A0A3Q0KLB5_SCHMA Loading...

Delta-like protein

Putative Notch ligand involved in the mediation of Notch signaling.

AlphaFold DB , UniProt , Accession A0A3Q0KLB5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 613 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	50.5	Low	64	Low	213 Å²	213	127.8 Å²	127.8	100%	1.049	65%	0.654	S	S	*	*				0	-33	0	-78.1	174.2	94.7	0	0	114.9	M3 I4	M1-M3 PolarHBondContact O-N 3.14Å; M1-I4 PolarHBondContact O-N 3.45Å
2	K	52.1	Low	65	Low	199 Å²	199	125.3 Å²	125.3	87%	0.865	64%	0.642	S	S	*	*	H	α-helix	trans	-62.5	-34.4	-177.3	-77.8	-176.2	175	-179.2	0	115.9
3	M	52.6	Low	66	Low	158 Å²	158	123.6 Å²	123.6	78%	0.778	64%	0.635	S	S	*	*	H	α-helix	trans	-72.1	-27.8	-179.7	-74.5	-153.1	-69	0	0	114.6	M1 S5 S6	M1-M3 PolarHBondContact O-N 3.14Å; M3-S5 VanDerWaalsContact C-N 3.28Å; M3-S5 PolarHBondContact O-N 3.43Å; M3-S6 PolarHBondContact O-N 3.44Å
4	I	53.9	Low	66.5	Low	132 Å²	132	122.1 Å²	122.1	68%	0.677	63%	0.628	S	S	*	*	H	α-helix	trans	-71.2	-29.1	-178.1	-60.5	166.3	0	0	0	110.7	M1 C8	M1-I4 PolarHBondContact O-N 3.45Å; I4-C8 PolarHBondContact O-N 3.21Å
5	S	62.2	Low	67	Low	83 Å²	83	123.1 Å²	123.1	58%	0.58	63%	0.626	S	S	*	*	H	α-helix	trans	-65.1	-41.5	178	-175.9	0	0	0	0	112.5	M3 C8 L9	M3-S5 VanDerWaalsContact C-N 3.28Å; M3-S5 PolarHBondContact O-N 3.43Å; S5-C8 PolarHBondContact O-N 3.37Å; S5-L9 PolarHBondContact O-N 3.42Å
6	S	66.1	Low	67.5	Low	71 Å²	71	122.1 Å²	122.1	50%	0.497	62%	0.622	S	S	.	*	H	α-helix	trans	-70.1	-39.3	-175.5	-170.8	0	0	0	0	112.8	M3 L9 I10	M3-S6 PolarHBondContact O-N 3.44Å; S6-L9 PolarHBondContact O-N 3.41Å; S6-I10 WeakPolarHBondContact O-CG1 3.47Å; S6-I10 PolarHBondContact O-N 3.47Å
7	Y	70.1	Confident	67.8	Low	172 Å²	172	123.6 Å²	123.6	68%	0.675	62%	0.619	S	S	*	*	H	α-helix	trans	-66.6	-38.6	176.2	-87.7	-83.6	0	0	0	112.3	L9 I10 I11	Y7-L9 VanDerWaalsContact C-N 3.31Å; Y7-L9 PolarHBondContact O-N 3.31Å; Y7-I10 PolarHBondContact O-N 3.28Å; Y7-I11 WeakPolarHBondContact O-CG1 3.37Å; Y7-I11 PolarHBondContact O-N 3.47Å
8	C	71.2	Confident	67.7	Low	77 Å²	77	125.6 Å²	125.6	52%	0.52	62%	0.62	S	S	.	*	H	α-helix	trans	-64.8	-37.7	178.4	-148.1	0	0	0	0	111.6	I4 S5 I11 L12	I4-C8 PolarHBondContact O-N 3.21Å; S5-C8 PolarHBondContact O-N 3.37Å; C8-I11 PolarHBondContact O-N 3.47Å; C8-L12 PolarHBondContact O-N 3.46Å; C8-L12 VanDerWaalsContact O-N 3.12Å
9	L	73.4	Confident	67.9	Low	110 Å²	110	123.9 Å²	123.9	58%	0.576	61%	0.612	S	S	*	*	H	α-helix	trans	-65.7	-41	177.9	-150.1	82.7	0	0	0	112.5	S5 S6 Y7 L12 L13	S5-L9 PolarHBondContact O-N 3.42Å; S6-L9 PolarHBondContact O-N 3.41Å; Y7-L9 VanDerWaalsContact C-N 3.31Å; Y7-L9 PolarHBondContact O-N 3.31Å; L9-L12 PolarHBondContact O-N 3.37Å; L9-L13 WeakPolarHBondContact O-CG 3.46Å; L9-L13 PolarHBondContact O-N 3.5Å
10	I	75.6	Confident	67.7	Low	89 Å²	89	124.1 Å²	124.1	46%	0.456	61%	0.612	S	S	.	*	H	α-helix	trans	-65.4	-39.7	178.7	-67.4	165.2	0	0	0	111	S6 Y7 L13 N14	S6-I10 WeakPolarHBondContact O-CG1 3.47Å; S6-I10 PolarHBondContact O-N 3.47Å; Y7-I10 PolarHBondContact O-N 3.28Å; I10-L13 PolarHBondContact O-N 3.42Å; I10-N14 PolarHBondContact O-N 3.44Å
11	I	76.5	Confident	67.6	Low	102 Å²	102	121.1 Å²	121.1	52%	0.523	60%	0.597	S	S	.	*	H	α-helix	trans	-66.6	-39.3	177.8	-64.7	167.3	0	0	0	111	Y7 C8 K15	Y7-I11 WeakPolarHBondContact O-CG1 3.37Å; Y7-I11 PolarHBondContact O-N 3.47Å; C8-I11 PolarHBondContact O-N 3.47Å; I11-K15 PolarHBondContact O-N 3.3Å
12	L	76	Confident	67.9	Low	97 Å²	97	115.3 Å²	115.3	51%	0.508	57%	0.57	S	S	.	*	H	α-helix	trans	-65	-43.8	175.9	-84.8	158.4	0	0	0	112.1	C8 L9 K15 L16	C8-L12 PolarHBondContact O-N 3.46Å; C8-L12 VanDerWaalsContact O-N 3.12Å; L9-L12 PolarHBondContact O-N 3.37Å; L12-K15 PolarHBondContact O-N 3.39Å; L12-L16 PolarHBondContact O-N 3.21Å
13	L	77.9	Confident	68.2	Low	104 Å²	104	111 Å²	111	55%	0.545	56%	0.556	S	S	.	*	H	α-helix	trans	-63.6	-42.3	177.1	-74	165.3	0	0	0	112	L9 I10 K15 L16 Y17	L9-L13 WeakPolarHBondContact O-CG 3.46Å; L9-L13 PolarHBondContact O-N 3.5Å; I10-L13 PolarHBondContact O-N 3.42Å; L13-K15 VanDerWaalsContact C-N 3.32Å; L13-K15 PolarHBondContact O-N 3.4Å; L13-L16 PolarHBondContact O-N 3.39Å; L13-Y17 WeakPolarHBondContact O-CB 3.47Å; L13-Y17 PolarHBondContact O-N 3.43Å
14	N	73.6	Confident	68.2	Low	102 Å²	102	108.6 Å²	108.6	55%	0.545	55%	0.547	S	S	.	.	H	α-helix	trans	-64.5	-35.8	175.1	-83.3	-13.3	0	0	0	112.5	I10 Y18	I10-N14 PolarHBondContact O-N 3.44Å; N14-Y18 PolarHBondContact O-N 3.48Å
15	K	74.1	Confident	67.9	Low	138 Å²	138	108.1 Å²	108.1	60%	0.6	54%	0.541	S	S	*	.	H	α-helix	trans	-67.6	-42.3	173.9	-81.8	-172.3	174.5	-173.2	0	112.3	I11 L12 L13 Y17 Y18 I19	I11-K15 PolarHBondContact O-N 3.3Å; L12-K15 PolarHBondContact O-N 3.39Å; L13-K15 VanDerWaalsContact C-N 3.32Å; L13-K15 PolarHBondContact O-N 3.4Å; K15-Y17 VanDerWaalsContact C-N 3.33Å; K15-Y18 PolarHBondContact O-N 3.35Å; K15-I19 VanDerWaalsContact O-CG1 3.26Å; K15-I19 WeakPolarHBondContact O-CG1 3.31Å; K15-I19 PolarHBondContact O-N 3.45Å
16	L	74.1	Confident	67.3	Low	106 Å²	106	109.1 Å²	109.1	56%	0.555	54%	0.544	S	S	*	.	H	α-helix	trans	-60.9	-43.2	174.9	-90.2	146.4	0	0	0	111.5	L12 L13 Y18 I19 E20	L12-L16 PolarHBondContact O-N 3.21Å; L13-L16 PolarHBondContact O-N 3.39Å; L16-Y18 PolarHBondContact O-N 3.09Å; L16-I19 PolarHBondContact O-N 3.47Å; L16-E20 PolarHBondContact O-N 3.33Å
17	Y	72.9	Confident	66.3	Low	148 Å²	148	114.1 Å²	114.1	58%	0.58	55%	0.553	S	S	*	*	H	α-helix	trans	-63.6	-40.7	176.2	-172.4	-108.1	0	0	0	112.6	L13 K15 I19 E20 I21	L13-Y17 WeakPolarHBondContact O-CB 3.47Å; L13-Y17 PolarHBondContact O-N 3.43Å; K15-Y17 VanDerWaalsContact C-N 3.33Å; Y17-I19 VanDerWaalsContact C-N 3.34Å; Y17-I19 PolarHBondContact O-N 3.11Å; Y17-E20 PolarHBondContact O-N 3.03Å; Y17-I21 HydrophobicContact CD1-CD1 3.75Å; Y17-I21 HydrophobicContact CE1-CD1 3.39Å; Y17-I21 HydrophobicContact CE1-CG1 4.32Å; Y17-I21 WeakPolarHBondContact O-CG1 3.3Å; Y17-I21 PolarHBondContact O-N 3.07Å
18	Y	66.4	Low	65.1	Low	160 Å²	160	110.2 Å²	110.2	63%	0.627	55%	0.551	S	S	*	*	H	α-helix	trans	-65.7	-36.3	174.3	-115.6	-86.9	0	0	0	112.8	N14 K15 L16 I21 L22	N14-Y18 PolarHBondContact O-N 3.48Å; K15-Y18 PolarHBondContact O-N 3.35Å; L16-Y18 PolarHBondContact O-N 3.09Å; Y18-I21 PolarHBondContact O-N 3.13Å; Y18-L22 WeakPolarHBondContact O-CB 3.48Å; Y18-L22 WeakPolarHBondContact O-CG 3.4Å; Y18-L22 PolarHBondContact O-N 3.34Å
19	I	71.1	Confident	63.7	Low	93 Å²	93	113 Å²	113	48%	0.477	56%	0.561	S	S	.	*	H	α-helix	trans	-66.9	-39.6	175.1	-69.8	164.6	0	0	0	110.4	K15 L16 Y17 L22 L23	K15-I19 VanDerWaalsContact O-CG1 3.26Å; K15-I19 WeakPolarHBondContact O-CG1 3.31Å; K15-I19 PolarHBondContact O-N 3.45Å; L16-I19 PolarHBondContact O-N 3.47Å; Y17-I19 VanDerWaalsContact C-N 3.34Å; Y17-I19 PolarHBondContact O-N 3.11Å; I19-L22 PolarHBondContact O-N 3.06Å; I19-L23 HydrophobicContact CG2-CD1 3.72Å; I19-L23 HydrophobicContact CG2-CG 4.45Å; I19-L23 WeakPolarHBondContact O-CB 3.35Å; I19-L23 WeakPolarHBondContact O-CG 3.37Å; I19-L23 PolarHBondContact O-N 3.44Å
