 4.4Å; V219-M245 HydrophobicContact CG1-CE 3.73Å; V242-M245 HydrophobicContact CG2-SD 4.49Å; A243-M245 PolarHBondContact O-N 3.34Å; M245-A254 CarbonylContact O-C 3.38Å; M245-A254 WeakPolarHBondContact O-CA 3.25Å; M245-G255 PolarHBondContact O-N 2.91Å; M245-I256 HydrophobicContact CB-CG2 4.07Å; M245-I256 HydrophobicContact CE-CB 4.31Å; M245-I256 HydrophobicContact CE-CG2 3.61Å; M245-I256 HydrophobicContact CG-CG2 4.03Å
246	R	70.1	Confident	79.6	Confident	86 Å²	86	27.2 Å²	27.2	33%	0.325	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	161.3	166.3	-60.9	-178.9	74	110.7	6.8	110	V31 I32 I34 T248	V31-R246 HydrophobicContact CG1-CG 4.08Å; I32-R246 PolarHBondContact O-NH1 3.45Å; I34-R246 PolarHBondContact O-NH1 3.24Å; R246-T248 PolarHBondContact O-N 2.93Å
247	S	69.3	Low	79.1	Confident	16 Å²	16	27.2 Å²	27.2	11%	0.112	16%	0.164	C	C	.	.			trans	-54	130.7	166.8	179.7	0	0	0	0	110	S210 K249 G250 V253	S210-S247 CarbonylContact O-C 3.57Å; S210-S247 WeakPolarHBondContact O-CA 3.48Å; S210-S247 PolarHBondContact O-OG 2.98Å; S210-S247 VanDerWaalsContact O-OG 3.09Å; S247-K249 PolarHBondContact OG-N 3.01Å; S247-G250 VanDerWaalsContact CB-O 3.22Å; S247-G250 WeakPolarHBondContact CB-O 3.38Å; S247-G250 PolarHBondContact OG-N 3.01Å; S247-G250 PolarHBondContact OG-O 3.49Å; S247-V253 WeakPolarHBondContact CA-O 3.45Å; S247-V253 WeakPolarHBondContact CB-O 3.45Å; S247-V253 PolarHBondContact N-O 3.14Å
248	T	71.1	Confident	78.6	Confident	47 Å²	47	27.3 Å²	27.3	29%	0.288	17%	0.165	S	C	.	.	S	Bend	trans	-89.2	-21	174.9	44.8	0	0	0	0	110.8	S210 L211 D212 F215 R246 G250	S210-T248 PolarHBondContact O-N 3.11Å; S210-T248 PolarHBondContact O-OG1 3.17Å; L211-T248 VanDerWaalsContact CA-OG1 3.28Å; L211-T248 WeakPolarHBondContact CA-OG1 3.27Å; D212-T248 PolarHBondContact N-OG1 3.47Å; D212-T248 WeakPolarHBondContact OD2-CB 3.4Å; F215-T248 HydrophobicContact CD2-CG2 3.8Å; F215-T248 HydrophobicContact CE1-CG2 4.17Å; F215-T248 HydrophobicContact CE2-CG2 3.37Å; F215-T248 HydrophobicContact CG-CG2 4.35Å; F215-T248 HydrophobicContact CZ-CG2 3.58Å; R246-T248 PolarHBondContact O-N 2.93Å; T248-G250 VanDerWaalsContact C-N 3.27Å; T248-G250 PolarHBondContact O-N 2.88Å
249	K	68.4	Low	78	Confident	112 Å²	112	31 Å²	31	49%	0.487	19%	0.187	S	C	.	.	S	Bend	trans	-85.3	10.5	170.1	-62.9	-166.4	-167.3	134.7	0	114.7	R209 S210 L211 D212 S247	R209-K249 WeakPolarHBondContact O-CD 3.25Å; R209-K249 PolarHBondContact O-NZ 3.3Å; S210-K249 PolarHBondContact O-N 2.79Å; L211-K249 WeakPolarHBondContact O-CE 3.33Å; L211-K249 PolarHBondContact O-NZ 2.99Å; D212-K249 VanDerWaalsContact OD1-CG 3.31Å; D212-K249 WeakPolarHBondContact OD1-CG 3.43Å; S247-K249 PolarHBondContact OG-N 3.01Å
250	G	65.2	Low	77.4	Confident	46 Å²	46	33.3 Å²	33.3	47%	0.474	20%	0.2	S	C	.	.	S	Bend	trans	77.9	178.5	-176.1	0	0	0	0	0	114	S247 T248	S247-G250 VanDerWaalsContact CB-O 3.22Å; S247-G250 WeakPolarHBondContact CB-O 3.38Å; S247-G250 PolarHBondContact OG-N 3.01Å; S247-G250 PolarHBondContact OG-O 3.49Å; T248-G250 VanDerWaalsContact C-N 3.27Å; T248-G250 PolarHBondContact O-N 2.88Å
251	G	59.3	Low	76.8	Confident	60 Å²	60	36 Å²	36	62%	0.619	22%	0.218	S	C	*	.	S	Bend	trans	84.6	171.1	-173	0	0	0	0	0	114.1	V253	G251-V253 VanDerWaalsContact C-N 3.29Å; G251-V253 PolarHBondContact O-N 2.67Å
252	N	59.9	Low	76.3	Confident	115 Å²	115	37.5 Å²	37.5	62%	0.615	23%	0.226	S	C	*	.	S	Bend	trans	-88.4	70.7	172.9	-64.8	-23.9	0	0	0	108	A28	A28-N252 HydrophobicContact CB-CB 4.08Å; A28-N252 WeakPolarHBondContact CB-O 3.34Å
253	V	60.3	Low	76.3	Confident	47 Å²	47	39.6 Å²	39.6	29%	0.285	23%	0.233	S	C	.	.			trans	-134.1	145	170.7	-171.5	0	0	0	0	107.5	S247 G251	S247-V253 WeakPolarHBondContact CA-O 3.45Å; S247-V253 WeakPolarHBondContact CB-O 3.45Å; S247-V253 PolarHBondContact N-O 3.14Å; G251-V253 VanDerWaalsContact C-N 3.29Å; G251-V253 PolarHBondContact O-N 2.67Å
254	A	69.1	Low	76.4	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	142	173.7	0	0	0	0	0	111	I26 V31 S207 S210 M245 V257	I26-A254 HydrophobicContact CG2-CB 3.86Å; V31-A254 HydrophobicContact CB-CB 3.91Å; V31-A254 HydrophobicContact CG1-CB 4.15Å; V31-A254 HydrophobicContact CG2-CB 3.4Å; S207-A254 WeakPolarHBondContact CB-O 3.38Å; S210-A254 PolarHBondContact OG-O 2.96Å; M245-A254 CarbonylContact O-C 3.38Å; M245-A254 WeakPolarHBondContact O-CA 3.25Å; A254-V257 HydrophobicContact CB-CG1 3.39Å
255	G	77.4	Confident	76.7	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-40.5	175.6	0	0	0	0	0	112.8	V206 S207 S210 M245	V206-G255 WeakPolarHBondContact CA-O 3.23Å; S207-G255 PolarHBondContact N-O 3.27Å; S210-G255 WeakPolarHBondContact OG-CA 3.01Å; M245-G255 PolarHBondContact O-N 2.91Å
256	I	84.6	Confident	77.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	136.1	174.7	-173.1	166.7	0	0	0	110.1	Q195 V204 A205 V206 V242 M245	Q195-I256 HydrophobicContact CB-CD1 4.09Å; Q195-I256 HydrophobicContact CG-CD1 4.44Å; V204-I256 HydrophobicContact CB-CD1 4.16Å; V204-I256 HydrophobicContact CB-CG1 4.11Å; V204-I256 HydrophobicContact CG1-CD1 4.47Å; V204-I256 HydrophobicContact CG2-CD1 4.13Å; A205-I256 WeakPolarHBondContact O-CA 3.45Å; V206-I256 HydrophobicContact CG2-CB 4.09Å; V206-I256 HydrophobicContact CG2-CD1 3.9Å; V206-I256 HydrophobicContact CG2-CG1 3.82Å; V242-I256 HydrophobicContact CG1-CD1 3.75Å; V242-I256 HydrophobicContact CG1-CG2 4.14Å; M245-I256 HydrophobicContact CB-CG2 4.07Å; M245-I256 HydrophobicContact CE-CB 4.31Å; M245-I256 HydrophobicContact CE-CG2 3.61Å; M245-I256 HydrophobicContact CG-CG2 4.03Å
257	V	84.8	Confident	78.6	Confident	7 Å²	7	35.5 Å²	35.5	4%	0.042	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	161.7	174.1	-63.7	0	0	0	0	110.8	I26 V31 V204 A205 A254	I26-V257 HydrophobicContact CB-CG2 4.29Å; I26-V257 HydrophobicContact CD1-CG2 4.04Å; I26-V257 HydrophobicContact CG1-CG2 4.02Å; I26-V257 HydrophobicContact CG2-CB 3.99Å; I26-V257 HydrophobicContact CG2-CG1 3.44Å; I26-V257 VanDerWaalsContact CG2-CG1 3.44Å; I26-V257 HydrophobicContact CG2-CG2 3.34Å; V31-V257 HydrophobicContact CG2-CG1 3.57Å; V204-V257 CarbonylContact C-O 3.45Å; V204-V257 WeakPolarHBondContact CA-O 3.43Å; V204-V257 WeakPolarHBondContact CB-O 3.28Å; A205-V257 HydrophobicContact CB-CG2 4.03Å; A205-V257 PolarHBondContact N-O 3.06Å; A205-V257 PolarHBondContact O-N 2.94Å; A254-V257 HydrophobicContact CB-CG1 3.39Å
258	A	86.3	Confident	79.7	Confident	3 Å²	3	34.9 Å²	34.9	3%	0.025	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	140.7	165.9	0	0	0	0	0	110.6	H203 D260	H203-A258 CarbonylContact O-C 3.46Å; H203-A258 WeakPolarHBondContact O-CA 3.44Å; A258-D260 WeakPolarHBondContact CB-O 3.49Å
259	V	84.9	Confident	80.8	Confident	78 Å²	78	33 Å²	33	47%	0.473	20%	0.199	S	C	.	.	S	Bend	trans	-66.6	-42.7	174.8	169.4	0	0	0	0	110.5	H203 A205 P261	H203-V259 PolarHBondContact O-N 3.48Å; A205-V259 HydrophobicContact CB-CG2 4.37Å; V259-P261 WeakPolarHBondContact O-CD 3.31Å
260	D	84.3	Confident	82	Confident	48 Å²	48	27.9 Å²	27.9	26%	0.257	18%	0.177	S	C	.	.	S	Bend	trans	-88.1	112.8	168.2	178	-6.6	0	0	0	108.6	A258 N262 Y263 Y403	A258-D260 WeakPolarHBondContact CB-O 3.49Å; D260-N262 PolarHBondContact O-N 2.8Å; D260-N262 VanDerWaalsContact OD1-CB 3.29Å; D260-N262 WeakPolarHBondContact OD1-CB 3.42Å; D260-N262 VanDerWaalsContact OD1-CG 3.31Å; D260-N262 PolarHBondContact OD1-N 2.91Å; D260-N262 PolarHBondContact OD1-ND2 3.05Å; D260-Y263 HydrophobicContact CB-CD2 3.99Å; D260-Y263 PolarHBondContact O-N 2.78Å; D260-Y403 WeakPolarHBondContact OD2-CE1 3.28Å; D260-Y403 PolarHBondContact OD2-OH 3.48Å
261	P	84	Confident	83.3	Confident	60 Å²	60	28.8 Å²	28.8	39%	0.39	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-58.3	-21.1	-176.6	-24.9	35.6	0	0	0	114	Q30 V259 Y263 Q264	Q30-P261 VanDerWaalsContact NE2-CG 3.34Å; V259-P261 WeakPolarHBondContact O-CD 3.31Å; P261-Y263 PolarHBondContact O-N 2.79Å; P261-Q264 WeakPolarHBondContact O-CB 3.09Å; P261-Q264 PolarHBondContact O-N 3.24Å; P261-Q264 VanDerWaalsContact O-N 3.13Å
262	N	87.3	Confident	85.1	Confident	31 Å²	31	29.5 Å²	29.5	17%	0.166	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-67	-22.4	178	-60.2	-49.7	0	0	0	112.7	D260 Y403 F405 P411 F416	D260-N262 PolarHBondContact O-N 2.8Å; D260-N262 VanDerWaalsContact OD1-CB 3.29Å; D260-N262 WeakPolarHBondContact OD1-CB 3.42Å; D260-N262 VanDerWaalsContact OD1-CG 3.31Å; D260-N262 PolarHBondContact OD1-N 2.91Å; D260-N262 PolarHBondContact OD1-ND2 3.05Å; N262-Y403 HydrophobicContact CB-CD1 3.3Å; N262-Y403 HydrophobicContact CB-CD2 4.16Å; N262-Y403 HydrophobicContact CB-CE1 3.49Å; N262-Y403 VanDerWaalsContact CB-CE1 3.49Å; N262-Y403 HydrophobicContact CB-CE2 4.37Å; N262-Y403 HydrophobicContact CB-CG 3.64Å; N262-F405 HydrophobicContact CB-CZ 4.19Å; N262-P411 WeakPolarHBondContact OD1-CB 3.38Å; N262-P411 VanDerWaalsContact OD1-CG 3.29Å; N262-P411 WeakPolarHBondContact OD1-CG 3.45Å; N262-F416 HydrophobicContact CB-CE1 4.26Å
263	Y	90.4	Very high	86.9	Confident	46 Å²	46	24 Å²	24	18%	0.18	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-90.1	-1.8	174.5	-74.4	-65.5	0	0	0	113.8	L236 D260 P261 W265 T266 I267 T401 G402 Y403	L236-Y263 HydrophobicContact CB-CD1 4.28Å; L236-Y263 HydrophobicContact CB-CG 4.47Å; L236-Y263 HydrophobicContact CD1-CD1 3.84Å; L236-Y263 HydrophobicContact CD1-CD2 3.37Å; L236-Y263 HydrophobicContact CD1-CE1 4.32Å; L236-Y263 HydrophobicContact CD1-CE2 3.9Å; L236-Y263 HydrophobicContact CD1-CG 3.36Å; L236-Y263 HydrophobicContact CG-CG 4.48Å; D260-Y263 HydrophobicContact CB-CD2 3.99Å; D260-Y263 PolarHBondContact O-N 2.78Å; P261-Y263 PolarHBondContact O-N 2.79Å; Y263-W265 PolarHBondContact O-N 2.79Å; Y263-W265 VanDerWaalsContact O-N 3.1Å; Y263-T266 HydrophobicContact CD1-CG2 4.3Å; Y263-T266 WeakPolarHBondContact O-CA 3.4Å; Y263-T266 VanDerWaalsContact O-CB 3.28Å; Y263-T266 WeakPolarHBondContact O-CB 3.25Å; Y263-T266 PolarHBondContact O-N 2.87Å; Y263-I267 PolarHBondContact O-N 3.07Å; Y263-T401 VanDerWaalsContact CE1-O 3.29Å; Y263-T401 WeakPolarHBondContact CE1-O 3.31Å; Y263-G402 VanDerWaalsContact CE1-C 3.43Å; Y263-Y403 AromaticContact CD1-CD1 3.64Å; Y263-Y403 HydrophobicContact CD1-CD1 3.64Å; Y263-Y403 HydrophobicContact CD1-CE1 4.12Å; Y263-Y403 AromaticContact CD2-CD1 3.82Å; Y263-Y403 HydrophobicContact CD2-CD1 3.82Å; Y263-Y403 AromaticContact CD2-CE1 3.47Å; Y263-Y403 HydrophobicContact CD2-CE1 3.47Å; Y263-Y403 VanDerWaalsContact CD2-CE1 3.47Å; Y263-Y403 AromaticContact CE1-CD1 3.53Å; Y263-Y403 HydrophobicContact CE1-CD1 3.53Å; Y263-Y403 AromaticContact CE1-CE1 3.82Å; Y263-Y403 HydrophobicContact CE1-CE1 3.82Å; Y263-Y403 HydrophobicContact CE1-CG 4.48Å; Y263-Y403 AromaticContact CE2-CD1 3.73Å; Y263-Y403 HydrophobicContact CE2-CD1 3.73Å; Y263-Y403 AromaticContact CE2-CE1 3.14Å; Y263-Y403 HydrophobicContact CE2-CE1 3.14Å; Y263-Y403 AromaticContact CG-CD1 3.76Å; Y263-Y403 HydrophobicContact CG-CD1 3.76Å; Y263-Y403 AromaticContact CG-CE1 3.93Å; Y263-Y403 HydrophobicContact CG-CE1 3.93Å; Y263-Y403 AromaticContact CZ-CD1 3.55Å; Y263-Y403 AromaticContact CZ-CE1 3.3Å
264	Q	87.9	Confident	88.7	Confident	4 Å²	4	22.4 Å²	22.4	2%	0.019	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-33.6	-170.8	-176.9	59.4	24.1	0	0	113.3	Q30 S244 P261	Q30-Q264 HydrophobicContact CB-CG 4.09Å; S244-Q264 PolarHBondContact OG-NE2 2.99Å; P261-Q264 WeakPolarHBondContact O-CB 3.09Å; P261-Q264 PolarHBondContact O-N 3.24Å; P261-Q264 VanDerWaalsContact O-N 3.13Å
265	W	89.7	Confident	90	Very high	25 Å²	25	23.4 Å²	23.4	10%	0.095	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-2.1	177.9	-61	103	0	0	0	113.7	S33 I34 Y263 R383 T384 C385	S33-W265 VanDerWaalsContact OG-CH2 3.25Å; S33-W265 WeakPolarHBondContact OG-CH2 3.25Å; I34-W265 HydrophobicContact CG1-CH2 4.2Å; I34-W265 HydrophobicContact CG1-CZ3 4.36Å; Y263-W265 PolarHBondContact O-N 2.79Å; Y263-W265 VanDerWaalsContact O-N 3.1Å; W265-R383 VanDerWaalsContact CE3-O 3.22Å; W265-R383 VanDerWaalsContact CZ3-O 3.24Å; W265-R383 WeakPolarHBondContact CZ3-O 3.12Å; W265-T384 WeakPolarHBondContact O-CA 3.3Å; W265-T384 PolarHBondContact O-OG1 3.37Å; W265-T384 VanDerWaalsContact O-OG1 3.07Å; W265-C385 HydrophobicContact CB-CB 4.28Å; W265-C385 VanDerWaalsContact CB-SG 3.52Å; W265-C385 PolarHBondContact O-N 3.23Å
266	T	93.8	Very high	91	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-37.3	173.4	-57.3	0	0	0	0	111.3	L236 Y263 T401 G402 R404	L236-T266 HydrophobicContact CB-CG2 4.47Å; Y263-T266 HydrophobicContact CD1-CG2 4.3Å; Y263-T266 WeakPolarHBondContact O-CA 3.4Å; Y263-T266 VanDerWaalsContact O-CB 3.28Å; Y263-T266 WeakPolarHBondContact O-CB 3.25Å; Y263-T266 PolarHBondContact O-N 2.87Å; T266-T401 HydrophobicContact CG2-CG2 3.53Å; T266-G402 WeakPolarHBondContact CG2-O 3.35Å; T266-G402 PolarHBondContact OG1-O 3.16Å; T266-R404 PolarHBondContact OG1-N 2.68Å; T266-R404 VanDerWaalsContact OG1-N 3.1Å
267	I	93.3	Very high	91.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	145.9	-175.2	66.4	174.6	0	0	0	113.4	L236 S244 Y263	L236-I267 HydrophobicContact CB-CG2 3.84Å; L236-I267 HydrophobicContact CD2-CG2 3.41Å; L236-I267 VanDerWaalsContact CD2-CG2 3.41Å; L236-I267 HydrophobicContact CG-CG2 4.23Å; L236-I267 VanDerWaalsContact O-CA 3.28Å; L236-I267 WeakPolarHBondContact O-CA 3.33Å; L236-I267 WeakPolarHBondContact O-CG2 3.41Å; S244-I267 VanDerWaalsContact OG-CD1 3.25Å; S244-I267 WeakPolarHBondContact OG-CD1 3.5Å; S244-I267 WeakPolarHBondContact OG-CG1 3.41Å; Y263-I267 PolarHBondContact O-N 3.07Å
268	G	92.6	Very high	92.3	Very high	3 Å²	3	24.3 Å²	24.3	3%	0.031	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	9.9	173.1	0	0	0	0	0	116.4	V242 A243	V242-G268 PolarHBondContact O-N 3.14Å; A243-G268 VanDerWaalsContact CA-CA 3.42Å
269	Q	93.7	Very high	92.7	Very high	7 Å²	7	25.4 Å²	25.4	3%	0.033	13%	0.128	C	C	.	.			trans	-58.6	142.4	176.9	72.5	83.3	14.3	0	0	111.6	G237 K272 S386	G237-Q269 WeakPolarHBondContact O-CG 3.38Å; G237-Q269 PolarHBondContact O-NE2 3.41Å; Q269-K272 PolarHBondContact NE2-O 3.08Å; Q269-K272 PolarHBondContact OE1-O 3.46Å; Q269-S386 WeakPolarHBondContact CA-OG 3.24Å; Q269-S386 WeakPolarHBondContact CB-OG 3.29Å
270	R	92.9	Very high	93.1	Very high	5 Å²	5	23.1 Å²	23.1	2%	0.019	11%	0.113	C	C	.	.			trans	-130.4	36.4	177.7	-66.5	-66.4	-177.9	-86.1	3.3	111.4	E45 G179 L180 V239 H241	E45-R270 VanDerWaalsContact CD-NH2 3.34Å; E45-R270 IonicContact OE1-NH2 3.61Å; E45-R270 PolarHBondContact OE1-NH2 2.84Å; E45-R270 IonicContact OE2-CZ 2.95Å; E45-R270 IonicContact OE2-NE 3.15Å; E45-R270 PolarHBondContact OE2-NE 3.16Å; E45-R270 IonicContact OE2-NH2 3.68Å; E45-R270 PolarHBondContact OE2-NH2 3.35Å; G179-R270 WeakPolarHBondContact CA-O 3.33Å; L180-R270 HydrophobicContact CD2-CG 4.15Å; L180-R270 HydrophobicContact CG-CB 4.47Å; L180-R270 HydrophobicContact CG-CG 4.44Å; V239-R270 PolarHBondContact O-NH1 2.95Å; V239-R270 VanDerWaalsContact O-NH1 3.15Å; H241-R270 PolarHBondContact O-NH1 2.83Å; H241-R270 PolarHBondContact O-NH2 3.02Å
271	K	93.5	Very high	93.7	Very high	65 Å²	65	20.8 Å²	20.8	28%	0.283	10%	0.101	S	C	.	.	S	Bend	trans	-88.7	-51.4	178.8	-176.2	172.8	177.9	-176.8	0	111.9	S386 E428	K271-S386 WeakPolarHBondContact CD-O 3.37Å; K271-S386 PolarHBondContact NZ-O 3.36Å; K271-E428 IonicContact NZ-OE1 3.49Å; K271-E428 PolarHBondContact NZ-OE1 3.39Å; K271-E428 IonicContact NZ-OE2 3.31Å; K271-E428 PolarHBondContact NZ-OE2 3.44Å; K271-E428 VanDerWaalsContact NZ-OE2 3.1Å
272	K	95.8	Very high	94.2	Very high	75 Å²	75	18.2 Å²	18.2	33%	0.326	8%	0.084	S	C	.	.	S	Bend	trans	-164.3	160.5	-179.6	60	-179.7	-177.2	-178.4	0	111	L125 Q269	L125-K272 HydrophobicContact CD1-CB 3.83Å; Q269-K272 PolarHBondContact NE2-O 3.08Å; Q269-K272 PolarHBondContact OE1-O 3.46Å
273	P	98.1	Very high	94.3	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.006	9%	0.091	C	C	.	.			trans	-55	141.7	166.8	-18.3	28.5	0	0	0	111.6	W126 A182 V239 D277 Y278	W126-P273 HydrophobicContact CD2-CG 4.39Å; W126-P273 HydrophobicContact CH2-CB 3.86Å; W126-P273 HydrophobicContact CH2-CG 3.87Å; W126-P273 HydrophobicContact CZ2-CB 4.06Å; W126-P273 HydrophobicContact CZ2-CG 3.54Å; W126-P273 HydrophobicContact CZ3-CB 4.32Å; W126-P273 HydrophobicContact CZ3-CG 4.41Å; A182-P273 HydrophobicContact CB-CG 3.95Å; V239-P273 HydrophobicContact CG1-CB 4.06Å; V239-P273 HydrophobicContact CG1-CG 4.19Å; P273-D277 WeakPolarHBondContact CA-OD2 3.35Å; P273-D277 HydrophobicContact CB-CB 3.72Å; P273-Y278 HydrophobicContact CB-CD1 4.15Å; P273-Y278 HydrophobicContact CB-CE1 3.59Å; P273-Y278 HydrophobicContact CB-CE2 4.18Å; P273-Y278 WeakPolarHBondContact CD-OH 3.44Å; P273-Y278 HydrophobicContact CG-CE1 3.81Å; P273-Y278 VanDerWaalsContact O-CE2 3.31Å; P273-Y278 WeakPolarHBondContact O-CE2 3.15Å
274	S	98	Very high	94.3	Very high	12 Å²	12	20.4 Å²	20.4	8%	0.084	10%	0.098	C	C	.	.			trans	-74.3	172.5	176.7	78.6	0	0	0	0	111.4	D235 L276 D277 Y278	D235-S274 WeakPolarHBondContact OD2-CB 2.79Å; D235-S274 PolarHBondContact OD2-OG 3.4Å; S274-L276 PolarHBondContact O-N 3.18Å; S274-L276 PolarHBondContact OG-N 2.81Å; S274-D277 PolarHBondContact N-OD2 2.8Å; S274-D277 PolarHBondContact O-N 3.18Å; S274-D277 VanDerWaalsContact OG-CG 3.29Å; S274-D277 PolarHBondContact OG-N 2.86Å; S274-D277 PolarHBondContact OG-OD2 2.98Å; S274-Y278 WeakPolarHBondContact O-CD2 3.22Å; S274-Y278 PolarHBondContact O-N 3.3Å
275	F	98.1	Very high	94.5	Very high	22 Å²	22	21.4 Å²	21.4	10%	0.096	10%	0.102	C	C	.	.	H	α-helix	trans	-58	-39.6	172.9	179.1	-95.7	0	0	0	112	Y278 K279 Y301 R311 C312 P313 D399	F275-Y278 PolarHBondContact O-N 3Å; F275-K279 HydrophobicContact CE1-CD 4.06Å; F275-K279 WeakPolarHBondContact O-CB 3.17Å; F275-K279 PolarHBondContact O-N 2.86Å; F275-Y301 HydrophobicContact CD2-CE1 4.4Å; F275-Y301 AromaticContact CE1-CD1 4Å; F275-Y301 HydrophobicContact CE1-CD1 4Å; F275-Y301 AromaticContact CE1-CE1 3.86Å; F275-Y301 HydrophobicContact CE1-CE1 3.86Å; F275-Y301 HydrophobicContact CE2-CD1 4.12Å; F275-Y301 AromaticContact CE2-CE1 3.62Å; F275-Y301 HydrophobicContact CE2-CE1 3.62Å; F275-Y301 AromaticContact CZ-CD1 3.43Å; F275-Y301 HydrophobicContact CZ-CD1 3.43Å; F275-Y301 VanDerWaalsContact CZ-CD1 3.43Å; F275-Y301 AromaticContact CZ-CE1 3.32Å; F275-Y301 HydrophobicContact CZ-CE1 3.32Å; F275-R311 HydrophobicContact CD2-CG 4.28Å; F275-R311 HydrophobicContact CE2-CG 3.71Å; F275-R311 WeakPolarHBondContact CE2-O 3.35Å; F275-C312 VanDerWaalsContact CD2-O 3.3Å; F275-C312 WeakPolarHBondContact CD2-O 3.27Å; F275-C312 VanDerWaalsContact CE2-O 3.23Å; F275-C312 WeakPolarHBondContact CE2-O 3.37Å; F275-P313 HydrophobicContact CD1-CG 4.47Å; F275-P313 HydrophobicContact CE1-CG 4.08Å; F275-P313 HydrophobicContact CE2-CG 4.34Å; F275-P313 HydrophobicContact CZ-CG 3.99Å; F275-D399 HydrophobicContact CD1-CB 3.62Å; F275-D399 HydrophobicContact CE1-CB 3.56Å
276	L	97.4	Very high	94.6	Very high	7 Å²	7	20.4 Å²	20.4	4%	0.037	10%	0.098	C	C	.	.	H	α-helix	trans	-74.6	-31.7	179.8	-70	174.7	0	0	0	112.8	L232 P233 D235 S274 Y278 K279 L280 D399	L232-L276 HydrophobicContact CD1-CD2 4.49Å; L232-L276 HydrophobicContact CD2-CD2 4.24Å; P233-L276 HydrophobicContact CG-CD1 3.74Å; P233-L276 HydrophobicContact CG-CD2 4.43Å; D235-L276 HydrophobicContact CB-CB 4.19Å; D235-L276 HydrophobicContact CB-CD1 3.75Å; S274-L276 PolarHBondContact O-N 3.18Å; S274-L276 PolarHBondContact OG-N 2.81Å; L276-Y278 VanDerWaalsContact C-N 3.35Å; L276-Y278 PolarHBondContact O-N 3.12Å; L276-K279 HydrophobicContact CD2-CD 4.05Å; L276-K279 PolarHBondContact O-N 3.39Å; L276-L280 VanDerWaalsContact O-CB 3.3Å; L276-L280 WeakPolarHBondContact O-CB 3.08Å; L276-L280 PolarHBondContact O-N 2.73Å; L276-D399 HydrophobicContact CD2-CB 4.05Å
277	D	98.2	Very high	94.2	Very high	7 Å²	7	24.3 Å²	24.3	4%	0.037	13%	0.13	C	C	.	.	H	α-helix	trans	-58.9	-47.6	170.8	-65.7	-36.1	0	0	0	110.6	W126 S238 V239 P273 S274 L280 V281	W126-D277 HydrophobicContact CH2-CB 4.35Å; S238-D277 WeakPolarHBondContact CB-OD1 3.1Å; S238-D277 PolarHBondContact OG-OD1 2.99Å; S238-D277 PolarHBondContact OG-OD2 2.93Å; V239-D277 WeakPolarHBondContact CG1-OD2 3.36Å; V239-D277 PolarHBondContact N-OD2 2.89Å; P273-D277 WeakPolarHBondContact CA-OD2 3.35Å; P273-D277 HydrophobicContact CB-CB 3.72Å; S274-D277 PolarHBondContact N-OD2 2.8Å; S274-D277 PolarHBondContact O-N 3.18Å; S274-D277 VanDerWaalsContact OG-CG 3.29Å; S274-D277 PolarHBondContact OG-N 2.86Å; S274-D277 PolarHBondContact OG-OD2 2.98Å; D277-L280 PolarHBondContact O-N 3.1Å; D277-V281 WeakPolarHBondContact O-CG2 3.44Å; D277-V281 PolarHBondContact O-N 3.34Å
278	Y	98	Very high	93.9	Very high	11 Å²	11	30.4 Å²	30.4	4%	0.043	16%	0.163	C	C	.	.	H	α-helix	trans	-66.1	-42	176.1	-60.8	-53	0	0	0	112.5	W126 N129 T130 P273 S274 F275 L276 L280 V281 N282	W126-Y278 HydrophobicContact CD2-CE1 4.39Å; W126-Y278 AromaticContact CE3-CD1 3.76Å; W126-Y278 HydrophobicContact CE3-CD1 3.76Å; W126-Y278 AromaticContact CE3-CE1 3.89Å; W126-Y278 HydrophobicContact CE3-CE1 3.89Å; W126-Y278 AromaticContact CZ3-CD1 3.74Å; W126-Y278 HydrophobicContact CZ3-CD1 3.74Å; W126-Y278 HydrophobicContact CZ3-CE1 4.09Å; N129-Y278 HydrophobicContact CB-CD1 3.36Å; N129-Y278 HydrophobicContact CB-CD2 3.63Å; N129-Y278 HydrophobicContact CB-CE1 3.53Å; N129-Y278 HydrophobicContact CB-CE2 3.8Å; N129-Y278 HydrophobicContact CB-CG 3.41Å; N129-Y278 VanDerWaalsContact CB-CG 3.41Å; T130-Y278 HydrophobicContact CG2-CD1 4.18Å; P273-Y278 HydrophobicContact CB-CD1 4.15Å; P273-Y278 HydrophobicContact CB-CE1 3.59Å; P273-Y278 HydrophobicContact CB-CE2 4.18Å; P273-Y278 WeakPolarHBondContact CD-OH 3.44Å; P273-Y278 HydrophobicContact CG-CE1 3.81Å; P273-Y278 VanDerWaalsContact O-CE2 3.31Å; P273-Y278 WeakPolarHBondContact O-CE2 3.15Å; S274-Y278 WeakPolarHBondContact O-CD2 3.22Å; S274-Y278 PolarHBondContact O-N 3.3Å; F275-Y278 PolarHBondContact O-N 3Å; L276-Y278 VanDerWaalsContact C-N 3.35Å; L276-Y278 PolarHBondContact O-N 3.12Å; Y278-L280 VanDerWaalsContact C-N 3.31Å; Y278-L280 PolarHBondContact O-N 3.4Å; Y278-V281 PolarHBondContact O-N 3.49Å; Y278-N282 WeakPolarHBondContact O-CB 3.14Å; Y278-N282 VanDerWaalsContact O-CG 3.27Å; Y278-N282 PolarHBondContact O-N 2.04Å; Y278-N282 PolarHBondContact O-ND2 2.77Å
279	K	96	Very high	93.8	Very high	26 Å²	26	34.7 Å²	34.7	11%	0.113	18%	0.181	C	C	.	.	H	α-helix	trans	-60	-43.1	178.1	-169	170.4	-176.2	171.8	0	110.9	L232 F275 L276 N282 L283 D299 Y301 D399	L232-K279 HydrophobicContact CD1-CB 4.35Å; L232-K279 HydrophobicContact CD1-CG 4.28Å; L232-K279 HydrophobicContact CD2-CD 3.77Å; L232-K279 HydrophobicContact CD2-CG 4.16Å; F275-K279 HydrophobicContact CE1-CD 4.06Å; F275-K279 WeakPolarHBondContact O-CB 3.17Å; F275-K279 PolarHBondContact O-N 2.86Å; L276-K279 HydrophobicContact CD2-CD 4.05Å; L276-K279 PolarHBondContact O-N 3.39Å; K279-N282 PolarHBondContact O-N 2.87Å; K279-L283 HydrophobicContact CG-CD1 4.34Å; K279-L283 VanDerWaalsContact O-CG 3.3Å; K279-L283 WeakPolarHBondContact O-CG 3.39Å; K279-L283 PolarHBondContact O-N 2.82Å; K279-D299 PolarHBondContact NZ-O 3.32Å; K279-Y301 HydrophobicContact CB-CD1 4.37Å; K279-Y301 HydrophobicContact CB-CE1 3.75Å; K279-Y301 HydrophobicContact CD-CD1 3.77Å; K279-Y301 HydrophobicContact CD-CE1 3.98Å; K279-Y301 HydrophobicContact CG-CD1 3.86Å; K279-Y301 HydrophobicContact CG-CE1 3.76Å; K279-Y301 HydrophobicContact CG-CG 4.45Å; K279-D399 IonicContact NZ-OD2 3.99Å