20	E	64.6	Low	62.4	Low	128 Å²	128	110.6 Å²	110.6	60%	0.598	55%	0.553	S	S	*	*	H	α-helix	trans	-64.6	-39.9	173.2	-79	-160	164.9	0	0	112.6	L16 Y17 L23 N24	L16-E20 PolarHBondContact O-N 3.33Å; Y17-E20 PolarHBondContact O-N 3.03Å; E20-L23 PolarHBondContact O-N 3.46Å; E20-N24 WeakPolarHBondContact O-CB 3.44Å; E20-N24 PolarHBondContact O-N 3.01Å
21	I	64.9	Low	61	Low	61 Å²	61	113.4 Å²	113.4	31%	0.313	56%	0.564	S	S	.	*	H	α-helix	trans	-63.6	-44.2	174.6	-68.7	168.7	0	0	0	110.7	Y17 Y18 N24 Q25	Y17-I21 HydrophobicContact CD1-CD1 3.75Å; Y17-I21 HydrophobicContact CE1-CD1 3.39Å; Y17-I21 HydrophobicContact CE1-CG1 4.32Å; Y17-I21 WeakPolarHBondContact O-CG1 3.3Å; Y17-I21 PolarHBondContact O-N 3.07Å; Y18-I21 PolarHBondContact O-N 3.13Å; I21-N24 PolarHBondContact O-N 3.07Å; I21-Q25 HydrophobicContact CG2-CG 4.48Å; I21-Q25 WeakPolarHBondContact O-CB 3.37Å; I21-Q25 WeakPolarHBondContact O-CG 3.37Å; I21-Q25 PolarHBondContact O-N 3.2Å
22	L	57.8	Low	59.8	Low	92 Å²	92	112.3 Å²	112.3	48%	0.482	56%	0.564	S	S	.	*	H	α-helix	trans	-65.5	-40.6	177.4	-79.1	163.3	0	0	0	111.7	Y18 I19 Q25 V26	Y18-L22 WeakPolarHBondContact O-CB 3.48Å; Y18-L22 WeakPolarHBondContact O-CG 3.4Å; Y18-L22 PolarHBondContact O-N 3.34Å; I19-L22 PolarHBondContact O-N 3.06Å; L22-Q25 PolarHBondContact O-N 3.03Å; L22-V26 WeakPolarHBondContact O-CB 3.41Å; L22-V26 WeakPolarHBondContact O-CG2 3.42Å; L22-V26 PolarHBondContact O-N 3.07Å
23	L	56.8	Low	59.4	Low	109 Å²	109	116.7 Å²	116.7	57%	0.571	58%	0.575	S	S	*	*	H	α-helix	trans	-63.9	-41.6	174	-83	159.6	0	0	0	111.4	I19 E20 V26 Y27	I19-L23 HydrophobicContact CG2-CD1 3.72Å; I19-L23 HydrophobicContact CG2-CG 4.45Å; I19-L23 WeakPolarHBondContact O-CB 3.35Å; I19-L23 WeakPolarHBondContact O-CG 3.37Å; I19-L23 PolarHBondContact O-N 3.44Å; E20-L23 PolarHBondContact O-N 3.46Å; L23-V26 PolarHBondContact O-N 3.37Å; L23-Y27 WeakPolarHBondContact O-CB 3.2Å; L23-Y27 PolarHBondContact O-N 3.27Å
24	N	52.7	Low	59.4	Low	107 Å²	107	111.9 Å²	111.9	57%	0.572	55%	0.55	S	S	*	*	H	α-helix	trans	-69.6	-32.2	175.3	-95.9	-8.2	0	0	0	113	E20 I21 S28	E20-N24 WeakPolarHBondContact O-CB 3.44Å; E20-N24 PolarHBondContact O-N 3.01Å; I21-N24 PolarHBondContact O-N 3.07Å; N24-S28 VanDerWaalsContact O-CB 3.25Å; N24-S28 WeakPolarHBondContact O-CB 3.44Å; N24-S28 PolarHBondContact O-N 3.48Å; N24-S28 PolarHBondContact O-OG 2.72Å
25	Q	48.6	Very low	60.1	Low	122 Å²	122	107 Å²	107	57%	0.57	52%	0.524	S	S	*	.	H	α-helix	trans	-70.4	-44.4	172.6	-81.8	-176.5	-34.1	0	0	111.1	I21 L22 Y27 S28 D29	I21-Q25 HydrophobicContact CG2-CG 4.48Å; I21-Q25 WeakPolarHBondContact O-CB 3.37Å; I21-Q25 WeakPolarHBondContact O-CG 3.37Å; I21-Q25 PolarHBondContact O-N 3.2Å; L22-Q25 PolarHBondContact O-N 3.03Å; Q25-Y27 VanDerWaalsContact C-N 3.25Å; Q25-Y27 PolarHBondContact O-N 3.08Å; Q25-S28 PolarHBondContact O-N 3.34Å; Q25-D29 VanDerWaalsContact O-CB 3.31Å; Q25-D29 WeakPolarHBondContact O-CB 3.36Å; Q25-D29 PolarHBondContact O-N 3.02Å
26	V	50.1	Low	61.1	Low	103 Å²	103	100.4 Å²	100.4	62%	0.624	50%	0.496	S	S	*	.	H	α-helix	trans	-62.9	-35.4	173.7	172.9	0	0	0	0	110.8	L22 L23 S30	L22-V26 WeakPolarHBondContact O-CB 3.41Å; L22-V26 WeakPolarHBondContact O-CG2 3.42Å; L22-V26 PolarHBondContact O-N 3.07Å; L23-V26 PolarHBondContact O-N 3.37Å; V26-S30 PolarHBondContact O-N 3.44Å; V26-S30 VanDerWaalsContact O-N 3.14Å
27	Y	45.1	Very low	62.1	Low	176 Å²	176	100.1 Å²	100.1	69%	0.69	49%	0.491	S	S	*	.	H	α-helix	trans	-73.2	-35.3	175.3	-163.5	-97.2	0	0	0	112.5	L23 Q25 S30	L23-Y27 WeakPolarHBondContact O-CB 3.2Å; L23-Y27 PolarHBondContact O-N 3.27Å; Q25-Y27 VanDerWaalsContact C-N 3.25Å; Q25-Y27 PolarHBondContact O-N 3.08Å; Y27-S30 PolarHBondContact O-N 3.31Å; Y27-S30 PolarHBondContact O-OG 3.46Å
28	S	43.4	Very low	63.3	Low	91 Å²	91	93 Å²	93	64%	0.636	46%	0.464	S	S	*	.	H	α-helix	trans	-78.1	-30	178	-60.4	0	0	0	0	112.9	N24 Q25	N24-S28 VanDerWaalsContact O-CB 3.25Å; N24-S28 WeakPolarHBondContact O-CB 3.44Å; N24-S28 PolarHBondContact O-N 3.48Å; N24-S28 PolarHBondContact O-OG 2.72Å; Q25-S28 PolarHBondContact O-N 3.34Å
29	D	42.3	Very low	64.7	Low	135 Å²	135	88.3 Å²	88.3	72%	0.722	45%	0.446	S	S	*	.	S	Bend	trans	-79.2	-9.7	171.8	-146.9	23.1	0	0	0	111.7	Q25 Q31	Q25-D29 VanDerWaalsContact O-CB 3.31Å; Q25-D29 WeakPolarHBondContact O-CB 3.36Å; Q25-D29 PolarHBondContact O-N 3.02Å; D29-Q31 PolarHBondContact O-N 3.13Å
30	S	45.3	Very low	66	Low	59 Å²	59	83.9 Å²	83.9	41%	0.413	42%	0.423	S	S	.	.			trans	-80.1	56.9	159.6	80	0	0	0	0	110.5	V26 Y27 P32	V26-S30 PolarHBondContact O-N 3.44Å; V26-S30 VanDerWaalsContact O-N 3.14Å; Y27-S30 PolarHBondContact O-N 3.31Å; Y27-S30 PolarHBondContact O-OG 3.46Å; S30-P32 VanDerWaalsContact O-CD 3.28Å; S30-P32 WeakPolarHBondContact O-CD 3.18Å
31	Q	46.4	Very low	67.6	Low	149 Å²	149	78.1 Å²	78.1	70%	0.696	40%	0.397	S	S	*	.			trans	-52.4	118.5	144.6	-80.4	-161.5	-14.9	0	0	104.4	D29 Y33	D29-Q31 PolarHBondContact O-N 3.13Å; Q31-Y33 VanDerWaalsContact C-N 3.31Å; Q31-Y33 PolarHBondContact O-N 3.47Å
32	P	52.5	Low	69.2	Low	79 Å²	79	75.4 Å²	75.4	51%	0.513	38%	0.382	S	S	.	.			trans	-57.9	109.2	178.3	22.5	-29.6	0	0	0	104.2	S30 G34 Y186	S30-P32 VanDerWaalsContact O-CD 3.28Å; S30-P32 WeakPolarHBondContact O-CD 3.18Å; P32-G34 PolarHBondContact O-N 3.02Å; P32-Y186 PolarHBondContact O-OH 3.43Å
33	Y	65.9	Low	71.1	Confident	188 Å²	188	71.9 Å²	71.9	74%	0.737	36%	0.364	S	S	*	.			trans	-45.8	113.2	172.8	-69.8	-88.6	0	0	0	104.2	Q31 F113	Q31-Y33 VanDerWaalsContact C-N 3.31Å; Q31-Y33 PolarHBondContact O-N 3.47Å; Y33-F113 WeakPolarHBondContact O-CZ 3.43Å
34	G	78.8	Confident	73	Confident	3 Å²	3	66.7 Å²	66.7	3%	0.031	34%	0.337	C	S	.	.			trans	-61.9	172.6	-177.2	0	0	0	0	0	109.7	P32 Q116 Y186	P32-G34 PolarHBondContact O-N 3.02Å; G34-Q116 VanDerWaalsContact CA-NE2 3.27Å; G34-Q116 WeakPolarHBondContact O-CG 3.37Å; G34-Q116 PolarHBondContact O-N 3.24Å; G34-Q116 VanDerWaalsContact O-N 3.14Å; G34-Y186 VanDerWaalsContact CA-CE2 3.43Å; G34-Y186 PolarHBondContact N-OH 3.32Å
35	G	89.1	Confident	75.2	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.1	-162.6	-176.8	0	0	0	0	0	111.1	V114 V183 C191	G35-V114 CarbonylContact C-O 3.59Å; G35-V114 VanDerWaalsContact CA-O 3.26Å; G35-V114 WeakPolarHBondContact CA-O 3.4Å; G35-V183 PolarHBondContact O-N 3.19Å; G35-C191 VanDerWaalsContact O-CB 3.3Å; G35-C191 WeakPolarHBondContact O-CB 3.28Å