280	L	93	Very high	93.8	Very high	30 Å²	30	35.6 Å²	35.6	16%	0.157	19%	0.188	C	C	.	.	H	α-helix	trans	-61.2	-46.4	177.1	-179.7	52.1	0	0	0	112	L191 I228 F230 L232 L276 D277 Y278 N282 L283 L284	L191-L280 HydrophobicContact CD2-CD2 3.67Å; L191-L280 HydrophobicContact CD2-CG 3.81Å; I228-L280 WeakPolarHBondContact O-CD1 3.48Å; F230-L280 HydrophobicContact CD2-CD1 3.49Å; F230-L280 VanDerWaalsContact CD2-CD1 3.49Å; F230-L280 HydrophobicContact CE2-CD1 3.9Å; L232-L280 HydrophobicContact CD1-CB 3.9Å; L232-L280 HydrophobicContact CD1-CD1 4.37Å; L276-L280 VanDerWaalsContact O-CB 3.3Å; L276-L280 WeakPolarHBondContact O-CB 3.08Å; L276-L280 PolarHBondContact O-N 2.73Å; D277-L280 PolarHBondContact O-N 3.1Å; Y278-L280 VanDerWaalsContact C-N 3.31Å; Y278-L280 PolarHBondContact O-N 3.4Å; L280-N282 PolarHBondContact O-N 2.97Å; L280-L283 PolarHBondContact O-N 2.91Å; L280-L284 PolarHBondContact O-N 3.17Å
281	V	95.2	Very high	93.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.7	-40.6	175.3	174.5	0	0	0	0	111.4	W126 T130 L132 L189 L191 D277 Y278 L283 L284 Y285	W126-V281 HydrophobicContact CE3-CG2 4.3Å; W126-V281 HydrophobicContact CH2-CG2 4.11Å; W126-V281 HydrophobicContact CZ3-CB 4.21Å; W126-V281 HydrophobicContact CZ3-CG2 3.55Å; T130-V281 HydrophobicContact CG2-CB 4.14Å; T130-V281 HydrophobicContact CG2-CG1 3.79Å; L132-V281 HydrophobicContact CD1-CG1 3.62Å; L132-V281 HydrophobicContact CG-CG1 4.41Å; L189-V281 HydrophobicContact CD1-CG1 4.16Å; L189-V281 HydrophobicContact CD1-CG2 4.34Å; L191-V281 HydrophobicContact CD1-CG2 3.9Å; L191-V281 HydrophobicContact CD2-CG2 3.93Å; L191-V281 HydrophobicContact CG-CG2 4.1Å; D277-V281 WeakPolarHBondContact O-CG2 3.44Å; D277-V281 PolarHBondContact O-N 3.34Å; Y278-V281 PolarHBondContact O-N 3.49Å; V281-L283 PolarHBondContact O-N 2.05Å; V281-L284 PolarHBondContact O-N 3.29Å; V281-L284 VanDerWaalsContact O-N 3.16Å; V281-Y285 HydrophobicContact CG1-CD2 3.72Å; V281-Y285 HydrophobicContact CG1-CE2 4.22Å; V281-Y285 WeakPolarHBondContact O-CD2 3.36Å; V281-Y285 PolarHBondContact O-N 2.92Å
282	N	94.7	Very high	93.6	Very high	6 Å²	6	46 Å²	46	3%	0.032	24%	0.244	C	C	.	.	H	α-helix	trans	-65.4	-38.4	177.4	-73.8	-39.7	0	0	0	112.8	N129 T130 Y278 K279 L280 L284 C286 A287 Y301 V304	N129-N282 PolarHBondContact O-ND2 2.89Å; T130-N282 WeakPolarHBondContact CA-OD1 3.22Å; T130-N282 WeakPolarHBondContact CB-OD1 3.26Å; Y278-N282 WeakPolarHBondContact O-CB 3.14Å; Y278-N282 VanDerWaalsContact O-CG 3.27Å; Y278-N282 PolarHBondContact O-N 2.04Å; Y278-N282 PolarHBondContact O-ND2 2.77Å; K279-N282 PolarHBondContact O-N 2.87Å; L280-N282 PolarHBondContact O-N 2.97Å; N282-L284 VanDerWaalsContact C-N 3.27Å; N282-L284 PolarHBondContact O-N 3.13Å; N282-C286 HydrophobicContact CB-CB 4.29Å; N282-C286 CarbonylContact O-C 3.52Å; N282-C286 VanDerWaalsContact O-CA 3.26Å; N282-C286 WeakPolarHBondContact O-CA 2.98Å; N282-C286 VanDerWaalsContact O-CB 3.27Å; N282-C286 WeakPolarHBondContact O-CB 2.96Å; N282-C286 PolarHBondContact O-N 2.84Å; N282-C286 PolarHBondContact OD1-SG 2.89Å; N282-C286 VanDerWaalsContact OD1-SG 3.38Å; N282-A287 PolarHBondContact O-N 3.19Å; N282-Y301 HydrophobicContact CB-CE2 4.28Å; N282-Y301 PolarHBondContact ND2-OH 3Å; N282-V304 HydrophobicContact CB-CG1 4.35Å; N282-V304 WeakPolarHBondContact OD1-CG2 3.36Å
283	L	90.1	Very high	93.4	Very high	63 Å²	63	48.3 Å²	48.3	33%	0.33	27%	0.265	S	S	.	.	H	α-helix	trans	-65.3	-32.7	173.1	-70.3	170.4	0	0	0	112	F230 L232 K279 L280 V281	F230-L283 HydrophobicContact CB-CD1 3.66Å; F230-L283 HydrophobicContact CD1-CB 4.23Å; F230-L283 HydrophobicContact CD2-CB 3.88Å; F230-L283 HydrophobicContact CD2-CD1 4.27Å; F230-L283 HydrophobicContact CE1-CB 4.33Å; F230-L283 HydrophobicContact CE2-CB 3.98Å; F230-L283 HydrophobicContact CG-CB 4Å; F230-L283 HydrophobicContact CG-CD1 3.97Å; F230-L283 HydrophobicContact CZ-CB 4.2Å; L232-L283 HydrophobicContact CD1-CD1 4.04Å; L232-L283 HydrophobicContact CD2-CD1 4.18Å; L232-L283 HydrophobicContact CG-CD1 4.2Å; K279-L283 HydrophobicContact CG-CD1 4.34Å; K279-L283 VanDerWaalsContact O-CG 3.3Å; K279-L283 WeakPolarHBondContact O-CG 3.39Å; K279-L283 PolarHBondContact O-N 2.82Å; L280-L283 PolarHBondContact O-N 2.91Å; V281-L283 PolarHBondContact O-N 2.05Å
284	L	89.9	Confident	93.3	Very high	59 Å²	59	49.8 Å²	49.8	31%	0.309	27%	0.272	S	S	.	.	H	α-helix	trans	-76.5	-37.8	179.3	-171.7	58.4	0	0	0	113.3	P97 F230 L280 V281 N282	P97-L284 HydrophobicContact CB-CD1 4.49Å; P97-L284 HydrophobicContact CB-CD2 4.42Å; P97-L284 HydrophobicContact CB-CG 4.34Å; F230-L284 HydrophobicContact CE2-CB 4.34Å; F230-L284 HydrophobicContact CZ-CD1 4.29Å; L280-L284 PolarHBondContact O-N 3.17Å; V281-L284 PolarHBondContact O-N 3.29Å; V281-L284 VanDerWaalsContact O-N 3.16Å; N282-L284 VanDerWaalsContact C-N 3.27Å; N282-L284 PolarHBondContact O-N 3.13Å
285	Y	92.5	Very high	93.2	Very high	26 Å²	26	53.5 Å²	53.5	10%	0.102	30%	0.296	C	S	.	.	H	α-helix	trans	-118.4	-18.7	-168.6	-69.6	-77.6	0	0	0	116	P97 W98 L132 L189 V281	P97-Y285 WeakPolarHBondContact CA-OH 3.48Å; P97-Y285 HydrophobicContact CB-CD1 4.46Å; P97-Y285 HydrophobicContact CB-CE1 3.56Å; W98-Y285 HydrophobicContact CB-CE1 4.01Å; W98-Y285 PolarHBondContact N-OH 2.99Å; W98-Y285 WeakPolarHBondContact O-CE1 3.35Å; L132-Y285 HydrophobicContact CD1-CD2 3.89Å; L132-Y285 HydrophobicContact CD1-CE2 4.17Å; L132-Y285 HydrophobicContact CD1-CG 4.19Å; L132-Y285 HydrophobicContact CD2-CD1 3.88Å; L132-Y285 HydrophobicContact CD2-CD2 4.3Å; L132-Y285 HydrophobicContact CD2-CG 3.74Å; L132-Y285 HydrophobicContact CG-CD2 4.44Å; L132-Y285 HydrophobicContact CG-CG 4.29Å; L189-Y285 HydrophobicContact CB-CE2 4.34Å; L189-Y285 WeakPolarHBondContact O-CE2 3.13Å; L189-Y285 PolarHBondContact O-OH 3.29Å; V281-Y285 HydrophobicContact CG1-CD2 3.72Å; V281-Y285 HydrophobicContact CG1-CE2 4.22Å; V281-Y285 WeakPolarHBondContact O-CD2 3.36Å; V281-Y285 PolarHBondContact O-N 2.92Å
286	C	92.7	Very high	93.2	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.02	30%	0.301	C	S	.	.			trans	-129	10.7	-162.3	-50	0	0	0	0	113.6	C131 N282 D288 K289 V304	C131-C286 HydrophobicContact CB-CB 3.72Å; C131-C286 WeakPolarHBondContact CB-SG 3.43Å; C131-C286 PolarHBondContact N-SG 3.13Å; C131-C286 VanDerWaalsContact SG-CA 3.54Å; C131-C286 WeakPolarHBondContact SG-CB 3.11Å; C131-C286 CovalentContact SG-SG 2.02Å; C131-C286 PolarHBondContact SG-SG 3.32Å; N282-C286 HydrophobicContact CB-CB 4.29Å; N282-C286 CarbonylContact O-C 3.52Å; N282-C286 VanDerWaalsContact O-CA 3.26Å; N282-C286 WeakPolarHBondContact O-CA 2.98Å; N282-C286 VanDerWaalsContact O-CB 3.27Å; N282-C286 WeakPolarHBondContact O-CB 2.96Å; N282-C286 PolarHBondContact O-N 2.84Å; N282-C286 PolarHBondContact OD1-SG 2.89Å; N282-C286 VanDerWaalsContact OD1-SG 3.38Å; C286-D288 PolarHBondContact O-N 3.01Å; C286-K289 HydrophobicContact CB-CG 3.93Å; C286-K289 WeakPolarHBondContact O-CB 3.05Å; C286-K289 WeakPolarHBondContact O-CG 3.48Å; C286-K289 PolarHBondContact O-N 3.09Å; C286-V304 HydrophobicContact CB-CB 4.26Å; C286-V304 HydrophobicContact CB-CG1 3.84Å
287	A	83.6	Confident	93.1	Very high	82 Å²	82	57.7 Å²	57.7	68%	0.678	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-22.8	-171.9	0	0	0	0	0	114.2	N282	N282-A287 PolarHBondContact O-N 3.19Å
288	D	86.9	Confident	93	Very high	129 Å²	129	58.4 Å²	58.4	69%	0.69	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	2.4	-179.1	66.2	-25.9	0	0	0	113.9	C286	C286-D288 PolarHBondContact O-N 3.01Å
289	K	92	Very high	92.8	Very high	93 Å²	93	60.1 Å²	60.1	40%	0.404	33%	0.332	S	S	.	.	S	Bend	trans	-71.1	-41.4	-174.6	-71.3	-67.6	-177.5	-178.2	0	113.7	C131 C286 V304	C131-K289 HydrophobicContact CB-CD 4.21Å; C131-K289 HydrophobicContact CB-CG 3.87Å; C286-K289 HydrophobicContact CB-CG 3.93Å; C286-K289 WeakPolarHBondContact O-CB 3.05Å; C286-K289 WeakPolarHBondContact O-CG 3.48Å; C286-K289 PolarHBondContact O-N 3.09Å; K289-V304 HydrophobicContact CB-CB 4.36Å
290	C	93.7	Very high	92.8	Very high	26 Å²	26	59.4 Å²	59.4	18%	0.176	33%	0.332	C	S	.	.			trans	-104.2	120.5	178.4	-60.7	0	0	0	0	109.5	E302 C307	C290-E302 HydrophobicContact CB-CB 3.96Å; C290-E302 HydrophobicContact CB-CG 4.28Å; C290-C307 WeakPolarHBondContact CA-SG 3.42Å; C290-C307 HydrophobicContact CB-CB 3.72Å; C290-C307 WeakPolarHBondContact CB-SG 3.24Å; C290-C307 VanDerWaalsContact SG-CA 3.56Å; C290-C307 WeakPolarHBondContact SG-CB 3.15Å; C290-C307 CovalentContact SG-SG 2.05Å; C290-C307 PolarHBondContact SG-SG 3.13Å
291	Q	90.5	Very high	93	Very high	192 Å²	192	59.2 Å²	59.2	90%	0.897	33%	0.329	S	S	*	.			trans	-82.9	-17	-176.3	-63.2	179.2	4.2	0	0	113.1
292	T	90.3	Very high	93	Very high	97 Å²	97	61.1 Å²	61.1	60%	0.595	34%	0.338	S	S	*	.	S	Bend	trans	-118.9	132.8	-175.3	-51.9	0	0	0	0	109.3
293	T	91.7	Very high	93.1	Very high	122 Å²	122	61.4 Å²	61.4	75%	0.748	34%	0.34	S	S	*	.			trans	-80.4	128.2	172.5	-53.8	0	0	0	0	109.9	E302	T293-E302 WeakPolarHBondContact CA-OE1 3.34Å; T293-E302 WeakPolarHBondContact CG2-OE1 3.32Å
294	L	95.8	Very high	93.4	Very high	32 Å²	32	59.5 Å²	59.5	17%	0.168	33%	0.331	C	S	.	.			trans	-96.6	152.3	175.5	-63.2	-179	0	0	0	110.4	C296 E302 F320	L294-C296 PolarHBondContact O-N 3.01Å; L294-E302 HydrophobicContact CB-CG 4.24Å; L294-E302 HydrophobicContact CD1-CG 4.34Å; L294-E302 HydrophobicContact CG-CG 4.08Å; L294-E302 PolarHBondContact N-OE1 2.83Å; L294-F320 HydrophobicContact CB-CD1 4.36Å; L294-F320 HydrophobicContact CB-CE1 4.21Å; L294-F320 HydrophobicContact CD2-CE1 4.33Å
295	P	96.9	Very high	93.6	Very high	91 Å²	91	59.9 Å²	59.9	59%	0.591	33%	0.333	S	S	*	.			trans	-77.4	57.4	176.7	34.1	-37.8	0	0	0	112	Q297 F320	P295-Q297 PolarHBondContact O-N 3.22Å; P295-F320 HydrophobicContact CG-CD1 3.78Å; P295-F320 HydrophobicContact CG-CE1 3.85Å; P295-F320 HydrophobicContact CG-CG 4.33Å; P295-F320 HydrophobicContact CG-CZ 4.43Å
296	C	97.2	Very high	93.7	Very high	28 Å²	28	60.8 Å²	60.8	19%	0.189	34%	0.34	C	S	.	.			trans	-63.2	125.3	179.1	-55	0	0	0	0	111.2	L294 G300 Y301 C310	L294-C296 PolarHBondContact O-N 3.01Å; C296-G300 VanDerWaalsContact CB-C 3.42Å; C296-G300 WeakPolarHBondContact CB-O 3.23Å; C296-Y301 VanDerWaalsContact SG-C 3.52Å; C296-C310 WeakPolarHBondContact CA-SG 3.15Å; C296-C310 HydrophobicContact CB-CB 3.8Å; C296-C310 WeakPolarHBondContact CB-SG 3.39Å; C296-C310 WeakPolarHBondContact SG-CB 3.16Å; C296-C310 CovalentContact SG-SG 2.02Å; C296-C310 PolarHBondContact SG-SG 2.59Å
297	Q	96.9	Very high	93.9	Very high	88 Å²	88	62.9 Å²	62.9	41%	0.411	35%	0.354	S	S	.	.			trans	-88	167.4	177.2	-58.5	-173.1	26.8	0	0	111.3	P295 D299 G300 F320	P295-Q297 PolarHBondContact O-N 3.22Å; Q297-D299 VanDerWaalsContact C-N 3.29Å; Q297-D299 PolarHBondContact O-N 2.91Å; Q297-D299 VanDerWaalsContact O-N 3.16Å; Q297-G300 PolarHBondContact O-N 3.07Å; Q297-F320 WeakPolarHBondContact CB-O 3.33Å; Q297-F320 PolarHBondContact N-O 2.93Å
298	H	95.9	Very high	94.4	Very high	23 Å²	23	68.3 Å²	68.3	11%	0.106	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	43.3	173.4	-53.1	114.1	0	0	0	114.2	G300 P313 L316 C321 F398 E422	H298-G300 PolarHBondContact O-N 3.34Å; H298-P313 VanDerWaalsContact O-CG 3.22Å; H298-P313 WeakPolarHBondContact O-CG 3.39Å; H298-L316 HydrophobicContact CB-CD1 3.36Å; H298-C321 PolarHBondContact ND1-O 3.05Å; H298-F398 HydrophobicContact CB-CB 4.26Å; H298-F398 HydrophobicContact CB-CD2 3.99Å; H298-F398 AromaticContact CD2-CD2 3.54Å; H298-F398 AromaticContact CD2-CE2 3.71Å; H298-E422 IonicContact CD2-OE2 2.96Å; H298-E422 IonicContact NE2-OE2 3.73Å; H298-E422 PolarHBondContact NE2-OE2 3.16Å
299	D	93.8	Very high	94.8	Very high	46 Å²	46	66.4 Å²	66.4	25%	0.246	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	14.5	-179.1	-56.6	-82.7	0	0	0	116.3	K279 Q297 R397 F398 D399	K279-D299 PolarHBondContact NZ-O 3.32Å; Q297-D299 VanDerWaalsContact C-N 3.29Å; Q297-D299 PolarHBondContact O-N 2.91Å; Q297-D299 VanDerWaalsContact O-N 3.16Å; D299-R397 IonicContact OD1-CZ 3.33Å; D299-R397 IonicContact OD1-NE 2.93Å; D299-R397 IonicContact OD1-NH2 3.81Å; D299-R397 PolarHBondContact OD1-NH2 3.23Å; D299-R397 VanDerWaalsContact OD2-CA 3.23Å; D299-R397 WeakPolarHBondContact OD2-CA 3.45Å; D299-R397 WeakPolarHBondContact OD2-CB 3.19Å; D299-F398 PolarHBondContact OD2-N 3.13Å; D299-D399 HydrophobicContact CB-CB 3.62Å
300	G	96.5	Very high	95.1	Very high	12 Å²	12	62.3 Å²	62.3	12%	0.124	33%	0.325	C	S	.	.			trans	-58.8	163.2	167.2	0	0	0	0	0	112.9	C296 Q297 H298 R311	C296-G300 VanDerWaalsContact CB-C 3.42Å; C296-G300 WeakPolarHBondContact CB-O 3.23Å; Q297-G300 PolarHBondContact O-N 3.07Å; H298-G300 PolarHBondContact O-N 3.34Å; G300-R311 WeakPolarHBondContact CA-O 3.48Å
301	Y	95.3	Very high	95.3	Very high	25 Å²	25	62.9 Å²	62.9	10%	0.098	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	167.3	175.5	65.1	-85	0	0	0	110.1	F275 K279 N282 C296 D303 C310 R311	F275-Y301 HydrophobicContact CD2-CE1 4.4Å; F275-Y301 AromaticContact CE1-CD1 4Å; F275-Y301 HydrophobicContact CE1-CD1 4Å; F275-Y301 AromaticContact CE1-CE1 3.86Å; F275-Y301 HydrophobicContact CE1-CE1 3.86Å; F275-Y301 HydrophobicContact CE2-CD1 4.12Å; F275-Y301 AromaticContact CE2-CE1 3.62Å; F275-Y301 HydrophobicContact CE2-CE1 3.62Å; F275-Y301 AromaticContact CZ-CD1 3.43Å; F275-Y301 HydrophobicContact CZ-CD1 3.43Å; F275-Y301 VanDerWaalsContact CZ-CD1 3.43Å; F275-Y301 AromaticContact CZ-CE1 3.32Å; F275-Y301 HydrophobicContact CZ-CE1 3.32Å; K279-Y301 HydrophobicContact CB-CD1 4.37Å; K279-Y301 HydrophobicContact CB-CE1 3.75Å; K279-Y301 HydrophobicContact CD-CD1 3.77Å; K279-Y301 HydrophobicContact CD-CE1 3.98Å; K279-Y301 HydrophobicContact CG-CD1 3.86Å; K279-Y301 HydrophobicContact CG-CE1 3.76Å; K279-Y301 HydrophobicContact CG-CG 4.45Å; N282-Y301 HydrophobicContact CB-CE2 4.28Å; N282-Y301 PolarHBondContact ND2-OH 3Å; C296-Y301 VanDerWaalsContact SG-C 3.52Å; Y301-D303 PolarHBondContact O-N 3.35Å; Y301-C310 CarbonylContact O-C 3.28Å; Y301-C310 VanDerWaalsContact O-CA 3.25Å; Y301-C310 WeakPolarHBondContact O-CA 3.45Å; Y301-R311 HydrophobicContact CE1-CB 4.4Å; Y301-R311 HydrophobicContact CE1-CG 4.08Å; Y301-R311 HydrophobicContact CE2-CB 4.35Å; Y301-R311 PolarHBondContact N-O 2.83Å; Y301-R311 PolarHBondContact O-N 2.86Å; Y301-R311 VanDerWaalsContact OH-CD 3.23Å; Y301-R311 WeakPolarHBondContact OH-CD 3.21Å
302	E	96.6	Very high	95.6	Very high	41 Å²	41	55 Å²	55	19%	0.192	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	132.2	-178.5	-62.7	74.3	-165.1	0	0	111.4	C290 T293 L294 V304	C290-E302 HydrophobicContact CB-CB 3.96Å; C290-E302 HydrophobicContact CB-CG 4.28Å; T293-E302 WeakPolarHBondContact CA-OE1 3.34Å; T293-E302 WeakPolarHBondContact CG2-OE1 3.32Å; L294-E302 HydrophobicContact CB-CG 4.24Å; L294-E302 HydrophobicContact CD1-CG 4.34Å; L294-E302 HydrophobicContact CG-CG 4.08Å; L294-E302 PolarHBondContact N-OE1 2.83Å; E302-V304 PolarHBondContact O-N 3.41Å; E302-V304 VanDerWaalsContact O-N 3.11Å
303	D	96.5	Very high	96	Very high	12 Å²	12	50.4 Å²	50.4	6%	0.064	26%	0.261	C	S	.	.			trans	-71.8	108.9	174.2	-169.2	-20.2	0	0	0	109.3	Y301 N305 D306 C307 K309 R311	Y301-D303 PolarHBondContact O-N 3.35Å; D303-N305 PolarHBondContact O-N 3.38Å; D303-N305 PolarHBondContact OD1-N 3.46Å; D303-D306 CarbonylContact O-C 3.55Å; D303-D306 WeakPolarHBondContact O-CA 3.45Å; D303-D306 PolarHBondContact O-N 2.94Å; D303-C307 PolarHBondContact O-N 3.1Å; D303-K309 HydrophobicContact CB-CG 4.16Å; D303-K309 WeakPolarHBondContact CB-O 3.47Å; D303-K309 PolarHBondContact N-O 3.37Å; D303-K309 WeakPolarHBondContact OD2-CE 3.48Å; D303-R311 HydrophobicContact CB-CB 4.12Å; D303-R311 VanDerWaalsContact CG-NH1 3.31Å; D303-R311 IonicContact OD1-NH1 3.64Å; D303-R311 PolarHBondContact OD1-NH1 2.8Å; D303-R311 IonicContact OD2-CZ 3.8Å; D303-R311 IonicContact OD2-NH1 3.55Å; D303-R311 PolarHBondContact OD2-NH1 2.9Å
304	V	95.4	Very high	96.2	Very high	22 Å²	22	46.2 Å²	46.2	13%	0.133	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-12.9	-178.7	-60.2	0	0	0	0	114.2	C131 N282 C286 K289 E302	C131-V304 HydrophobicContact CB-CB 4.24Å; C131-V304 HydrophobicContact CB-CG2 4.07Å; C131-V304 VanDerWaalsContact N-CG2 3.32Å; N282-V304 HydrophobicContact CB-CG1 4.35Å; N282-V304 WeakPolarHBondContact OD1-CG2 3.36Å; C286-V304 HydrophobicContact CB-CB 4.26Å; C286-V304 HydrophobicContact CB-CG1 3.84Å; K289-V304 HydrophobicContact CB-CB 4.36Å; E302-V304 PolarHBondContact O-N 3.41Å; E302-V304 VanDerWaalsContact O-N 3.11Å
305	N	94.5	Very high	96.2	Very high	68 Å²	68	44.7 Å²	44.7	36%	0.364	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-15	172	-72.5	-51.7	0	0	0	112.8	Q127 E128 T130 K133 D303	Q127-N305 PolarHBondContact O-ND2 2.86Å; E128-N305 PolarHBondContact O-ND2 3.08Å; E128-N305 VanDerWaalsContact O-ND2 3.09Å; T130-N305 PolarHBondContact O-ND2 3.24Å; T130-N305 PolarHBondContact O-OD1 2.88Å; K133-N305 PolarHBondContact NZ-OD1 2.79Å; D303-N305 PolarHBondContact O-N 3.38Å; D303-N305 PolarHBondContact OD1-N 3.46Å
306	D	95.3	Very high	96.2	Very high	45 Å²	45	40.6 Å²	40.6	24%	0.241	20%	0.198	C	C	.	.			trans	-153.4	89.1	172.9	-173.6	-3.6	0	0	0	110.5	D303 R308 K309	D303-D306 CarbonylContact O-C 3.55Å; D303-D306 WeakPolarHBondContact O-CA 3.45Å; D303-D306 PolarHBondContact O-N 2.94Å; D306-R308 PolarHBondContact O-N 3.23Å; D306-R308 WeakPolarHBondContact OD1-CB 3.44Å; D306-R308 IonicContact OD1-CZ 3.89Å; D306-R308 PolarHBondContact OD1-N 2.98Å; D306-R308 IonicContact OD1-NE 3.66Å; D306-R308 PolarHBondContact OD1-NE 3.42Å; D306-R308 IonicContact OD1-NH2 3.49Å; D306-R308 PolarHBondContact OD1-NH2 3.29Å; D306-R308 IonicContact OD2-CZ 2.98Å; D306-R308 IonicContact OD2-NE 2.62Å; D306-R308 IonicContact OD2-NH2 3.72Å; D306-R308 PolarHBondContact OD2-NH2 2.93Å; D306-K309 HydrophobicContact CB-CG 4.31Å; D306-K309 PolarHBondContact O-N 3.03Å; D306-K309 VanDerWaalsContact O-N 3.17Å
307	C	95.7	Very high	96.2	Very high	47 Å²	47	39.8 Å²	39.8	32%	0.318	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	9.6	-174.9	-61.5	0	0	0	0	115.3	C290 D303	C290-C307 WeakPolarHBondContact CA-SG 3.42Å; C290-C307 HydrophobicContact CB-CB 3.72Å; C290-C307 WeakPolarHBondContact CB-SG 3.24Å; C290-C307 VanDerWaalsContact SG-CA 3.56Å; C290-C307 WeakPolarHBondContact SG-CB 3.15Å; C290-C307 CovalentContact SG-SG 2.05Å; C290-C307 PolarHBondContact SG-SG 3.13Å; D303-C307 PolarHBondContact O-N 3.1Å
308	R	95.2	Very high	96	Very high	196 Å²	196	36.9 Å²	36.9	74%	0.74	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-7	175	-59.1	171.9	-62.6	168.4	8.7	112.8	D306	D306-R308 PolarHBondContact O-N 3.23Å; D306-R308 WeakPolarHBondContact OD1-CB 3.44Å; D306-R308 IonicContact OD1-CZ 3.89Å; D306-R308 PolarHBondContact OD1-N 2.98Å; D306-R308 IonicContact OD1-NE 3.66Å; D306-R308 PolarHBondContact OD1-NE 3.42Å; D306-R308 IonicContact OD1-NH2 3.49Å; D306-R308 PolarHBondContact OD1-NH2 3.29Å; D306-R308 IonicContact OD2-CZ 2.98Å; D306-R308 IonicContact OD2-NE 2.62Å; D306-R308 IonicContact OD2-NH2 3.72Å; D306-R308 PolarHBondContact OD2-NH2 2.93Å
309	K	96	Very high	96	Very high	89 Å²	89	38.9 Å²	38.9	39%	0.387	21%	0.205	S	C	.	.	S	Bend	trans	-138.8	163.3	179.1	65	175.2	-177.3	176.1	0	111.5	D303 D306	D303-K309 HydrophobicContact CB-CG 4.16Å; D303-K309 WeakPolarHBondContact CB-O 3.47Å; D303-K309 PolarHBondContact N-O 3.37Å; D303-K309 WeakPolarHBondContact OD2-CE 3.48Å; D306-K309 HydrophobicContact CB-CG 4.31Å; D306-K309 PolarHBondContact O-N 3.03Å; D306-K309 VanDerWaalsContact O-N 3.17Å
310	C	97.7	Very high	96.1	Very high	6 Å²	6	40.1 Å²	40.1	4%	0.041	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	145.8	172.2	-58.8	0	0	0	0	111.2	C296 Y301 S319 C321	C296-C310 WeakPolarHBondContact CA-SG 3.15Å; C296-C310 HydrophobicContact CB-CB 3.8Å; C296-C310 WeakPolarHBondContact CB-SG 3.39Å; C296-C310 WeakPolarHBondContact SG-CB 3.16Å; C296-C310 CovalentContact SG-SG 2.02Å; C296-C310 PolarHBondContact SG-SG 2.59Å; Y301-C310 CarbonylContact O-C 3.28Å; Y301-C310 VanDerWaalsContact O-CA 3.25Å; Y301-C310 WeakPolarHBondContact O-CA 3.45Å; C310-S319 PolarHBondContact N-O 3.13Å; C310-C321 WeakPolarHBondContact CB-SG 3.4Å
311	R	97	Very high	96.2	Very high	38 Å²	38	39.6 Å²	39.6	14%	0.143	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	123.2	158.9	168.4	152.8	-96.9	116.1	-2.4	108.2	E128 N129 F275 G300 Y301 D303	E128-R311 PolarHBondContact O-NH1 3.09Å; E128-R311 PolarHBondContact O-NH2 2.78Å; N129-R311 PolarHBondContact OD1-NE 3.33Å; N129-R311 VanDerWaalsContact OD1-NE 3.09Å; N129-R311 PolarHBondContact OD1-NH2 2.84Å; F275-R311 HydrophobicContact CD2-CG 4.28Å; F275-R311 HydrophobicContact CE2-CG 3.71Å; F275-R311 WeakPolarHBondContact CE2-O 3.35Å; G300-R311 WeakPolarHBondContact CA-O 3.48Å; Y301-R311 HydrophobicContact CE1-CB 4.4Å; Y301-R311 HydrophobicContact CE1-CG 4.08Å; Y301-R311 HydrophobicContact CE2-CB 4.35Å; Y301-R311 PolarHBondContact N-O 2.83Å; Y301-R311 PolarHBondContact O-N 2.86Å; Y301-R311 VanDerWaalsContact OH-CD 3.23Å; Y301-R311 WeakPolarHBondContact OH-CD 3.21Å; D303-R311 HydrophobicContact CB-CB 4.12Å; D303-R311 VanDerWaalsContact CG-NH1 3.31Å; D303-R311 IonicContact OD1-NH1 3.64Å; D303-R311 PolarHBondContact OD1-NH1 2.8Å; D303-R311 IonicContact OD2-CZ 3.8Å; D303-R311 IonicContact OD2-NH1 3.55Å; D303-R311 PolarHBondContact OD2-NH1 2.9Å
312	C	97.8	Very high	96.2	Very high	26 Å²	26	41.2 Å²	41.2	18%	0.176	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-100.7	146.6	-171.3	-56.8	0	0	0	0	113	F275 L316 C321	F275-C312 VanDerWaalsContact CD2-O 3.3Å; F275-C312 WeakPolarHBondContact CD2-O 3.27Å; F275-C312 VanDerWaalsContact CE2-O 3.23Å; F275-C312 WeakPolarHBondContact CE2-O 3.37Å; C312-L316 HydrophobicContact CB-CB 4.28Å; C312-L316 VanDerWaalsContact CB-O 3.26Å; C312-L316 WeakPolarHBondContact CB-O 3.4Å; C312-C321 WeakPolarHBondContact CA-SG 3.43Å; C312-C321 HydrophobicContact CB-CB 3.67Å; C312-C321 WeakPolarHBondContact CB-SG 3.45Å; C312-C321 WeakPolarHBondContact SG-CA 3.28Å; C312-C321 WeakPolarHBondContact SG-CB 3.33Å; C312-C321 CovalentContact SG-SG 2.04Å; C312-C321 PolarHBondContact SG-SG 3.45Å
313	P	97.7	Very high	96.2	Very high	1 Å²	1	45 Å²	45	1%	0.006	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-55.3	151.9	169	-25.6	34.5	0	0	0	112.2	F275 H298 G315 L316 F398 D399	F275-P313 HydrophobicContact CD1-CG 4.47Å; F275-P313 HydrophobicContact CE1-CG 4.08Å; F275-P313 HydrophobicContact CE2-CG 4.34Å; F275-P313 HydrophobicContact CZ-CG 3.99Å; H298-P313 VanDerWaalsContact O-CG 3.22Å; H298-P313 WeakPolarHBondContact O-CG 3.39Å; P313-G315 PolarHBondContact O-N 2.96Å; P313-L316 HydrophobicContact CB-CD1 4.29Å; P313-L316 HydrophobicContact CG-CD1 4.27Å; P313-L316 PolarHBondContact O-N 3.03Å; P313-F398 VanDerWaalsContact CB-O 3.23Å; P313-F398 WeakPolarHBondContact CB-O 2.88Å; P313-D399 HydrophobicContact CG-CB 4.19Å