36	A	95	Very high	77.4	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	149.5	-178	0	0	0	0	0	111.3	F113 V114 V118 L180 S181	A36-F113 WeakPolarHBondContact O-CD2 3.04Å; A36-V114 HydrophobicContact CB-CB 4.39Å; A36-V114 PolarHBondContact N-O 3.04Å; A36-V114 PolarHBondContact O-N 2.85Å; A36-V118 HydrophobicContact CB-CG1 4.43Å; A36-V118 HydrophobicContact CB-CG2 4.06Å; A36-L180 HydrophobicContact CB-CD1 3.49Å; A36-L180 VanDerWaalsContact CB-CD1 3.49Å; A36-L180 HydrophobicContact CB-CD2 4.46Å; A36-L180 HydrophobicContact CB-CG 3.94Å; A36-S181 CarbonylContact C-O 3.59Å; A36-S181 WeakPolarHBondContact CA-O 3.01Å; A36-S181 WeakPolarHBondContact CB-O 3.37Å
37	Q	95.3	Very high	79.4	Confident	99 Å²	99	57.2 Å²	57.2	46%	0.463	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	128.5	163.3	-65.3	-179.3	-37.7	0	0	107.8	L180 S181 V183	Q37-L180 WeakPolarHBondContact O-CA 3.09Å; Q37-S181 PolarHBondContact N-O 3.32Å; Q37-S181 PolarHBondContact O-N 3.29Å; Q37-V183 HydrophobicContact CG-CG2 4.26Å
38	L	96.5	Very high	81.7	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123.1	176.6	175.1	62.6	0	0	0	108.8	I40 L73 E111 I112 V114 L150 M178 R179 L180	L38-I40 HydrophobicContact CD2-CD1 4.43Å; L38-I40 HydrophobicContact CD2-CG1 4.45Å; L38-I40 HydrophobicContact CG-CG1 4.18Å; L38-L73 HydrophobicContact CD2-CD2 3.35Å; L38-E111 WeakPolarHBondContact O-CA 3.49Å; L38-I112 HydrophobicContact CB-CG1 3.99Å; L38-I112 HydrophobicContact CD2-CD1 4.07Å; L38-I112 HydrophobicContact CD2-CG1 4.32Å; L38-I112 HydrophobicContact CG-CG1 4.38Å; L38-I112 PolarHBondContact N-O 2.7Å; L38-I112 PolarHBondContact O-N 3.42Å; L38-V114 HydrophobicContact CB-CG2 3.91Å; L38-V114 HydrophobicContact CD2-CG2 4.24Å; L38-L150 HydrophobicContact CD1-CD1 3.72Å; L38-L150 HydrophobicContact CD2-CD1 4.42Å; L38-M178 HydrophobicContact CD1-CB 4Å; L38-R179 WeakPolarHBondContact CA-O 3.1Å; L38-L180 HydrophobicContact CB-CD1 3.94Å; L38-L180 HydrophobicContact CD1-CB 4.45Å; L38-L180 HydrophobicContact CD1-CD1 4.1Å
39	K	97	Very high	84	Confident	60 Å²	60	48 Å²	48	26%	0.261	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	138.6	169.8	-52	-160.1	179.8	-161.3	0	110.4	I110 E111 W156 M178 R179	K39-I110 CarbonylContact C-O 3.44Å; K39-I110 VanDerWaalsContact CA-O 3.29Å; K39-I110 WeakPolarHBondContact CA-O 3.03Å; K39-E111 HydrophobicContact CD-CG 3.96Å; K39-E111 WeakPolarHBondContact CE-OE1 3.35Å; K39-E111 WeakPolarHBondContact CE-OE2 3.43Å; K39-E111 HydrophobicContact CG-CG 3.94Å; K39-E111 VanDerWaalsContact NZ-CD 3.28Å; K39-E111 IonicContact NZ-OE1 3.79Å; K39-E111 PolarHBondContact NZ-OE1 2.9Å; K39-E111 IonicContact NZ-OE2 2.63Å; K39-E111 PolarHBondContact NZ-OE2 3.35Å; K39-W156 HydrophobicContact CB-CH2 3.99Å; K39-W156 HydrophobicContact CB-CZ3 4.45Å; K39-M178 CarbonylContact O-C 3.58Å; K39-M178 VanDerWaalsContact O-CA 3.26Å; K39-M178 WeakPolarHBondContact O-CA 3.49Å; K39-R179 HydrophobicContact CB-CB 4.36Å; K39-R179 PolarHBondContact N-O 3.35Å; K39-R179 PolarHBondContact O-N 3.1Å
40	I	98.2	Very high	86.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	125.3	179.4	-50.3	176.7	0	0	0	108.3	L38 W42 L71 L89 I110 F124 V176 M178	L38-I40 HydrophobicContact CD2-CD1 4.43Å; L38-I40 HydrophobicContact CD2-CG1 4.45Å; L38-I40 HydrophobicContact CG-CG1 4.18Å; I40-W42 HydrophobicContact CG2-CE3 4.42Å; I40-L71 HydrophobicContact CG2-CD2 4.47Å; I40-L89 HydrophobicContact CD1-CD2 3.57Å; I40-I110 HydrophobicContact CB-CB 4.35Å; I40-I110 PolarHBondContact N-O 2.71Å; I40-I110 PolarHBondContact O-N 3.33Å; I40-F124 HydrophobicContact CD1-CE2 4.31Å; I40-F124 HydrophobicContact CG2-CZ 4.32Å; I40-V176 HydrophobicContact CG2-CG1 4.37Å; I40-M178 HydrophobicContact CD1-CE 4.23Å; I40-M178 HydrophobicContact CG1-CE 4.36Å; I40-M178 HydrophobicContact CG1-CG 4.2Å; I40-M178 HydrophobicContact CG1-SD 4.48Å; I40-M178 HydrophobicContact CG2-CE 4.13Å; I40-M178 HydrophobicContact CG2-CG 4.29Å
41	E	98.3	Very high	88.7	Confident	8 Å²	8	40.6 Å²	40.6	4%	0.037	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	145.2	173.2	-72.9	-178.8	170	0	0	109.5	F104 R105 E106 W156 R177	E41-F104 WeakPolarHBondContact CB-O 3.34Å; E41-F104 WeakPolarHBondContact CG-O 3.18Å; E41-R105 WeakPolarHBondContact OE2-CD 3.01Å; E41-R105 IonicContact OE2-NE 2.77Å; E41-R105 IonicContact OE2-NH1 2.7Å; E41-R105 PolarHBondContact OE2-NH1 3.4Å; E41-E106 PolarHBondContact OE1-N 3.14Å; E41-W156 HydrophobicContact CB-CH2 4.11Å; E41-W156 HydrophobicContact CB-CZ3 4.14Å; E41-W156 VanDerWaalsContact CD-CZ2 3.42Å; E41-W156 HydrophobicContact CG-CH2 3.48Å; E41-W156 VanDerWaalsContact CG-CH2 3.48Å; E41-W156 HydrophobicContact CG-CZ2 4.18Å; E41-W156 HydrophobicContact CG-CZ3 4.02Å; E41-W156 WeakPolarHBondContact OE1-CZ2 2.94Å; E41-W156 WeakPolarHBondContact OE2-CZ2 3.47Å; E41-R177 HydrophobicContact CB-CG 3.98Å; E41-R177 PolarHBondContact N-O 3.14Å; E41-R177 PolarHBondContact O-N 2.82Å; E41-R177 VanDerWaalsContact O-O 3.1Å; E41-R177 IonicContact OE2-CZ 3.38Å; E41-R177 IonicContact OE2-NE 3.05Å; E41-R177 PolarHBondContact OE2-NE 3.44Å; E41-R177 IonicContact OE2-NH2 3.13Å; E41-R177 PolarHBondContact OE2-NH2 3.47Å
42	W	98.1	Very high	91.1	Very high	3 Å²	3	34.8 Å²	34.8	1%	0.011	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	159.3	175.2	71.6	100	0	0	0	111.9	I40 F69 L71 T93 F104 I110 N175 V176	I40-W42 HydrophobicContact CG2-CE3 4.42Å; W42-F69 AromaticContact NE1-CD1 3.86Å; W42-L71 HydrophobicContact CD2-CD2 4.47Å; W42-L71 HydrophobicContact CE3-CD2 3.97Å; W42-L71 HydrophobicContact CH2-CD1 4.24Å; W42-L71 HydrophobicContact CH2-CD2 3.95Å; W42-L71 HydrophobicContact CZ2-CD1 4.13Å; W42-L71 HydrophobicContact CZ2-CD2 4.42Å; W42-L71 HydrophobicContact CZ3-CD2 3.7Å; W42-T93 HydrophobicContact CH2-CG2 4.38Å; W42-T93 HydrophobicContact CZ2-CG2 4.12Å; W42-F104 AromaticContact CD1-CD2 3.8Å; W42-F104 HydrophobicContact CD2-CB 4.03Å; W42-F104 AromaticContact CD2-CD2 3.88Å; W42-F104 HydrophobicContact CD2-CD2 3.88Å; W42-F104 HydrophobicContact CD2-CG 4.07Å; W42-F104 AromaticContact CE2-CD2 3.25Å; W42-F104 AromaticContact CE2-CE2 3.63Å; W42-F104 AromaticContact CE2-CG 3.59Å; W42-F104 HydrophobicContact CE3-CB 4Å; W42-F104 HydrophobicContact CE3-CG 4.38Å; W42-F104 HydrophobicContact CG-CD2 4.19Å; W42-F104 HydrophobicContact CH2-CB 4.05Å; W42-F104 AromaticContact CH2-CD1 3.83Å; W42-F104 HydrophobicContact CH2-CD1 3.83Å; W42-F104 HydrophobicContact CH2-CD2 4.31Å; W42-F104 HydrophobicContact CH2-CE1 4.34Å; W42-F104 AromaticContact CH2-CG 3.8Å; W42-F104 HydrophobicContact CH2-CG 3.8Å; W42-F104 HydrophobicContact CZ2-CB 4.1Å; W42-F104 AromaticContact CZ2-CD1 3.62Å; W42-F104 HydrophobicContact CZ2-CD1 3.62Å; W42-F104 AromaticContact CZ2-CD2 3.52Å; W42-F104 HydrophobicContact CZ2-CD2 3.52Å; W42-F104 AromaticContact CZ2-CE1 3.82Å; W42-F104 HydrophobicContact CZ2-CE1 3.82Å; W42-F104 AromaticContact CZ2-CE2 3.73Å; W42-F104 HydrophobicContact CZ2-CE2 3.73Å; W42-F104 AromaticContact CZ2-CG 3.46Å; W42-F104 HydrophobicContact CZ2-CG 3.46Å; W42-F104 VanDerWaalsContact CZ2-CG 3.46Å; W42-F104 AromaticContact CZ2-CZ 3.88Å; W42-F104 HydrophobicContact CZ2-CZ 3.88Å; W42-F104 HydrophobicContact CZ3-CB 4Å; W42-F104 HydrophobicContact CZ3-CG 4.25Å; W42-F104 PolarHBondContact N-O 2.81Å; W42-F104 AromaticContact NE1-CD2 3.23Å; W42-F104 AromaticContact NE1-CE2 3.33Å; W42-F104 VanDerWaalsContact NE1-CE2 3.33Å; W42-F104 PolarHBondContact O-N 2.73Å; W42-I110 HydrophobicContact CH2-CD1 4.02Å; W42-I110 HydrophobicContact CH2-CG1 4.25Å; W42-I110 HydrophobicContact CZ3-CD1 3.94Å; W42-I110 HydrophobicContact CZ3-CG1 3.99Å; W42-N175 CarbonylContact C-O 3.51Å; W42-N175 WeakPolarHBondContact CA-O 3.18Å; W42-N175 WeakPolarHBondContact CB-O 3.36Å; W42-V176 HydrophobicContact CB-CG2 4.03Å