314	F	96.3	Very high	96.2	Very high	35 Å²	35	44.5 Å²	44.5	15%	0.154	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	124.8	176.3	-174.5	-106	0	0	0	110.7	F389 K393 I426	F314-F389 HydrophobicContact CE1-CE2 4.11Å; F314-F389 AromaticContact CE1-CZ 3.95Å; F314-F389 HydrophobicContact CE1-CZ 3.95Å; F314-F389 HydrophobicContact CZ-CZ 4.17Å; F314-K393 PolarHBondContact O-NZ 2.86Å; F314-I426 HydrophobicContact CD1-CD1 3.58Å; F314-I426 HydrophobicContact CD1-CG2 4.34Å; F314-I426 HydrophobicContact CE1-CB 4.49Å; F314-I426 HydrophobicContact CE1-CD1 4.01Å; F314-I426 HydrophobicContact CE1-CG2 3.68Å; F314-I426 HydrophobicContact CZ-CG2 4.27Å; F314-I426 WeakPolarHBondContact O-CD1 3.5Å
315	G	96.6	Very high	96.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.1	-5.9	-176.8	0	0	0	0	0	115.4	P313 E325 S357	P313-G315 PolarHBondContact O-N 2.96Å; G315-E325 VanDerWaalsContact C-CB 3.43Å; G315-E325 WeakPolarHBondContact CA-OE2 3.49Å; G315-E325 PolarHBondContact N-OE2 3.34Å; G315-E325 PolarHBondContact O-N 3.3Å; G315-S357 WeakPolarHBondContact CA-OG 3.07Å; G315-S357 WeakPolarHBondContact O-CB 2.99Å
316	L	97.4	Very high	96.1	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.021	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	152.6	176.6	-64.8	170.2	0	0	0	111.6	H298 C312 P313 R323 L359 F398 L424	H298-L316 HydrophobicContact CB-CD1 3.36Å; C312-L316 HydrophobicContact CB-CB 4.28Å; C312-L316 VanDerWaalsContact CB-O 3.26Å; C312-L316 WeakPolarHBondContact CB-O 3.4Å; P313-L316 HydrophobicContact CB-CD1 4.29Å; P313-L316 HydrophobicContact CG-CD1 4.27Å; P313-L316 PolarHBondContact O-N 3.03Å; L316-R323 CarbonylContact C-O 3.6Å; L316-R323 WeakPolarHBondContact CA-O 3.42Å; L316-R323 WeakPolarHBondContact CD2-O 3.42Å; L316-L359 HydrophobicContact CD2-CD1 4.47Å; L316-F398 HydrophobicContact CD1-CB 3.96Å; L316-F398 HydrophobicContact CD1-CG 4.47Å; L316-L424 HydrophobicContact CD1-CD2 4.47Å; L316-L424 HydrophobicContact CD2-CD1 3.9Å; L316-L424 HydrophobicContact CD2-CD2 4.27Å; L316-L424 HydrophobicContact CG-CD1 4.41Å; L316-L424 HydrophobicContact CG-CD2 3.93Å
317	G	95.6	Very high	95.6	Very high	12 Å²	12	45.2 Å²	45.2	12%	0.124	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	-168.4	-179.5	0	0	0	0	0	112.6	C321 E322 R323	G317-C321 CarbonylContact O-C 3.55Å; G317-C321 VanDerWaalsContact O-C 3.28Å; G317-C321 WeakPolarHBondContact O-CA 3.16Å; G317-E322 PolarHBondContact O-N 3.09Å; G317-R323 PolarHBondContact N-O 3.49Å; G317-R323 WeakPolarHBondContact O-CG 3.48Å; G317-R323 PolarHBondContact O-N 3.27Å
318	G	94.3	Very high	94.8	Very high	27 Å²	27	50.8 Å²	50.8	28%	0.278	25%	0.25	S	C	.	.	S	Bend	trans	94.4	170.5	-167.4	0	0	0	0	0	111.9	F320 E322	G318-F320 PolarHBondContact O-N 2.86Å; G318-E322 WeakPolarHBondContact CA-OE1 3.29Å
319	S	94.6	Very high	94	Very high	65 Å²	65	44.3 Å²	44.3	46%	0.455	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-24.5	-177.8	-63.9	0	0	0	0	112.2	C310 E322	C310-S319 PolarHBondContact N-O 3.13Å; S319-E322 PolarHBondContact N-OE2 2.9Å
320	F	97.1	Very high	93.2	Very high	72 Å²	72	41.7 Å²	41.7	32%	0.316	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.8	17.9	-178.1	-54.7	-69.6	0	0	0	112.6	L294 P295 Q297 G318 E322	L294-F320 HydrophobicContact CB-CD1 4.36Å; L294-F320 HydrophobicContact CB-CE1 4.21Å; L294-F320 HydrophobicContact CD2-CE1 4.33Å; P295-F320 HydrophobicContact CG-CD1 3.78Å; P295-F320 HydrophobicContact CG-CE1 3.85Å; P295-F320 HydrophobicContact CG-CG 4.33Å; P295-F320 HydrophobicContact CG-CZ 4.43Å; Q297-F320 WeakPolarHBondContact CB-O 3.33Å; Q297-F320 PolarHBondContact N-O 2.93Å; G318-F320 PolarHBondContact O-N 2.86Å; F320-E322 VanDerWaalsContact CA-OE2 3.26Å; F320-E322 WeakPolarHBondContact CA-OE2 3.41Å; F320-E322 PolarHBondContact N-OE2 3.39Å; F320-E322 PolarHBondContact O-N 3.07Å
321	C	97.6	Very high	92.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	63.5	26.6	-179.3	-44.6	0	0	0	0	114.1	H298 C310 C312 G317	H298-C321 PolarHBondContact ND1-O 3.05Å; C310-C321 WeakPolarHBondContact CB-SG 3.4Å; C312-C321 WeakPolarHBondContact CA-SG 3.43Å; C312-C321 HydrophobicContact CB-CB 3.67Å; C312-C321 WeakPolarHBondContact CB-SG 3.45Å; C312-C321 WeakPolarHBondContact SG-CA 3.28Å; C312-C321 WeakPolarHBondContact SG-CB 3.33Å; C312-C321 CovalentContact SG-SG 2.04Å; C312-C321 PolarHBondContact SG-SG 3.45Å; G317-C321 CarbonylContact O-C 3.55Å; G317-C321 VanDerWaalsContact O-C 3.28Å; G317-C321 WeakPolarHBondContact O-CA 3.16Å
322	E	95.6	Very high	91.5	Very high	59 Å²	59	53.2 Å²	53.2	28%	0.276	29%	0.293	S	S	.	.			trans	-78.5	-16.5	-173	69	-78.3	-179.1	0	0	114.6	G317 G318 S319 F320 R361	G317-E322 PolarHBondContact O-N 3.09Å; G318-E322 WeakPolarHBondContact CA-OE1 3.29Å; S319-E322 PolarHBondContact N-OE2 2.9Å; F320-E322 VanDerWaalsContact CA-OE2 3.26Å; F320-E322 WeakPolarHBondContact CA-OE2 3.41Å; F320-E322 PolarHBondContact N-OE2 3.39Å; F320-E322 PolarHBondContact O-N 3.07Å; E322-R361 PolarHBondContact O-NH2 2.88Å; E322-R361 VanDerWaalsContact O-NH2 3.13Å
323	R	95.5	Very high	91	Very high	122 Å²	122	52.5 Å²	52.5	46%	0.46	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	167	-170.3	63.8	174.8	-161.6	173.4	6.5	112.1	L316 G317 E336	L316-R323 CarbonylContact C-O 3.6Å; L316-R323 WeakPolarHBondContact CA-O 3.42Å; L316-R323 WeakPolarHBondContact CD2-O 3.42Å; G317-R323 PolarHBondContact N-O 3.49Å; G317-R323 WeakPolarHBondContact O-CG 3.48Å; G317-R323 PolarHBondContact O-N 3.27Å; R323-E336 VanDerWaalsContact CA-OE1 3.3Å; R323-E336 WeakPolarHBondContact CA-OE1 3.5Å; R323-E336 WeakPolarHBondContact CB-OE1 3.39Å
324	A	96.7	Very high	90.8	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.008	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	147	170.5	0	0	0	0	0	111	V326 E336 S357 L359	A324-V326 PolarHBondContact O-N 2.85Å; A324-E336 PolarHBondContact N-OE1 3.15Å; A324-S357 WeakPolarHBondContact CB-O 3.45Å; A324-L359 HydrophobicContact CB-CB 4.24Å
325	E	95.6	Very high	90.7	Very high	41 Å²	41	52.8 Å²	52.8	19%	0.192	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-68.4	125.3	177.5	-169.1	-177.7	163.4	0	0	110.7	G315 Q327 R355	G315-E325 VanDerWaalsContact C-CB 3.43Å; G315-E325 WeakPolarHBondContact CA-OE2 3.49Å; G315-E325 PolarHBondContact N-OE2 3.34Å; G315-E325 PolarHBondContact O-N 3.3Å; E325-Q327 VanDerWaalsContact CG-NE2 3.31Å; E325-Q327 PolarHBondContact OE1-NE2 3.47Å; E325-R355 IonicContact OE1-CZ 3.49Å; E325-R355 VanDerWaalsContact OE1-CZ 3.3Å; E325-R355 IonicContact OE1-NH1 3.97Å; E325-R355 PolarHBondContact OE1-NH1 2.82Å; E325-R355 IonicContact OE1-NH2 3.65Å; E325-R355 PolarHBondContact OE1-NH2 3.16Å; E325-R355 IonicContact OE2-CZ 2.79Å; E325-R355 IonicContact OE2-NH1 2.73Å; E325-R355 IonicContact OE2-NH2 3.32Å; E325-R355 PolarHBondContact OE2-NH2 2.81Å
326	V	92.4	Very high	90.6	Very high	64 Å²	64	57.3 Å²	57.3	39%	0.388	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-99.4	124.1	171.6	-177	0	0	0	0	107.6	A324 E331	A324-V326 PolarHBondContact O-N 2.85Å; V326-E331 HydrophobicContact CG1-CB 4.39Å; V326-E331 HydrophobicContact CG1-CG 4.22Å
327	Q	85	Confident	90.6	Very high	44 Å²	44	59.5 Å²	59.5	21%	0.206	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-84.2	144.3	173.3	-57.3	-60.6	-82.8	0	0	110.3	E325 G329 E330 R355	E325-Q327 VanDerWaalsContact CG-NE2 3.31Å; E325-Q327 PolarHBondContact OE1-NE2 3.47Å; Q327-G329 PolarHBondContact O-N 3.21Å; Q327-E330 HydrophobicContact CB-CB 4.12Å; Q327-E330 HydrophobicContact CB-CG 4.3Å; Q327-E330 PolarHBondContact O-N 3.43Å; Q327-R355 HydrophobicContact CG-CB 4.18Å; Q327-R355 HydrophobicContact CG-CG 4.23Å; Q327-R355 WeakPolarHBondContact CG-O 3.4Å
328	D	79.7	Confident	90.7	Very high	164 Å²	164	62.3 Å²	62.3	88%	0.877	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	123.7	171.4	-63.5	-24.9	0	0	0	109.9	E330	D328-E330 VanDerWaalsContact C-N 3.33Å
329	G	77.6	Confident	90.8	Very high	61 Å²	61	61 Å²	61	63%	0.629	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	3	-178	0	0	0	0	0	115.6	Q327 E331	Q327-G329 PolarHBondContact O-N 3.21Å; G329-E331 VanDerWaalsContact C-OE2 3.27Å; G329-E331 WeakPolarHBondContact CA-OE1 3.36Å; G329-E331 WeakPolarHBondContact CA-OE2 3.4Å; G329-E331 PolarHBondContact N-OE1 3.49Å
330	E	79.2	Confident	90.8	Very high	34 Å²	34	63.1 Å²	63.1	16%	0.159	34%	0.337	C	S	.	.			trans	-124.9	37.9	173	-51.2	-169.5	172.8	0	0	111	Q327 D328 L332 C333 S353 R354 R355	Q327-E330 HydrophobicContact CB-CB 4.12Å; Q327-E330 HydrophobicContact CB-CG 4.3Å; Q327-E330 PolarHBondContact O-N 3.43Å; D328-E330 VanDerWaalsContact C-N 3.33Å; E330-L332 PolarHBondContact O-N 3.04Å; E330-L332 VanDerWaalsContact O-N 3.13Å; E330-C333 HydrophobicContact CB-CB 4.34Å; E330-C333 WeakPolarHBondContact O-CB 3.43Å; E330-C333 PolarHBondContact O-N 2.86Å; E330-S353 WeakPolarHBondContact OE2-CB 3.24Å; E330-R354 VanDerWaalsContact CD-N 3.28Å; E330-R354 PolarHBondContact OE1-N 3.41Å; E330-R354 PolarHBondContact OE2-N 3.47Å; E330-R354 VanDerWaalsContact OE2-N 3.15Å; E330-R355 PolarHBondContact OE2-N 2.03Å
331	E	77.5	Confident	90.7	Very high	127 Å²	127	67 Å²	67	59%	0.593	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-19.4	-173	-59.9	81.9	-179	0	0	113.8	V326 G329 C333	V326-E331 HydrophobicContact CG1-CB 4.39Å; V326-E331 HydrophobicContact CG1-CG 4.22Å; G329-E331 VanDerWaalsContact C-OE2 3.27Å; G329-E331 WeakPolarHBondContact CA-OE1 3.36Å; G329-E331 WeakPolarHBondContact CA-OE2 3.4Å; G329-E331 PolarHBondContact N-OE1 3.49Å; E331-C333 VanDerWaalsContact C-N 3.27Å
332	L	80.9	Confident	90.5	Very high	159 Å²	159	75.3 Å²	75.3	83%	0.832	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-5.5	175.8	-61.8	178	0	0	0	112.8	E330	E330-L332 PolarHBondContact O-N 3.04Å; E330-L332 VanDerWaalsContact O-N 3.13Å
333	C	89.1	Confident	90.6	Very high	10 Å²	10	74.8 Å²	74.8	7%	0.068	39%	0.385	C	S	.	.	S	Bend	trans	-111.6	137.1	-175	-156.9	0	0	0	0	113.4	E330 E331 P349 S353 C356	E330-C333 HydrophobicContact CB-CB 4.34Å; E330-C333 WeakPolarHBondContact O-CB 3.43Å; E330-C333 PolarHBondContact O-N 2.86Å; E331-C333 VanDerWaalsContact C-N 3.27Å; C333-P349 VanDerWaalsContact SG-CB 3.59Å; C333-P349 WeakPolarHBondContact SG-CG 3.45Å; C333-S353 WeakPolarHBondContact CB-OG 3.43Å; C333-C356 HydrophobicContact CB-CB 3.99Å; C333-C356 WeakPolarHBondContact CB-SG 3.4Å; C333-C356 WeakPolarHBondContact SG-CB 3.34Å; C333-C356 CovalentContact SG-SG 1.99Å; C333-C356 PolarHBondContact SG-SG 2.97Å
334	G	93.2	Very high	90.6	Very high	22 Å²	22	70.5 Å²	70.5	23%	0.227	37%	0.374	C	S	.	.			trans	93.4	-158.9	-177.3	0	0	0	0	0	113.4	S357 W358	G334-S357 CarbonylContact C-O 3.52Å; G334-S357 WeakPolarHBondContact CA-O 3.4Å; G334-W358 VanDerWaalsContact C-CD1 3.42Å; G334-W358 VanDerWaalsContact CA-NE1 3.27Å; G334-W358 PolarHBondContact O-NE1 2.91Å
335	G	94	Very high	90.6	Very high	20 Å²	20	76.3 Å²	76.3	21%	0.206	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	114.1	-179.8	173.2	0	0	0	0	0	114.9	S357 W358 L359	G335-S357 PolarHBondContact N-O 3.38Å; G335-W358 VanDerWaalsContact O-CA 3.24Å; G335-W358 WeakPolarHBondContact O-CA 3.43Å; G335-L359 PolarHBondContact O-N 2.67Å; G335-L359 VanDerWaalsContact O-N 3.09Å
336	E	95	Very high	90.6	Very high	96 Å²	96	75 Å²	75	45%	0.449	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	126.3	179.3	-62.6	67	-144.7	0	0	110.6	R323 A324 L359	R323-E336 VanDerWaalsContact CA-OE1 3.3Å; R323-E336 WeakPolarHBondContact CA-OE1 3.5Å; R323-E336 WeakPolarHBondContact CB-OE1 3.39Å; A324-E336 PolarHBondContact N-OE1 3.15Å; E336-L359 WeakPolarHBondContact CA-O 3.44Å; E336-L359 HydrophobicContact CG-CB 4.46Å
337	L	96.4	Very high	90.7	Very high	49 Å²	49	78.5 Å²	78.5	26%	0.257	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137.6	177.8	-56.8	177.5	0	0	0	110.4	L346 W358 L359 L360 R361	L337-L346 HydrophobicContact CD1-CD1 4.24Å; L337-W358 HydrophobicContact CD1-CB 4.43Å; L337-W358 HydrophobicContact CD1-CG 4.26Å; L337-L359 PolarHBondContact N-O 2.83Å; L337-L360 HydrophobicContact CB-CD2 3.72Å; L337-L360 HydrophobicContact CD1-CD2 3.78Å; L337-L360 HydrophobicContact CG-CD2 4.18Å; L337-L360 CarbonylContact O-C 3.59Å; L337-L360 WeakPolarHBondContact O-CA 3.34Å; L337-R361 PolarHBondContact O-N 2.76Å
338	T	96.8	Very high	91	Very high	72 Å²	72	77.7 Å²	77.7	44%	0.442	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127.1	174.6	-51.2	0	0	0	0	110.7	R361 G363	T338-R361 CarbonylContact C-O 3.59Å; T338-R361 WeakPolarHBondContact CA-O 3.28Å; T338-G363 VanDerWaalsContact CG2-CA 3.41Å
339	A	96.7	Very high	91.4	Very high	0 Å²	0	71 Å²	71	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	121.7	172.3	0	0	0	0	0	109.5	R361 G363 V369 Y441 S443	A339-R361 PolarHBondContact N-O 3.1Å; A339-G363 PolarHBondContact O-N 2.61Å; A339-V369 HydrophobicContact CB-CG1 4.33Å; A339-V369 HydrophobicContact CB-CG2 4.19Å; A339-Y441 HydrophobicContact CB-CD2 3.76Å; A339-Y441 HydrophobicContact CB-CE2 4.05Å; A339-S443 VanDerWaalsContact O-CB 3.25Å; A339-S443 WeakPolarHBondContact O-CB 3.39Å
340	H	95.9	Very high	91.8	Very high	108 Å²	108	75.3 Å²	75.3	50%	0.5	38%	0.381	S	S	.	.			trans	-104.5	174.8	172.4	-59.1	-70	0	0	0	110.1	K342 R442 S443	H340-K342 PolarHBondContact O-N 3.29Å; H340-R442 CarbonylContact O-C 3.56Å; H340-R442 VanDerWaalsContact O-CA 3.31Å; H340-R442 WeakPolarHBondContact O-CA 3.44Å; H340-R442 WeakPolarHBondContact O-CB 3.23Å; H340-S443 PolarHBondContact O-N 3.1Å
341	R	93.6	Very high	92	Very high	154 Å²	154	77.7 Å²	77.7	58%	0.581	40%	0.395	S	S	*	.	S	Bend	trans	-60.6	-29.5	177.2	-58.4	-169.5	179	179.3	-1	113.8	E364 Q445	R341-E364 WeakPolarHBondContact CD-OE1 3.14Å; R341-E364 WeakPolarHBondContact CG-OE1 3.37Å; R341-E364 IonicContact CZ-OE1 3.41Å; R341-E364 IonicContact CZ-OE2 3.07Å; R341-E364 IonicContact NE-OE1 3.19Å; R341-E364 PolarHBondContact NE-OE1 3.37Å; R341-E364 IonicContact NE-OE2 3.25Å; R341-E364 PolarHBondContact NE-OE2 3.42Å; R341-E364 IonicContact NH2-OE1 2.74Å; R341-E364 IonicContact NH2-OE2 2.79Å; R341-E364 PolarHBondContact NH2-OE2 3.15Å; R341-Q445 VanDerWaalsContact NH2-NE2 3.16Å
342	K	94.9	Very high	92.3	Very high	174 Å²	174	74.4 Å²	74.4	76%	0.757	40%	0.395	S	S	*	.	S	Bend	trans	-76.9	141.1	175.3	-173.5	177.8	177.4	-177.7	0	109.4	H340 S344	H340-K342 PolarHBondContact O-N 3.29Å; K342-S344 PolarHBondContact O-N 3.36Å
343	D	96	Very high	92.5	Very high	48 Å²	48	67.4 Å²	67.4	26%	0.257	36%	0.36	S	S	.	.			trans	-56.4	126.2	174.5	-69.5	-10.6	0	0	0	111	R440 R442	D343-R440 HydrophobicContact CB-CG 3.97Å; D343-R440 VanDerWaalsContact OD2-CD 3.3Å; D343-R440 WeakPolarHBondContact OD2-CD 3.47Å; D343-R440 IonicContact OD2-CZ 3.58Å; D343-R440 IonicContact OD2-NE 2.86Å; D343-R440 IonicContact OD2-NH1 3.78Å; D343-R440 PolarHBondContact OD2-NH1 3.01Å; D343-R442 WeakPolarHBondContact OD1-CD 3.39Å; D343-R442 IonicContact OD1-NH1 3.73Å
344	S	97.2	Very high	92.4	Very high	32 Å²	32	74.2 Å²	74.2	22%	0.224	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	160.9	166.7	-68.5	0	0	0	0	109.5	K342 R440 Y441	K342-S344 PolarHBondContact O-N 3.36Å; S344-R440 CarbonylContact O-C 3.6Å; S344-R440 WeakPolarHBondContact O-CA 3.05Å; S344-Y441 WeakPolarHBondContact CB-OH 3.2Å; S344-Y441 PolarHBondContact N-O 3.28Å; S344-Y441 PolarHBondContact O-N 2.91Å
345	F	96.4	Very high	92.4	Very high	123 Å²	123	74.8 Å²	74.8	54%	0.539	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	138.9	-177	-64.4	-89.2	0	0	0	111.1	V374 L439 R440	F345-V374 HydrophobicContact CE1-CG2 4.41Å; F345-L439 CarbonylContact C-O 3.52Å; F345-L439 VanDerWaalsContact CA-O 3.31Å; F345-L439 WeakPolarHBondContact CA-O 3.46Å; F345-R440 HydrophobicContact CD1-CB 4.16Å; F345-R440 HydrophobicContact CD1-CG 4.42Å; F345-R440 HydrophobicContact CE1-CB 4.01Å; F345-R440 HydrophobicContact CE1-CG 3.99Å; F345-R440 HydrophobicContact CZ-CG 4.34Å
346	L	95.1	Very high	92.5	Very high	13 Å²	13	73.9 Å²	73.9	7%	0.068	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	133.6	171.4	173.7	62.8	0	0	0	108	L337 W358 V425 F437 A438 L439 Y441	L337-L346 HydrophobicContact CD1-CD1 4.24Å; L346-W358 HydrophobicContact CD1-CD2 3.82Å; L346-W358 VanDerWaalsContact CD1-CE2 3.48Å; L346-W358 HydrophobicContact CD1-CE3 4.45Å; L346-W358 HydrophobicContact CD1-CG 4.11Å; L346-W358 HydrophobicContact CD1-CH2 4.43Å; L346-W358 HydrophobicContact CD1-CZ2 3.84Å; L346-W358 HydrophobicContact CD2-CB 4.19Å; L346-W358 HydrophobicContact CD2-CD2 3.7Å; L346-W358 HydrophobicContact CD2-CE3 3.82Å; L346-W358 HydrophobicContact CD2-CG 3.87Å; L346-W358 HydrophobicContact CD2-CZ3 4.42Å; L346-W358 HydrophobicContact CG-CD2 4.35Å; L346-V425 HydrophobicContact CD2-CB 4.36Å; L346-V425 HydrophobicContact CD2-CG1 4.1Å; L346-F437 HydrophobicContact CD2-CE2 4.42Å; L346-F437 HydrophobicContact CG-CE2 4.13Å; L346-F437 HydrophobicContact CG-CZ 4.45Å; L346-A438 CarbonylContact O-C 3.45Å; L346-A438 WeakPolarHBondContact O-CA 3.32Å; L346-L439 HydrophobicContact CB-CB 4.34Å; L346-L439 HydrophobicContact CD2-CD1 4.27Å; L346-L439 PolarHBondContact N-O 2.92Å; L346-L439 PolarHBondContact O-N 2.81Å; L346-Y441 HydrophobicContact CB-CD1 4.31Å; L346-Y441 HydrophobicContact CB-CE1 4.1Å
347	K	93.6	Very high	92.6	Very high	139 Å²	139	69.3 Å²	69.3	60%	0.604	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.7	165.6	-176.7	-64.7	-174.9	179.6	-177.3	0	110.5	F437 A438	K347-F437 WeakPolarHBondContact CA-O 3.08Å; K347-A438 HydrophobicContact CG-CB 4.12Å
348	T	91.3	Very high	92.7	Very high	27 Å²	27	67.7 Å²	67.7	17%	0.166	34%	0.339	C	S	.	.			trans	-50.6	138.2	168.5	-62.4	0	0	0	0	111.1	F427 S435 E436 F437	T348-F427 HydrophobicContact CG2-CE1 4.36Å; T348-F427 HydrophobicContact CG2-CE2 4.44Å; T348-F427 HydrophobicContact CG2-CZ 3.92Å; T348-S435 VanDerWaalsContact CG2-O 3.27Å; T348-S435 WeakPolarHBondContact CG2-O 3.43Å; T348-E436 VanDerWaalsContact OG1-CA 3.27Å; T348-E436 WeakPolarHBondContact OG1-CA 3.25Å; T348-F437 PolarHBondContact N-O 3.1Å; T348-F437 WeakPolarHBondContact OG1-CD1 3.08Å; T348-F437 PolarHBondContact OG1-N 2.82Å; T348-F437 PolarHBondContact OG1-O 3.23Å
349	P	89.7	Confident	92.7	Very high	24 Å²	24	64.3 Å²	64.3	16%	0.156	32%	0.318	C	S	.	.			trans	-60.5	140.3	174.1	-18.2	31.5	0	0	0	111.5	C333 D351 C356 W358 F427	C333-P349 VanDerWaalsContact SG-CB 3.59Å; C333-P349 WeakPolarHBondContact SG-CG 3.45Å; P349-D351 WeakPolarHBondContact CB-OD1 3.19Å; P349-C356 HydrophobicContact CG-CB 4.43Å; P349-C356 WeakPolarHBondContact CG-SG 3.21Å; P349-W358 HydrophobicContact CG-CH2 4.18Å; P349-W358 HydrophobicContact CG-CZ2 4.32Å; P349-F427 HydrophobicContact CG-CD1 4.44Å
350	T	85.5	Confident	92.7	Very high	150 Å²	150	64.3 Å²	64.3	92%	0.92	32%	0.318	S	S	*	.	S	Bend	trans	-96	-6.7	-178.6	55.1	0	0	0	0	113.3	G352	T350-G352 VanDerWaalsContact C-N 3.31Å
351	D	83.4	Confident	92.7	Very high	85 Å²	85	63.2 Å²	63.2	46%	0.455	31%	0.309	S	S	.	.	S	Bend	trans	-83.6	-4.6	179	56.8	0.8	0	0	0	113.5	P349 S353	P349-D351 WeakPolarHBondContact CB-OD1 3.19Å; D351-S353 WeakPolarHBondContact OD1-CB 2.98Å; D351-S353 PolarHBondContact OD1-N 3.39Å; D351-S353 PolarHBondContact OD1-OG 3.44Å; D351-S353 VanDerWaalsContact OD1-OG 3.1Å; D351-S353 PolarHBondContact OD2-OG 3.18Å
352	G	82.9	Confident	92.8	Very high	58 Å²	58	56.7 Å²	56.7	60%	0.598	29%	0.287	S	S	*	.			trans	85.5	10.4	-178.4	0	0	0	0	0	114.2	T350 R354	T350-G352 VanDerWaalsContact C-N 3.31Å; G352-R354 PolarHBondContact O-N 3.22Å
353	S	85.4	Confident	92.7	Very high	12 Å²	12	50.5 Å²	50.5	8%	0.084	27%	0.273	C	S	.	.			trans	-53.5	134.5	172.7	-71.8	0	0	0	0	111.5	E330 C333 D351 C356	E330-S353 WeakPolarHBondContact OE2-CB 3.24Å; C333-S353 WeakPolarHBondContact CB-OG 3.43Å; D351-S353 WeakPolarHBondContact OD1-CB 2.98Å; D351-S353 PolarHBondContact OD1-N 3.39Å; D351-S353 PolarHBondContact OD1-OG 3.44Å; D351-S353 VanDerWaalsContact OD1-OG 3.1Å; D351-S353 PolarHBondContact OD2-OG 3.18Å; S353-C356 VanDerWaalsContact CB-SG 3.55Å
354	R	88.2	Confident	92.3	Very high	153 Å²	153	50.7 Å²	50.7	58%	0.577	27%	0.273	S	S	*	.	S	Bend	trans	-95	-22.6	-174.5	-64.4	-176.4	-179	179.8	1.2	112.3	E330 G352 E428 S429	E330-R354 VanDerWaalsContact CD-N 3.28Å; E330-R354 PolarHBondContact OE1-N 3.41Å; E330-R354 PolarHBondContact OE2-N 3.47Å; E330-R354 VanDerWaalsContact OE2-N 3.15Å; G352-R354 PolarHBondContact O-N 3.22Å; R354-E428 CarbonylContact O-C 3.55Å; R354-E428 WeakPolarHBondContact O-CA 3.36Å; R354-S429 WeakPolarHBondContact CA-OG 3.47Å; R354-S429 WeakPolarHBondContact CB-OG 3.37Å; R354-S429 PolarHBondContact O-N 3.06Å; R354-S429 PolarHBondContact O-OG 2.86Å
355	R	93.2	Very high	91.6	Very high	34 Å²	34	54.7 Å²	54.7	13%	0.128	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	116.7	-177.4	-178.8	175.2	176.4	-132.2	-11.1	112.7	E325 Q327 E330 F427	E325-R355 IonicContact OE1-CZ 3.49Å; E325-R355 VanDerWaalsContact OE1-CZ 3.3Å; E325-R355 IonicContact OE1-NH1 3.97Å; E325-R355 PolarHBondContact OE1-NH1 2.82Å; E325-R355 IonicContact OE1-NH2 3.65Å; E325-R355 PolarHBondContact OE1-NH2 3.16Å; E325-R355 IonicContact OE2-CZ 2.79Å; E325-R355 IonicContact OE2-NH1 2.73Å; E325-R355 IonicContact OE2-NH2 3.32Å; E325-R355 PolarHBondContact OE2-NH2 2.81Å; Q327-R355 HydrophobicContact CG-CB 4.18Å; Q327-R355 HydrophobicContact CG-CG 4.23Å; Q327-R355 WeakPolarHBondContact CG-O 3.4Å; E330-R355 PolarHBondContact OE2-N 2.03Å; R355-F427 CarbonylContact C-O 3.48Å; R355-F427 WeakPolarHBondContact CA-O 3.13Å
356	C	95.3	Very high	90.9	Very high	1 Å²	1	56 Å²	56	1%	0.007	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	147.4	-175.5	-51.8	0	0	0	0	111.3	C333 P349 S353 W358 I426 F427	C333-C356 HydrophobicContact CB-CB 3.99Å; C333-C356 WeakPolarHBondContact CB-SG 3.4Å; C333-C356 WeakPolarHBondContact SG-CB 3.34Å; C333-C356 CovalentContact SG-SG 1.99Å; C333-C356 PolarHBondContact SG-SG 2.97Å; P349-C356 HydrophobicContact CG-CB 4.43Å; P349-C356 WeakPolarHBondContact CG-SG 3.21Å; S353-C356 VanDerWaalsContact CB-SG 3.55Å; C356-W358 HydrophobicContact CB-CE3 4.35Å; C356-W358 HydrophobicContact CB-CH2 3.27Å; C356-W358 HydrophobicContact CB-CZ2 3.66Å; C356-W358 HydrophobicContact CB-CZ3 3.65Å; C356-I426 CarbonylContact O-C 3.57Å; C356-I426 WeakPolarHBondContact O-CA 3.5Å; C356-F427 PolarHBondContact N-O 3.35Å; C356-F427 PolarHBondContact O-N 3.44Å
357	S	97.2	Very high	90.8	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	132.4	-179.8	-48.9	0	0	0	0	110	G315 A324 G334 G335 V425	G315-S357 WeakPolarHBondContact CA-OG 3.07Å; G315-S357 WeakPolarHBondContact O-CB 2.99Å; A324-S357 WeakPolarHBondContact CB-O 3.45Å; G334-S357 CarbonylContact C-O 3.52Å; G334-S357 WeakPolarHBondContact CA-O 3.4Å; G335-S357 PolarHBondContact N-O 3.38Å; S357-V425 CarbonylContact C-O 3.5Å; S357-V425 WeakPolarHBondContact CA-O 3.08Å