43	D	97.5	Very high	93	Very high	19 Å²	19	34.7 Å²	34.7	10%	0.102	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	153.2	168.5	51	-96.6	0	0	0	109.7	L102 E103 R105 V174 N175	D43-L102 CarbonylContact C-O 3.58Å; D43-L102 WeakPolarHBondContact CA-O 3.27Å; D43-E103 HydrophobicContact CB-CG 4.16Å; D43-R105 IonicContact OD1-CZ 2.74Å; D43-R105 IonicContact OD1-NH2 3.26Å; D43-R105 PolarHBondContact OD1-NH2 3.32Å; D43-V174 WeakPolarHBondContact O-CA 3.24Å; D43-N175 PolarHBondContact N-O 3.05Å; D43-N175 PolarHBondContact O-N 3.44Å; D43-N175 WeakPolarHBondContact OD1-CB 3.39Å; D43-N175 WeakPolarHBondContact OD2-CB 3.44Å; D43-N175 PolarHBondContact OD2-N 3.4Å; D43-N175 PolarHBondContact OD2-ND2 3.06Å
44	Y	97.5	Very high	94.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	135.6	-176.7	161.5	-101.9	0	0	0	109.7	N46 V67 F69 Y101 L102 I128 I140 I172 Y173 V174	Y44-N46 HydrophobicContact CE1-CB 4.18Å; Y44-N46 HydrophobicContact CE2-CB 3.89Å; Y44-N46 VanDerWaalsContact CZ-CB 3.44Å; Y44-N46 WeakPolarHBondContact OH-CB 3.37Å; Y44-N46 PolarHBondContact OH-ND2 3.46Å; Y44-V67 HydrophobicContact CE1-CG1 4.23Å; Y44-V67 HydrophobicContact CE1-CG2 4.08Å; Y44-F69 HydrophobicContact CD1-CE1 4.38Å; Y44-F69 AromaticContact CD1-CZ 3.84Å; Y44-F69 HydrophobicContact CD1-CZ 3.84Å; Y44-F69 HydrophobicContact CD2-CE1 4.23Å; Y44-F69 HydrophobicContact CD2-CZ 4.48Å; Y44-F69 HydrophobicContact CE1-CZ 4.48Å; Y44-F69 AromaticContact CG-CE1 3.93Å; Y44-F69 HydrophobicContact CG-CE1 3.93Å; Y44-F69 AromaticContact CG-CZ 3.8Å; Y44-F69 HydrophobicContact CG-CZ 3.8Å; Y44-Y101 CarbonylContact O-C 3.58Å; Y44-Y101 VanDerWaalsContact O-CA 3.3Å; Y44-Y101 WeakPolarHBondContact O-CA 2.99Å; Y44-Y101 VanDerWaalsContact O-CD2 3.29Å; Y44-Y101 WeakPolarHBondContact O-CD2 3.42Å; Y44-L102 HydrophobicContact CD1-CB 4.34Å; Y44-L102 HydrophobicContact CD1-CD1 4.46Å; Y44-L102 PolarHBondContact N-O 3.17Å; Y44-L102 PolarHBondContact O-N 3.31Å; Y44-I128 HydrophobicContact CD2-CD1 3.8Å; Y44-I128 HydrophobicContact CD2-CG2 4.33Å; Y44-I128 HydrophobicContact CE2-CD1 4Å; Y44-I128 HydrophobicContact CE2-CG2 3.82Å; Y44-I140 HydrophobicContact CE2-CG2 4.4Å; Y44-I172 HydrophobicContact CE2-CB 4.49Å; Y44-Y173 CarbonylContact C-O 3.4Å; Y44-Y173 WeakPolarHBondContact CA-O 3.38Å; Y44-V174 HydrophobicContact CD2-CG2 4.14Å
45	D	97.7	Very high	94.8	Very high	49 Å²	49	30.7 Å²	30.7	26%	0.262	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	123.5	172.7	-176.7	15.6	0	0	0	109.9	P47 G100 Y101 I172 Y173	D45-P47 WeakPolarHBondContact OD1-CD 3.41Å; D45-G100 WeakPolarHBondContact CA-O 3.44Å; D45-Y101 HydrophobicContact CB-CD2 4.06Å; D45-I172 CarbonylContact O-C 3.56Å; D45-I172 VanDerWaalsContact O-CA 3.27Å; D45-I172 WeakPolarHBondContact O-CA 2.97Å; D45-Y173 HydrophobicContact CB-CD2 4.33Å; D45-Y173 PolarHBondContact N-O 2.96Å; D45-Y173 PolarHBondContact O-N 3.15Å
46	N	95.3	Very high	94.8	Very high	1 Å²	1	35 Å²	35	1%	0.005	20%	0.196	C	C	.	.			trans	-121.6	79.8	170.2	-178.8	4.8	0	0	0	109	Y44 A48 S49 L50 G100 I172	Y44-N46 HydrophobicContact CE1-CB 4.18Å; Y44-N46 HydrophobicContact CE2-CB 3.89Å; Y44-N46 VanDerWaalsContact CZ-CB 3.44Å; Y44-N46 WeakPolarHBondContact OH-CB 3.37Å; Y44-N46 PolarHBondContact OH-ND2 3.46Å; N46-A48 PolarHBondContact O-N 3.35Å; N46-A48 VanDerWaalsContact O-N 3.09Å; N46-S49 PolarHBondContact O-N 3.17Å; N46-S49 PolarHBondContact OD1-N 3.42Å; N46-L50 PolarHBondContact ND2-N 3.5Å; N46-L50 PolarHBondContact ND2-O 3.05Å; N46-L50 PolarHBondContact OD1-N 3.34Å; N46-G100 PolarHBondContact N-O 2.04Å; N46-I172 HydrophobicContact CB-CG2 3.99Å
47	P	92.5	Very high	94.4	Very high	82 Å²	82	35.4 Å²	35.4	53%	0.532	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.7	-168	26.8	-36.5	0	0	0	113.2	D45 Y173	D45-P47 WeakPolarHBondContact OD1-CD 3.41Å; P47-Y173 HydrophobicContact CG-CD2 4.5Å; P47-Y173 HydrophobicContact CG-CE2 4.13Å
48	A	92.2	Very high	93.7	Very high	54 Å²	54	32 Å²	32	45%	0.446	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-4.4	178.6	0	0	0	0	0	113.1	N46 L50	N46-A48 PolarHBondContact O-N 3.35Å; N46-A48 VanDerWaalsContact O-N 3.09Å; A48-L50 HydrophobicContact CB-CD1 3.78Å; A48-L50 HydrophobicContact CB-CG 3.69Å; A48-L50 WeakPolarHBondContact O-CG 3.23Å; A48-L50 PolarHBondContact O-N 3.22Å
49	S	92	Very high	92.5	Very high	20 Å²	20	40.7 Å²	40.7	14%	0.14	22%	0.217	C	C	.	.			trans	50.2	44.8	-175.7	-60.5	0	0	0	0	112.7	N46 C57 C65	N46-S49 PolarHBondContact O-N 3.17Å; N46-S49 PolarHBondContact OD1-N 3.42Å; S49-C57 PolarHBondContact O-N 3.25Å; S49-C65 VanDerWaalsContact C-SG 3.59Å
50	L	93.7	Very high	91.2	Very high	37 Å²	37	44.2 Å²	44.2	19%	0.194	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-108.2	141	-177.2	-60.7	179.9	0	0	0	111.7	N46 A48 Q55 I56 N170	N46-L50 PolarHBondContact ND2-N 3.5Å; N46-L50 PolarHBondContact ND2-O 3.05Å; N46-L50 PolarHBondContact OD1-N 3.34Å; A48-L50 HydrophobicContact CB-CD1 3.78Å; A48-L50 HydrophobicContact CB-CG 3.69Å; A48-L50 WeakPolarHBondContact O-CG 3.23Å; A48-L50 PolarHBondContact O-N 3.22Å; L50-Q55 CarbonylContact C-O 3.5Å; L50-Q55 WeakPolarHBondContact CA-O 3.5Å; L50-I56 HydrophobicContact CD2-CB 4.49Å; L50-I56 HydrophobicContact CD2-CG1 3.88Å; L50-N170 HydrophobicContact CB-CB 3.69Å; L50-N170 PolarHBondContact O-ND2 3.46Å
51	L	93.9	Very high	89.6	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	28%	0.275	C	S	.	.			trans	-68.2	165.7	166	-59.7	173.7	0	0	0	111	N53 G54 Q55 C57 E130 E138 I140 N170	L51-N53 WeakPolarHBondContact CB-OD1 3.47Å; L51-N53 PolarHBondContact O-N 3.47Å; L51-N53 VanDerWaalsContact O-N 3.11Å; L51-G54 PolarHBondContact O-N 3.27Å; L51-Q55 HydrophobicContact CD1-CB 4.28Å; L51-Q55 PolarHBondContact N-O 2.74Å; L51-C57 HydrophobicContact CD2-CB 4.42Å; L51-E130 HydrophobicContact CD2-CB 3.73Å; L51-E130 HydrophobicContact CD2-CG 4.19Å; L51-E138 HydrophobicContact CD1-CB 4.21Å; L51-E138 WeakPolarHBondContact CD1-OE2 3.39Å; L51-E138 HydrophobicContact CD2-CB 3.93Å; L51-I140 HydrophobicContact CD2-CG1 4.01Å; L51-N170 VanDerWaalsContact O-CB 3.31Å; L51-N170 WeakPolarHBondContact O-CB 3.48Å; L51-N170 PolarHBondContact O-ND2 3.06Å