358	W	97.6	Very high	90.9	Very high	15 Å²	15	50.6 Å²	50.6	6%	0.057	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.2	178.1	-61.9	-89.5	0	0	0	110.8	G334 G335 L337 L346 P349 C356 L360 L424 V425 F427 F437	G334-W358 VanDerWaalsContact C-CD1 3.42Å; G334-W358 VanDerWaalsContact CA-NE1 3.27Å; G334-W358 PolarHBondContact O-NE1 2.91Å; G335-W358 VanDerWaalsContact O-CA 3.24Å; G335-W358 WeakPolarHBondContact O-CA 3.43Å; L337-W358 HydrophobicContact CD1-CB 4.43Å; L337-W358 HydrophobicContact CD1-CG 4.26Å; L346-W358 HydrophobicContact CD1-CD2 3.82Å; L346-W358 VanDerWaalsContact CD1-CE2 3.48Å; L346-W358 HydrophobicContact CD1-CE3 4.45Å; L346-W358 HydrophobicContact CD1-CG 4.11Å; L346-W358 HydrophobicContact CD1-CH2 4.43Å; L346-W358 HydrophobicContact CD1-CZ2 3.84Å; L346-W358 HydrophobicContact CD2-CB 4.19Å; L346-W358 HydrophobicContact CD2-CD2 3.7Å; L346-W358 HydrophobicContact CD2-CE3 3.82Å; L346-W358 HydrophobicContact CD2-CG 3.87Å; L346-W358 HydrophobicContact CD2-CZ3 4.42Å; L346-W358 HydrophobicContact CG-CD2 4.35Å; P349-W358 HydrophobicContact CG-CH2 4.18Å; P349-W358 HydrophobicContact CG-CZ2 4.32Å; C356-W358 HydrophobicContact CB-CE3 4.35Å; C356-W358 HydrophobicContact CB-CH2 3.27Å; C356-W358 HydrophobicContact CB-CZ2 3.66Å; C356-W358 HydrophobicContact CB-CZ3 3.65Å; W358-L360 HydrophobicContact CB-CD2 4.2Å; W358-L424 WeakPolarHBondContact O-CD1 3.18Å; W358-V425 HydrophobicContact CB-CB 4.45Å; W358-V425 HydrophobicContact CE3-CB 4.38Å; W358-V425 HydrophobicContact CE3-CG1 4.15Å; W358-V425 PolarHBondContact N-O 2.97Å; W358-V425 PolarHBondContact O-N 2.95Å; W358-F427 HydrophobicContact CH2-CB 4.15Å; W358-F427 HydrophobicContact CZ3-CB 3.72Å; W358-F437 HydrophobicContact CH2-CE1 4.37Å; W358-F437 AromaticContact CH2-CZ 3.85Å; W358-F437 HydrophobicContact CH2-CZ 3.85Å; W358-F437 HydrophobicContact CZ3-CE1 4.46Å; W358-F437 AromaticContact CZ3-CZ 3.81Å; W358-F437 HydrophobicContact CZ3-CZ 3.81Å
359	L	97.3	Very high	91.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	102.1	171	-177.5	61.6	0	0	0	108.5	L316 A324 G335 E336 L337 R361 E422 L424	L316-L359 HydrophobicContact CD2-CD1 4.47Å; A324-L359 HydrophobicContact CB-CB 4.24Å; G335-L359 PolarHBondContact O-N 2.67Å; G335-L359 VanDerWaalsContact O-N 3.09Å; E336-L359 WeakPolarHBondContact CA-O 3.44Å; E336-L359 HydrophobicContact CG-CB 4.46Å; L337-L359 PolarHBondContact N-O 2.83Å; L359-R361 HydrophobicContact CG-CG 4.29Å; L359-E422 HydrophobicContact CD1-CB 4.33Å; L359-L424 HydrophobicContact CB-CD1 4.39Å; L359-L424 HydrophobicContact CD1-CD1 4.44Å
360	L	97.3	Very high	91.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	124.8	177	-49.4	-176.7	0	0	0	108.9	L337 W358 V369 L371 E422 M423 V425 Y441	L337-L360 HydrophobicContact CB-CD2 3.72Å; L337-L360 HydrophobicContact CD1-CD2 3.78Å; L337-L360 HydrophobicContact CG-CD2 4.18Å; L337-L360 CarbonylContact O-C 3.59Å; L337-L360 WeakPolarHBondContact O-CA 3.34Å; W358-L360 HydrophobicContact CB-CD2 4.2Å; L360-V369 HydrophobicContact CB-CG1 4.12Å; L360-V369 HydrophobicContact CB-CG2 4.39Å; L360-V369 HydrophobicContact CD1-CG1 4.08Å; L360-L371 HydrophobicContact CD1-CD1 3.76Å; L360-E422 CarbonylContact O-C 3.49Å; L360-E422 VanDerWaalsContact O-CA 3.25Å; L360-E422 WeakPolarHBondContact O-CA 3.38Å; L360-M423 HydrophobicContact CB-CB 4.34Å; L360-M423 WeakPolarHBondContact CB-O 3.23Å; L360-M423 PolarHBondContact N-O 2.9Å; L360-M423 PolarHBondContact O-N 2.96Å; L360-V425 HydrophobicContact CD1-CG2 3.88Å; L360-V425 HydrophobicContact CG-CG2 4.29Å; L360-Y441 HydrophobicContact CD1-CD2 4.27Å; L360-Y441 HydrophobicContact CD1-CG 4.12Å; L360-Y441 HydrophobicContact CD2-CE2 4.37Å
361	R	96.3	Very high	92	Very high	85 Å²	85	42.6 Å²	42.6	32%	0.321	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	136	176.6	-56	-167.8	178.5	-132.1	7.9	110.7	E322 L337 T338 A339 L359 G363 P421 E422	E322-R361 PolarHBondContact O-NH2 2.88Å; E322-R361 VanDerWaalsContact O-NH2 3.13Å; L337-R361 PolarHBondContact O-N 2.76Å; T338-R361 CarbonylContact C-O 3.59Å; T338-R361 WeakPolarHBondContact CA-O 3.28Å; A339-R361 PolarHBondContact N-O 3.1Å; L359-R361 HydrophobicContact CG-CG 4.29Å; R361-G363 PolarHBondContact O-N 3.38Å; R361-P421 CarbonylContact C-O 3.55Å; R361-P421 WeakPolarHBondContact CA-O 3.32Å; R361-E422 HydrophobicContact CG-CG 4.13Å; R361-E422 IonicContact CZ-OE1 3.1Å; R361-E422 IonicContact NE-OE1 2.61Å; R361-E422 PolarHBondContact NE-OE1 2.77Å; R361-E422 IonicContact NH1-OE1 2.75Å; R361-E422 PolarHBondContact NH1-OE1 2.75Å; R361-E422 IonicContact NH2-OE1 3.39Å
362	S	95.8	Very high	92.6	Very high	17 Å²	17	40.7 Å²	40.7	12%	0.119	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	129.8	171.3	176.5	0	0	0	0	110.3	E364 A367 P421 S443	S362-E364 PolarHBondContact O-N 2.79Å; S362-E364 PolarHBondContact OG-N 3.04Å; S362-E364 PolarHBondContact OG-O 3.07Å; S362-A367 WeakPolarHBondContact CB-O 3.49Å; S362-A367 VanDerWaalsContact OG-CB 3.27Å; S362-A367 WeakPolarHBondContact OG-CB 3.41Å; S362-P421 PolarHBondContact N-O 2.92Å; S362-S443 PolarHBondContact OG-OG 2.92Å
363	G	92	Very high	93.1	Very high	45 Å²	45	38.1 Å²	38.1	46%	0.464	20%	0.2	S	C	.	.	S	Bend	trans	-73.7	-4.2	173.3	0	0	0	0	0	114.1	T338 A339 R361	T338-G363 VanDerWaalsContact CG2-CA 3.41Å; A339-G363 PolarHBondContact O-N 2.61Å; R361-G363 PolarHBondContact O-N 3.38Å
364	E	88.6	Confident	93.4	Very high	51 Å²	51	41.7 Å²	41.7	24%	0.238	22%	0.221	C	C	.	.	S	Bend	trans	-118.6	134.4	177.7	-70.2	175.4	-132.3	0	0	110.3	R341 S362 A367	R341-E364 WeakPolarHBondContact CD-OE1 3.14Å; R341-E364 WeakPolarHBondContact CG-OE1 3.37Å; R341-E364 IonicContact CZ-OE1 3.41Å; R341-E364 IonicContact CZ-OE2 3.07Å; R341-E364 IonicContact NE-OE1 3.19Å; R341-E364 PolarHBondContact NE-OE1 3.37Å; R341-E364 IonicContact NE-OE2 3.25Å; R341-E364 PolarHBondContact NE-OE2 3.42Å; R341-E364 IonicContact NH2-OE1 2.74Å; R341-E364 IonicContact NH2-OE2 2.79Å; R341-E364 PolarHBondContact NH2-OE2 3.15Å; S362-E364 PolarHBondContact O-N 2.79Å; S362-E364 PolarHBondContact OG-N 3.04Å; S362-E364 PolarHBondContact OG-O 3.07Å; E364-A367 HydrophobicContact CB-CB 3.85Å; E364-A367 PolarHBondContact O-N 3.31Å
365	S	81.9	Confident	93.5	Very high	117 Å²	117	38.5 Å²	38.5	82%	0.818	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	136.2	172.8	-55	0	0	0	0	110.8	A367	S365-A367 PolarHBondContact O-N 3.21Å
366	N	81.9	Confident	93.4	Very high	150 Å²	150	37.4 Å²	37.4	80%	0.802	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	15.9	-179.5	-57.1	-26.6	0	0	0	116
367	A	92.8	Very high	93.2	Very high	3 Å²	3	40.5 Å²	40.5	3%	0.025	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	158.1	171.3	0	0	0	0	0	111.4	S362 E364 S365 P421 S443 I444	S362-A367 WeakPolarHBondContact CB-O 3.49Å; S362-A367 VanDerWaalsContact OG-CB 3.27Å; S362-A367 WeakPolarHBondContact OG-CB 3.41Å; E364-A367 HydrophobicContact CB-CB 3.85Å; E364-A367 PolarHBondContact O-N 3.31Å; S365-A367 PolarHBondContact O-N 3.21Å; A367-P421 VanDerWaalsContact O-CA 3.3Å; A367-P421 WeakPolarHBondContact O-CA 3.44Å; A367-S443 VanDerWaalsContact CB-OG 3.27Å; A367-S443 WeakPolarHBondContact CB-OG 3.13Å; A367-I444 WeakPolarHBondContact CA-O 3.36Å; A367-I444 VanDerWaalsContact CB-O 3.28Å; A367-I444 WeakPolarHBondContact CB-O 3.4Å
368	M	95.5	Very high	92.8	Very high	36 Å²	36	40.8 Å²	40.8	18%	0.177	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	160.1	180	-62.4	176.9	-63.2	0	0	110.4	T417 S418 G420 S443 I444 N446	M368-T417 HydrophobicContact CB-CG2 4.06Å; M368-T417 HydrophobicContact CE-CG2 3.9Å; M368-T417 HydrophobicContact SD-CG2 3.97Å; M368-S418 WeakPolarHBondContact CG-O 3.38Å; M368-G420 WeakPolarHBondContact CA-O 3.38Å; M368-S443 CarbonylContact O-C 3.52Å; M368-S443 WeakPolarHBondContact O-CA 3.34Å; M368-I444 HydrophobicContact CB-CG1 4.13Å; M368-I444 HydrophobicContact CE-CD1 4.33Å; M368-I444 PolarHBondContact N-O 2.96Å; M368-I444 PolarHBondContact O-N 3.44Å; M368-N446 HydrophobicContact CE-CB 4.46Å
369	V	96.7	Very high	92.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	123.3	171.2	-178	0	0	0	0	108.6	A339 L360 T417 S418 M423	A339-V369 HydrophobicContact CB-CG1 4.33Å; A339-V369 HydrophobicContact CB-CG2 4.19Å; L360-V369 HydrophobicContact CB-CG1 4.12Å; L360-V369 HydrophobicContact CB-CG2 4.39Å; L360-V369 HydrophobicContact CD1-CG1 4.08Å; V369-T417 WeakPolarHBondContact O-CA 3.35Å; V369-S418 PolarHBondContact N-OG 3.24Å; V369-S418 PolarHBondContact O-N 3.43Å; V369-S418 PolarHBondContact O-OG 3.02Å; V369-M423 HydrophobicContact CB-CB 4.14Å; V369-M423 HydrophobicContact CB-CE 4.38Å; V369-M423 HydrophobicContact CG1-CB 4.24Å; V369-M423 HydrophobicContact CG1-CE 4.39Å; V369-M423 HydrophobicContact CG1-SD 4.48Å; V369-M423 VanDerWaalsContact O-CE 3.28Å; V369-M423 WeakPolarHBondContact O-CE 3.3Å
370	H	96.6	Very high	91.6	Very high	32 Å²	32	45.2 Å²	45.2	15%	0.148	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134	167.1	-176.3	71.5	0	0	0	109.2	H415 F416 T417 Y441 R442 I444	H370-H415 AromaticContact CE1-CG 3.95Å; H370-H415 AromaticContact CE1-ND1 3.83Å; H370-F416 CarbonylContact C-O 3.51Å; H370-F416 WeakPolarHBondContact CA-O 3.22Å; H370-T417 PolarHBondContact ND1-OG1 2.82Å; H370-Y441 CarbonylContact O-C 3.41Å; H370-Y441 WeakPolarHBondContact O-CA 3.07Å; H370-Y441 WeakPolarHBondContact O-CB 3.42Å; H370-R442 HydrophobicContact CB-CG 4.2Å; H370-R442 PolarHBondContact N-O 3.02Å; H370-R442 PolarHBondContact O-N 3.32Å; H370-I444 HydrophobicContact CB-CD1 3.92Å; H370-I444 HydrophobicContact CB-CG1 4.02Å; H370-I444 HydrophobicContact CB-CG2 3.76Å
371	L	96.5	Very high	90.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	141.2	-178.2	-176.6	144.9	0	0	0	110.1	L360 I392 H415 F416 M423 V425 L439 R440	L360-L371 HydrophobicContact CD1-CD1 3.76Å; L371-I392 HydrophobicContact CD1-CD1 4.38Å; L371-I392 HydrophobicContact CD2-CD1 4.14Å; L371-H415 CarbonylContact O-C 3.59Å; L371-H415 VanDerWaalsContact O-CA 3.23Å; L371-H415 WeakPolarHBondContact O-CA 3.09Å; L371-F416 HydrophobicContact CD2-CD2 3.99Å; L371-F416 PolarHBondContact N-O 3.02Å; L371-F416 PolarHBondContact O-N 3.03Å; L371-M423 HydrophobicContact CB-CE 4.13Å; L371-M423 HydrophobicContact CB-SD 3.59Å; L371-M423 VanDerWaalsContact CB-SD 3.59Å; L371-M423 HydrophobicContact CD1-SD 3.71Å; L371-M423 HydrophobicContact CG-SD 4.2Å; L371-V425 HydrophobicContact CD1-CG2 3.66Å; L371-L439 HydrophobicContact CD1-CB 4.41Å; L371-L439 HydrophobicContact CD1-CD1 3.9Å; L371-L439 HydrophobicContact CD2-CD1 4.24Å; L371-L439 HydrophobicContact CD2-CD2 3.89Å; L371-L439 HydrophobicContact CD2-CG 4.42Å; L371-L439 HydrophobicContact CG-CB 4.36Å; L371-L439 HydrophobicContact CG-CD1 4.44Å; L371-R440 CarbonylContact C-O 3.59Å; L371-R440 WeakPolarHBondContact CA-O 3.4Å
372	Q	94.8	Very high	89.9	Confident	46 Å²	46	45.2 Å²	45.2	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	137.4	176	-171.4	-176.3	13.3	0	0	110.6	V374 N414 H415 L439 R440	Q372-V374 PolarHBondContact O-N 3.05Å; Q372-N414 WeakPolarHBondContact CA-O 3.48Å; Q372-N414 WeakPolarHBondContact CG-O 3.27Å; Q372-N414 WeakPolarHBondContact CG-OD1 3.27Å; Q372-N414 PolarHBondContact NE2-OD1 2.87Å; Q372-H415 HydrophobicContact CB-CB 4.33Å; Q372-H415 HydrophobicContact CG-CB 4.22Å; Q372-L439 CarbonylContact O-C 3.53Å; Q372-L439 WeakPolarHBondContact O-CA 3.03Å; Q372-R440 PolarHBondContact N-O 2.63Å; Q372-R440 PolarHBondContact O-N 2.49Å
373	F	93.4	Very high	89.1	Confident	3 Å²	3	45.7 Å²	45.7	1%	0.013	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	125.3	168.1	-76.6	-93.9	0	0	0	110.6	L376 V390 I392 F405 L410 N414 F416 L439	F373-L376 HydrophobicContact CD1-CB 4.12Å; F373-L376 HydrophobicContact CD1-CD1 4.3Å; F373-L376 HydrophobicContact CE1-CD1 3.87Å; F373-V390 HydrophobicContact CE1-CB 4.1Å; F373-V390 HydrophobicContact CE1-CG1 3.99Å; F373-V390 HydrophobicContact CE1-CG2 4.41Å; F373-V390 HydrophobicContact CZ-CB 4.15Å; F373-V390 HydrophobicContact CZ-CG1 3.86Å; F373-I392 HydrophobicContact CE2-CG1 4.2Å; F373-I392 HydrophobicContact CZ-CD1 4.38Å; F373-I392 HydrophobicContact CZ-CG1 4.21Å; F373-F405 AromaticContact CE2-CD2 3.75Å; F373-F405 HydrophobicContact CE2-CD2 3.75Å; F373-F405 AromaticContact CE2-CE2 3.96Å; F373-F405 HydrophobicContact CE2-CE2 3.96Å; F373-F405 HydrophobicContact CE2-CG 4.4Å; F373-F405 HydrophobicContact CZ-CB 4.39Å; F373-F405 AromaticContact CZ-CD2 3.64Å; F373-F405 HydrophobicContact CZ-CD2 3.64Å; F373-F405 HydrophobicContact CZ-CE2 4.28Å; F373-F405 HydrophobicContact CZ-CG 4.24Å; F373-L410 HydrophobicContact CB-CD1 3.57Å; F373-L410 HydrophobicContact CB-CD2 3.89Å; F373-L410 HydrophobicContact CB-CG 4.4Å; F373-L410 HydrophobicContact CD1-CD1 4.49Å; F373-L410 HydrophobicContact CD1-CD2 3.78Å; F373-L410 HydrophobicContact CD2-CD2 3.55Å; F373-L410 HydrophobicContact CE1-CD2 4.17Å; F373-L410 HydrophobicContact CE2-CD2 3.95Å; F373-L410 HydrophobicContact CG-CD1 4.07Å; F373-L410 HydrophobicContact CG-CD2 3.46Å; F373-L410 VanDerWaalsContact CG-CD2 3.46Å; F373-L410 HydrophobicContact CG-CG 4.43Å; F373-L410 HydrophobicContact CZ-CD2 4.25Å; F373-N414 HydrophobicContact CB-CB 4.45Å; F373-N414 PolarHBondContact N-O 3.33Å; F373-N414 PolarHBondContact O-ND2 2.92Å; F373-F416 HydrophobicContact CD2-CD2 4.41Å; F373-F416 AromaticContact CD2-CE2 3.69Å; F373-F416 HydrophobicContact CD2-CE2 3.69Å; F373-F416 HydrophobicContact CE2-CD2 4.3Å; F373-F416 AromaticContact CE2-CE2 3.58Å; F373-F416 HydrophobicContact CE2-CE2 3.58Å; F373-F416 HydrophobicContact CE2-CZ 4.3Å; F373-L439 HydrophobicContact CB-CD2 4.22Å; F373-L439 HydrophobicContact CD1-CD2 3.25Å; F373-L439 HydrophobicContact CD2-CD2 3.94Å; F373-L439 HydrophobicContact CE1-CD2 3.43Å; F373-L439 VanDerWaalsContact CE1-CD2 3.43Å; F373-L439 HydrophobicContact CE2-CD2 4.1Å; F373-L439 HydrophobicContact CG-CD2 3.53Å; F373-L439 HydrophobicContact CZ-CD2 3.86Å
374	V	92.7	Very high	88.9	Confident	88 Å²	88	43.7 Å²	43.7	53%	0.533	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-39.7	168.2	179.5	0	0	0	0	109.9	F345 Q372 A438 R440	F345-V374 HydrophobicContact CE1-CG2 4.41Å; Q372-V374 PolarHBondContact O-N 3.05Å; V374-A438 HydrophobicContact CB-CB 4.06Å; V374-A438 PolarHBondContact N-O 2.88Å; V374-R440 HydrophobicContact CG2-CB 3.74Å
375	Q	90.9	Very high	89.1	Confident	85 Å²	85	41.2 Å²	41.2	40%	0.397	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	142.8	179	-175.9	-178.4	-16.5	0	0	109.4	E436 F437 A438	Q375-E436 PolarHBondContact NE2-OE2 2.99Å; Q375-E436 VanDerWaalsContact NE2-OE2 3.12Å; Q375-F437 CarbonylContact O-C 3.56Å; Q375-F437 WeakPolarHBondContact O-CA 3.31Å; Q375-A438 HydrophobicContact CB-CB 3.98Å; Q375-A438 PolarHBondContact N-O 2.75Å; Q375-A438 VanDerWaalsContact N-O 3.1Å; Q375-A438 PolarHBondContact O-N 2.78Å
376	L	90.8	Very high	89.5	Confident	12 Å²	12	36 Å²	36	6%	0.063	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	120.2	166.6	-178.6	74.9	0	0	0	107.2	F373 M378 V390 F405 N408 L410 F437	F373-L376 HydrophobicContact CD1-CB 4.12Å; F373-L376 HydrophobicContact CD1-CD1 4.3Å; F373-L376 HydrophobicContact CE1-CD1 3.87Å; L376-M378 HydrophobicContact CD1-CG 3.45Å; L376-M378 VanDerWaalsContact CD1-CG 3.45Å; L376-M378 HydrophobicContact CG-CG 4.14Å; L376-V390 HydrophobicContact CD1-CB 4.45Å; L376-V390 HydrophobicContact CD1-CG2 3.97Å; L376-F405 HydrophobicContact CD2-CB 3.72Å; L376-N408 PolarHBondContact O-OD1 3.19Å; L376-L410 HydrophobicContact CB-CD1 3.99Å; L376-L410 HydrophobicContact CB-CD2 4.15Å; L376-L410 HydrophobicContact CB-CG 4.06Å; L376-L410 HydrophobicContact CD2-CD2 3.65Å; L376-L410 HydrophobicContact CD2-CG 3.9Å; L376-L410 HydrophobicContact CG-CD2 4.48Å; L376-F437 HydrophobicContact CD1-CB 4.24Å
377	N	89.7	Confident	89.9	Confident	66 Å²	66	30.3 Å²	30.3	35%	0.353	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	77.3	173.5	-174.3	25.8	0	0	0	109.5	N408 S435 E436	N377-N408 WeakPolarHBondContact CA-OD1 3.36Å; N377-N408 PolarHBondContact OD1-OD1 3.05Å; N377-S435 CarbonylContact O-C 3.56Å; N377-S435 WeakPolarHBondContact O-CA 3.47Å; N377-E436 CarbonylContact C-O 3.42Å; N377-E436 WeakPolarHBondContact CA-O 3.46Å; N377-E436 HydrophobicContact CB-CB 4.39Å; N377-E436 PolarHBondContact N-O 3.25Å; N377-E436 PolarHBondContact O-N 3.32Å
378	M	89.2	Confident	89.8	Confident	5 Å²	5	30.1 Å²	30.1	3%	0.025	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-101.9	166.5	178.9	-61.5	-63.7	-71.5	0	0	110	L376 C380 S388 V390 C406 C407 F427 E428	L376-M378 HydrophobicContact CD1-CG 3.45Å; L376-M378 VanDerWaalsContact CD1-CG 3.45Å; L376-M378 HydrophobicContact CG-CG 4.14Å; M378-C380 PolarHBondContact O-N 2.97Å; M378-S388 WeakPolarHBondContact CE-OG 3.44Å; M378-V390 HydrophobicContact SD-CG2 4.34Å; M378-C406 HydrophobicContact CB-CB 4.23Å; M378-C407 PolarHBondContact N-O 3.18Å; M378-C407 WeakPolarHBondContact O-CA 3.26Å; M378-C407 PolarHBondContact O-N 3.44Å; M378-F427 HydrophobicContact CE-CD2 3.86Å; M378-F427 HydrophobicContact CE-CE2 3.52Å; M378-F427 HydrophobicContact SD-CD2 4.26Å; M378-F427 HydrophobicContact SD-CE2 3.75Å; M378-E428 VanDerWaalsContact CE-O 3.3Å; M378-E428 WeakPolarHBondContact CE-O 3.23Å
379	S	87	Confident	89.8	Confident	27 Å²	27	28.5 Å²	28.5	19%	0.189	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-63.4	140.5	172.7	-66.3	0	0	0	0	110.9	S388 C407 H432	S379-S388 PolarHBondContact N-OG 3.48Å; S379-C407 PolarHBondContact O-N 2.86Å; S379-H432 VanDerWaalsContact CB-CD2 3.45Å; S379-H432 WeakPolarHBondContact CB-CD2 3.22Å; S379-H432 WeakPolarHBondContact OG-CB 3.21Å; S379-H432 PolarHBondContact OG-CD2 2.89Å; S379-H432 VanDerWaalsContact OG-CD2 3.27Å; S379-H432 PolarHBondContact OG-ND1 3.26Å
380	C	83.7	Confident	89.8	Confident	82 Å²	82	28.5 Å²	28.5	55%	0.554	15%	0.154	S	C	*	.	P	Polyproline II helix	trans	-83.2	124.7	-178.2	-59.3	0	0	0	0	109.9	M378 C407	M378-C380 PolarHBondContact O-N 2.97Å; C380-C407 HydrophobicContact CB-CB 3.69Å; C380-C407 WeakPolarHBondContact CB-SG 3.43Å; C380-C407 WeakPolarHBondContact SG-CA 3.35Å; C380-C407 WeakPolarHBondContact SG-CB 3.5Å; C380-C407 CovalentContact SG-SG 2.05Å; C380-C407 PolarHBondContact SG-SG 2.76Å
381	E	81.8	Confident	89.8	Confident	11 Å²	11	27 Å²	27	5%	0.051	15%	0.147	C	C	.	.			trans	-104.4	144	171.2	-85.6	-173.4	-86.2	0	0	109.7	Q42 T384 C385 S386 T387 S388 R409	Q42-E381 PolarHBondContact NE2-OE2 3.06Å; E381-T384 WeakPolarHBondContact CB-O 3.29Å; E381-T384 VanDerWaalsContact CD-O 3.29Å; E381-C385 WeakPolarHBondContact OE1-CA 3.29Å; E381-S386 VanDerWaalsContact CD-N 3.31Å; E381-S386 PolarHBondContact OE1-N 2.87Å; E381-S386 WeakPolarHBondContact OE2-CB 3.29Å; E381-S386 PolarHBondContact OE2-N 3.32Å; E381-T387 PolarHBondContact OE1-N 3.49Å; E381-T387 PolarHBondContact OE1-OG1 3.46Å; E381-T387 PolarHBondContact OE2-N 3.49Å; E381-T387 VanDerWaalsContact OE2-N 3.13Å; E381-T387 PolarHBondContact OE2-OG1 3.16Å; E381-S388 PolarHBondContact OE1-N 3.09Å; E381-R409 PolarHBondContact O-NH1 2.86Å
382	E	75.7	Confident	89.8	Confident	74 Å²	74	27 Å²	27	35%	0.346	15%	0.147	S	C	.	.	S	Bend	trans	-81	-22	-165.8	-49.2	-178	116.1	0	0	113.3	T35 P38 S39	T35-E382 HydrophobicContact CG2-CB 3.31Å; T35-E382 HydrophobicContact CG2-CG 4.07Å; P38-E382 WeakPolarHBondContact CA-OE2 3.49Å; S39-E382 PolarHBondContact N-OE2 3.49Å
383	R	78.7	Confident	89.9	Confident	27 Å²	27	25.2 Å²	25.2	10%	0.102	14%	0.139	C	C	.	.	S	Bend	trans	-130.1	-41.6	-176.9	-62.7	-148	150.9	-167.7	4.5	116.2	I34 T35 P38 E47 W265	I34-R383 HydrophobicContact CG2-CG 4.02Å; T35-R383 HydrophobicContact CG2-CG 4.42Å; T35-R383 PolarHBondContact O-NE 2.93Å; T35-R383 PolarHBondContact O-NH2 2.78Å; P38-R383 HydrophobicContact CB-CG 4Å; E47-R383 IonicContact OE1-CZ 2.63Å; E47-R383 IonicContact OE1-NE 2.68Å; E47-R383 IonicContact OE1-NH1 2.84Å; E47-R383 PolarHBondContact OE1-NH1 2.81Å; E47-R383 IonicContact OE1-NH2 2.62Å; E47-R383 PolarHBondContact OE1-NH2 3.41Å; E47-R383 IonicContact OE2-CZ 2.99Å; E47-R383 IonicContact OE2-NH1 3.93Å; E47-R383 PolarHBondContact OE2-NH1 2.84Å; W265-R383 VanDerWaalsContact CE3-O 3.22Å; W265-R383 VanDerWaalsContact CZ3-O 3.24Å; W265-R383 WeakPolarHBondContact CZ3-O 3.12Å
384	T	88.7	Confident	89.9	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.012	14%	0.142	C	C	.	.			trans	-150.2	142.2	-170	167.6	0	0	0	0	107.4	Q42 W265 E381 S386	Q42-T384 PolarHBondContact NE2-O 3.39Å; W265-T384 WeakPolarHBondContact O-CA 3.3Å; W265-T384 PolarHBondContact O-OG1 3.37Å; W265-T384 VanDerWaalsContact O-OG1 3.07Å; E381-T384 WeakPolarHBondContact CB-O 3.29Å; E381-T384 VanDerWaalsContact CD-O 3.29Å; T384-S386 VanDerWaalsContact C-N 3.31Å; T384-S386 WeakPolarHBondContact CG2-OG 3.39Å; T384-S386 PolarHBondContact O-N 3.06Å; T384-S386 PolarHBondContact OG1-OG 2.9Å
385	C	91.9	Very high	89.7	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.124	C	C	.	.			trans	-81.7	83.4	174.8	-58.4	0	0	0	0	108	W265 E381 F389 R404 C406	W265-C385 HydrophobicContact CB-CB 4.28Å; W265-C385 VanDerWaalsContact CB-SG 3.52Å; W265-C385 PolarHBondContact O-N 3.23Å; E381-C385 WeakPolarHBondContact OE1-CA 3.29Å; C385-F389 HydrophobicContact CB-CB 3.97Å; C385-F389 WeakPolarHBondContact O-CD1 3.3Å; C385-R404 HydrophobicContact CB-CB 3.96Å; C385-R404 WeakPolarHBondContact O-CD 3.41Å; C385-C406 VanDerWaalsContact CA-SG 3.56Å; C385-C406 HydrophobicContact CB-CB 3.59Å; C385-C406 WeakPolarHBondContact CB-SG 3.27Å; C385-C406 WeakPolarHBondContact SG-CB 3.4Å; C385-C406 PolarHBondContact SG-N 2.86Å; C385-C406 CovalentContact SG-SG 2.03Å; C385-C406 PolarHBondContact SG-SG 2.9Å
386	S	91.1	Very high	89.4	Confident	6 Å²	6	22.8 Å²	22.8	4%	0.042	14%	0.135	C	C	.	.	S	Bend	trans	-102.8	-31.6	-172.4	-74.1	0	0	0	0	113.4	Q269 K271 E381 T384 F389	Q269-S386 WeakPolarHBondContact CA-OG 3.24Å; Q269-S386 WeakPolarHBondContact CB-OG 3.29Å; K271-S386 WeakPolarHBondContact CD-O 3.37Å; K271-S386 PolarHBondContact NZ-O 3.36Å; E381-S386 VanDerWaalsContact CD-N 3.31Å; E381-S386 PolarHBondContact OE1-N 2.87Å; E381-S386 WeakPolarHBondContact OE2-CB 3.29Å; E381-S386 PolarHBondContact OE2-N 3.32Å; T384-S386 VanDerWaalsContact C-N 3.31Å; T384-S386 WeakPolarHBondContact CG2-OG 3.39Å; T384-S386 PolarHBondContact O-N 3.06Å; T384-S386 PolarHBondContact OG1-OG 2.9Å; S386-F389 WeakPolarHBondContact O-CE1 3.21Å
387	T	89.3	Confident	89.4	Confident	31 Å²	31	26.5 Å²	26.5	19%	0.19	15%	0.148	C	C	.	.	S	Bend	trans	-113.4	-38.5	-172.4	57.8	0	0	0	0	112.7	E381 G430	E381-T387 PolarHBondContact OE1-N 3.49Å; E381-T387 PolarHBondContact OE1-OG1 3.46Å; E381-T387 PolarHBondContact OE2-N 3.49Å; E381-T387 VanDerWaalsContact OE2-N 3.13Å; E381-T387 PolarHBondContact OE2-OG1 3.16Å; T387-G430 WeakPolarHBondContact O-CA 3.23Å; T387-G430 PolarHBondContact O-N 3.06Å; T387-G430 VanDerWaalsContact O-N 3.1Å
388	S	91.8	Very high	89.7	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	-125.2	109.2	-179	-170	0	0	0	0	109.1	M378 S379 E381 C406 E428 S429	M378-S388 WeakPolarHBondContact CE-OG 3.44Å; S379-S388 PolarHBondContact N-OG 3.48Å; E381-S388 PolarHBondContact OE1-N 3.09Å; S388-C406 WeakPolarHBondContact O-CB 3.07Å; S388-E428 CarbonylContact C-O 3.44Å; S388-E428 VanDerWaalsContact CA-O 3.24Å; S388-E428 WeakPolarHBondContact CA-O 3.46Å; S388-S429 WeakPolarHBondContact CB-O 3.35Å; S388-S429 PolarHBondContact OG-O 2.95Å
389	F	94.9	Very high	89.9	Confident	1 Å²	1	23.6 Å²	23.6	0%	0.004	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	159.7	-176.7	57.8	-99.4	0	0	0	114.3	F314 C385 S386 E391 R404 F405 E428	F314-F389 HydrophobicContact CE1-CE2 4.11Å; F314-F389 AromaticContact CE1-CZ 3.95Å; F314-F389 HydrophobicContact CE1-CZ 3.95Å; F314-F389 HydrophobicContact CZ-CZ 4.17Å; C385-F389 HydrophobicContact CB-CB 3.97Å; C385-F389 WeakPolarHBondContact O-CD1 3.3Å; S386-F389 WeakPolarHBondContact O-CE1 3.21Å; F389-E391 HydrophobicContact CD2-CB 3.71Å; F389-E391 HydrophobicContact CE2-CB 3.71Å; F389-R404 HydrophobicContact CB-CB 4.25Å; F389-R404 HydrophobicContact CD2-CG 4.18Å; F389-R404 HydrophobicContact CG-CB 4.44Å; F389-R404 HydrophobicContact CG-CG 4.28Å; F389-F405 CarbonylContact C-O 3.56Å; F389-F405 WeakPolarHBondContact CA-O 3.17Å; F389-E428 HydrophobicContact CE1-CB 4.21Å; F389-E428 HydrophobicContact CE2-CB 4.21Å; F389-E428 HydrophobicContact CZ-CB 4.02Å; F389-E428 WeakPolarHBondContact CZ-OE2 3.41Å; F389-E428 PolarHBondContact N-O 3.03Å; F389-E428 PolarHBondContact O-N 3.3Å
390	V	95.7	Very high	90.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	118.8	154.7	-179.2	0	0	0	0	107.5	F373 L376 M378 I392 F405 V425 I426 F427 F437 L439	F373-V390 HydrophobicContact CE1-CB 4.1Å; F373-V390 HydrophobicContact CE1-CG1 3.99Å; F373-V390 HydrophobicContact CE1-CG2 4.41Å; F373-V390 HydrophobicContact CZ-CB 4.15Å; F373-V390 HydrophobicContact CZ-CG1 3.86Å; L376-V390 HydrophobicContact CD1-CB 4.45Å; L376-V390 HydrophobicContact CD1-CG2 3.97Å; M378-V390 HydrophobicContact SD-CG2 4.34Å; V390-I392 HydrophobicContact CG1-CD1 3.91Å; V390-F405 PolarHBondContact N-O 3.1Å; V390-F405 PolarHBondContact O-N 2.81Å; V390-V425 HydrophobicContact CG1-CG1 4.12Å; V390-I426 CarbonylContact C-O 3.54Å; V390-I426 WeakPolarHBondContact CA-O 3.4Å; V390-F427 HydrophobicContact CG2-CD2 4.3Å; V390-F437 HydrophobicContact CG2-CB 3.84Å; V390-F437 HydrophobicContact CG2-CD1 3.79Å; V390-F437 HydrophobicContact CG2-CD2 4.22Å; V390-F437 HydrophobicContact CG2-CE1 4.45Å; V390-F437 HydrophobicContact CG2-CG 3.68Å; V390-L439 HydrophobicContact CG1-CD1 4.47Å
391	E	97.1	Very high	90.9	Very high	1 Å²	1	20 Å²	20	1%	0.005	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	127.3	176.1	-173.5	176.5	145.7	0	0	109.9	F389 K393 G402 Y403 R404 V425 I426	F389-E391 HydrophobicContact CD2-CB 3.71Å; F389-E391 HydrophobicContact CE2-CB 3.71Å; E391-K393 WeakPolarHBondContact OE1-CE 3.43Å; E391-K393 IonicContact OE1-NZ 3.66Å; E391-G402 PolarHBondContact OE1-N 3.44Å; E391-Y403 CarbonylContact C-O 3.19Å; E391-Y403 WeakPolarHBondContact CA-O 3.46Å; E391-R404 HydrophobicContact CB-CG 4.05Å; E391-R404 HydrophobicContact CG-CG 3.93Å; E391-R404 IonicContact OE2-CZ 2.61Å; E391-R404 IonicContact OE2-NE 3.8Å; E391-R404 PolarHBondContact OE2-NE 2.98Å; E391-R404 IonicContact OE2-NH2 3.98Å; E391-R404 PolarHBondContact OE2-NH2 2.77Å; E391-V425 CarbonylContact O-C 3.45Å; E391-V425 WeakPolarHBondContact O-CA 3.23Å; E391-I426 HydrophobicContact CB-CB 4.19Å; E391-I426 PolarHBondContact N-O 3.38Å; E391-I426 PolarHBondContact O-N 3.31Å
392	I	97	Very high	91.5	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123	175.8	-52.1	-62	0	0	0	108.6	L371 F373 V390 T394 G402 Y403 F405 F416 M423 V425 L439	L371-I392 HydrophobicContact CD1-CD1 4.38Å; L371-I392 HydrophobicContact CD2-CD1 4.14Å; F373-I392 HydrophobicContact CE2-CG1 4.2Å; F373-I392 HydrophobicContact CZ-CD1 4.38Å; F373-I392 HydrophobicContact CZ-CG1 4.21Å; V390-I392 HydrophobicContact CG1-CD1 3.91Å; I392-T394 HydrophobicContact CG2-CG2 4.23Å; I392-G402 WeakPolarHBondContact O-CA 3.3Å; I392-Y403 HydrophobicContact CB-CD2 4.33Å; I392-Y403 PolarHBondContact N-O 2.91Å; I392-Y403 PolarHBondContact O-N 3.29Å; I392-F405 HydrophobicContact CG1-CD2 4.41Å; I392-F405 HydrophobicContact CG1-CE2 4.13Å; I392-F416 HydrophobicContact CG2-CB 4.42Å; I392-F416 HydrophobicContact CG2-CG 4.41Å; I392-M423 HydrophobicContact CG2-CG 4.21Å; I392-M423 HydrophobicContact CG2-SD 3.88Å; I392-V425 HydrophobicContact CD1-CB 4.28Å; I392-V425 HydrophobicContact CD1-CG1 3.91Å; I392-V425 HydrophobicContact CD1-CG2 3.84Å; I392-L439 HydrophobicContact CD1-CD1 4.26Å
393	K	97.2	Very high	92.4	Very high	8 Å²	8	17.3 Å²	17.3	4%	0.035	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	115.5	168.4	-55.6	-173.8	-178.3	176.2	0	109.1	F314 E391 G395 F398 S400 M423 L424	F314-K393 PolarHBondContact O-NZ 2.86Å; E391-K393 WeakPolarHBondContact OE1-CE 3.43Å; E391-K393 IonicContact OE1-NZ 3.66Å; K393-G395 VanDerWaalsContact C-N 3.34Å; K393-F398 HydrophobicContact CB-CD1 3.68Å; K393-F398 HydrophobicContact CB-CE1 3.99Å; K393-F398 HydrophobicContact CD-CB 4.49Å; K393-F398 HydrophobicContact CD-CD1 4.15Å; K393-F398 WeakPolarHBondContact CD-O 3.38Å; K393-F398 PolarHBondContact NZ-O 3.47Å; K393-S400 WeakPolarHBondContact CE-O 3.11Å; K393-S400 PolarHBondContact NZ-O 3.28Å; K393-M423 WeakPolarHBondContact O-CG 3.45Å; K393-L424 HydrophobicContact CB-CB 4.17Å; K393-L424 HydrophobicContact CD-CD2 4.07Å; K393-L424 PolarHBondContact N-O 3.32Å; K393-L424 PolarHBondContact O-N 3.39Å
394	T	93.9	Very high	93.2	Very high	14 Å²	14	17 Å²	17	9%	0.086	9%	0.094	C	C	.	.			trans	-84.9	-6.1	-178.2	52.6	0	0	0	0	113.3	I392 Y403 F416 S418 V419 M423	I392-T394 HydrophobicContact CG2-CG2 4.23Å; T394-Y403 HydrophobicContact CG2-CD2 4.31Å; T394-Y403 HydrophobicContact CG2-CE2 3.72Å; T394-F416 HydrophobicContact CG2-CB 4.19Å; T394-S418 CarbonylContact O-C 3.58Å; T394-S418 WeakPolarHBondContact O-CA 3.21Å; T394-S418 WeakPolarHBondContact O-CB 3.34Å; T394-V419 PolarHBondContact O-N 2.91Å; T394-M423 HydrophobicContact CG2-CE 4.23Å
395	G	87.2	Confident	93.4	Very high	15 Å²	15	17.1 Å²	17.1	16%	0.155	9%	0.094	C	C	.	.	S	Bend	trans	74.8	-177.6	-169.3	0	0	0	0	0	112.5	K393 R397	K393-G395 VanDerWaalsContact C-N 3.34Å; G395-R397 VanDerWaalsContact C-N 3.3Å
396	P	85.7	Confident	93.3	Very high	96 Å²	96	17.1 Å²	17.1	62%	0.623	9%	0.094	S	C	*	.	S	Bend	cis	-77.9	-12.9	7.4	32.1	-35.2	0	0	0	113.5	V419	P396-V419 HydrophobicContact CB-CG1 4.21Å; P396-V419 HydrophobicContact CG-CG1 4.24Å
397	R	90	Very high	93	Very high	91 Å²	91	17.8 Å²	17.8	34%	0.343	10%	0.098	S	C	.	.			trans	-101.9	142.5	176	-61.9	-176.2	69.1	113.7	23.1	111.3	D299 G395 D399	D299-R397 IonicContact OD1-CZ 3.33Å; D299-R397 IonicContact OD1-NE 2.93Å; D299-R397 IonicContact OD1-NH2 3.81Å; D299-R397 PolarHBondContact OD1-NH2 3.23Å; D299-R397 VanDerWaalsContact OD2-CA 3.23Å; D299-R397 WeakPolarHBondContact OD2-CA 3.45Å; D299-R397 WeakPolarHBondContact OD2-CB 3.19Å; G395-R397 VanDerWaalsContact C-N 3.3Å; R397-D399 WeakPolarHBondContact CB-OD1 3.36Å; R397-D399 IonicContact CZ-OD1 3.23Å; R397-D399 IonicContact CZ-OD2 3.28Å; R397-D399 IonicContact NE-OD1 2.9Å; R397-D399 PolarHBondContact NE-OD1 3.23Å; R397-D399 IonicContact NE-OD2 2.99Å; R397-D399 IonicContact NH2-OD1 3.75Å; R397-D399 IonicContact NH2-OD2 3.49Å; R397-D399 PolarHBondContact NH2-OD2 3.02Å
398	F	95.4	Very high	92.7	Very high	7 Å²	7	21.3 Å²	21.3	3%	0.031	12%	0.116	C	C	.	.	S	Bend	trans	-112	-5.5	177.7	-67.3	-66.7	0	0	0	113.8	H298 D299 P313 L316 K393 E422 L424	H298-F398 HydrophobicContact CB-CB 4.26Å; H298-F398 HydrophobicContact CB-CD2 3.99Å; H298-F398 AromaticContact CD2-CD2 3.54Å; H298-F398 AromaticContact CD2-CE2 3.71Å; D299-F398 PolarHBondContact OD2-N 3.13Å; P313-F398 VanDerWaalsContact CB-O 3.23Å; P313-F398 WeakPolarHBondContact CB-O 2.88Å; L316-F398 HydrophobicContact CD1-CB 3.96Å; L316-F398 HydrophobicContact CD1-CG 4.47Å; K393-F398 HydrophobicContact CB-CD1 3.68Å; K393-F398 HydrophobicContact CB-CE1 3.99Å; K393-F398 HydrophobicContact CD-CB 4.49Å; K393-F398 HydrophobicContact CD-CD1 4.15Å; K393-F398 WeakPolarHBondContact CD-O 3.38Å; K393-F398 PolarHBondContact NZ-O 3.47Å; F398-E422 HydrophobicContact CE2-CB 4.29Å; F398-E422 HydrophobicContact CZ-CB 4.03Å; F398-L424 HydrophobicContact CD1-CB 3.94Å; F398-L424 HydrophobicContact CE1-CB 3.86Å
399	D	94.7	Very high	91.8	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.011	13%	0.127	C	C	.	.	S	Bend	trans	-73.1	-27.5	177.8	59	-7.9	0	0	0	114.6	F275 L276 K279 D299 P313 R397	F275-D399 HydrophobicContact CD1-CB 3.62Å; F275-D399 HydrophobicContact CE1-CB 3.56Å; L276-D399 HydrophobicContact CD2-CB 4.05Å; K279-D399 IonicContact NZ-OD2 3.99Å; D299-D399 HydrophobicContact CB-CB 3.62Å; P313-D399 HydrophobicContact CG-CB 4.19Å; R397-D399 WeakPolarHBondContact CB-OD1 3.36Å; R397-D399 IonicContact CZ-OD1 3.23Å; R397-D399 IonicContact CZ-OD2 3.28Å; R397-D399 IonicContact NE-OD1 2.9Å; R397-D399 PolarHBondContact NE-OD1 3.23Å; R397-D399 IonicContact NE-OD2 2.99Å; R397-D399 IonicContact NH2-OD1 3.75Å; R397-D399 IonicContact NH2-OD2 3.49Å; R397-D399 PolarHBondContact NH2-OD2 3.02Å
400	S	94.3	Very high	90.9	Very high	22 Å²	22	26.8 Å²	26.8	15%	0.154	14%	0.14	C	C	.	.	S	Bend	trans	-76	151.1	175.4	-53.6	0	0	0	0	111.5	P233 K393	P233-S400 WeakPolarHBondContact CG-OG 3Å; K393-S400 WeakPolarHBondContact CE-O 3.11Å; K393-S400 PolarHBondContact NZ-O 3.28Å
401	T	96.9	Very high	89.7	Confident	13 Å²	13	27.9 Å²	27.9	8%	0.08	15%	0.148	C	C	.	.			trans	-68.3	133.1	172.8	-49.4	0	0	0	0	109.9	D235 G237 Y263 T266	D235-T401 PolarHBondContact OD1-N 2.91Å; D235-T401 PolarHBondContact OD1-OG1 3.28Å; G237-T401 WeakPolarHBondContact CA-OG1 2.99Å; Y263-T401 VanDerWaalsContact CE1-O 3.29Å; Y263-T401 WeakPolarHBondContact CE1-O 3.31Å; T266-T401 HydrophobicContact CG2-CG2 3.53Å
402	G	95.5	Very high	88	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.01	19%	0.191	C	C	.	.			trans	-83.2	-167.9	-176.3	0	0	0	0	0	115.2	Y263 T266 E391 I392 R404	Y263-G402 VanDerWaalsContact CE1-C 3.43Å; T266-G402 WeakPolarHBondContact CG2-O 3.35Å; T266-G402 PolarHBondContact OG1-O 3.16Å; E391-G402 PolarHBondContact OE1-N 3.44Å; I392-G402 WeakPolarHBondContact O-CA 3.3Å; G402-R404 PolarHBondContact O-N 2.72Å
403	Y	94.6	Very high	86.7	Confident	26 Å²	26	43.5 Å²	43.5	10%	0.102	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	114.9	174	-52.1	-47	0	0	0	110.1	D260 N262 Y263 E391 I392 T394 F405 F416	D260-Y403 WeakPolarHBondContact OD2-CE1 3.28Å; D260-Y403 PolarHBondContact OD2-OH 3.48Å; N262-Y403 HydrophobicContact CB-CD1 3.3Å; N262-Y403 HydrophobicContact CB-CD2 4.16Å; N262-Y403 HydrophobicContact CB-CE1 3.49Å; N262-Y403 VanDerWaalsContact CB-CE1 3.49Å; N262-Y403 HydrophobicContact CB-CE2 4.37Å; N262-Y403 HydrophobicContact CB-CG 3.64Å; Y263-Y403 AromaticContact CD1-CD1 3.64Å; Y263-Y403 HydrophobicContact CD1-CD1 3.64Å; Y263-Y403 HydrophobicContact CD1-CE1 4.12Å; Y263-Y403 AromaticContact CD2-CD1 3.82Å; Y263-Y403 HydrophobicContact CD2-CD1 3.82Å; Y263-Y403 AromaticContact CD2-CE1 3.47Å; Y263-Y403 HydrophobicContact CD2-CE1 3.47Å; Y263-Y403 VanDerWaalsContact CD2-CE1 3.47Å; Y263-Y403 AromaticContact CE1-CD1 3.53Å; Y263-Y403 HydrophobicContact CE1-CD1 3.53Å; Y263-Y403 AromaticContact CE1-CE1 3.82Å; Y263-Y403 HydrophobicContact CE1-CE1 3.82Å; Y263-Y403 HydrophobicContact CE1-CG 4.48Å; Y263-Y403 AromaticContact CE2-CD1 3.73Å; Y263-Y403 HydrophobicContact CE2-CD1 3.73Å; Y263-Y403 AromaticContact CE2-CE1 3.14Å; Y263-Y403 HydrophobicContact CE2-CE1 3.14Å; Y263-Y403 AromaticContact CG-CD1 3.76Å; Y263-Y403 HydrophobicContact CG-CD1 3.76Å; Y263-Y403 AromaticContact CG-CE1 3.93Å; Y263-Y403 HydrophobicContact CG-CE1 3.93Å; Y263-Y403 AromaticContact CZ-CD1 3.55Å; Y263-Y403 AromaticContact CZ-CE1 3.3Å; E391-Y403 CarbonylContact C-O 3.19Å; E391-Y403 WeakPolarHBondContact CA-O 3.46Å; I392-Y403 HydrophobicContact CB-CD2 4.33Å; I392-Y403 PolarHBondContact N-O 2.91Å; I392-Y403 PolarHBondContact O-N 3.29Å; T394-Y403 HydrophobicContact CG2-CD2 4.31Å; T394-Y403 HydrophobicContact CG2-CE2 3.72Å; Y403-F405 HydrophobicContact CG-CZ 4.43Å; Y403-F416 AromaticContact CD2-CD1 3.74Å; Y403-F416 HydrophobicContact CD2-CD1 3.74Å; Y403-F416 AromaticContact CD2-CE1 3.84Å; Y403-F416 HydrophobicContact CD2-CE1 3.84Å; Y403-F416 AromaticContact CE2-CD1 3.86Å; Y403-F416 HydrophobicContact CE2-CD1 3.86Å; Y403-F416 HydrophobicContact CE2-CE1 4.23Å; Y403-F416 HydrophobicContact CG-CE1 4.5Å
404	R	95	Very high	86.1	Confident	22 Å²	22	45.1 Å²	45.1	8%	0.083	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	128.6	178.6	-66	-168.8	176.1	158.9	-0.7	111.7	T266 C385 F389 E391 G402	T266-R404 PolarHBondContact OG1-N 2.68Å; T266-R404 VanDerWaalsContact OG1-N 3.1Å; C385-R404 HydrophobicContact CB-CB 3.96Å; C385-R404 WeakPolarHBondContact O-CD 3.41Å; F389-R404 HydrophobicContact CB-CB 4.25Å; F389-R404 HydrophobicContact CD2-CG 4.18Å; F389-R404 HydrophobicContact CG-CB 4.44Å; F389-R404 HydrophobicContact CG-CG 4.28Å; E391-R404 HydrophobicContact CB-CG 4.05Å; E391-R404 HydrophobicContact CG-CG 3.93Å; E391-R404 IonicContact OE2-CZ 2.61Å; E391-R404 IonicContact OE2-NE 3.8Å; E391-R404 PolarHBondContact OE2-NE 2.98Å; E391-R404 IonicContact OE2-NH2 3.98Å; E391-R404 PolarHBondContact OE2-NH2 2.77Å; G402-R404 PolarHBondContact O-N 2.72Å
405	F	92.6	Very high	86	Confident	4 Å²	4	48.2 Å²	48.2	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.1	177.9	-53.4	-76	0	0	0	110.9	N262 F373 L376 F389 V390 I392 Y403 L410 P411 F416	N262-F405 HydrophobicContact CB-CZ 4.19Å; F373-F405 AromaticContact CE2-CD2 3.75Å; F373-F405 HydrophobicContact CE2-CD2 3.75Å; F373-F405 AromaticContact CE2-CE2 3.96Å; F373-F405 HydrophobicContact CE2-CE2 3.96Å; F373-F405 HydrophobicContact CE2-CG 4.4Å; F373-F405 HydrophobicContact CZ-CB 4.39Å; F373-F405 AromaticContact CZ-CD2 3.64Å; F373-F405 HydrophobicContact CZ-CD2 3.64Å; F373-F405 HydrophobicContact CZ-CE2 4.28Å; F373-F405 HydrophobicContact CZ-CG 4.24Å; L376-F405 HydrophobicContact CD2-CB 3.72Å; F389-F405 CarbonylContact C-O 3.56Å; F389-F405 WeakPolarHBondContact CA-O 3.17Å; V390-F405 PolarHBondContact N-O 3.1Å; V390-F405 PolarHBondContact O-N 2.81Å; I392-F405 HydrophobicContact CG1-CD2 4.41Å; I392-F405 HydrophobicContact CG1-CE2 4.13Å; Y403-F405 HydrophobicContact CG-CZ 4.43Å; F405-L410 HydrophobicContact CG-CD2 4.44Å; F405-P411 HydrophobicContact CE1-CG 4.07Å; F405-P411 HydrophobicContact CZ-CG 4.46Å; F405-F416 HydrophobicContact CE1-CZ 4.2Å; F405-F416 HydrophobicContact CE2-CE1 4.08Å; F405-F416 HydrophobicContact CE2-CE2 4.2Å; F405-F416 AromaticContact CE2-CZ 3.59Å; F405-F416 HydrophobicContact CE2-CZ 3.59Å; F405-F416 AromaticContact CZ-CE1 3.67Å; F405-F416 HydrophobicContact CZ-CE1 3.67Å; F405-F416 HydrophobicContact CZ-CE2 4.27Å; F405-F416 AromaticContact CZ-CZ 3.28Å; F405-F416 HydrophobicContact CZ-CZ 3.28Å
406	C	90.2	Very high	86.3	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.242	C	C	.	.			trans	-145.5	179.5	177.4	66.6	0	0	0	0	110.8	M378 C385 S388 N408 R409	M378-C406 HydrophobicContact CB-CB 4.23Å; C385-C406 VanDerWaalsContact CA-SG 3.56Å; C385-C406 HydrophobicContact CB-CB 3.59Å; C385-C406 WeakPolarHBondContact CB-SG 3.27Å; C385-C406 WeakPolarHBondContact SG-CB 3.4Å; C385-C406 PolarHBondContact SG-N 2.86Å; C385-C406 CovalentContact SG-SG 2.03Å; C385-C406 PolarHBondContact SG-SG 2.9Å; S388-C406 WeakPolarHBondContact O-CB 3.07Å; C406-N408 PolarHBondContact O-N 3.09Å; C406-R409 PolarHBondContact O-N 3.36Å
407	C	84.3	Confident	86.6	Confident	19 Å²	19	45.9 Å²	45.9	13%	0.128	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	-136	-170.6	-158.4	0	0	0	0	110	M378 S379 C380 R409	M378-C407 PolarHBondContact N-O 3.18Å; M378-C407 WeakPolarHBondContact O-CA 3.26Å; M378-C407 PolarHBondContact O-N 3.44Å; S379-C407 PolarHBondContact O-N 2.86Å; C380-C407 HydrophobicContact CB-CB 3.69Å; C380-C407 WeakPolarHBondContact CB-SG 3.43Å; C380-C407 WeakPolarHBondContact SG-CA 3.35Å; C380-C407 WeakPolarHBondContact SG-CB 3.5Å; C380-C407 CovalentContact SG-SG 2.05Å; C380-C407 PolarHBondContact SG-SG 2.76Å; C407-R409 HydrophobicContact CB-CG 4.08Å
408	N	82.8	Confident	86.9	Confident	106 Å²	106	41.7 Å²	41.7	57%	0.567	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.3	34.1	166.4	-64.9	-11.3	0	0	0	110.7	L376 N377 C406 L410	L376-N408 PolarHBondContact O-OD1 3.19Å; N377-N408 WeakPolarHBondContact CA-OD1 3.36Å; N377-N408 PolarHBondContact OD1-OD1 3.05Å; C406-N408 PolarHBondContact O-N 3.09Å; N408-L410 PolarHBondContact O-N 3.09Å
409	R	73.9	Confident	86.6	Confident	60 Å²	60	45.4 Å²	45.4	23%	0.226	24%	0.235	C	C	.	.			trans	-96	91.2	-172.4	-65.4	175.8	-170.5	159.3	8	110	E381 C406 C407	E381-R409 PolarHBondContact O-NH1 2.86Å; C406-R409 PolarHBondContact O-N 3.36Å; C407-R409 HydrophobicContact CB-CG 4.08Å
410	L	76.3	Confident	86.4	Confident	55 Å²	55	46.6 Å²	46.6	29%	0.288	25%	0.248	S	C	.	.			trans	-103.6	145.4	171	-69.7	173.1	0	0	0	110.9	F373 L376 F405 N408 N414	F373-L410 HydrophobicContact CB-CD1 3.57Å; F373-L410 HydrophobicContact CB-CD2 3.89Å; F373-L410 HydrophobicContact CB-CG 4.4Å; F373-L410 HydrophobicContact CD1-CD1 4.49Å; F373-L410 HydrophobicContact CD1-CD2 3.78Å; F373-L410 HydrophobicContact CD2-CD2 3.55Å; F373-L410 HydrophobicContact CE1-CD2 4.17Å; F373-L410 HydrophobicContact CE2-CD2 3.95Å; F373-L410 HydrophobicContact CG-CD1 4.07Å; F373-L410 HydrophobicContact CG-CD2 3.46Å; F373-L410 VanDerWaalsContact CG-CD2 3.46Å; F373-L410 HydrophobicContact CG-CG 4.43Å; F373-L410 HydrophobicContact CZ-CD2 4.25Å; L376-L410 HydrophobicContact CB-CD1 3.99Å; L376-L410 HydrophobicContact CB-CD2 4.15Å; L376-L410 HydrophobicContact CB-CG 4.06Å; L376-L410 HydrophobicContact CD2-CD2 3.65Å; L376-L410 HydrophobicContact CD2-CG 3.9Å; L376-L410 HydrophobicContact CG-CD2 4.48Å; F405-L410 HydrophobicContact CG-CD2 4.44Å; N408-L410 PolarHBondContact O-N 3.09Å; L410-N414 HydrophobicContact CB-CB 4.4Å; L410-N414 HydrophobicContact CD1-CB 4.42Å
411	P	69	Low	86.4	Confident	24 Å²	24	48.8 Å²	48.8	16%	0.156	26%	0.262	C	S	.	.			trans	-64.3	151.6	170.3	29.8	-35.2	0	0	0	109.3	N262 F405 R413 N414 F416	N262-P411 WeakPolarHBondContact OD1-CB 3.38Å; N262-P411 VanDerWaalsContact OD1-CG 3.29Å; N262-P411 WeakPolarHBondContact OD1-CG 3.45Å; F405-P411 HydrophobicContact CE1-CG 4.07Å; F405-P411 HydrophobicContact CZ-CG 4.46Å; P411-R413 PolarHBondContact O-N 3.22Å; P411-N414 PolarHBondContact O-N 3.39Å; P411-F416 HydrophobicContact CG-CZ 3.96Å
412	P	62.8	Low	86.3	Confident	141 Å²	141	49.9 Å²	49.9	92%	0.916	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-31.5	-175.8	-28.7	34.3	0	0	0	114.6
413	R	69.2	Low	86.4	Confident	187 Å²	187	49.8 Å²	49.8	71%	0.706	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-25.7	179.7	-72.3	-170.3	-179.1	-172.3	0.2	114.1	P411 H415	P411-R413 PolarHBondContact O-N 3.22Å; R413-H415 PolarHBondContact O-CD2 3.29Å; R413-H415 PolarHBondContact O-N 3.03Å
414	N	83.9	Confident	86.5	Confident	43 Å²	43	48.6 Å²	48.6	23%	0.23	26%	0.26	C	S	.	.			trans	42.2	15.9	-178.8	80	2.2	0	0	0	118.3	Q372 F373 L410 P411	Q372-N414 WeakPolarHBondContact CA-O 3.48Å; Q372-N414 WeakPolarHBondContact CG-O 3.27Å; Q372-N414 WeakPolarHBondContact CG-OD1 3.27Å; Q372-N414 PolarHBondContact NE2-OD1 2.87Å; F373-N414 HydrophobicContact CB-CB 4.45Å; F373-N414 PolarHBondContact N-O 3.33Å; F373-N414 PolarHBondContact O-ND2 2.92Å; L410-N414 HydrophobicContact CB-CB 4.4Å; L410-N414 HydrophobicContact CD1-CB 4.42Å; P411-N414 PolarHBondContact O-N 3.39Å
415	H	91.6	Very high	86.7	Confident	78 Å²	78	47.5 Å²	47.5	36%	0.361	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	145.7	-178.4	74.1	75.1	0	0	0	111.2	H370 L371 Q372 R413	H370-H415 AromaticContact CE1-CG 3.95Å; H370-H415 AromaticContact CE1-ND1 3.83Å; L371-H415 CarbonylContact O-C 3.59Å; L371-H415 VanDerWaalsContact O-CA 3.23Å; L371-H415 WeakPolarHBondContact O-CA 3.09Å; Q372-H415 HydrophobicContact CB-CB 4.33Å; Q372-H415 HydrophobicContact CG-CB 4.22Å; R413-H415 PolarHBondContact O-CD2 3.29Å; R413-H415 PolarHBondContact O-N 3.03Å
416	F	93	Very high	86.9	Confident	10 Å²	10	47.3 Å²	47.3	4%	0.044	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	142.7	-174.4	-54.7	-87.3	0	0	0	109	N262 H370 L371 F373 I392 T394 Y403 F405 P411 M423	N262-F416 HydrophobicContact CB-CE1 4.26Å; H370-F416 CarbonylContact C-O 3.51Å; H370-F416 WeakPolarHBondContact CA-O 3.22Å; L371-F416 HydrophobicContact CD2-CD2 3.99Å; L371-F416 PolarHBondContact N-O 3.02Å; L371-F416 PolarHBondContact O-N 3.03Å; F373-F416 HydrophobicContact CD2-CD2 4.41Å; F373-F416 AromaticContact CD2-CE2 3.69Å; F373-F416 HydrophobicContact CD2-CE2 3.69Å; F373-F416 HydrophobicContact CE2-CD2 4.3Å; F373-F416 AromaticContact CE2-CE2 3.58Å; F373-F416 HydrophobicContact CE2-CE2 3.58Å; F373-F416 HydrophobicContact CE2-CZ 4.3Å; I392-F416 HydrophobicContact CG2-CB 4.42Å; I392-F416 HydrophobicContact CG2-CG 4.41Å; T394-F416 HydrophobicContact CG2-CB 4.19Å; Y403-F416 AromaticContact CD2-CD1 3.74Å; Y403-F416 HydrophobicContact CD2-CD1 3.74Å; Y403-F416 AromaticContact CD2-CE1 3.84Å; Y403-F416 HydrophobicContact CD2-CE1 3.84Å; Y403-F416 AromaticContact CE2-CD1 3.86Å; Y403-F416 HydrophobicContact CE2-CD1 3.86Å; Y403-F416 HydrophobicContact CE2-CE1 4.23Å; Y403-F416 HydrophobicContact CG-CE1 4.5Å; F405-F416 HydrophobicContact CE1-CZ 4.2Å; F405-F416 HydrophobicContact CE2-CE1 4.08Å; F405-F416 HydrophobicContact CE2-CE2 4.2Å; F405-F416 AromaticContact CE2-CZ 3.59Å; F405-F416 HydrophobicContact CE2-CZ 3.59Å; F405-F416 AromaticContact CZ-CE1 3.67Å; F405-F416 HydrophobicContact CZ-CE1 3.67Å; F405-F416 HydrophobicContact CZ-CE2 4.27Å; F405-F416 AromaticContact CZ-CZ 3.28Å; F405-F416 HydrophobicContact CZ-CZ 3.28Å; P411-F416 HydrophobicContact CG-CZ 3.96Å; F416-M423 HydrophobicContact CB-CE 4.38Å
417	T	94.1	Very high	87.1	Confident	53 Å²	53	47.4 Å²	47.4	33%	0.325	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	132.6	176.3	-64.5	0	0	0	0	107.9	M368 V369 H370 I444	M368-T417 HydrophobicContact CB-CG2 4.06Å; M368-T417 HydrophobicContact CE-CG2 3.9Å; M368-T417 HydrophobicContact SD-CG2 3.97Å; V369-T417 WeakPolarHBondContact O-CA 3.35Å; H370-T417 PolarHBondContact ND1-OG1 2.82Å; T417-I444 HydrophobicContact CG2-CD1 3.77Å
418	S	94.9	Very high	87.6	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.014	26%	0.257	C	S	.	.			trans	-69.3	149.7	177.6	58.3	0	0	0	0	112.1	M368 V369 T394 G420 E422 M423	M368-S418 WeakPolarHBondContact CG-O 3.38Å; V369-S418 PolarHBondContact N-OG 3.24Å; V369-S418 PolarHBondContact O-N 3.43Å; V369-S418 PolarHBondContact O-OG 3.02Å; T394-S418 CarbonylContact O-C 3.58Å; T394-S418 WeakPolarHBondContact O-CA 3.21Å; T394-S418 WeakPolarHBondContact O-CB 3.34Å; S418-G420 WeakPolarHBondContact CB-O 3.35Å; S418-G420 PolarHBondContact O-N 2.02Å; S418-G420 PolarHBondContact OG-O 3.31Å; S418-E422 WeakPolarHBondContact CB-O 3.22Å; S418-M423 VanDerWaalsContact N-CE 3.3Å
419	V	88.4	Confident	88	Confident	85 Å²	85	43.4 Å²	43.4	52%	0.515	23%	0.233	S	C	.	.	S	Bend	trans	-92.1	86	166.3	-174.8	0	0	0	0	107.1	T394 P396	T394-V419 PolarHBondContact O-N 2.91Å; P396-V419 HydrophobicContact CB-CG1 4.21Å; P396-V419 HydrophobicContact CG-CG1 4.24Å