52	E	95.5	Very high	88	Confident	28 Å²	28	50.3 Å²	50.3	13%	0.131	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-32.2	-179.4	-170.5	170.9	-103.8	0	0	112.6	G54 V139 I140 R163 N165 K169	E52-G54 PolarHBondContact O-N 3.25Å; E52-V139 HydrophobicContact CB-CG1 4.33Å; E52-V139 VanDerWaalsContact CB-O 3.25Å; E52-V139 WeakPolarHBondContact CB-O 3.42Å; E52-V139 PolarHBondContact N-O 3.43Å; E52-I140 WeakPolarHBondContact CB-O 3.02Å; E52-R163 IonicContact OE1-NH1 3.64Å; E52-R163 PolarHBondContact OE1-NH1 3.22Å; E52-N165 PolarHBondContact OE2-ND2 3.19Å; E52-K169 PolarHBondContact O-N 3.01Å
53	N	93.2	Very high	87	Confident	77 Å²	77	55.6 Å²	55.6	41%	0.412	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-1.1	178	68.4	12.2	0	0	0	114.2	L51 Q55	L51-N53 WeakPolarHBondContact CB-OD1 3.47Å; L51-N53 PolarHBondContact O-N 3.47Å; L51-N53 VanDerWaalsContact O-N 3.11Å; N53-Q55 VanDerWaalsContact OD1-CB 3.22Å; N53-Q55 WeakPolarHBondContact OD1-CB 3.37Å; N53-Q55 VanDerWaalsContact OD1-CG 3.32Å; N53-Q55 WeakPolarHBondContact OD1-CG 3.48Å; N53-Q55 PolarHBondContact OD1-N 3.35Å
54	G	92.3	Very high	86.4	Confident	28 Å²	28	58.9 Å²	58.9	29%	0.289	35%	0.346	S	S	.	.	S	Bend	trans	83.3	6.1	-179.5	0	0	0	0	0	115.1	L51 E52	L51-G54 PolarHBondContact O-N 3.27Å; E52-G54 PolarHBondContact O-N 3.25Å
55	Q	91.2	Very high	86.1	Confident	79 Å²	79	59 Å²	59	37%	0.369	35%	0.346	S	S	.	.			trans	-80.1	152.5	171.7	-63	179	-2.2	0	0	110.5	L50 L51 N53	L50-Q55 CarbonylContact C-O 3.5Å; L50-Q55 WeakPolarHBondContact CA-O 3.5Å; L51-Q55 HydrophobicContact CD1-CB 4.28Å; L51-Q55 PolarHBondContact N-O 2.74Å; N53-Q55 VanDerWaalsContact OD1-CB 3.22Å; N53-Q55 WeakPolarHBondContact OD1-CB 3.37Å; N53-Q55 VanDerWaalsContact OD1-CG 3.32Å; N53-Q55 WeakPolarHBondContact OD1-CG 3.48Å; N53-Q55 PolarHBondContact OD1-N 3.35Å
56	I	88.8	Confident	85.9	Confident	91 Å²	91	57.5 Å²	57.5	47%	0.467	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-71.5	135.5	173.1	-56	167.6	0	0	0	108	L50	L50-I56 HydrophobicContact CD2-CB 4.49Å; L50-I56 HydrophobicContact CD2-CG1 3.88Å
57	C	86.8	Confident	85.8	Confident	7 Å²	7	57.4 Å²	57.4	5%	0.047	34%	0.338	C	S	.	.	S	Bend	trans	-55.6	-69.3	176.7	-62.4	0	0	0	0	110.4	S49 L51 R59 C65 E130	S49-C57 PolarHBondContact O-N 3.25Å; L51-C57 HydrophobicContact CD2-CB 4.42Å; C57-R59 PolarHBondContact O-N 2.89Å; C57-C65 HydrophobicContact CB-CB 3.74Å; C57-C65 WeakPolarHBondContact CB-SG 3.38Å; C57-C65 WeakPolarHBondContact SG-CB 3.45Å; C57-C65 CovalentContact SG-SG 2.04Å; C57-C65 PolarHBondContact SG-SG 3.26Å; C57-E130 HydrophobicContact CB-CG 4.34Å
58	D	80.7	Confident	86	Confident	29 Å²	29	55 Å²	55	16%	0.155	32%	0.319	C	S	.	.			trans	-92.6	88.1	179.9	-93.1	-11	0	0	0	112.3	V60 K63	D58-V60 PolarHBondContact O-N 3.23Å; D58-V60 VanDerWaalsContact O-N 3.09Å; D58-K63 HydrophobicContact CB-CB 4.17Å
59	R	70.9	Confident	86.2	Confident	182 Å²	182	52.4 Å²	52.4	69%	0.687	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-25.9	176.7	-63.3	-175.3	-177.3	-171.7	3.5	113.2	C57	C57-R59 PolarHBondContact O-N 2.89Å
60	V	69	Low	86.5	Confident	133 Å²	133	53.1 Å²	53.1	81%	0.806	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	104.6	-177.8	-176.1	0	0	0	0	109.5	D58	D58-V60 PolarHBondContact O-N 3.23Å; D58-V60 VanDerWaalsContact O-N 3.09Å
61	G	64.4	Low	86.7	Confident	66 Å²	66	51.3 Å²	51.3	68%	0.68	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.9	-8.5	172.9	0	0	0	0	0	115.1	K63	G61-K63 VanDerWaalsContact C-N 3.29Å; G61-K63 PolarHBondContact O-N 3.02Å
62	G	64.2	Low	86.7	Confident	71 Å²	71	52.2 Å²	52.2	73%	0.732	30%	0.298	S	S	*	.			trans	63.3	37.1	175.6	0	0	0	0	0	112.6
63	K	78.1	Confident	86.8	Confident	114 Å²	114	50.9 Å²	50.9	50%	0.496	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-94.1	165.8	-178.2	-50.1	-171	-175.5	172.7	0	111.5	D58 G61 N98	D58-K63 HydrophobicContact CB-CB 4.17Å; G61-K63 VanDerWaalsContact C-N 3.29Å; G61-K63 PolarHBondContact O-N 3.02Å; K63-N98 WeakPolarHBondContact CB-OD1 3Å; K63-N98 WeakPolarHBondContact CD-OD1 3.46Å
64	E	85.6	Confident	86.7	Confident	88 Å²	88	48.8 Å²	48.8	41%	0.411	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-68	166.8	171.2	-65	175	179	0	0	110.2	N98 A99 G100	E64-N98 VanDerWaalsContact CB-C 3.44Å; E64-N98 HydrophobicContact CB-CB 4.31Å; E64-N98 PolarHBondContact O-OD1 3.01Å; E64-A99 WeakPolarHBondContact OE2-CA 3.4Å; E64-G100 PolarHBondContact OE2-N 3.39Å
65	C	90.8	Very high	86.7	Confident	1 Å²	1	50 Å²	50	1%	0.007	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-72.9	142.2	-176.2	-55.6	0	0	0	0	111.6	S49 C57 V67 N98 A99 E130 I140	S49-C65 VanDerWaalsContact C-SG 3.59Å; C57-C65 HydrophobicContact CB-CB 3.74Å; C57-C65 WeakPolarHBondContact CB-SG 3.38Å; C57-C65 WeakPolarHBondContact SG-CB 3.45Å; C57-C65 CovalentContact SG-SG 2.04Å; C57-C65 PolarHBondContact SG-SG 3.26Å; C65-V67 HydrophobicContact CB-CG2 3.56Å; C65-V67 WeakPolarHBondContact O-CG2 3.48Å; C65-V67 PolarHBondContact O-N 3.33Å; C65-N98 CarbonylContact O-C 3.54Å; C65-N98 WeakPolarHBondContact O-CA 2.99Å; C65-N98 PolarHBondContact O-N 3Å; C65-A99 PolarHBondContact O-N 3.07Å; C65-E130 VanDerWaalsContact C-OE2 3.25Å; C65-E130 VanDerWaalsContact CA-OE2 3.29Å; C65-E130 WeakPolarHBondContact CA-OE2 3.49Å; C65-E130 WeakPolarHBondContact CB-OE2 3.47Å; C65-I140 HydrophobicContact CB-CD1 3.97Å
66	D	92.1	Very high	86.6	Confident	18 Å²	18	47 Å²	47	10%	0.096	27%	0.267	C	S	.	.			trans	-79.7	82.6	166.4	-69.2	-22	0	0	0	110.6	V95 D97 N98 E130 Q131	D66-V95 HydrophobicContact CB-CG1 4.16Å; D66-D97 WeakPolarHBondContact OD1-CA 3.39Å; D66-N98 PolarHBondContact OD1-N 3.4Å; D66-N98 PolarHBondContact OD1-ND2 3.41Å; D66-E130 WeakPolarHBondContact CA-OE2 3.49Å; D66-E130 PolarHBondContact N-OE1 3.22Å; D66-E130 PolarHBondContact N-OE2 2.93Å; D66-Q131 PolarHBondContact O-N 3.39Å
67	V	94.4	Very high	86.3	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	140.8	-164.4	-174.6	0	0	0	0	113.4	Y44 C65 F69 V95 F96 I128 F129 I140	Y44-V67 HydrophobicContact CE1-CG1 4.23Å; Y44-V67 HydrophobicContact CE1-CG2 4.08Å; C65-V67 HydrophobicContact CB-CG2 3.56Å; C65-V67 WeakPolarHBondContact O-CG2 3.48Å; C65-V67 PolarHBondContact O-N 3.33Å; V67-F69 HydrophobicContact CG1-CE1 4.22Å; V67-F69 HydrophobicContact CG1-CE2 3.89Å; V67-F69 HydrophobicContact CG1-CZ 3.7Å; V67-V95 CarbonylContact O-C 3.58Å; V67-V95 WeakPolarHBondContact O-CA 3.09Å; V67-F96 PolarHBondContact N-O 3.15Å; V67-F96 PolarHBondContact O-N 2.81Å; V67-I128 HydrophobicContact CG1-CG2 3.65Å; V67-F129 CarbonylContact C-O 3.58Å; V67-F129 WeakPolarHBondContact CA-O 3.01Å; V67-I140 HydrophobicContact CG1-CD1 4.4Å; V67-I140 HydrophobicContact CG2-CD1 3.81Å
68	Y	95.7	Very high	85.5	Confident	31 Å²	31	47.3 Å²	47.3	12%	0.122	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	161.3	159.7	76	-87.2	0	0	0	112.3	T70 T92 V95 F129 Q131 V137	Y68-T70 HydrophobicContact CD2-CG2 4.4Å; Y68-T70 HydrophobicContact CE2-CG2 3.91Å; Y68-T92 HydrophobicContact CD2-CG2 3.86Å; Y68-T92 HydrophobicContact CE2-CG2 4.1Å; Y68-V95 HydrophobicContact CD1-CG2 4.29Å; Y68-F129 HydrophobicContact CD1-CB 3.94Å; Y68-F129 HydrophobicContact CD2-CD2 4.43Å; Y68-F129 HydrophobicContact CE1-CB 3.38Å; Y68-F129 HydrophobicContact CE1-CG 4.28Å; Y68-F129 HydrophobicContact CE2-CB 4Å; Y68-F129 AromaticContact CE2-CD2 3.79Å; Y68-F129 HydrophobicContact CE2-CD2 3.79Å; Y68-F129 HydrophobicContact CE2-CG 4.14Å; Y68-F129 HydrophobicContact CG-CB 4.47Å; Y68-F129 VanDerWaalsContact CZ-CB 3.41Å; Y68-F129 AromaticContact CZ-CD2 3.94Å; Y68-F129 AromaticContact CZ-CG 3.79Å; Y68-F129 PolarHBondContact N-O 3.29Å; Y68-F129 PolarHBondContact O-N 3.48Å; Y68-Q131 HydrophobicContact CD1-CB 3.92Å; Y68-Q131 HydrophobicContact CE1-CB 3.99Å; Y68-V137 HydrophobicContact CE1-CG1 4.33Å; Y68-V137 WeakPolarHBondContact OH-CG1 3.36Å
69	F	97.6	Very high	84.8	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	143.6	-175.1	-55.6	-91.4	0	0	0	112	W42 Y44 V67 L71 T92 T93 F96 L102 F104 L126 G127 I128	W42-F69 AromaticContact NE1-CD1 3.86Å; Y44-F69 HydrophobicContact CD1-CE1 4.38Å; Y44-F69 AromaticContact CD1-CZ 3.84Å; Y44-F69 HydrophobicContact CD1-CZ 3.84Å; Y44-F69 HydrophobicContact CD2-CE1 4.23Å; Y44-F69 HydrophobicContact CD2-CZ 4.48Å; Y44-F69 HydrophobicContact CE1-CZ 4.48Å; Y44-F69 AromaticContact CG-CE1 3.93Å; Y44-F69 HydrophobicContact CG-CE1 3.93Å; Y44-F69 AromaticContact CG-CZ 3.8Å; Y44-F69 HydrophobicContact CG-CZ 3.8Å; V67-F69 HydrophobicContact CG1-CE1 4.22Å; V67-F69 HydrophobicContact CG1-CE2 3.89Å; V67-F69 HydrophobicContact CG1-CZ 3.7Å; F69-L71 HydrophobicContact CB-CD1 3.83Å; F69-T92 CarbonylContact O-C 3.54Å; F69-T92 WeakPolarHBondContact O-CA 3.41Å; F69-T93 HydrophobicContact CB-CG2 3.96Å; F69-T93 HydrophobicContact CD2-CG2 4.3Å; F69-T93 PolarHBondContact N-OG1 2.86Å; F69-T93 PolarHBondContact O-N 2.77Å; F69-F96 HydrophobicContact CE2-CD2 4.46Å; F69-L102 HydrophobicContact CE2-CD1 3.62Å; F69-L102 HydrophobicContact CZ-CD1 3.94Å; F69-F104 HydrophobicContact CD2-CE2 4.14Å; F69-F104 AromaticContact CD2-CZ 3.86Å; F69-F104 HydrophobicContact CD2-CZ 3.86Å; F69-F104 AromaticContact CE2-CE2 3.71Å; F69-F104 HydrophobicContact CE2-CE2 3.71Å; F69-F104 AromaticContact CE2-CZ 3.65Å; F69-F104 HydrophobicContact CE2-CZ 3.65Å; F69-F104 HydrophobicContact CZ-CE2 4.16Å; F69-L126 HydrophobicContact CB-CD1 4.16Å; F69-L126 HydrophobicContact CD1-CD1 4.06Å; F69-G127 CarbonylContact C-O 3.45Å; F69-G127 VanDerWaalsContact CA-O 3.28Å; F69-G127 WeakPolarHBondContact CA-O 3.03Å; F69-I128 HydrophobicContact CD1-CB 4.42Å; F69-I128 HydrophobicContact CD1-CG1 3.82Å; F69-I128 HydrophobicContact CD1-CG2 4.25Å; F69-I128 HydrophobicContact CE1-CB 4.41Å; F69-I128 HydrophobicContact CE1-CD1 4.24Å; F69-I128 HydrophobicContact CE1-CG1 3.87Å; F69-I128 HydrophobicContact CE1-CG2 3.86Å
70	T	97	Very high	84.3	Confident	34 Å²	34	45.9 Å²	45.9	21%	0.209	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.3	166	68.6	0	0	0	0	110	Y68 H91 T92 L126 G127 F129	Y68-T70 HydrophobicContact CD2-CG2 4.4Å; Y68-T70 HydrophobicContact CE2-CG2 3.91Å; T70-H91 CarbonylContact C-O 3.59Å; T70-H91 WeakPolarHBondContact CA-O 3.43Å; T70-T92 HydrophobicContact CG2-CG2 4.16Å; T70-L126 WeakPolarHBondContact O-CA 3.41Å; T70-G127 PolarHBondContact N-O 3.37Å; T70-G127 PolarHBondContact O-N 3.43Å; T70-F129 HydrophobicContact CG2-CD2 4.09Å; T70-F129 HydrophobicContact CG2-CE2 3.73Å; T70-F129 WeakPolarHBondContact OG1-CE2 3.45Å
71	L	97.5	Very high	83.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	126.8	-179.9	-75.8	76.5	0	0	0	109.2	I40 W42 F69 L89 H91 I110 F124 L126	I40-L71 HydrophobicContact CG2-CD2 4.47Å; W42-L71 HydrophobicContact CD2-CD2 4.47Å; W42-L71 HydrophobicContact CE3-CD2 3.97Å; W42-L71 HydrophobicContact CH2-CD1 4.24Å; W42-L71 HydrophobicContact CH2-CD2 3.95Å; W42-L71 HydrophobicContact CZ2-CD1 4.13Å; W42-L71 HydrophobicContact CZ2-CD2 4.42Å; W42-L71 HydrophobicContact CZ3-CD2 3.7Å; F69-L71 HydrophobicContact CB-CD1 3.83Å; L71-L89 HydrophobicContact CB-CD2 4.26Å; L71-H91 HydrophobicContact CB-CB 4.47Å; L71-H91 PolarHBondContact N-O 2.79Å; L71-H91 PolarHBondContact O-N 3.01Å; L71-I110 HydrophobicContact CD2-CD1 3.58Å; L71-F124 HydrophobicContact CB-CE2 4.08Å; L71-F124 HydrophobicContact CB-CZ 4.28Å; L71-F124 HydrophobicContact CD2-CE2 4.14Å; L71-F124 HydrophobicContact CD2-CZ 3.75Å; L71-F124 HydrophobicContact CG-CE2 4.19Å; L71-F124 HydrophobicContact CG-CZ 3.87Å; L71-L126 HydrophobicContact CD1-CD1 3.48Å; L71-L126 VanDerWaalsContact CD1-CD1 3.48Å; L71-L126 HydrophobicContact CD2-CD1 4.43Å; L71-L126 HydrophobicContact CG-CD1 3.68Å
72	C	95.9	Very high	83.8	Confident	20 Å²	20	46.3 Å²	46.3	14%	0.135	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	120	177.5	170.1	0	0	0	0	109.4	C86 L89 F124 T125	C72-C86 HydrophobicContact CB-CB 3.85Å; C72-C86 WeakPolarHBondContact CB-SG 3.38Å; C72-C86 WeakPolarHBondContact SG-CB 3.17Å; C72-C86 CovalentContact SG-SG 2.01Å; C72-C86 PolarHBondContact SG-SG 3.02Å; C72-L89 CarbonylContact C-O 3.47Å; C72-L89 WeakPolarHBondContact CA-O 3.32Å; C72-F124 CarbonylContact O-C 3.53Å; C72-F124 WeakPolarHBondContact O-CA 3.44Å; C72-F124 VanDerWaalsContact O-CD2 3.28Å; C72-F124 WeakPolarHBondContact O-CD2 3.05Å; C72-T125 PolarHBondContact N-O 3.48Å; C72-T125 PolarHBondContact O-N 3.48Å
73	L	95.9	Very high	83.5	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	134.1	172	-169.9	72.6	0	0	0	110.1	L38 C86 L88 L89 I112 Y122 F124 F148 M178	L38-L73 HydrophobicContact CD2-CD2 3.35Å; L73-C86 CarbonylContact O-C 3.58Å; L73-L88 HydrophobicContact CB-CB 4.2Å; L73-L88 HydrophobicContact CD2-CB 4Å; L73-L88 HydrophobicContact CD2-CD1 4.16Å; L73-L88 HydrophobicContact CG-CB 4.1Å; L73-L88 HydrophobicContact CG-CD1 4.12Å; L73-L88 WeakPolarHBondContact O-CB 3.31Å; L73-L88 PolarHBondContact O-N 2.92Å; L73-L88 VanDerWaalsContact O-N 3.08Å; L73-L89 HydrophobicContact CB-CB 3.7Å; L73-L89 PolarHBondContact N-O 3.35Å; L73-L89 PolarHBondContact O-N 2.03Å; L73-I112 HydrophobicContact CD2-CD1 3.95Å; L73-Y122 HydrophobicContact CD1-CD1 4.23Å; L73-Y122 HydrophobicContact CD2-CD1 4.34Å; L73-Y122 HydrophobicContact CG-CD1 4.34Å; L73-F124 HydrophobicContact CB-CD2 4.17Å; L73-F124 HydrophobicContact CD1-CB 3.83Å; L73-F124 HydrophobicContact CD1-CD2 3.84Å; L73-F124 HydrophobicContact CD1-CG 4.26Å; L73-F148 HydrophobicContact CD1-CZ 4.17Å; L73-M178 HydrophobicContact CD1-CE 4.43Å
74	K	92.3	Very high	83	Confident	32 Å²	32	49 Å²	49	14%	0.139	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	161.2	176.2	59.8	-177.3	172.6	178.6	0	111.8	I83 Y122 T123	K74-I83 PolarHBondContact NZ-O 2.83Å; K74-Y122 WeakPolarHBondContact O-CA 3.25Å; K74-T123 HydrophobicContact CG-CG2 4.41Å; K74-T123 PolarHBondContact N-O 3.33Å; K74-T123 PolarHBondContact O-N 3.22Å