420	G	91.1	Very high	88.5	Confident	28 Å²	28	42.2 Å²	42.2	29%	0.289	24%	0.239	S	C	.	.	S	Bend	trans	114.8	-172.9	-174.2	0	0	0	0	0	112.9	M368 S418 E422	M368-G420 WeakPolarHBondContact CA-O 3.38Å; S418-G420 WeakPolarHBondContact CB-O 3.35Å; S418-G420 PolarHBondContact O-N 2.02Å; S418-G420 PolarHBondContact OG-O 3.31Å; G420-E422 PolarHBondContact O-N 2.98Å
421	P	93.9	Very high	88.6	Confident	67 Å²	67	41.5 Å²	41.5	44%	0.435	25%	0.245	S	C	.	.	S	Bend	trans	-78	-1.2	-172.5	30.2	-32.1	0	0	0	114.4	R361 S362 A367	R361-P421 CarbonylContact C-O 3.55Å; R361-P421 WeakPolarHBondContact CA-O 3.32Å; S362-P421 PolarHBondContact N-O 2.92Å; A367-P421 VanDerWaalsContact O-CA 3.3Å; A367-P421 WeakPolarHBondContact O-CA 3.44Å
422	E	95.3	Very high	89.1	Confident	36 Å²	36	44.5 Å²	44.5	17%	0.168	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	145.4	-168.3	-60.9	179.1	146.9	0	0	112.5	H298 L359 L360 R361 F398 S418 G420	H298-E422 IonicContact CD2-OE2 2.96Å; H298-E422 IonicContact NE2-OE2 3.73Å; H298-E422 PolarHBondContact NE2-OE2 3.16Å; L359-E422 HydrophobicContact CD1-CB 4.33Å; L360-E422 CarbonylContact O-C 3.49Å; L360-E422 VanDerWaalsContact O-CA 3.25Å; L360-E422 WeakPolarHBondContact O-CA 3.38Å; R361-E422 HydrophobicContact CG-CG 4.13Å; R361-E422 IonicContact CZ-OE1 3.1Å; R361-E422 IonicContact NE-OE1 2.61Å; R361-E422 PolarHBondContact NE-OE1 2.77Å; R361-E422 IonicContact NH1-OE1 2.75Å; R361-E422 PolarHBondContact NH1-OE1 2.75Å; R361-E422 IonicContact NH2-OE1 3.39Å; F398-E422 HydrophobicContact CE2-CB 4.29Å; F398-E422 HydrophobicContact CZ-CB 4.03Å; S418-E422 WeakPolarHBondContact CB-O 3.22Å; G420-E422 PolarHBondContact O-N 2.98Å
423	M	96.8	Very high	89.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	136.4	173.6	-173	178.4	-67.3	0	0	109	L360 V369 L371 I392 K393 T394 F416 S418	L360-M423 HydrophobicContact CB-CB 4.34Å; L360-M423 WeakPolarHBondContact CB-O 3.23Å; L360-M423 PolarHBondContact N-O 2.9Å; L360-M423 PolarHBondContact O-N 2.96Å; V369-M423 HydrophobicContact CB-CB 4.14Å; V369-M423 HydrophobicContact CB-CE 4.38Å; V369-M423 HydrophobicContact CG1-CB 4.24Å; V369-M423 HydrophobicContact CG1-CE 4.39Å; V369-M423 HydrophobicContact CG1-SD 4.48Å; V369-M423 VanDerWaalsContact O-CE 3.28Å; V369-M423 WeakPolarHBondContact O-CE 3.3Å; L371-M423 HydrophobicContact CB-CE 4.13Å; L371-M423 HydrophobicContact CB-SD 3.59Å; L371-M423 VanDerWaalsContact CB-SD 3.59Å; L371-M423 HydrophobicContact CD1-SD 3.71Å; L371-M423 HydrophobicContact CG-SD 4.2Å; I392-M423 HydrophobicContact CG2-CG 4.21Å; I392-M423 HydrophobicContact CG2-SD 3.88Å; K393-M423 WeakPolarHBondContact O-CG 3.45Å; T394-M423 HydrophobicContact CG2-CE 4.23Å; F416-M423 HydrophobicContact CB-CE 4.38Å; S418-M423 VanDerWaalsContact N-CE 3.3Å
424	L	98	Very high	90	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	130.2	176.1	-173	69.2	0	0	0	109.8	L316 W358 L359 K393 F398 I426	L316-L424 HydrophobicContact CD1-CD2 4.47Å; L316-L424 HydrophobicContact CD2-CD1 3.9Å; L316-L424 HydrophobicContact CD2-CD2 4.27Å; L316-L424 HydrophobicContact CG-CD1 4.41Å; L316-L424 HydrophobicContact CG-CD2 3.93Å; W358-L424 WeakPolarHBondContact O-CD1 3.18Å; L359-L424 HydrophobicContact CB-CD1 4.39Å; L359-L424 HydrophobicContact CD1-CD1 4.44Å; K393-L424 HydrophobicContact CB-CB 4.17Å; K393-L424 HydrophobicContact CD-CD2 4.07Å; K393-L424 PolarHBondContact N-O 3.32Å; K393-L424 PolarHBondContact O-N 3.39Å; F398-L424 HydrophobicContact CD1-CB 3.94Å; F398-L424 HydrophobicContact CE1-CB 3.86Å; L424-I426 HydrophobicContact CD2-CD1 3.9Å; L424-I426 HydrophobicContact CD2-CG1 4.16Å; L424-I426 HydrophobicContact CG-CD1 4.31Å; L424-I426 HydrophobicContact CG-CG1 4.05Å
425	V	97.9	Very high	90.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	127.6	173.8	-179.4	0	0	0	0	108.2	L346 S357 W358 L360 L371 V390 E391 I392 L439	L346-V425 HydrophobicContact CD2-CB 4.36Å; L346-V425 HydrophobicContact CD2-CG1 4.1Å; S357-V425 CarbonylContact C-O 3.5Å; S357-V425 WeakPolarHBondContact CA-O 3.08Å; W358-V425 HydrophobicContact CB-CB 4.45Å; W358-V425 HydrophobicContact CE3-CB 4.38Å; W358-V425 HydrophobicContact CE3-CG1 4.15Å; W358-V425 PolarHBondContact N-O 2.97Å; W358-V425 PolarHBondContact O-N 2.95Å; L360-V425 HydrophobicContact CD1-CG2 3.88Å; L360-V425 HydrophobicContact CG-CG2 4.29Å; L371-V425 HydrophobicContact CD1-CG2 3.66Å; V390-V425 HydrophobicContact CG1-CG1 4.12Å; E391-V425 CarbonylContact O-C 3.45Å; E391-V425 WeakPolarHBondContact O-CA 3.23Å; I392-V425 HydrophobicContact CD1-CB 4.28Å; I392-V425 HydrophobicContact CD1-CG1 3.91Å; I392-V425 HydrophobicContact CD1-CG2 3.84Å; V425-L439 HydrophobicContact CG1-CD1 3.64Å; V425-L439 HydrophobicContact CG2-CD1 4.27Å
426	I	97.2	Very high	90	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	128.7	178.2	-51.8	160.2	0	0	0	108.4	F314 C356 V390 E391 L424	F314-I426 HydrophobicContact CD1-CD1 3.58Å; F314-I426 HydrophobicContact CD1-CG2 4.34Å; F314-I426 HydrophobicContact CE1-CB 4.49Å; F314-I426 HydrophobicContact CE1-CD1 4.01Å; F314-I426 HydrophobicContact CE1-CG2 3.68Å; F314-I426 HydrophobicContact CZ-CG2 4.27Å; F314-I426 WeakPolarHBondContact O-CD1 3.5Å; C356-I426 CarbonylContact O-C 3.57Å; C356-I426 WeakPolarHBondContact O-CA 3.5Å; V390-I426 CarbonylContact C-O 3.54Å; V390-I426 WeakPolarHBondContact CA-O 3.4Å; E391-I426 HydrophobicContact CB-CB 4.19Å; E391-I426 PolarHBondContact N-O 3.38Å; E391-I426 PolarHBondContact O-N 3.31Å; L424-I426 HydrophobicContact CD2-CD1 3.9Å; L424-I426 HydrophobicContact CD2-CG1 4.16Å; L424-I426 HydrophobicContact CG-CD1 4.31Å; L424-I426 HydrophobicContact CG-CG1 4.05Å
427	F	95.5	Very high	90.1	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.009	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	133.3	172.7	167.5	-109.7	0	0	0	108.9	T348 P349 R355 C356 W358 M378 V390 F437	T348-F427 HydrophobicContact CG2-CE1 4.36Å; T348-F427 HydrophobicContact CG2-CE2 4.44Å; T348-F427 HydrophobicContact CG2-CZ 3.92Å; P349-F427 HydrophobicContact CG-CD1 4.44Å; R355-F427 CarbonylContact C-O 3.48Å; R355-F427 WeakPolarHBondContact CA-O 3.13Å; C356-F427 PolarHBondContact N-O 3.35Å; C356-F427 PolarHBondContact O-N 3.44Å; W358-F427 HydrophobicContact CH2-CB 4.15Å; W358-F427 HydrophobicContact CZ3-CB 3.72Å; M378-F427 HydrophobicContact CE-CD2 3.86Å; M378-F427 HydrophobicContact CE-CE2 3.52Å; M378-F427 HydrophobicContact SD-CD2 4.26Å; M378-F427 HydrophobicContact SD-CE2 3.75Å; V390-F427 HydrophobicContact CG2-CD2 4.3Å; F427-F437 HydrophobicContact CB-CE1 3.72Å; F427-F437 HydrophobicContact CB-CZ 4.23Å; F427-F437 HydrophobicContact CD1-CE1 4.35Å; F427-F437 AromaticContact CD2-CD1 3.48Å; F427-F437 HydrophobicContact CD2-CD1 3.48Å; F427-F437 VanDerWaalsContact CD2-CD1 3.48Å; F427-F437 AromaticContact CD2-CE1 3.39Å; F427-F437 HydrophobicContact CD2-CE1 3.39Å; F427-F437 AromaticContact CE2-CD1 3.82Å; F427-F437 HydrophobicContact CE2-CD1 3.82Å; F427-F437 HydrophobicContact CE2-CE1 4Å; F427-F437 HydrophobicContact CG-CD1 4.17Å; F427-F437 AromaticContact CG-CE1 3.57Å; F427-F437 HydrophobicContact CG-CE1 3.57Å
428	E	94.2	Very high	90.1	Very high	34 Å²	34	40.7 Å²	40.7	16%	0.159	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	123.6	166.1	-164.7	170.8	175	0	0	109	K271 R354 M378 S388 F389	K271-E428 IonicContact NZ-OE1 3.49Å; K271-E428 PolarHBondContact NZ-OE1 3.39Å; K271-E428 IonicContact NZ-OE2 3.31Å; K271-E428 PolarHBondContact NZ-OE2 3.44Å; K271-E428 VanDerWaalsContact NZ-OE2 3.1Å; R354-E428 CarbonylContact O-C 3.55Å; R354-E428 WeakPolarHBondContact O-CA 3.36Å; M378-E428 VanDerWaalsContact CE-O 3.3Å; M378-E428 WeakPolarHBondContact CE-O 3.23Å; S388-E428 CarbonylContact C-O 3.44Å; S388-E428 VanDerWaalsContact CA-O 3.24Å; S388-E428 WeakPolarHBondContact CA-O 3.46Å; F389-E428 HydrophobicContact CE1-CB 4.21Å; F389-E428 HydrophobicContact CE2-CB 4.21Å; F389-E428 HydrophobicContact CZ-CB 4.02Å; F389-E428 WeakPolarHBondContact CZ-OE2 3.41Å; F389-E428 PolarHBondContact N-O 3.03Å; F389-E428 PolarHBondContact O-N 3.3Å
429	S	91.4	Very high	90.1	Very high	7 Å²	7	40.6 Å²	40.6	5%	0.049	24%	0.235	C	C	.	.			trans	-82	-18.4	-175.8	63.5	0	0	0	0	113.8	R354 S388 G431 H432 S435	R354-S429 WeakPolarHBondContact CA-OG 3.47Å; R354-S429 WeakPolarHBondContact CB-OG 3.37Å; R354-S429 PolarHBondContact O-N 3.06Å; R354-S429 PolarHBondContact O-OG 2.86Å; S388-S429 WeakPolarHBondContact CB-O 3.35Å; S388-S429 PolarHBondContact OG-O 2.95Å; S429-G431 PolarHBondContact O-N 2.66Å; S429-G431 PolarHBondContact OG-N 3.12Å; S429-H432 PolarHBondContact O-CD2 2.79Å; S429-H432 VanDerWaalsContact O-CD2 3.3Å; S429-H432 PolarHBondContact O-N 3.43Å; S429-S435 PolarHBondContact O-OG 3.48Å
430	G	83.7	Confident	90.5	Very high	35 Å²	35	40.6 Å²	40.6	36%	0.361	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	12.6	-171.6	0	0	0	0	0	114.4	T387	T387-G430 WeakPolarHBondContact O-CA 3.23Å; T387-G430 PolarHBondContact O-N 3.06Å; T387-G430 VanDerWaalsContact O-N 3.1Å
431	G	79.8	Confident	90.8	Very high	40 Å²	40	40 Å²	40	41%	0.412	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	5.9	-173.8	0	0	0	0	0	114.2	S429	S429-G431 PolarHBondContact O-N 2.66Å; S429-G431 PolarHBondContact OG-N 3.12Å
432	H	79.6	Confident	91	Very high	87 Å²	87	41.6 Å²	41.6	40%	0.403	21%	0.213	S	C	.	.			trans	-88.4	120.2	178.3	-60.2	-80.9	0	0	0	111.5	S379 S429 H434 S435	S379-H432 VanDerWaalsContact CB-CD2 3.45Å; S379-H432 WeakPolarHBondContact CB-CD2 3.22Å; S379-H432 WeakPolarHBondContact OG-CB 3.21Å; S379-H432 PolarHBondContact OG-CD2 2.89Å; S379-H432 VanDerWaalsContact OG-CD2 3.27Å; S379-H432 PolarHBondContact OG-ND1 3.26Å; S429-H432 PolarHBondContact O-CD2 2.79Å; S429-H432 VanDerWaalsContact O-CD2 3.3Å; S429-H432 PolarHBondContact O-N 3.43Å; H432-H434 PolarHBondContact O-N 3.15Å; H432-S435 PolarHBondContact O-OG 2.89Å; H432-S435 VanDerWaalsContact O-OG 3.13Å
433	L	71.5	Confident	91	Very high	162 Å²	162	40.1 Å²	40.1	85%	0.848	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-17.9	-174.3	-66.9	169.8	0	0	0	114.9
434	H	78.3	Confident	90.9	Very high	154 Å²	154	42.2 Å²	42.2	71%	0.713	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.9	20.4	-173.9	-57	-56.7	0	0	0	113.4	H432 E436	H432-H434 PolarHBondContact O-N 3.15Å; H434-E436 PolarHBondContact O-N 2.76Å
435	S	86.5	Confident	90.4	Very high	6 Å²	6	48 Å²	48	4%	0.042	24%	0.244	C	C	.	.			trans	-81.7	107.6	-179.7	-58.7	0	0	0	0	110.7	T348 N377 S429 H432	T348-S435 VanDerWaalsContact CG2-O 3.27Å; T348-S435 WeakPolarHBondContact CG2-O 3.43Å; N377-S435 CarbonylContact O-C 3.56Å; N377-S435 WeakPolarHBondContact O-CA 3.47Å; S429-S435 PolarHBondContact O-OG 3.48Å; H432-S435 PolarHBondContact O-OG 2.89Å; H432-S435 VanDerWaalsContact O-OG 3.13Å
436	E	90.1	Very high	89	Confident	96 Å²	96	52.9 Å²	52.9	45%	0.449	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	142.1	-177.5	-66.5	-177.3	177.4	0	0	112.3	T348 Q375 N377 H434	T348-E436 VanDerWaalsContact OG1-CA 3.27Å; T348-E436 WeakPolarHBondContact OG1-CA 3.25Å; Q375-E436 PolarHBondContact NE2-OE2 2.99Å; Q375-E436 VanDerWaalsContact NE2-OE2 3.12Å; N377-E436 CarbonylContact C-O 3.42Å; N377-E436 WeakPolarHBondContact CA-O 3.46Å; N377-E436 HydrophobicContact CB-CB 4.39Å; N377-E436 PolarHBondContact N-O 3.25Å; N377-E436 PolarHBondContact O-N 3.32Å; H434-E436 PolarHBondContact O-N 2.76Å
437	F	93.3	Very high	87	Confident	5 Å²	5	61.1 Å²	61.1	2%	0.022	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	154.5	170.8	78.2	-90	0	0	0	110.2	L346 K347 T348 W358 Q375 L376 V390 F427 L439	L346-F437 HydrophobicContact CD2-CE2 4.42Å; L346-F437 HydrophobicContact CG-CE2 4.13Å; L346-F437 HydrophobicContact CG-CZ 4.45Å; K347-F437 WeakPolarHBondContact CA-O 3.08Å; T348-F437 PolarHBondContact N-O 3.1Å; T348-F437 WeakPolarHBondContact OG1-CD1 3.08Å; T348-F437 PolarHBondContact OG1-N 2.82Å; T348-F437 PolarHBondContact OG1-O 3.23Å; W358-F437 HydrophobicContact CH2-CE1 4.37Å; W358-F437 AromaticContact CH2-CZ 3.85Å; W358-F437 HydrophobicContact CH2-CZ 3.85Å; W358-F437 HydrophobicContact CZ3-CE1 4.46Å; W358-F437 AromaticContact CZ3-CZ 3.81Å; W358-F437 HydrophobicContact CZ3-CZ 3.81Å; Q375-F437 CarbonylContact O-C 3.56Å; Q375-F437 WeakPolarHBondContact O-CA 3.31Å; L376-F437 HydrophobicContact CD1-CB 4.24Å; V390-F437 HydrophobicContact CG2-CB 3.84Å; V390-F437 HydrophobicContact CG2-CD1 3.79Å; V390-F437 HydrophobicContact CG2-CD2 4.22Å; V390-F437 HydrophobicContact CG2-CE1 4.45Å; V390-F437 HydrophobicContact CG2-CG 3.68Å; F427-F437 HydrophobicContact CB-CE1 3.72Å; F427-F437 HydrophobicContact CB-CZ 4.23Å; F427-F437 HydrophobicContact CD1-CE1 4.35Å; F427-F437 AromaticContact CD2-CD1 3.48Å; F427-F437 HydrophobicContact CD2-CD1 3.48Å; F427-F437 VanDerWaalsContact CD2-CD1 3.48Å; F427-F437 AromaticContact CD2-CE1 3.39Å; F427-F437 HydrophobicContact CD2-CE1 3.39Å; F427-F437 AromaticContact CE2-CD1 3.82Å; F427-F437 HydrophobicContact CE2-CD1 3.82Å; F427-F437 HydrophobicContact CE2-CE1 4Å; F427-F437 HydrophobicContact CG-CD1 4.17Å; F427-F437 AromaticContact CG-CE1 3.57Å; F427-F437 HydrophobicContact CG-CE1 3.57Å; F437-L439 HydrophobicContact CD2-CD1 4.09Å; F437-L439 HydrophobicContact CD2-CD2 4.48Å; F437-L439 HydrophobicContact CD2-CG 3.82Å; F437-L439 HydrophobicContact CE2-CD1 3.87Å; F437-L439 HydrophobicContact CE2-CG 3.98Å
438	A	94.4	Very high	84.2	Confident	8 Å²	8	66.9 Å²	66.9	7%	0.066	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	130.7	169.3	0	0	0	0	0	109.4	L346 K347 V374 Q375	L346-A438 CarbonylContact O-C 3.45Å; L346-A438 WeakPolarHBondContact O-CA 3.32Å; K347-A438 HydrophobicContact CG-CB 4.12Å; V374-A438 HydrophobicContact CB-CB 4.06Å; V374-A438 PolarHBondContact N-O 2.88Å; Q375-A438 HydrophobicContact CB-CB 3.98Å; Q375-A438 PolarHBondContact N-O 2.75Å; Q375-A438 VanDerWaalsContact N-O 3.1Å; Q375-A438 PolarHBondContact O-N 2.78Å
439	L	95.9	Very high	81.3	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	145.6	177.9	-56.4	174.9	0	0	0	109.1	F345 L346 L371 Q372 F373 V390 I392 V425 F437	F345-L439 CarbonylContact C-O 3.52Å; F345-L439 VanDerWaalsContact CA-O 3.31Å; F345-L439 WeakPolarHBondContact CA-O 3.46Å; L346-L439 HydrophobicContact CB-CB 4.34Å; L346-L439 HydrophobicContact CD2-CD1 4.27Å; L346-L439 PolarHBondContact N-O 2.92Å; L346-L439 PolarHBondContact O-N 2.81Å; L371-L439 HydrophobicContact CD1-CB 4.41Å; L371-L439 HydrophobicContact CD1-CD1 3.9Å; L371-L439 HydrophobicContact CD2-CD1 4.24Å; L371-L439 HydrophobicContact CD2-CD2 3.89Å; L371-L439 HydrophobicContact CD2-CG 4.42Å; L371-L439 HydrophobicContact CG-CB 4.36Å; L371-L439 HydrophobicContact CG-CD1 4.44Å; Q372-L439 CarbonylContact O-C 3.53Å; Q372-L439 WeakPolarHBondContact O-CA 3.03Å; F373-L439 HydrophobicContact CB-CD2 4.22Å; F373-L439 HydrophobicContact CD1-CD2 3.25Å; F373-L439 HydrophobicContact CD2-CD2 3.94Å; F373-L439 HydrophobicContact CE1-CD2 3.43Å; F373-L439 VanDerWaalsContact CE1-CD2 3.43Å; F373-L439 HydrophobicContact CE2-CD2 4.1Å; F373-L439 HydrophobicContact CG-CD2 3.53Å; F373-L439 HydrophobicContact CZ-CD2 3.86Å; V390-L439 HydrophobicContact CG1-CD1 4.47Å; I392-L439 HydrophobicContact CD1-CD1 4.26Å; V425-L439 HydrophobicContact CG1-CD1 3.64Å; V425-L439 HydrophobicContact CG2-CD1 4.27Å; F437-L439 HydrophobicContact CD2-CD1 4.09Å; F437-L439 HydrophobicContact CD2-CD2 4.48Å; F437-L439 HydrophobicContact CD2-CG 3.82Å; F437-L439 HydrophobicContact CE2-CD1 3.87Å; F437-L439 HydrophobicContact CE2-CG 3.98Å
440	R	96.4	Very high	78.2	Confident	85 Å²	85	80.5 Å²	80.5	32%	0.321	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.5	167.8	179.9	169.7	72	159.2	-13.6	108.2	D343 S344 F345 L371 Q372 V374	D343-R440 HydrophobicContact CB-CG 3.97Å; D343-R440 VanDerWaalsContact OD2-CD 3.3Å; D343-R440 WeakPolarHBondContact OD2-CD 3.47Å; D343-R440 IonicContact OD2-CZ 3.58Å; D343-R440 IonicContact OD2-NE 2.86Å; D343-R440 IonicContact OD2-NH1 3.78Å; D343-R440 PolarHBondContact OD2-NH1 3.01Å; S344-R440 CarbonylContact O-C 3.6Å; S344-R440 WeakPolarHBondContact O-CA 3.05Å; F345-R440 HydrophobicContact CD1-CB 4.16Å; F345-R440 HydrophobicContact CD1-CG 4.42Å; F345-R440 HydrophobicContact CE1-CB 4.01Å; F345-R440 HydrophobicContact CE1-CG 3.99Å; F345-R440 HydrophobicContact CZ-CG 4.34Å; L371-R440 CarbonylContact C-O 3.59Å; L371-R440 WeakPolarHBondContact CA-O 3.4Å; Q372-R440 PolarHBondContact N-O 2.63Å; Q372-R440 PolarHBondContact O-N 2.49Å; V374-R440 HydrophobicContact CG2-CB 3.74Å
441	Y	97.5	Very high	75.5	Confident	17 Å²	17	84.4 Å²	84.4	7%	0.067	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	152	-179.2	70.3	-83.9	0	0	0	112.5	A339 S344 L346 L360 H370	A339-Y441 HydrophobicContact CB-CD2 3.76Å; A339-Y441 HydrophobicContact CB-CE2 4.05Å; S344-Y441 WeakPolarHBondContact CB-OH 3.2Å; S344-Y441 PolarHBondContact N-O 3.28Å; S344-Y441 PolarHBondContact O-N 2.91Å; L346-Y441 HydrophobicContact CB-CD1 4.31Å; L346-Y441 HydrophobicContact CB-CE1 4.1Å; L360-Y441 HydrophobicContact CD1-CD2 4.27Å; L360-Y441 HydrophobicContact CD1-CG 4.12Å; L360-Y441 HydrophobicContact CD2-CE2 4.37Å; H370-Y441 CarbonylContact O-C 3.41Å; H370-Y441 WeakPolarHBondContact O-CA 3.07Å; H370-Y441 WeakPolarHBondContact O-CB 3.42Å
442	R	97.1	Very high	73.1	Confident	100 Å²	100	88.9 Å²	88.9	38%	0.377	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	161.4	178.5	60.1	171.7	178.4	-172	3.4	111.3	H340 D343 H370 I444	H340-R442 CarbonylContact O-C 3.56Å; H340-R442 VanDerWaalsContact O-CA 3.31Å; H340-R442 WeakPolarHBondContact O-CA 3.44Å; H340-R442 WeakPolarHBondContact O-CB 3.23Å; D343-R442 WeakPolarHBondContact OD1-CD 3.39Å; D343-R442 IonicContact OD1-NH1 3.73Å; H370-R442 HydrophobicContact CB-CG 4.2Å; H370-R442 PolarHBondContact N-O 3.02Å; H370-R442 PolarHBondContact O-N 3.32Å; R442-I444 HydrophobicContact CG-CG2 4.21Å
443	S	96.8	Very high	70.7	Confident	5 Å²	5	90.8 Å²	90.8	4%	0.035	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	136.3	168.3	178.9	0	0	0	0	110.2	A339 H340 S362 A367 M368	A339-S443 VanDerWaalsContact O-CB 3.25Å; A339-S443 WeakPolarHBondContact O-CB 3.39Å; H340-S443 PolarHBondContact O-N 3.1Å; S362-S443 PolarHBondContact OG-OG 2.92Å; A367-S443 VanDerWaalsContact CB-OG 3.27Å; A367-S443 WeakPolarHBondContact CB-OG 3.13Å; M368-S443 CarbonylContact O-C 3.52Å; M368-S443 WeakPolarHBondContact O-CA 3.34Å
444	I	94.7	Very high	68.9	Low	43 Å²	43	89 Å²	89	22%	0.221	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	137.1	174.8	58.7	163.9	0	0	0	109.7	A367 M368 H370 T417 R442	A367-I444 WeakPolarHBondContact CA-O 3.36Å; A367-I444 VanDerWaalsContact CB-O 3.28Å; A367-I444 WeakPolarHBondContact CB-O 3.4Å; M368-I444 HydrophobicContact CB-CG1 4.13Å; M368-I444 HydrophobicContact CE-CD1 4.33Å; M368-I444 PolarHBondContact N-O 2.96Å; M368-I444 PolarHBondContact O-N 3.44Å; H370-I444 HydrophobicContact CB-CD1 3.92Å; H370-I444 HydrophobicContact CB-CG1 4.02Å; H370-I444 HydrophobicContact CB-CG2 3.76Å; T417-I444 HydrophobicContact CG2-CD1 3.77Å; R442-I444 HydrophobicContact CG-CG2 4.21Å
445	Q	87	Confident	66.5	Low	122 Å²	122	86.2 Å²	86.2	57%	0.57	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.8	145.5	174.7	-69.9	-171.7	-27.5	0	0	110.3	R341 Q447	R341-Q445 VanDerWaalsContact NH2-NE2 3.16Å; Q445-Q447 VanDerWaalsContact C-N 3.32Å; Q445-Q447 PolarHBondContact O-N 2.82Å
446	N	68.7	Low	63.8	Low	102 Å²	102	91.8 Å²	91.8	55%	0.545	50%	0.498	S	S	.	.			trans	-66	93.3	172.5	-165.2	11.2	0	0	0	108.7	M368 T448	M368-N446 HydrophobicContact CE-CB 4.46Å; N446-T448 VanDerWaalsContact C-N 3.34Å; N446-T448 PolarHBondContact O-N 3.21Å
447	Q	54.5	Low	61	Low	174 Å²	174	92.2 Å²	92.2	81%	0.813	51%	0.509	S	S	*	.			trans	-68.8	100.2	168.7	-72.1	-173.9	-7.1	0	0	106.5	Q445 I449	Q445-Q447 VanDerWaalsContact C-N 3.32Å; Q445-Q447 PolarHBondContact O-N 2.82Å; Q447-I449 PolarHBondContact O-N 2.85Å
448	T	37.4	Very low	57.9	Low	122 Å²	122	99.2 Å²	99.2	75%	0.748	55%	0.545	S	S	*	.			trans	-48.9	112.5	158.4	-22.2	0	0	0	0	105.3	N446 Q450	N446-T448 VanDerWaalsContact C-N 3.34Å; N446-T448 PolarHBondContact O-N 3.21Å; T448-Q450 VanDerWaalsContact C-N 3.29Å; T448-Q450 PolarHBondContact O-N 2.98Å
449	I	33.1	Very low	54.9	Low	151 Å²	151	104.3 Å²	104.3	77%	0.774	58%	0.575	S	S	*	*			trans	-54	104.8	168.4	-65.2	172.4	0	0	0	104.7	Q447 T451	Q447-I449 PolarHBondContact O-N 2.85Å; I449-T451 PolarHBondContact O-N 3.05Å
450	Q	25.4	Very low	51.6	Low	177 Å²	177	110.4 Å²	110.4	83%	0.827	61%	0.613	S	S	*	*			trans	-68.4	87.8	168.9	-79.8	-174.7	-14.2	0	0	105.8	T448 T452	T448-Q450 VanDerWaalsContact C-N 3.29Å; T448-Q450 PolarHBondContact O-N 2.98Å; Q450-T452 PolarHBondContact O-N 2.73Å
451	T	28.1	Very low	48.5	Very low	116 Å²	116	115.6 Å²	115.6	71%	0.712	64%	0.64	S	S	*	*			trans	-54.2	108.9	154.8	6.8	0	0	0	0	106.3	I449 T453	I449-T451 PolarHBondContact O-N 3.05Å; T451-T453 PolarHBondContact O-N 3.34Å
452	T	28.5	Very low	45.4	Very low	134 Å²	134	121.8 Å²	121.8	82%	0.822	68%	0.68	S	S	*	*			trans	-66.6	88.5	173.9	-19	0	0	0	0	107.1	Q450 V454	Q450-T452 PolarHBondContact O-N 2.73Å; T452-V454 PolarHBondContact O-N 3.11Å
453	T	28.7	Very low	42.2	Very low	127 Å²	127	125.5 Å²	125.5	78%	0.779	70%	0.702	S	S	*	*			trans	-80	92.9	169.8	33.1	0	0	0	0	108.2	T451 A455	T451-T453 PolarHBondContact O-N 3.34Å; T453-A455 PolarHBondContact O-N 2.87Å
454	V	34.1	Very low	39.2	Very low	126 Å²	126	133.7 Å²	133.7	76%	0.764	74%	0.739	S	S	*	*			trans	-71	104.3	159.1	177.3	0	0	0	0	106.6	T452 T456	T452-V454 PolarHBondContact O-N 3.11Å; V454-T456 PolarHBondContact O-N 3.01Å
455	A	28.2	Very low	36.1	Very low	95 Å²	95	140.9 Å²	140.9	79%	0.785	77%	0.774	S	S	*	*			trans	-66.9	125.4	172.2	0	0	0	0	0	109.8	T453	T453-A455 PolarHBondContact O-N 2.87Å
456	T	30.7	Very low	34.3	Very low	123 Å²	123	139.3 Å²	139.3	76%	0.755	77%	0.77	S	S	*	*			trans	-131	126.3	153.8	-32.5	0	0	0	0	106.3	V454	V454-T456 PolarHBondContact O-N 3.01Å
457	P	30.4	Very low	33.8	Very low	105 Å²	105	138.4 Å²	138.4	68%	0.682	79%	0.785	S	S	*	*			trans	-78.6	159.3	-174	34.4	-33.6	0	0	0	109.6
458	I	29.5	Very low	34.3	Very low	152 Å²	152	131.5 Å²	131.5	78%	0.779	76%	0.755	S	S	*	*			trans	164.8	120.3	134.5	-82.6	154.4	0	0	0	110.6
459	T	30.5	Very low	36.1	Very low	114 Å²	114	128.6 Å²	128.6	70%	0.699	74%	0.739	S	S	*	*			trans	53.3	110.8	152.5	53.1	0	0	0	0	121.7	E461	T459-E461 PolarHBondContact O-N 3.19Å
460	T	26.9	Very low	38.3	Very low	129 Å²	129	122.8 Å²	122.8	79%	0.791	71%	0.711	S	S	*	*				5.4	104.9	124.6	45.7	0	0	0	0	116.7
461	E	31.6	Very low	41.1	Very low	193 Å²	193	116.4 Å²	116.4	90%	0.902	69%	0.686	S	S	*	*			trans	-163.5	140.6	130.1	-103.7	166.5	-154.8	0	0	108.3	T459 E463	T459-E461 PolarHBondContact O-N 3.19Å; E461-E463 PolarHBondContact O-N 2.88Å
462	V	31.8	Very low	43.9	Very low	147 Å²	147	116.4 Å²	116.4	89%	0.891	69%	0.688	S	S	*	*			trans	-78.3	105.3	-167.1	172.5	0	0	0	0	109
463	E	30.2	Very low	46.7	Very low	179 Å²	179	112.9 Å²	112.9	84%	0.836	66%	0.659	S	S	*	*			trans	-160.6	129.4	169.3	-112.1	164.1	-154.6	0	0	114.3	E461	E461-E463 PolarHBondContact O-N 2.88Å
464	E	34	Very low	49.6	Very low	176 Å²	176	111.8 Å²	111.8	82%	0.822	65%	0.646	S	S	*	*			trans	54.4	112.1	152	-67	-173.1	147.4	0	0	122.5	D466	E464-D466 PolarHBondContact O-N 3.04Å