75	N	91.4	Very high	82.8	Confident	55 Å²	55	50.5 Å²	50.5	29%	0.294	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	126.2	168.2	-179.1	-13.8	0	0	0	108.5	A77 S78 P119 E121	N75-A77 PolarHBondContact O-N 2.89Å; N75-A77 PolarHBondContact OD1-N 3.29Å; N75-S78 WeakPolarHBondContact O-CB 3.3Å; N75-S78 PolarHBondContact O-N 2.75Å; N75-S78 VanDerWaalsContact O-N 3.11Å; N75-S78 PolarHBondContact O-OG 3.42Å; N75-P119 HydrophobicContact CB-CB 4.19Å; N75-P119 HydrophobicContact CB-CG 3.97Å; N75-E121 PolarHBondContact OD1-O 3.49Å
76	A	89	Confident	82.7	Confident	16 Å²	16	51.4 Å²	51.4	13%	0.132	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.1	-176.3	0	0	0	0	0	113.2	S78 E121	A76-S78 VanDerWaalsContact C-N 3.28Å; A76-S78 PolarHBondContact O-N 3.32Å; A76-E121 HydrophobicContact CB-CB 4.12Å; A76-E121 HydrophobicContact CB-CG 3.84Å; A76-E121 PolarHBondContact N-O 3.32Å
77	A	82.1	Confident	82.3	Confident	70 Å²	70	55.7 Å²	55.7	58%	0.579	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	2.2	174.7	0	0	0	0	0	114.1	N75 V79	N75-A77 PolarHBondContact O-N 2.89Å; N75-A77 PolarHBondContact OD1-N 3.29Å; A77-V79 PolarHBondContact O-N 3.32Å
78	S	71.8	Confident	82.1	Confident	34 Å²	34	57.3 Å²	57.3	24%	0.238	32%	0.324	C	S	.	.			trans	-59.2	136.5	178.6	59.8	0	0	0	0	111.6	N75 A76	N75-S78 WeakPolarHBondContact O-CB 3.3Å; N75-S78 PolarHBondContact O-N 2.75Å; N75-S78 VanDerWaalsContact O-N 3.11Å; N75-S78 PolarHBondContact O-OG 3.42Å; A76-S78 VanDerWaalsContact C-N 3.28Å; A76-S78 PolarHBondContact O-N 3.32Å
79	V	65.2	Low	82.1	Confident	113 Å²	113	56.6 Å²	56.6	69%	0.685	32%	0.322	S	S	*	.			trans	-63	150.1	-176	-178.2	0	0	0	0	111.9	A77 D81 D82	A77-V79 PolarHBondContact O-N 3.32Å; V79-D81 VanDerWaalsContact C-N 3.25Å; V79-D81 PolarHBondContact O-N 2.72Å; V79-D81 VanDerWaalsContact O-N 3.12Å; V79-D82 PolarHBondContact O-N 3.49Å
80	A	59.2	Low	81.9	Confident	68 Å²	68	62.4 Å²	62.4	56%	0.562	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-52.8	-32.5	-174.2	0	0	0	0	0	115.6	D82 I83	A80-D82 PolarHBondContact O-N 3.47Å; A80-D82 VanDerWaalsContact O-N 3.16Å; A80-I83 HydrophobicContact CB-CD1 4.07Å; A80-I83 WeakPolarHBondContact O-CD1 3.13Å; A80-I83 WeakPolarHBondContact O-CG1 3.03Å; A80-I83 PolarHBondContact O-N 2.97Å
81	D	58.3	Low	81.8	Confident	162 Å²	162	64.4 Å²	64.4	87%	0.866	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-70.4	-8.7	-180	-70.1	-28.3	0	0	0	113.3	V79	V79-D81 VanDerWaalsContact C-N 3.25Å; V79-D81 PolarHBondContact O-N 2.72Å; V79-D81 VanDerWaalsContact O-N 3.12Å
82	D	64.8	Low	81.8	Confident	45 Å²	45	68.1 Å²	68.1	24%	0.241	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-121.7	19.3	-179	-127.8	-12.2	0	0	0	113.5	V79 A80 D84 K85 H87	V79-D82 PolarHBondContact O-N 3.49Å; A80-D82 PolarHBondContact O-N 3.47Å; A80-D82 VanDerWaalsContact O-N 3.16Å; D82-D84 PolarHBondContact O-N 3.15Å; D82-D84 VanDerWaalsContact O-N 3.07Å; D82-K85 PolarHBondContact O-N 2.97Å; D82-K85 WeakPolarHBondContact OD1-CB 3.45Å; D82-K85 WeakPolarHBondContact OD1-CD 3.35Å; D82-K85 WeakPolarHBondContact OD1-CE 3.42Å; D82-K85 WeakPolarHBondContact OD1-CG 3.38Å; D82-K85 IonicContact OD1-NZ 3.47Å; D82-K85 PolarHBondContact OD1-NZ 2.62Å; D82-K85 IonicContact OD2-NZ 3.43Å; D82-H87 VanDerWaalsContact CG-CE1 3.48Å; D82-H87 IonicContact OD1-CE1 3.07Å; D82-H87 IonicContact OD1-NE2 3.99Å; D82-H87 IonicContact OD2-CE1 2.72Å; D82-H87 PolarHBondContact OD2-CE1 2.81Å; D82-H87 IonicContact OD2-NE2 2.63Å; D82-H87 PolarHBondContact OD2-NE2 2.86Å
83	I	59.8	Low	81.7	Confident	88 Å²	88	68.1 Å²	68.1	45%	0.451	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-37.7	-176.1	-73.2	161.2	0	0	0	111.8	K74 A80	K74-I83 PolarHBondContact NZ-O 2.83Å; A80-I83 HydrophobicContact CB-CD1 4.07Å; A80-I83 WeakPolarHBondContact O-CD1 3.13Å; A80-I83 WeakPolarHBondContact O-CG1 3.03Å; A80-I83 PolarHBondContact O-N 2.97Å
84	D	65.8	Low	81.6	Confident	153 Å²	153	76.3 Å²	76.3	82%	0.818	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-1.3	-174.7	-64.7	-23.1	0	0	0	114.1	D82	D82-D84 PolarHBondContact O-N 3.15Å; D82-D84 VanDerWaalsContact O-N 3.07Å
85	K	81.4	Confident	81.6	Confident	120 Å²	120	77 Å²	77	52%	0.522	42%	0.417	S	S	.	.			trans	-93.8	123.3	176.9	-69	-157.8	-156.6	96.8	0	112.5	D82 H87	D82-K85 PolarHBondContact O-N 2.97Å; D82-K85 WeakPolarHBondContact OD1-CB 3.45Å; D82-K85 WeakPolarHBondContact OD1-CD 3.35Å; D82-K85 WeakPolarHBondContact OD1-CE 3.42Å; D82-K85 WeakPolarHBondContact OD1-CG 3.38Å; D82-K85 IonicContact OD1-NZ 3.47Å; D82-K85 PolarHBondContact OD1-NZ 2.62Å; D82-K85 IonicContact OD2-NZ 3.43Å; K85-H87 PolarHBondContact O-CD2 3.22Å; K85-H87 VanDerWaalsContact O-CD2 3.25Å; K85-H87 PolarHBondContact O-N 3.22Å; K85-H87 VanDerWaalsContact O-N 3.11Å
86	C	89	Confident	81.7	Confident	21 Å²	21	75.8 Å²	75.8	14%	0.142	41%	0.408	C	S	.	.			trans	-88.5	73.6	177.6	-46.4	0	0	0	0	110.3	C72 L73 L88 L89 Q90	C72-C86 HydrophobicContact CB-CB 3.85Å; C72-C86 WeakPolarHBondContact CB-SG 3.38Å; C72-C86 WeakPolarHBondContact SG-CB 3.17Å; C72-C86 CovalentContact SG-SG 2.01Å; C72-C86 PolarHBondContact SG-SG 3.02Å; L73-C86 CarbonylContact O-C 3.58Å; C86-L88 PolarHBondContact O-N 3.43Å; C86-L88 VanDerWaalsContact O-N 3.16Å; C86-L89 WeakPolarHBondContact CB-O 3.33Å; C86-L89 CarbonylContact O-C 3.59Å; C86-L89 PolarHBondContact O-N 2.03Å; C86-Q90 HydrophobicContact CB-CB 4.31Å; C86-Q90 PolarHBondContact SG-OE1 2.93Å
87	H	85.2	Confident	81.7	Confident	107 Å²	107	80.8 Å²	80.8	50%	0.495	43%	0.433	S	S	.	.	S	Bend	trans	-59.8	-26.2	-171.3	-65.9	-80	0	0	0	115.2	D82 K85	D82-H87 VanDerWaalsContact CG-CE1 3.48Å; D82-H87 IonicContact OD1-CE1 3.07Å; D82-H87 IonicContact OD1-NE2 3.99Å; D82-H87 IonicContact OD2-CE1 2.72Å; D82-H87 PolarHBondContact OD2-CE1 2.81Å; D82-H87 IonicContact OD2-NE2 2.63Å; D82-H87 PolarHBondContact OD2-NE2 2.86Å; K85-H87 PolarHBondContact O-CD2 3.22Å; K85-H87 VanDerWaalsContact O-CD2 3.25Å; K85-H87 PolarHBondContact O-N 3.22Å; K85-H87 VanDerWaalsContact O-N 3.11Å
88	L	90.2	Very high	82	Confident	35 Å²	35	79.9 Å²	79.9	18%	0.183	42%	0.419	C	S	.	.	S	Bend	trans	-94	-40	-176.6	-59.9	175	0	0	0	112.1	L73 C86 V114 P119 Y122	L73-L88 HydrophobicContact CB-CB 4.2Å; L73-L88 HydrophobicContact CD2-CB 4Å; L73-L88 HydrophobicContact CD2-CD1 4.16Å; L73-L88 HydrophobicContact CG-CB 4.1Å; L73-L88 HydrophobicContact CG-CD1 4.12Å; L73-L88 WeakPolarHBondContact O-CB 3.31Å; L73-L88 PolarHBondContact O-N 2.92Å; L73-L88 VanDerWaalsContact O-N 3.08Å; C86-L88 PolarHBondContact O-N 3.43Å; C86-L88 VanDerWaalsContact O-N 3.16Å; L88-V114 HydrophobicContact CD2-CG1 4.34Å; L88-P119 HydrophobicContact CD1-CG 4.11Å; L88-Y122 HydrophobicContact CD1-CD1 3.71Å; L88-Y122 HydrophobicContact CD1-CE1 3.73Å