465	M	29.6	Very low	52.3	Low	195 Å²	195	111.3 Å²	111.3	96%	0.961	65%	0.645	S	S	*	*			trans	-58	98.6	156.8	-74.4	171.5	50.4	0	0	111.5
466	D	49.5	Very low	55.1	Low	88 Å²	88	109.5 Å²	109.5	47%	0.471	62%	0.618	S	S	.	*			trans	-153.3	86.9	159.5	-135.3	-3.4	0	0	0	111.4	E464 C468 R493	E464-D466 PolarHBondContact O-N 3.04Å; D466-C468 PolarHBondContact O-N 2.92Å; D466-R493 IonicContact OD1-NH2 3.29Å; D466-R493 IonicContact OD2-CZ 3.52Å; D466-R493 IonicContact OD2-NH1 3.09Å; D466-R493 PolarHBondContact OD2-NH1 2.89Å; D466-R493 IonicContact OD2-NH2 3.24Å; D466-R493 PolarHBondContact OD2-NH2 3.02Å
467	G	56.6	Low	57.8	Low	84 Å²	84	105.3 Å²	105.3	87%	0.866	60%	0.599	S	S	*	*			trans	-73.6	32	173.3	0	0	0	0	0	113.8
468	C	66.3	Low	60.6	Low	29 Å²	29	109.1 Å²	109.1	20%	0.196	61%	0.608	C	S	.	*			trans	-113.9	121.2	-171.8	-94.4	0	0	0	0	111.6	D466 C470 C503	D466-C468 PolarHBondContact O-N 2.92Å; C468-C470 PolarHBondContact O-N 2.75Å; C468-C503 WeakPolarHBondContact CA-SG 3.49Å; C468-C503 HydrophobicContact CB-CB 3.82Å; C468-C503 WeakPolarHBondContact CB-SG 3.13Å; C468-C503 WeakPolarHBondContact SG-CA 2.98Å; C468-C503 WeakPolarHBondContact SG-CB 3.46Å; C468-C503 CovalentContact SG-SG 2.04Å; C468-C503 PolarHBondContact SG-SG 2.04Å
469	P	74.9	Confident	63.2	Low	61 Å²	61	103.1 Å²	103.1	40%	0.396	58%	0.579	S	S	.	*			trans	-77.2	69.2	178.7	33.2	-35.2	0	0	0	110.6	S496 D497	P469-S496 PolarHBondContact O-N 2.92Å; P469-S496 VanDerWaalsContact O-N 3.12Å; P469-D497 HydrophobicContact CG-CB 4.28Å
470	C	79.3	Confident	65.6	Low	28 Å²	28	100.9 Å²	100.9	19%	0.189	57%	0.565	C	S	.	*	B	Isolated β-bridge	trans	-115.9	150	178.7	-54.6	0	0	0	0	111.2	C468 R493 H494 C495 C503	C468-C470 PolarHBondContact O-N 2.75Å; C470-R493 VanDerWaalsContact CB-CD 3.45Å; C470-R493 HydrophobicContact CB-CG 3.95Å; C470-H494 CarbonylContact C-O 3.48Å; C470-H494 VanDerWaalsContact CA-O 3.26Å; C470-H494 WeakPolarHBondContact CA-O 3.26Å; C470-C495 HydrophobicContact CB-CB 4.01Å; C470-C495 WeakPolarHBondContact CB-SG 3.27Å; C470-C495 WeakPolarHBondContact SG-CB 3Å; C470-C495 CovalentContact SG-SG 2.04Å; C470-C495 PolarHBondContact SG-SG 3.39Å; C470-C503 VanDerWaalsContact SG-CB 3.59Å
471	S	85	Confident	68.1	Low	44 Å²	44	95.1 Å²	95.1	31%	0.308	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-55.5	160.3	165.4	75.7	0	0	0	0	110	H494	S471-H494 PolarHBondContact N-O 2.71Å; S471-H494 PolarHBondContact OG-N 1.99Å; S471-H494 PolarHBondContact OG-O 2.75Å
472	P	85.2	Confident	70.6	Confident	116 Å²	116	94.1 Å²	94.1	75%	0.753	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-50.4	150.3	163.2	-24.5	34.6	0	0	0	110.8
473	W	87.7	Confident	73.2	Confident	59 Å²	59	88.7 Å²	88.7	22%	0.223	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-62.8	135.5	172.4	-71.1	100.3	0	0	0	110.8	R491 R493 Q507	W473-R491 HydrophobicContact CB-CG 4.5Å; W473-R491 HydrophobicContact CD2-CG 4.27Å; W473-R491 HydrophobicContact CE3-CB 4.48Å; W473-R491 HydrophobicContact CE3-CG 3.73Å; W473-R491 HydrophobicContact CZ3-CG 4.35Å; W473-R491 WeakPolarHBondContact CZ3-O 3.24Å; W473-R493 HydrophobicContact CD2-CB 4.05Å; W473-R493 HydrophobicContact CD2-CG 4.05Å; W473-R493 HydrophobicContact CE3-CB 3.79Å; W473-R493 HydrophobicContact CE3-CG 3.86Å; W473-R493 HydrophobicContact CG-CB 4.49Å; W473-R493 HydrophobicContact CH2-CG 3.93Å; W473-R493 HydrophobicContact CZ2-CG 4.12Å; W473-R493 HydrophobicContact CZ3-CB 4.17Å; W473-R493 HydrophobicContact CZ3-CG 3.8Å; W473-Q507 HydrophobicContact CE3-CB 4.26Å; W473-Q507 HydrophobicContact CH2-CB 3.67Å; W473-Q507 HydrophobicContact CZ2-CB 4.1Å; W473-Q507 HydrophobicContact CZ3-CB 3.75Å
474	E	90.1	Very high	75.7	Confident	104 Å²	104	80.1 Å²	80.1	49%	0.486	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-60.1	159.4	166.3	-69	173.8	175	0	0	110.5	R491 T492	E474-R491 WeakPolarHBondContact O-CB 3.5Å; E474-R491 WeakPolarHBondContact O-CD 3.41Å; E474-T492 VanDerWaalsContact CB-O 3.31Å; E474-T492 WeakPolarHBondContact CB-O 3.41Å; E474-T492 WeakPolarHBondContact CG-O 3.33Å; E474-T492 PolarHBondContact N-O 3.26Å; E474-T492 WeakPolarHBondContact OE2-CB 3.49Å; E474-T492 PolarHBondContact OE2-OG1 2.88Å
475	P	90.1	Very high	77.9	Confident	117 Å²	117	71.8 Å²	71.8	76%	0.76	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-53.5	151.3	170.7	-24.5	34.6	0	0	0	111.8	G477	P475-G477 PolarHBondContact O-N 3.02Å
476	W	87.7	Confident	80	Confident	57 Å²	57	62.6 Å²	62.6	22%	0.216	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-61.9	130.8	171.7	-70.5	98	0	0	0	110.2	Q489 R491 Q507 R509	W476-Q489 HydrophobicContact CB-CB 4.22Å; W476-Q489 HydrophobicContact CD2-CB 4.39Å; W476-Q489 HydrophobicContact CE3-CB 3.71Å; W476-Q489 HydrophobicContact CZ3-CB 4.47Å; W476-Q489 WeakPolarHBondContact CZ3-O 3.3Å; W476-R491 HydrophobicContact CD2-CB 4.25Å; W476-R491 HydrophobicContact CD2-CG 4.01Å; W476-R491 VanDerWaalsContact CE2-CD 3.46Å; W476-R491 HydrophobicContact CE3-CB 4.06Å; W476-R491 HydrophobicContact CE3-CG 3.87Å; W476-R491 HydrophobicContact CH2-CG 4.01Å; W476-R491 HydrophobicContact CZ2-CG 4.11Å; W476-R491 HydrophobicContact CZ3-CB 4.45Å; W476-R491 HydrophobicContact CZ3-CG 3.86Å; W476-Q507 HydrophobicContact CH2-CB 4.25Å; W476-Q507 HydrophobicContact CH2-CG 3.89Å; W476-Q507 WeakPolarHBondContact CZ3-O 3.48Å; W476-R509 HydrophobicContact CD2-CG 4.09Å; W476-R509 HydrophobicContact CE3-CG 3.8Å; W476-R509 HydrophobicContact CH2-CB 3.67Å; W476-R509 HydrophobicContact CH2-CG 3.64Å; W476-R509 HydrophobicContact CZ2-CB 4.22Å; W476-R509 HydrophobicContact CZ2-CG 3.97Å; W476-R509 HydrophobicContact CZ3-CB 3.93Å; W476-R509 HydrophobicContact CZ3-CG 3.57Å
477	G	87.8	Confident	81.3	Confident	35 Å²	35	58.4 Å²	58.4	36%	0.361	35%	0.346	S	S	.	.			trans	-65.9	178.4	171.3	0	0	0	0	0	112.7	P475 Q489 S490	P475-G477 PolarHBondContact O-N 3.02Å; G477-Q489 VanDerWaalsContact O-CD 3.28Å; G477-Q489 WeakPolarHBondContact O-CG 3.41Å; G477-Q489 PolarHBondContact O-NE2 2.79Å; G477-S490 PolarHBondContact N-O 3.27Å
478	E	87.9	Confident	82.3	Confident	184 Å²	184	56 Å²	56	86%	0.86	32%	0.317	S	S	*	.			trans	-62.3	151.3	178.2	-64.5	-170.6	161.9	0	0	112.2
479	C	83.6	Confident	83.2	Confident	26 Å²	26	56.2 Å²	56.2	18%	0.176	32%	0.315	C	S	.	.			trans	-75.9	129.1	177.5	-172.5	0	0	0	0	109.7	Q481 Q489 C511 N512	C479-Q481 PolarHBondContact O-N 3.24Å; C479-Q481 VanDerWaalsContact O-N 3.09Å; C479-Q481 PolarHBondContact SG-O 2.96Å; C479-Q489 HydrophobicContact CB-CG 4.05Å; C479-C511 WeakPolarHBondContact CA-SG 3.13Å; C479-C511 HydrophobicContact CB-CB 3.77Å; C479-C511 WeakPolarHBondContact CB-SG 3.48Å; C479-C511 WeakPolarHBondContact SG-CB 3.46Å; C479-C511 CovalentContact SG-SG 2Å; C479-C511 PolarHBondContact SG-SG 2.92Å; C479-N512 WeakPolarHBondContact CB-ND2 3.48Å; C479-N512 VanDerWaalsContact SG-CB 3.59Å; C479-N512 PolarHBondContact SG-ND2 2.02Å; C479-N512 VanDerWaalsContact SG-ND2 3.37Å
480	T	81.3	Confident	83.5	Confident	67 Å²	67	56 Å²	56	41%	0.411	31%	0.314	S	S	.	.	S	Bend	trans	-67.9	-8.8	-177.2	57.7	0	0	0	0	115.4	G487 S488	T480-G487 WeakPolarHBondContact OG1-CA 3.03Å; T480-S488 VanDerWaalsContact CG2-O 3.31Å; T480-S488 WeakPolarHBondContact CG2-O 3.05Å; T480-S488 PolarHBondContact N-O 3.18Å; T480-S488 VanDerWaalsContact N-O 3.12Å; T480-S488 PolarHBondContact OG1-N 3.23Å; T480-S488 PolarHBondContact OG1-O 3.48Å
481	Q	79.6	Confident	83.9	Confident	8 Å²	8	57.5 Å²	57.5	4%	0.037	32%	0.316	C	S	.	.			trans	-143.8	148.3	178.4	-56.2	-65	-17.6	0	0	110	C479 C486 N512 N524 H529	C479-Q481 PolarHBondContact O-N 3.24Å; C479-Q481 VanDerWaalsContact O-N 3.09Å; C479-Q481 PolarHBondContact SG-O 2.96Å; Q481-C486 HydrophobicContact CB-CB 3.91Å; Q481-C486 HydrophobicContact CG-CB 3.67Å; Q481-N512 WeakPolarHBondContact O-CB 2.91Å; Q481-N512 VanDerWaalsContact O-CG 3.3Å; Q481-N512 PolarHBondContact O-ND2 3.3Å; Q481-N524 PolarHBondContact OE1-ND2 2.95Å; Q481-H529 PolarHBondContact NE2-NE2 3.4Å
482	E	85.1	Confident	84	Confident	173 Å²	173	58.2 Å²	58.2	81%	0.808	32%	0.319	S	S	*	.	S	Bend	trans	-81.8	-20.2	-174.6	-63.9	179	172.2	0	0	114	N512	E482-N512 WeakPolarHBondContact O-CB 3.38Å
483	C	85.4	Confident	84.2	Confident	32 Å²	32	53.7 Å²	53.7	22%	0.216	29%	0.287	C	S	.	.	S	Bend	trans	-157	-179.9	-173.5	61.1	0	0	0	0	113.1	G485 C486 N512 E514 C516	C483-G485 PolarHBondContact O-N 2.05Å; C483-G485 VanDerWaalsContact O-N 3.15Å; C483-C486 PolarHBondContact O-N 3.27Å; C483-N512 CarbonylContact C-O 3.52Å; C483-N512 WeakPolarHBondContact CA-O 3.46Å; C483-E514 CarbonylContact C-O 3.59Å; C483-E514 WeakPolarHBondContact CA-O 3.42Å; C483-E514 WeakPolarHBondContact CB-O 3.36Å; C483-C516 HydrophobicContact CB-CB 3.94Å; C483-C516 WeakPolarHBondContact CB-SG 3.49Å; C483-C516 WeakPolarHBondContact SG-CA 3.45Å; C483-C516 WeakPolarHBondContact SG-CB 3.31Å; C483-C516 CovalentContact SG-SG 2.03Å; C483-C516 PolarHBondContact SG-SG 3.34Å
484	G	82.2	Confident	84	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	1.3	175.3	0	0	0	0	0	114.8	C486 N512 E514 C516 G534 C536	G484-C486 PolarHBondContact O-N 3.23Å; G484-N512 PolarHBondContact N-O 3.23Å; G484-E514 WeakPolarHBondContact CA-O 3Å; G484-E514 PolarHBondContact N-O 2.9Å; G484-C516 PolarHBondContact N-SG 2.84Å; G484-G534 WeakPolarHBondContact CA-O 3.35Å; G484-C536 WeakPolarHBondContact O-CB 3.31Å; G484-C536 PolarHBondContact O-N 2.74Å
485	G	80.1	Confident	83.4	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	16.7	-166.4	0	0	0	0	0	112.7	C483 G487 C511 N512 M539	C483-G485 PolarHBondContact O-N 2.05Å; C483-G485 VanDerWaalsContact O-N 3.15Å; G485-G487 PolarHBondContact O-N 3Å; G485-C511 WeakPolarHBondContact CA-O 3.15Å; G485-N512 VanDerWaalsContact CA-O 3.24Å; G485-N512 WeakPolarHBondContact CA-O 3.37Å; G485-N512 PolarHBondContact N-O 2.73Å; G485-M539 WeakPolarHBondContact O-CE 3.45Å
486	C	74.9	Confident	82.2	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.014	27%	0.269	C	S	.	.			trans	-69.7	-25.8	-177.9	-63.6	0	0	0	0	112.1	Q481 C483 G484 K510 I522 H529 L531 C536	Q481-C486 HydrophobicContact CB-CB 3.91Å; Q481-C486 HydrophobicContact CG-CB 3.67Å; C483-C486 PolarHBondContact O-N 3.27Å; G484-C486 PolarHBondContact O-N 3.23Å; C486-K510 PolarHBondContact O-NZ 2.81Å; C486-I522 HydrophobicContact CB-CD1 3.96Å; C486-H529 HydrophobicContact CB-CB 4.45Å; C486-L531 VanDerWaalsContact SG-CD2 3.58Å; C486-C536 WeakPolarHBondContact CA-SG 3.36Å; C486-C536 HydrophobicContact CB-CB 4.07Å; C486-C536 WeakPolarHBondContact CB-SG 3.26Å; C486-C536 WeakPolarHBondContact SG-CB 3.42Å; C486-C536 CovalentContact SG-SG 2.02Å; C486-C536 PolarHBondContact SG-SG 3.09Å
487	G	76.2	Confident	81.1	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	157.4	-170.6	0	0	0	0	0	114.4	T480 G485 K510 C511	T480-G487 WeakPolarHBondContact OG1-CA 3.03Å; G485-G487 PolarHBondContact O-N 3Å; G487-K510 WeakPolarHBondContact O-CA 3.35Å; G487-K510 WeakPolarHBondContact O-CD 3.04Å; G487-C511 PolarHBondContact O-N 2.85Å; G487-C511 VanDerWaalsContact O-N 3.11Å; G487-C511 PolarHBondContact O-SG 2.81Å
488	S	78.2	Confident	79.6	Confident	35 Å²	35	57 Å²	57	25%	0.245	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.9	170.7	-168.9	0	0	0	0	109.1	T480 R509 C511	T480-S488 VanDerWaalsContact CG2-O 3.31Å; T480-S488 WeakPolarHBondContact CG2-O 3.05Å; T480-S488 PolarHBondContact N-O 3.18Å; T480-S488 VanDerWaalsContact N-O 3.12Å; T480-S488 PolarHBondContact OG1-N 3.23Å; T480-S488 PolarHBondContact OG1-O 3.48Å; S488-R509 CarbonylContact C-O 3.5Å; S488-R509 VanDerWaalsContact CA-O 3.26Å; S488-R509 WeakPolarHBondContact CA-O 3.01Å; S488-R509 PolarHBondContact OG-O 3.1Å; S488-C511 PolarHBondContact N-SG 2.93Å; S488-C511 VanDerWaalsContact N-SG 3.39Å
489	Q	84	Confident	78	Confident	33 Å²	33	55.6 Å²	55.6	15%	0.154	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	150.2	161.2	-65.7	-180	-57.2	0	0	108.1	W476 G477 C479 S508 R509 C511	W476-Q489 HydrophobicContact CB-CB 4.22Å; W476-Q489 HydrophobicContact CD2-CB 4.39Å; W476-Q489 HydrophobicContact CE3-CB 3.71Å; W476-Q489 HydrophobicContact CZ3-CB 4.47Å; W476-Q489 WeakPolarHBondContact CZ3-O 3.3Å; G477-Q489 VanDerWaalsContact O-CD 3.28Å; G477-Q489 WeakPolarHBondContact O-CG 3.41Å; G477-Q489 PolarHBondContact O-NE2 2.79Å; C479-Q489 HydrophobicContact CB-CG 4.05Å; Q489-S508 CarbonylContact O-C 3.21Å; Q489-S508 WeakPolarHBondContact O-CA 3.33Å; Q489-R509 HydrophobicContact CB-CG 4.22Å; Q489-R509 PolarHBondContact N-O 2.9Å; Q489-R509 PolarHBondContact O-N 3.06Å; Q489-C511 HydrophobicContact CG-CB 3.82Å
490	S	81.7	Confident	76.4	Confident	55 Å²	55	62.2 Å²	62.2	39%	0.385	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	151.8	171.5	-60.6	0	0	0	0	110.1	G477 Q507 S508	G477-S490 PolarHBondContact N-O 3.27Å; S490-Q507 CarbonylContact C-O 3.52Å; S490-Q507 VanDerWaalsContact CA-O 3.22Å; S490-Q507 WeakPolarHBondContact CA-O 3.36Å; S490-S508 PolarHBondContact OG-OG 3.04Å
491	R	88.1	Confident	75.2	Confident	61 Å²	61	66.4 Å²	66.4	23%	0.23	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.8	171.5	62.6	-179.8	-171.7	172	1.2	110.3	W473 E474 W476 V506 Q507	W473-R491 HydrophobicContact CB-CG 4.5Å; W473-R491 HydrophobicContact CD2-CG 4.27Å; W473-R491 HydrophobicContact CE3-CB 4.48Å; W473-R491 HydrophobicContact CE3-CG 3.73Å; W473-R491 HydrophobicContact CZ3-CG 4.35Å; W473-R491 WeakPolarHBondContact CZ3-O 3.24Å; E474-R491 WeakPolarHBondContact O-CB 3.5Å; E474-R491 WeakPolarHBondContact O-CD 3.41Å; W476-R491 HydrophobicContact CD2-CB 4.25Å; W476-R491 HydrophobicContact CD2-CG 4.01Å; W476-R491 VanDerWaalsContact CE2-CD 3.46Å; W476-R491 HydrophobicContact CE3-CB 4.06Å; W476-R491 HydrophobicContact CE3-CG 3.87Å; W476-R491 HydrophobicContact CH2-CG 4.01Å; W476-R491 HydrophobicContact CZ2-CG 4.11Å; W476-R491 HydrophobicContact CZ3-CB 4.45Å; W476-R491 HydrophobicContact CZ3-CG 3.86Å; R491-V506 WeakPolarHBondContact O-CA 3.48Å; R491-Q507 HydrophobicContact CG-CB 4.01Å; R491-Q507 PolarHBondContact N-O 2.82Å; R491-Q507 PolarHBondContact O-N 3.35Å
492	T	87.2	Confident	74.3	Confident	59 Å²	59	72.1 Å²	72.1	36%	0.362	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	156.4	-175.6	19.9	0	0	0	0	110.6	E474 S505 V506	E474-T492 VanDerWaalsContact CB-O 3.31Å; E474-T492 WeakPolarHBondContact CB-O 3.41Å; E474-T492 WeakPolarHBondContact CG-O 3.33Å; E474-T492 PolarHBondContact N-O 3.26Å; E474-T492 WeakPolarHBondContact OE2-CB 3.49Å; E474-T492 PolarHBondContact OE2-OG1 2.88Å; T492-S505 CarbonylContact C-O 3.52Å; T492-S505 VanDerWaalsContact CA-O 3.3Å; T492-S505 WeakPolarHBondContact CA-O 3.28Å; T492-V506 HydrophobicContact CG2-CG2 3.95Å
493	R	88.8	Confident	73.3	Confident	21 Å²	21	64.5 Å²	64.5	8%	0.079	32%	0.323	C	S	.	.			trans	-139.6	149	166.9	68.3	178.7	-179.7	-179.5	0.1	109.8	D466 C470 W473 P504 S505	D466-R493 IonicContact OD1-NH2 3.29Å; D466-R493 IonicContact OD2-CZ 3.52Å; D466-R493 IonicContact OD2-NH1 3.09Å; D466-R493 PolarHBondContact OD2-NH1 2.89Å; D466-R493 IonicContact OD2-NH2 3.24Å; D466-R493 PolarHBondContact OD2-NH2 3.02Å; C470-R493 VanDerWaalsContact CB-CD 3.45Å; C470-R493 HydrophobicContact CB-CG 3.95Å; W473-R493 HydrophobicContact CD2-CB 4.05Å; W473-R493 HydrophobicContact CD2-CG 4.05Å; W473-R493 HydrophobicContact CE3-CB 3.79Å; W473-R493 HydrophobicContact CE3-CG 3.86Å; W473-R493 HydrophobicContact CG-CB 4.49Å; W473-R493 HydrophobicContact CH2-CG 3.93Å; W473-R493 HydrophobicContact CZ2-CG 4.12Å; W473-R493 HydrophobicContact CZ3-CB 4.17Å; W473-R493 HydrophobicContact CZ3-CG 3.8Å; R493-P504 PolarHBondContact NE-O 2.85Å; R493-P504 PolarHBondContact NH2-O 2.93Å; R493-S505 PolarHBondContact N-O 2.8Å
494	H	84.4	Confident	72.7	Confident	109 Å²	109	66.4 Å²	66.4	51%	0.505	34%	0.335	S	S	.	.			trans	-88.2	128.3	177.4	-168.4	76.9	0	0	0	109.6	C470 S471 S496	C470-H494 CarbonylContact C-O 3.48Å; C470-H494 VanDerWaalsContact CA-O 3.26Å; C470-H494 WeakPolarHBondContact CA-O 3.26Å; S471-H494 PolarHBondContact N-O 2.71Å; S471-H494 PolarHBondContact OG-N 1.99Å; S471-H494 PolarHBondContact OG-O 2.75Å; H494-S496 PolarHBondContact CD2-OG 2.93Å
495	C	78.2	Confident	72.5	Confident	7 Å²	7	68.9 Å²	68.9	5%	0.047	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-114.3	121.7	176.8	-56.4	0	0	0	0	109.7	C470 C503	C470-C495 HydrophobicContact CB-CB 4.01Å; C470-C495 WeakPolarHBondContact CB-SG 3.27Å; C470-C495 WeakPolarHBondContact SG-CB 3Å; C470-C495 CovalentContact SG-SG 2.04Å; C470-C495 PolarHBondContact SG-SG 3.39Å; C495-C503 HydrophobicContact CB-CB 4.47Å
496	S	64.6	Low	72.4	Confident	79 Å²	79	72.9 Å²	72.9	55%	0.552	38%	0.377	S	S	*	.			trans	-109	77.3	-167.7	-48.7	0	0	0	0	111	P469 H494	P469-S496 PolarHBondContact O-N 2.92Å; P469-S496 VanDerWaalsContact O-N 3.12Å; H494-S496 PolarHBondContact CD2-OG 2.93Å
497	D	63.3	Low	72.5	Confident	98 Å²	98	76.5 Å²	76.5	52%	0.524	39%	0.393	S	S	.	.	S	Bend	trans	-177.4	171.4	162.4	-140.8	-21.6	0	0	0	111.9	P469 R499 R500	P469-D497 HydrophobicContact CG-CB 4.28Å; D497-R499 PolarHBondContact O-N 2.92Å; D497-R500 PolarHBondContact O-N 2.87Å
498	D	57	Low	72.4	Confident	148 Å²	148	79.9 Å²	79.9	79%	0.791	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-10.9	170.9	-92.3	-22.6	0	0	0	114.1	H501	D498-H501 PolarHBondContact O-CE1 2.83Å; D498-H501 PolarHBondContact O-ND1 2.8Å
499	R	54.9	Low	72.4	Confident	155 Å²	155	83.8 Å²	83.8	59%	0.585	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	12.3	175.2	-54.1	-173.8	-146.9	-175.4	5.8	114.6	D497 H501 L502	D497-R499 PolarHBondContact O-N 2.92Å; R499-H501 PolarHBondContact O-N 2.92Å; R499-L502 HydrophobicContact CB-CD1 4.41Å; R499-L502 PolarHBondContact O-N 2.78Å
500	R	49.1	Very low	72.2	Confident	165 Å²	165	87.4 Å²	87.4	62%	0.623	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-27.7	-178.3	-163.4	176.6	-172.8	-170.5	2.8	114.6	D497 L502	D497-R500 PolarHBondContact O-N 2.87Å; R500-L502 VanDerWaalsContact C-N 3.35Å
501	H	56.6	Low	72.2	Confident	155 Å²	155	85.1 Å²	85.1	72%	0.718	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-10.5	180	49	-88.3	0	0	0	114.7	D498 R499	D498-H501 PolarHBondContact O-CE1 2.83Å; D498-H501 PolarHBondContact O-ND1 2.8Å; R499-H501 PolarHBondContact O-N 2.92Å
502	L	60.1	Low	72.3	Confident	128 Å²	128	85.4 Å²	85.4	67%	0.67	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-12.2	179.3	-72	158.3	0	0	0	113.5	R499 R500	R499-L502 HydrophobicContact CB-CD1 4.41Å; R499-L502 PolarHBondContact O-N 2.78Å; R500-L502 VanDerWaalsContact C-N 3.35Å
503	C	65.4	Low	72.3	Confident	13 Å²	13	86.2 Å²	86.2	9%	0.088	43%	0.43	C	S	.	.	S	Bend	trans	-111	131.4	-173.2	-69.3	0	0	0	0	112.5	C468 C470 C495 S505	C468-C503 WeakPolarHBondContact CA-SG 3.49Å; C468-C503 HydrophobicContact CB-CB 3.82Å; C468-C503 WeakPolarHBondContact CB-SG 3.13Å; C468-C503 WeakPolarHBondContact SG-CA 2.98Å; C468-C503 WeakPolarHBondContact SG-CB 3.46Å; C468-C503 CovalentContact SG-SG 2.04Å; C468-C503 PolarHBondContact SG-SG 2.04Å; C470-C503 VanDerWaalsContact SG-CB 3.59Å; C495-C503 HydrophobicContact CB-CB 4.47Å; C503-S505 PolarHBondContact O-N 3.17Å
504	P	71.7	Confident	72.2	Confident	72 Å²	72	91.7 Å²	91.7	47%	0.468	46%	0.457	S	S	.	.			trans	-67.6	122.5	176.9	23.9	-28.7	0	0	0	109.9	R493	R493-P504 PolarHBondContact NE-O 2.85Å; R493-P504 PolarHBondContact NH2-O 2.93Å
505	S	77.3	Confident	72.2	Confident	52 Å²	52	88.6 Å²	88.6	36%	0.364	45%	0.447	S	S	.	.			trans	-102.6	-6	177.3	63	0	0	0	0	113.7	T492 R493 C503	T492-S505 CarbonylContact C-O 3.52Å; T492-S505 VanDerWaalsContact CA-O 3.3Å; T492-S505 WeakPolarHBondContact CA-O 3.28Å; R493-S505 PolarHBondContact N-O 2.8Å; C503-S505 PolarHBondContact O-N 3.17Å
506	V	78.7	Confident	72.4	Confident	84 Å²	84	88.8 Å²	88.8	51%	0.509	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	136.8	179.3	-173.5	0	0	0	0	109.2	R491 T492	R491-V506 WeakPolarHBondContact O-CA 3.48Å; T492-V506 HydrophobicContact CG2-CG2 3.95Å
507	Q	77.5	Confident	73	Confident	77 Å²	77	93.4 Å²	93.4	36%	0.36	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	141.6	172.4	-165.5	-178	16.4	0	0	110	W473 W476 S490 R491	W473-Q507 HydrophobicContact CE3-CB 4.26Å; W473-Q507 HydrophobicContact CH2-CB 3.67Å; W473-Q507 HydrophobicContact CZ2-CB 4.1Å; W473-Q507 HydrophobicContact CZ3-CB 3.75Å; W476-Q507 HydrophobicContact CH2-CB 4.25Å; W476-Q507 HydrophobicContact CH2-CG 3.89Å; W476-Q507 WeakPolarHBondContact CZ3-O 3.48Å; S490-Q507 CarbonylContact C-O 3.52Å; S490-Q507 VanDerWaalsContact CA-O 3.22Å; S490-Q507 WeakPolarHBondContact CA-O 3.36Å; R491-Q507 HydrophobicContact CG-CB 4.01Å; R491-Q507 PolarHBondContact N-O 2.82Å; R491-Q507 PolarHBondContact O-N 3.35Å
508	S	74.2	Confident	73	Confident	71 Å²	71	93.1 Å²	93.1	50%	0.497	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	147.4	177.5	-56.4	0	0	0	0	111.5	Q489 S490	Q489-S508 CarbonylContact O-C 3.21Å; Q489-S508 WeakPolarHBondContact O-CA 3.33Å; S490-S508 PolarHBondContact OG-OG 3.04Å
509	R	77.5	Confident	73	Confident	118 Å²	118	88.9 Å²	88.9	45%	0.445	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	154.1	174.5	73.1	177.9	179.5	-175.5	0.6	111.4	W476 S488 Q489	W476-R509 HydrophobicContact CD2-CG 4.09Å; W476-R509 HydrophobicContact CE3-CG 3.8Å; W476-R509 HydrophobicContact CH2-CB 3.67Å; W476-R509 HydrophobicContact CH2-CG 3.64Å; W476-R509 HydrophobicContact CZ2-CB 4.22Å; W476-R509 HydrophobicContact CZ2-CG 3.97Å; W476-R509 HydrophobicContact CZ3-CB 3.93Å; W476-R509 HydrophobicContact CZ3-CG 3.57Å; S488-R509 CarbonylContact C-O 3.5Å; S488-R509 VanDerWaalsContact CA-O 3.26Å; S488-R509 WeakPolarHBondContact CA-O 3.01Å; S488-R509 PolarHBondContact OG-O 3.1Å; Q489-R509 HydrophobicContact CB-CG 4.22Å; Q489-R509 PolarHBondContact N-O 2.9Å; Q489-R509 PolarHBondContact O-N 3.06Å
510	K	79	Confident	73.3	Confident	109 Å²	109	90.3 Å²	90.3	47%	0.474	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	150.2	170.3	-71.6	-61.4	-165.5	178.3	0	111.6	C486 G487 F513	C486-K510 PolarHBondContact O-NZ 2.81Å; G487-K510 WeakPolarHBondContact O-CA 3.35Å; G487-K510 WeakPolarHBondContact O-CD 3.04Å; K510-F513 HydrophobicContact CB-CE1 3.86Å; K510-F513 HydrophobicContact CB-CZ 3.62Å; K510-F513 WeakPolarHBondContact O-CZ 3.2Å
511	C	83	Confident	73.5	Confident	7 Å²	7	87.2 Å²	87.2	5%	0.047	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	170.3	-175.8	52.7	0	0	0	0	111.1	C479 G485 G487 S488 Q489	C479-C511 WeakPolarHBondContact CA-SG 3.13Å; C479-C511 HydrophobicContact CB-CB 3.77Å; C479-C511 WeakPolarHBondContact CB-SG 3.48Å; C479-C511 WeakPolarHBondContact SG-CB 3.46Å; C479-C511 CovalentContact SG-SG 2Å; C479-C511 PolarHBondContact SG-SG 2.92Å; G485-C511 WeakPolarHBondContact CA-O 3.15Å; G487-C511 PolarHBondContact O-N 2.85Å; G487-C511 VanDerWaalsContact O-N 3.11Å; G487-C511 PolarHBondContact O-SG 2.81Å; S488-C511 PolarHBondContact N-SG 2.93Å; S488-C511 VanDerWaalsContact N-SG 3.39Å; Q489-C511 HydrophobicContact CG-CB 3.82Å
512	N	88.8	Confident	73.7	Confident	67 Å²	67	81.3 Å²	81.3	36%	0.358	44%	0.441	S	S	.	.			trans	55.1	60.3	178.4	-67.9	2.2	0	0	0	113.9	C479 Q481 E482 C483 G484 G485 E514	C479-N512 WeakPolarHBondContact CB-ND2 3.48Å; C479-N512 VanDerWaalsContact SG-CB 3.59Å; C479-N512 PolarHBondContact SG-ND2 2.02Å; C479-N512 VanDerWaalsContact SG-ND2 3.37Å; Q481-N512 WeakPolarHBondContact O-CB 2.91Å; Q481-N512 VanDerWaalsContact O-CG 3.3Å; Q481-N512 PolarHBondContact O-ND2 3.3Å; E482-N512 WeakPolarHBondContact O-CB 3.38Å; C483-N512 CarbonylContact C-O 3.52Å; C483-N512 WeakPolarHBondContact CA-O 3.46Å; G484-N512 PolarHBondContact N-O 3.23Å; G485-N512 VanDerWaalsContact CA-O 3.24Å; G485-N512 WeakPolarHBondContact CA-O 3.37Å; G485-N512 PolarHBondContact N-O 2.73Å; N512-E514 VanDerWaalsContact C-N 3.26Å; N512-E514 PolarHBondContact O-N 3.16Å
513	F	87.1	Confident	73.4	Confident	75 Å²	75	79 Å²	79	33%	0.329	43%	0.433	S	S	.	.			trans	-76.6	-2.6	-176.5	-61.8	-76.7	0	0	0	114.5	K510 M539 L546 C547	K510-F513 HydrophobicContact CB-CE1 3.86Å; K510-F513 HydrophobicContact CB-CZ 3.62Å; K510-F513 WeakPolarHBondContact O-CZ 3.2Å; F513-M539 HydrophobicContact CD1-CE 4.13Å; F513-M539 HydrophobicContact CD1-SD 3.57Å; F513-M539 VanDerWaalsContact CD1-SD 3.57Å; F513-M539 HydrophobicContact CE1-CE 4.05Å; F513-M539 HydrophobicContact CE1-SD 3.68Å; F513-L546 HydrophobicContact CB-CD2 4.36Å; F513-L546 CarbonylContact O-C 3.47Å; F513-C547 WeakPolarHBondContact CD1-O 3.41Å; F513-C547 WeakPolarHBondContact O-CA 3.44Å; F513-C547 WeakPolarHBondContact O-CB 3.25Å; F513-C547 PolarHBondContact O-N 2.83Å; F513-C547 PolarHBondContact O-SG 3.41Å
514	E	87.9	Confident	72.7	Confident	137 Å²	137	81.7 Å²	81.7	64%	0.64	45%	0.446	S	S	*	.	B	Isolated β-bridge	trans	-64.2	140.3	173.8	-64.8	-179	177.6	0	0	110.5	C483 G484 N512 C516 L546	C483-E514 CarbonylContact C-O 3.59Å; C483-E514 WeakPolarHBondContact CA-O 3.42Å; C483-E514 WeakPolarHBondContact CB-O 3.36Å; G484-E514 WeakPolarHBondContact CA-O 3Å; G484-E514 PolarHBondContact N-O 2.9Å; N512-E514 VanDerWaalsContact C-N 3.26Å; N512-E514 PolarHBondContact O-N 3.16Å; E514-C516 PolarHBondContact O-N 2.65Å; E514-L546 HydrophobicContact CG-CD2 4.03Å
515	S	84.3	Confident	71.4	Confident	44 Å²	44	84 Å²	84	31%	0.308	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-60.2	136.7	179.2	60.8	0	0	0	0	112.5	G545	S515-G545 PolarHBondContact N-O 2.83Å
516	C	81.9	Confident	70	Confident	10 Å²	10	84.9 Å²	84.9	7%	0.068	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-69	133.4	167.7	-62.5	0	0	0	0	111.6	C483 G484 E514 L531 G534	C483-C516 HydrophobicContact CB-CB 3.94Å; C483-C516 WeakPolarHBondContact CB-SG 3.49Å; C483-C516 WeakPolarHBondContact SG-CA 3.45Å; C483-C516 WeakPolarHBondContact SG-CB 3.31Å; C483-C516 CovalentContact SG-SG 2.03Å; C483-C516 PolarHBondContact SG-SG 3.34Å; G484-C516 PolarHBondContact N-SG 2.84Å; E514-C516 PolarHBondContact O-N 2.65Å; C516-L531 HydrophobicContact CB-CD1 3.58Å; C516-G534 PolarHBondContact N-O 3.26Å; C516-G534 VanDerWaalsContact O-CA 3.26Å; C516-G534 WeakPolarHBondContact O-CA 3.2Å
517	E	77.2	Confident	68.4	Low	177 Å²	177	86.8 Å²	86.8	83%	0.827	48%	0.475	S	S	*	.	S	Bend	trans	-79.4	145.2	172.1	-66.6	-168	161.6	0	0	112.3	S519	E517-S519 PolarHBondContact O-N 2.81Å
518	G	62.8	Low	67.5	Low	92 Å²	92	90.3 Å²	90.3	95%	0.948	49%	0.489	S	S	*	.	S	Bend	trans	71.9	-10.3	162	0	0	0	0	0	118.4
519	S	57.8	Low	66.6	Low	59 Å²	59	88.2 Å²	88.2	41%	0.413	47%	0.472	S	S	.	.			trans	-126.2	133.6	-168.5	-52.6	0	0	0	0	113.3	E517 L531	E517-S519 PolarHBondContact O-N 2.81Å; S519-L531 WeakPolarHBondContact O-CD1 3.4Å
520	K	61.1	Low	65.9	Low	184 Å²	184	88 Å²	88	80%	0.8	48%	0.478	S	S	*	.	S	Bend	trans	-89.4	-5.3	172	-64.3	-174.1	-178.8	179.7	0	113.2	L531	K520-L531 PolarHBondContact O-N 2.9Å
521	M	53.8	Low	65.1	Low	101 Å²	101	83.4 Å²	83.4	50%	0.498	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	141.4	-177.5	-175.7	176.8	75.2	0	0	108	V523 F528 H529	M521-V523 HydrophobicContact CE-CG2 3.98Å; M521-F528 HydrophobicContact SD-CD1 4.2Å; M521-H529 WeakPolarHBondContact CA-O 3.17Å
522	I	61	Low	64.3	Low	31 Å²	31	86.3 Å²	86.3	16%	0.159	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	140.5	165	61.2	175.3	0	0	0	108.6	C486 H529 L531	C486-I522 HydrophobicContact CB-CD1 3.96Å; I522-H529 HydrophobicContact CD1-CB 4.19Å; I522-H529 HydrophobicContact CG1-CB 3.66Å; I522-H529 PolarHBondContact N-O 3.4Å; I522-H529 PolarHBondContact O-N 3.13Å; I522-L531 HydrophobicContact CG2-CD1 3.62Å; I522-L531 HydrophobicContact CG2-CG 4.45Å
523	V	52.9	Low	63.6	Low	80 Å²	80	88.3 Å²	88.3	49%	0.485	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	115.8	173.4	-176	0	0	0	0	105.6	M521 F528	M521-V523 HydrophobicContact CE-CG2 3.98Å; V523-F528 HydrophobicContact CB-CE1 4.46Å; V523-F528 HydrophobicContact CG1-CD1 4.38Å; V523-F528 HydrophobicContact CG1-CE1 4.12Å; V523-F528 HydrophobicContact CG1-CZ 4.29Å; V523-F528 HydrophobicContact CG2-CD1 3.54Å; V523-F528 HydrophobicContact CG2-CE1 3.5Å; V523-F528 HydrophobicContact CG2-CG 4.49Å; V523-F528 HydrophobicContact CG2-CZ 4.44Å
524	N	50.6	Low	63.2	Low	68 Å²	68	85.1 Å²	85.1	36%	0.364	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	141.5	-179.6	-165.1	6.2	0	0	0	110.9	Q481 G526 E527	Q481-N524 PolarHBondContact OE1-ND2 2.95Å; N524-G526 PolarHBondContact O-N 2.78Å; N524-E527 PolarHBondContact N-O 2.94Å; N524-E527 VanDerWaalsContact N-O 3.1Å; N524-E527 PolarHBondContact O-N 2.86Å; N524-E527 VanDerWaalsContact O-N 3.08Å
525	N	45.6	Very low	62.7	Low	120 Å²	120	78.6 Å²	78.6	64%	0.642	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	30.7	-173.5	-63.1	-34.7	0	0	0	114.6	E527	N525-E527 PolarHBondContact O-N 2.98Å
526	G	47	Very low	62.1	Low	71 Å²	71	77 Å²	77	73%	0.732	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	2.5	-178.1	0	0	0	0	0	114.7	N524	N524-G526 PolarHBondContact O-N 2.78Å
527	E	46	Very low	61.3	Low	125 Å²	125	81.1 Å²	81.1	58%	0.584	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	137.1	175.2	-66.4	-168.8	162.8	0	0	111	N524 N525 H529	N524-E527 PolarHBondContact N-O 2.94Å; N524-E527 VanDerWaalsContact N-O 3.1Å; N524-E527 PolarHBondContact O-N 2.86Å; N524-E527 VanDerWaalsContact O-N 3.08Å; N525-E527 PolarHBondContact O-N 2.98Å; E527-H529 IonicContact OE2-CE1 3.88Å; E527-H529 IonicContact OE2-NE2 2.68Å
528	F	57.3	Low	60.4	Low	151 Å²	151	75.2 Å²	75.2	66%	0.662	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	122.4	173.8	-71.7	-93.7	0	0	0	109.4	M521 V523	M521-F528 HydrophobicContact SD-CD1 4.2Å; V523-F528 HydrophobicContact CB-CE1 4.46Å; V523-F528 HydrophobicContact CG1-CD1 4.38Å; V523-F528 HydrophobicContact CG1-CE1 4.12Å; V523-F528 HydrophobicContact CG1-CZ 4.29Å; V523-F528 HydrophobicContact CG2-CD1 3.54Å; V523-F528 HydrophobicContact CG2-CE1 3.5Å; V523-F528 HydrophobicContact CG2-CG 4.49Å; V523-F528 HydrophobicContact CG2-CZ 4.44Å
529	H	56.4	Low	60.6	Low	27 Å²	27	71.6 Å²	71.6	13%	0.125	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.1	171	-56.8	-66.2	0	0	0	110.4	Q481 C486 M521 I522 E527	Q481-H529 PolarHBondContact NE2-NE2 3.4Å; C486-H529 HydrophobicContact CB-CB 4.45Å; M521-H529 WeakPolarHBondContact CA-O 3.17Å; I522-H529 HydrophobicContact CD1-CB 4.19Å; I522-H529 HydrophobicContact CG1-CB 3.66Å; I522-H529 PolarHBondContact N-O 3.4Å; I522-H529 PolarHBondContact O-N 3.13Å; E527-H529 IonicContact OE2-CE1 3.88Å; E527-H529 IonicContact OE2-NE2 2.68Å
530	L	62.6	Low	61.3	Low	112 Å²	112	71.6 Å²	71.6	59%	0.586	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	135.4	171.4	-71.1	168.6	0	0	0	109.2	C536 V537	L530-C536 WeakPolarHBondContact O-CA 3.3Å; L530-V537 HydrophobicContact CB-CG2 3.47Å; L530-V537 VanDerWaalsContact CB-CG2 3.47Å; L530-V537 HydrophobicContact CD1-CG2 4.44Å; L530-V537 PolarHBondContact O-N 2.79Å
531	L	63	Low	62.2	Low	13 Å²	13	65.6 Å²	65.6	7%	0.068	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.4	176.9	-61	175.1	0	0	0	110.1	C486 C516 S519 K520 I522 C535	C486-L531 VanDerWaalsContact SG-CD2 3.58Å; C516-L531 HydrophobicContact CB-CD1 3.58Å; S519-L531 WeakPolarHBondContact O-CD1 3.4Å; K520-L531 PolarHBondContact O-N 2.9Å; I522-L531 HydrophobicContact CG2-CD1 3.62Å; I522-L531 HydrophobicContact CG2-CG 4.45Å; L531-C535 CarbonylContact C-O 3.59Å; L531-C535 VanDerWaalsContact CA-O 3.27Å; L531-C535 WeakPolarHBondContact CA-O 3.5Å
532	F	66.4	Low	63.5	Low	69 Å²	69	63.4 Å²	63.4	30%	0.303	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	114.9	170.9	-169.6	-96.5	0	0	0	108.5	G534 C535 I553 L557	F532-G534 VanDerWaalsContact C-N 3.31Å; F532-G534 PolarHBondContact O-N 3.49Å; F532-C535 PolarHBondContact N-O 2.84Å; F532-C535 WeakPolarHBondContact O-CB 3.19Å; F532-C535 PolarHBondContact O-N 3.28Å; F532-I553 HydrophobicContact CD1-CD1 3.93Å; F532-I553 HydrophobicContact CD1-CG2 4.28Å; F532-I553 HydrophobicContact CE1-CD1 3.87Å; F532-I553 HydrophobicContact CE1-CG2 4.38Å; F532-L557 HydrophobicContact CD2-CD1 4.34Å; F532-L557 HydrophobicContact CD2-CD2 4.16Å; F532-L557 HydrophobicContact CE2-CD2 3.93Å; F532-L557 HydrophobicContact CE2-CG 4.39Å; F532-L557 HydrophobicContact CG-CD1 4.5Å
533	N	73.1	Confident	64.4	Low	108 Å²	108	68.5 Å²	68.5	58%	0.578	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	48.1	-171.4	-66	-7.6	0	0	0	113	C535 L541	N533-C535 PolarHBondContact O-N 3.32Å; N533-L541 HydrophobicContact CB-CB 4.27Å; N533-L541 HydrophobicContact CB-CD2 4.38Å
534	G	79.2	Confident	65.8	Low	9 Å²	9	68.6 Å²	68.6	9%	0.093	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	-2.5	-178.3	0	0	0	0	0	115	G484 C516 F532	G484-G534 WeakPolarHBondContact CA-O 3.35Å; C516-G534 PolarHBondContact N-O 3.26Å; C516-G534 VanDerWaalsContact O-CA 3.26Å; C516-G534 WeakPolarHBondContact O-CA 3.2Å; F532-G534 VanDerWaalsContact C-N 3.31Å; F532-G534 PolarHBondContact O-N 3.49Å
535	C	76.8	Confident	67.2	Low	0 Å²	0	67.1 Å²	67.1	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	141.6	-178.7	-63	0	0	0	0	112.9	L531 F532 N533 M539 L541 C547	L531-C535 CarbonylContact C-O 3.59Å; L531-C535 VanDerWaalsContact CA-O 3.27Å; L531-C535 WeakPolarHBondContact CA-O 3.5Å; F532-C535 PolarHBondContact N-O 2.84Å; F532-C535 WeakPolarHBondContact O-CB 3.19Å; F532-C535 PolarHBondContact O-N 3.28Å; N533-C535 PolarHBondContact O-N 3.32Å; C535-M539 HydrophobicContact CB-CB 4.06Å; C535-L541 VanDerWaalsContact SG-CA 3.51Å; C535-L541 PolarHBondContact SG-N 3.33Å; C535-C547 WeakPolarHBondContact CA-SG 3.36Å; C535-C547 HydrophobicContact CB-CB 3.63Å; C535-C547 WeakPolarHBondContact CB-SG 3.36Å; C535-C547 WeakPolarHBondContact SG-CA 3.36Å; C535-C547 WeakPolarHBondContact SG-CB 3.34Å; C535-C547 CovalentContact SG-SG 2.02Å; C535-C547 PolarHBondContact SG-SG 2.86Å
536	C	71.6	Confident	69.1	Low	9 Å²	9	64.3 Å²	64.3	6%	0.061	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	143.3	173.1	-115.2	0	0	0	0	111.6	G484 C486 L530 G538 M539	G484-C536 WeakPolarHBondContact O-CB 3.31Å; G484-C536 PolarHBondContact O-N 2.74Å; C486-C536 WeakPolarHBondContact CA-SG 3.36Å; C486-C536 HydrophobicContact CB-CB 4.07Å; C486-C536 WeakPolarHBondContact CB-SG 3.26Å; C486-C536 WeakPolarHBondContact SG-CB 3.42Å; C486-C536 CovalentContact SG-SG 2.02Å; C486-C536 PolarHBondContact SG-SG 3.09Å; L530-C536 WeakPolarHBondContact O-CA 3.3Å; C536-G538 PolarHBondContact O-N 3.21Å; C536-M539 HydrophobicContact CB-CE 4.33Å; C536-M539 WeakPolarHBondContact O-CB 3.25Å; C536-M539 PolarHBondContact O-N 3Å
537	V	64.5	Low	70.6	Confident	97 Å²	97	61 Å²	61	59%	0.588	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	125.5	176.3	170.7	0	0	0	0	111.2	L530	L530-V537 HydrophobicContact CB-CG2 3.47Å; L530-V537 VanDerWaalsContact CB-CG2 3.47Å; L530-V537 HydrophobicContact CD1-CG2 4.44Å; L530-V537 PolarHBondContact O-N 2.79Å
538	G	59.3	Low	72	Confident	53 Å²	53	59.2 Å²	59.2	55%	0.546	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.5	-11.7	-172.2	0	0	0	0	0	113.8	C536 S550	C536-G538 PolarHBondContact O-N 3.21Å; G538-S550 PolarHBondContact O-N 3.27Å
539	M	67	Low	72.1	Confident	16 Å²	16	57.1 Å²	57.1	8%	0.079	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	146.9	172.3	-62	-158.6	-109.8	0	0	111.6	G485 F513 C535 C536 C547 K548	G485-M539 WeakPolarHBondContact O-CE 3.45Å; F513-M539 HydrophobicContact CD1-CE 4.13Å; F513-M539 HydrophobicContact CD1-SD 3.57Å; F513-M539 VanDerWaalsContact CD1-SD 3.57Å; F513-M539 HydrophobicContact CE1-CE 4.05Å; F513-M539 HydrophobicContact CE1-SD 3.68Å; C535-M539 HydrophobicContact CB-CB 4.06Å; C536-M539 HydrophobicContact CB-CE 4.33Å; C536-M539 WeakPolarHBondContact O-CB 3.25Å; C536-M539 PolarHBondContact O-N 3Å; M539-C547 HydrophobicContact CB-CB 3.91Å; M539-C547 HydrophobicContact SD-CB 4.08Å; M539-C547 VanDerWaalsContact SD-O 3.36Å; M539-K548 CarbonylContact C-O 3.39Å; M539-K548 WeakPolarHBondContact CA-O 3.4Å
540	Q	72.8	Confident	72	Confident	59 Å²	59	56.5 Å²	56.5	28%	0.276	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.3	174	169.5	165.8	22.1	0	0	108	Q542 K548 S550 I553	Q540-Q542 PolarHBondContact O-N 3.33Å; Q540-Q542 VanDerWaalsContact O-N 3.13Å; Q540-Q542 PolarHBondContact O-NE2 2.83Å; Q540-K548 PolarHBondContact N-O 3.44Å; Q540-K548 PolarHBondContact O-N 2.87Å; Q540-S550 PolarHBondContact OE1-OG 3.25Å; Q540-I553 HydrophobicContact CB-CD1 3.42Å; Q540-I553 VanDerWaalsContact CB-CD1 3.42Å; Q540-I553 HydrophobicContact CB-CG1 3.91Å; Q540-I553 HydrophobicContact CG-CD1 3.43Å; Q540-I553 VanDerWaalsContact CG-CD1 3.43Å; Q540-I553 HydrophobicContact CG-CG1 3.98Å
541	L	79.9	Confident	71.2	Confident	59 Å²	59	56.1 Å²	56.1	31%	0.309	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	116.2	164.5	-172.7	57.2	0	0	0	108.8	N533 C535 G545	N533-L541 HydrophobicContact CB-CB 4.27Å; N533-L541 HydrophobicContact CB-CD2 4.38Å; C535-L541 VanDerWaalsContact SG-CA 3.51Å; C535-L541 PolarHBondContact SG-N 3.33Å; L541-G545 WeakPolarHBondContact CD1-O 3.3Å
542	Q	80.3	Confident	70.3	Confident	55 Å²	55	57.9 Å²	57.9	26%	0.257	36%	0.36	S	S	.	.			trans	-87.5	164.1	175.5	-63	-59.4	-51.1	0	0	110.3	Q540 D544 G545 L546 K548	Q540-Q542 PolarHBondContact O-N 3.33Å; Q540-Q542 VanDerWaalsContact O-N 3.13Å; Q540-Q542 PolarHBondContact O-NE2 2.83Å; Q542-D544 WeakPolarHBondContact CB-OD1 3.38Å; Q542-D544 PolarHBondContact O-N 3.13Å; Q542-G545 PolarHBondContact O-N 3.35Å; Q542-L546 WeakPolarHBondContact CB-O 3.28Å; Q542-L546 WeakPolarHBondContact CG-O 3.42Å; Q542-L546 PolarHBondContact N-O 2.62Å; Q542-K548 HydrophobicContact CG-CB 3.57Å; Q542-K548 HydrophobicContact CG-CD 3.76Å; Q542-K548 HydrophobicContact CG-CG 3.55Å
543	P	79.6	Confident	69.2	Low	137 Å²	137	55.6 Å²	55.6	89%	0.89	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-19.5	175.2	-26	35.4	0	0	0	114.7	G545	P543-G545 VanDerWaalsContact C-N 3.26Å; P543-G545 PolarHBondContact O-N 2.77Å
544	D	83.2	Confident	67.4	Low	83 Å²	83	55.4 Å²	55.4	44%	0.444	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	9.8	176.5	64.7	2.9	0	0	0	113.7	Q542 L546 K548	Q542-D544 WeakPolarHBondContact CB-OD1 3.38Å; Q542-D544 PolarHBondContact O-N 3.13Å; D544-L546 PolarHBondContact O-N 2.85Å; D544-L546 WeakPolarHBondContact OD1-CB 3.41Å; D544-L546 PolarHBondContact OD1-N 2.78Å; D544-L546 VanDerWaalsContact OD1-N 3.15Å; D544-K548 WeakPolarHBondContact OD2-CE 2.96Å; D544-K548 IonicContact OD2-NZ 3.82Å; D544-K548 PolarHBondContact OD2-NZ 2.82Å
545	G	80.4	Confident	65.3	Low	36 Å²	36	58.1 Å²	58.1	37%	0.371	37%	0.372	S	S	.	.	S	Bend	trans	78	-0.3	179.6	0	0	0	0	0	114.3	S515 L541 Q542 P543	S515-G545 PolarHBondContact N-O 2.83Å; L541-G545 WeakPolarHBondContact CD1-O 3.3Å; Q542-G545 PolarHBondContact O-N 3.35Å; P543-G545 VanDerWaalsContact C-N 3.26Å; P543-G545 PolarHBondContact O-N 2.77Å
546	L	85.5	Confident	63.6	Low	62 Å²	62	62.6 Å²	62.6	33%	0.325	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-99	135.7	-179	-60.9	171.5	0	0	0	111.5	F513 E514 Q542 D544 K548	F513-L546 HydrophobicContact CB-CD2 4.36Å; F513-L546 CarbonylContact O-C 3.47Å; E514-L546 HydrophobicContact CG-CD2 4.03Å; Q542-L546 WeakPolarHBondContact CB-O 3.28Å; Q542-L546 WeakPolarHBondContact CG-O 3.42Å; Q542-L546 PolarHBondContact N-O 2.62Å; D544-L546 PolarHBondContact O-N 2.85Å; D544-L546 WeakPolarHBondContact OD1-CB 3.41Å; D544-L546 PolarHBondContact OD1-N 2.78Å; D544-L546 VanDerWaalsContact OD1-N 3.15Å; L546-K548 HydrophobicContact CB-CG 4.4Å; L546-K548 PolarHBondContact O-N 3.21Å; L546-K548 VanDerWaalsContact O-N 3.13Å
547	C	78	Confident	62	Low	0 Å²	0	66.2 Å²	66.2	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	101.3	165.7	-59.2	0	0	0	0	109.1	F513 C535 M539	F513-C547 WeakPolarHBondContact CD1-O 3.41Å; F513-C547 WeakPolarHBondContact O-CA 3.44Å; F513-C547 WeakPolarHBondContact O-CB 3.25Å; F513-C547 PolarHBondContact O-N 2.83Å; F513-C547 PolarHBondContact O-SG 3.41Å; C535-C547 WeakPolarHBondContact CA-SG 3.36Å; C535-C547 HydrophobicContact CB-CB 3.63Å; C535-C547 WeakPolarHBondContact CB-SG 3.36Å; C535-C547 WeakPolarHBondContact SG-CA 3.36Å; C535-C547 WeakPolarHBondContact SG-CB 3.34Å; C535-C547 CovalentContact SG-SG 2.02Å; C535-C547 PolarHBondContact SG-SG 2.86Å; M539-C547 HydrophobicContact CB-CB 3.91Å; M539-C547 HydrophobicContact SD-CB 4.08Å; M539-C547 VanDerWaalsContact SD-O 3.36Å
548	K	76.3	Confident	60.7	Low	89 Å²	89	64.5 Å²	64.5	39%	0.387	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	150.7	172.8	-59	-168.3	-164	171	0	110.5	M539 Q540 Q542 D544 L546 S550	M539-K548 CarbonylContact C-O 3.39Å; M539-K548 WeakPolarHBondContact CA-O 3.4Å; Q540-K548 PolarHBondContact N-O 3.44Å; Q540-K548 PolarHBondContact O-N 2.87Å; Q542-K548 HydrophobicContact CG-CB 3.57Å; Q542-K548 HydrophobicContact CG-CD 3.76Å; Q542-K548 HydrophobicContact CG-CG 3.55Å; D544-K548 WeakPolarHBondContact OD2-CE 2.96Å; D544-K548 IonicContact OD2-NZ 3.82Å; D544-K548 PolarHBondContact OD2-NZ 2.82Å; L546-K548 HydrophobicContact CB-CG 4.4Å; L546-K548 PolarHBondContact O-N 3.21Å; L546-K548 VanDerWaalsContact O-N 3.13Å; K548-S550 PolarHBondContact O-N 3.3Å; K548-S550 VanDerWaalsContact O-N 3.11Å
549	P	58.8	Low	59.8	Low	107 Å²	107	66.8 Å²	66.8	70%	0.695	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-51.4	122	172.1	-25	33.6	0	0	0	110.5
550	S	54.1	Low	58.2	Low	13 Å²	13	72.2 Å²	72.2	9%	0.091	45%	0.447	C	S	.	.			trans	-90.2	125.2	-176.9	-171.4	0	0	0	0	111.7	G538 Q540 K548 A552 I553 T554	G538-S550 PolarHBondContact O-N 3.27Å; Q540-S550 PolarHBondContact OE1-OG 3.25Å; K548-S550 PolarHBondContact O-N 3.3Å; K548-S550 VanDerWaalsContact O-N 3.11Å; S550-A552 PolarHBondContact OG-N 2.79Å; S550-I553 WeakPolarHBondContact OG-CB 3.27Å; S550-I553 PolarHBondContact OG-N 2.83Å; S550-T554 PolarHBondContact O-OG1 2.75Å
551	A	46.5	Very low	56.5	Low	104 Å²	104	77.3 Å²	77.3	86%	0.86	48%	0.475	S	S	*	.	S	Bend	trans	-72.2	-18.5	163.7	0	0	0	0	0	112.6
552	A	43.4	Very low	54.3	Low	50 Å²	50	81.2 Å²	81.2	41%	0.413	50%	0.496	S	S	.	.	S	Bend	trans	-115.5	-28	-163.7	0	0	0	0	0	115.7	S550 T554 S555	S550-A552 PolarHBondContact OG-N 2.79Å; A552-T554 PolarHBondContact O-N 2.84Å; A552-S555 VanDerWaalsContact O-CB 3.28Å; A552-S555 WeakPolarHBondContact O-CB 3.27Å; A552-S555 PolarHBondContact O-N 3.21Å
553	I	42.3	Very low	52.1	Low	21 Å²	21	86.6 Å²	86.6	11%	0.108	53%	0.525	C	S	.	.	H	α-helix	trans	-72.6	-20.8	177.6	-69.2	-165.8	0	0	0	111.6	F532 Q540 S550 S555 I556 L557	F532-I553 HydrophobicContact CD1-CD1 3.93Å; F532-I553 HydrophobicContact CD1-CG2 4.28Å; F532-I553 HydrophobicContact CE1-CD1 3.87Å; F532-I553 HydrophobicContact CE1-CG2 4.38Å; Q540-I553 HydrophobicContact CB-CD1 3.42Å; Q540-I553 VanDerWaalsContact CB-CD1 3.42Å; Q540-I553 HydrophobicContact CB-CG1 3.91Å; Q540-I553 HydrophobicContact CG-CD1 3.43Å; Q540-I553 VanDerWaalsContact CG-CD1 3.43Å; Q540-I553 HydrophobicContact CG-CG1 3.98Å; S550-I553 WeakPolarHBondContact OG-CB 3.27Å; S550-I553 PolarHBondContact OG-N 2.83Å; I553-S555 PolarHBondContact O-N 2.78Å; I553-S555 VanDerWaalsContact O-N 3.11Å; I553-I556 PolarHBondContact O-N 3.4Å; I553-L557 HydrophobicContact CG2-CD1 3.85Å
554	T	35.8	Very low	49.6	Very low	105 Å²	105	83.7 Å²	83.7	64%	0.644	52%	0.52	S	S	*	.	H	α-helix	trans	-60.8	-13.9	166.3	-30.3	0	0	0	0	113	S550 A552	S550-T554 PolarHBondContact O-OG1 2.75Å; A552-T554 PolarHBondContact O-N 2.84Å
555	S	36.4	Very low	47.2	Very low	66 Å²	66	92.7 Å²	92.7	46%	0.462	56%	0.56	S	S	.	*	H	α-helix	trans	-99.9	-30.5	179.7	151.7	0	0	0	0	113.9	A552 I553	A552-S555 VanDerWaalsContact O-CB 3.28Å; A552-S555 WeakPolarHBondContact O-CB 3.27Å; A552-S555 PolarHBondContact O-N 3.21Å; I553-S555 PolarHBondContact O-N 2.78Å; I553-S555 VanDerWaalsContact O-N 3.11Å
556	I	40.2	Very low	45.5	Very low	94 Å²	94	95.6 Å²	95.6	48%	0.482	57%	0.569	S	S	.	*	H	α-helix	trans	-99.1	-27.4	-167.4	-64.5	173.3	0	0	0	114.2	I553 G558 T559 L560	I553-I556 PolarHBondContact O-N 3.4Å; I556-G558 PolarHBondContact O-N 2.91Å; I556-G558 VanDerWaalsContact O-N 3.12Å; I556-T559 PolarHBondContact O-N 2.74Å; I556-T559 PolarHBondContact O-OG1 3.31Å; I556-T559 VanDerWaalsContact O-OG1 3.07Å; I556-L560 HydrophobicContact CG2-CD1 4.44Å
557	L	38.1	Very low	43.4	Very low	85 Å²	85	97.3 Å²	97.3	45%	0.445	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.6	-12.5	169.8	-82.6	158.8	0	0	0	112.5	F532 I553	F532-L557 HydrophobicContact CD2-CD1 4.34Å; F532-L557 HydrophobicContact CD2-CD2 4.16Å; F532-L557 HydrophobicContact CE2-CD2 3.93Å; F532-L557 HydrophobicContact CE2-CG 4.39Å; F532-L557 HydrophobicContact CG-CD1 4.5Å; I553-L557 HydrophobicContact CG2-CD1 3.85Å
558	G	36.7	Very low	41.5	Very low	61 Å²	61	102.7 Å²	102.7	63%	0.629	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-5.6	174.9	0	0	0	0	0	115.7	I556	I556-G558 PolarHBondContact O-N 2.91Å; I556-G558 VanDerWaalsContact O-N 3.12Å
559	T	39.7	Very low	39.4	Very low	100 Å²	100	103.5 Å²	103.5	61%	0.613	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	-11.8	-179.2	34.1	0	0	0	0	114.9	I556	I556-T559 PolarHBondContact O-N 2.74Å; I556-T559 PolarHBondContact O-OG1 3.31Å; I556-T559 VanDerWaalsContact O-OG1 3.07Å
560	L	34.1	Very low	38.2	Very low	131 Å²	131	103.3 Å²	103.3	69%	0.686	62%	0.624	S	S	*	*	S	Bend	trans	-104.5	-0.7	-168.3	-79.5	168.9	0	0	0	117.5	I556	I556-L560 HydrophobicContact CG2-CD1 4.44Å
561	L	37.6	Very low	37.1	Very low	165 Å²	165	109.3 Å²	109.3	86%	0.864	66%	0.659	S	S	*	*	S	Bend	trans	-109.6	10.4	175.1	-68.5	171.5	0	0	0	113.8
562	N	34.1	Very low	36.5	Very low	141 Å²	141	109.7 Å²	109.7	75%	0.754	65%	0.645	S	S	*	*			trans	-99.5	92.9	161.1	-89	-24.8	0	0	0	108.3
563	I	32.5	Very low	35.9	Very low	168 Å²	168	114.3 Å²	114.3	86%	0.862	66%	0.663	S	S	*	*	S	Bend	trans	-179.6	126	145.4	-82.4	143.6	0	0	0	104.9	Q565	I563-Q565 PolarHBondContact O-N 3.19Å
564	G	28.6	Very low	35.4	Very low	77 Å²	77	122.1 Å²	122.1	79%	0.794	71%	0.709	S	S	*	*			trans	-61.8	130.6	-171.4	0	0	0	0	0	115.2
565	Q	31.2	Very low	35.4	Very low	272 Å²	272	123.6 Å²	123.6	100%	1.271	72%	0.715	S	S	*	*			trans	-164.2	0	141.8	-105.9	-175.9	0.3	0	0	109	I563	I563-Q565 PolarHBondContact O-N 3.19Å

Retrieved 565 of 565 residues in 545.4 ms (Link to these results)

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