89	L	94.3	Very high	82.9	Confident	15 Å²	15	78.8 Å²	78.8	8%	0.079	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	125.5	177.4	177.7	62	0	0	0	109.7	I40 L71 C72 L73 C86 H91 I110 I112	I40-L89 HydrophobicContact CD1-CD2 3.57Å; L71-L89 HydrophobicContact CB-CD2 4.26Å; C72-L89 CarbonylContact C-O 3.47Å; C72-L89 WeakPolarHBondContact CA-O 3.32Å; L73-L89 HydrophobicContact CB-CB 3.7Å; L73-L89 PolarHBondContact N-O 3.35Å; L73-L89 PolarHBondContact O-N 2.03Å; C86-L89 WeakPolarHBondContact CB-O 3.33Å; C86-L89 CarbonylContact O-C 3.59Å; C86-L89 PolarHBondContact O-N 2.03Å; L89-H91 HydrophobicContact CD1-CB 3.74Å; L89-H91 HydrophobicContact CG-CB 4.2Å; L89-I110 HydrophobicContact CD1-CG2 4.09Å; L89-I110 HydrophobicContact CD2-CD1 4.36Å; L89-I110 HydrophobicContact CD2-CG2 3.96Å; L89-I112 HydrophobicContact CB-CD1 3.97Å; L89-I112 HydrophobicContact CD1-CG2 3.81Å
90	Q	94.5	Very high	83.9	Confident	123 Å²	123	73.8 Å²	73.8	58%	0.575	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	114.2	159.6	-177.4	71.2	22.1	0	0	106.8	C86	C86-Q90 HydrophobicContact CB-CB 4.31Å; C86-Q90 PolarHBondContact SG-OE1 2.93Å
91	H	95	Very high	85.7	Confident	76 Å²	76	76.5 Å²	76.5	35%	0.352	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	138.7	-179.4	-174	-92.7	0	0	0	111.4	T70 L71 L89 I110	T70-H91 CarbonylContact C-O 3.59Å; T70-H91 WeakPolarHBondContact CA-O 3.43Å; L71-H91 HydrophobicContact CB-CB 4.47Å; L71-H91 PolarHBondContact N-O 2.79Å; L71-H91 PolarHBondContact O-N 3.01Å; L89-H91 HydrophobicContact CD1-CB 3.74Å; L89-H91 HydrophobicContact CG-CB 4.2Å; H91-I110 HydrophobicContact CB-CD1 4.17Å
92	T	95.7	Very high	87.5	Confident	77 Å²	77	70 Å²	70	47%	0.472	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	125.7	174.3	-58.7	0	0	0	0	107.7	Y68 F69 T70	Y68-T92 HydrophobicContact CD2-CG2 3.86Å; Y68-T92 HydrophobicContact CE2-CG2 4.1Å; F69-T92 CarbonylContact O-C 3.54Å; F69-T92 WeakPolarHBondContact O-CA 3.41Å; T70-T92 HydrophobicContact CG2-CG2 4.16Å
93	T	95.5	Very high	89	Confident	20 Å²	20	72.1 Å²	72.1	12%	0.123	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-73.9	167.4	177.9	67.1	0	0	0	0	110.7	W42 F69	W42-T93 HydrophobicContact CH2-CG2 4.38Å; W42-T93 HydrophobicContact CZ2-CG2 4.12Å; F69-T93 HydrophobicContact CB-CG2 3.96Å; F69-T93 HydrophobicContact CD2-CG2 4.3Å; F69-T93 PolarHBondContact N-OG1 2.86Å; F69-T93 PolarHBondContact O-N 2.77Å
94	R	94	Very high	90.7	Very high	172 Å²	172	68.6 Å²	68.6	65%	0.649	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-62.8	165.4	160.1	65.4	179.1	-178.2	83.1	-5.3	110.9	F96	R94-F96 HydrophobicContact CG-CE1 4.48Å; R94-F96 HydrophobicContact CG-CE2 4.05Å; R94-F96 HydrophobicContact CG-CZ 3.95Å; R94-F96 VanDerWaalsContact O-CD2 3.28Å; R94-F96 WeakPolarHBondContact O-CD2 3.4Å; R94-F96 VanDerWaalsContact O-CE2 3.22Å; R94-F96 WeakPolarHBondContact O-CE2 3.23Å
95	V	92.5	Very high	92	Very high	48 Å²	48	63.9 Å²	63.9	29%	0.291	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-74.7	141.9	168.4	-173.3	0	0	0	0	109.5	D66 V67 Y68 Q131	D66-V95 HydrophobicContact CB-CG1 4.16Å; V67-V95 CarbonylContact O-C 3.58Å; V67-V95 WeakPolarHBondContact O-CA 3.09Å; Y68-V95 HydrophobicContact CD1-CG2 4.29Å; V95-Q131 HydrophobicContact CG1-CB 4.28Å; V95-Q131 HydrophobicContact CG2-CB 4.09Å; V95-Q131 HydrophobicContact CG2-CG 4.15Å
96	F	92.6	Very high	92.3	Very high	28 Å²	28	65.9 Å²	65.9	12%	0.123	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-116.4	102.1	175.9	-64	-95.4	0	0	0	107.9	V67 F69 R94 N98 A99 L102 F104	V67-F96 PolarHBondContact N-O 3.15Å; V67-F96 PolarHBondContact O-N 2.81Å; F69-F96 HydrophobicContact CE2-CD2 4.46Å; R94-F96 HydrophobicContact CG-CE1 4.48Å; R94-F96 HydrophobicContact CG-CE2 4.05Å; R94-F96 HydrophobicContact CG-CZ 3.95Å; R94-F96 VanDerWaalsContact O-CD2 3.28Å; R94-F96 WeakPolarHBondContact O-CD2 3.4Å; R94-F96 VanDerWaalsContact O-CE2 3.22Å; R94-F96 WeakPolarHBondContact O-CE2 3.23Å; F96-N98 PolarHBondContact O-N 3.07Å; F96-A99 HydrophobicContact CB-CB 3.99Å; F96-L102 HydrophobicContact CB-CD1 3.78Å; F96-L102 HydrophobicContact CB-CD2 4.28Å; F96-L102 HydrophobicContact CD1-CD1 4.29Å; F96-L102 HydrophobicContact CD1-CD2 3.92Å; F96-L102 HydrophobicContact CD2-CD1 3.98Å; F96-L102 HydrophobicContact CG-CD1 3.78Å; F96-L102 HydrophobicContact CG-CD2 4.18Å; F96-F104 HydrophobicContact CE1-CE1 4.32Å; F96-F104 HydrophobicContact CE1-CZ 4.41Å; F96-F104 AromaticContact CE2-CE1 3.95Å; F96-F104 HydrophobicContact CE2-CE1 3.95Å; F96-F104 AromaticContact CE2-CZ 3.77Å; F96-F104 HydrophobicContact CE2-CZ 3.77Å; F96-F104 AromaticContact CZ-CE1 3.54Å; F96-F104 HydrophobicContact CZ-CE1 3.54Å; F96-F104 AromaticContact CZ-CZ 3.74Å; F96-F104 HydrophobicContact CZ-CZ 3.74Å
97	D	89.6	Confident	92.1	Very high	122 Å²	122	68.7 Å²	68.7	65%	0.652	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	131.7	-175.3	-51.5	-24.2	0	0	0	111	D66 A99	D66-D97 WeakPolarHBondContact OD1-CA 3.39Å; D97-A99 PolarHBondContact O-N 3.22Å
98	N	88.2	Confident	92.3	Very high	51 Å²	51	69.1 Å²	69.1	27%	0.273	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	61.7	173.9	-55.9	-94.3	0	0	0	112.9	K63 E64 C65 D66 F96	K63-N98 WeakPolarHBondContact CB-OD1 3Å; K63-N98 WeakPolarHBondContact CD-OD1 3.46Å; E64-N98 VanDerWaalsContact CB-C 3.44Å; E64-N98 HydrophobicContact CB-CB 4.31Å; E64-N98 PolarHBondContact O-OD1 3.01Å; C65-N98 CarbonylContact O-C 3.54Å; C65-N98 WeakPolarHBondContact O-CA 2.99Å; C65-N98 PolarHBondContact O-N 3Å; D66-N98 PolarHBondContact OD1-N 3.4Å; D66-N98 PolarHBondContact OD1-ND2 3.41Å; F96-N98 PolarHBondContact O-N 3.07Å
99	A	89.8	Confident	92.3	Very high	11 Å²	11	68.2 Å²	68.2	9%	0.091	35%	0.351	C	S	.	.			trans	-120.3	109.4	-173.9	0	0	0	0	0	113.3	E64 C65 F96 D97 L102	E64-A99 WeakPolarHBondContact OE2-CA 3.4Å; C65-A99 PolarHBondContact O-N 3.07Å; F96-A99 HydrophobicContact CB-CB 3.99Å; D97-A99 PolarHBondContact O-N 3.22Å; A99-L102 HydrophobicContact CB-CD1 3.84Å; A99-L102 HydrophobicContact CB-CD2 3.87Å; A99-L102 HydrophobicContact CB-CG 3.86Å
100	G	87.4	Confident	92.3	Very high	7 Å²	7	68.3 Å²	68.3	7%	0.072	35%	0.352	C	S	.	.	S	Bend	trans	-86.8	-33.5	176.6	0	0	0	0	0	113.8	D45 N46 E64	D45-G100 WeakPolarHBondContact CA-O 3.44Å; N46-G100 PolarHBondContact N-O 2.04Å; E64-G100 PolarHBondContact OE2-N 3.39Å
101	Y	95.2	Very high	92.3	Very high	126 Å²	126	67.9 Å²	67.9	49%	0.494	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	132.1	174.6	175.3	-95.6	0	0	0	110.5	Y44 D45 E103	Y44-Y101 CarbonylContact O-C 3.58Å; Y44-Y101 VanDerWaalsContact O-CA 3.3Å; Y44-Y101 WeakPolarHBondContact O-CA 2.99Å; Y44-Y101 VanDerWaalsContact O-CD2 3.29Å; Y44-Y101 WeakPolarHBondContact O-CD2 3.42Å; D45-Y101 HydrophobicContact CB-CD2 4.06Å; Y101-E103 HydrophobicContact CE1-CB 3.92Å; Y101-E103 PolarHBondContact OH-OE2 2.88Å
102	L	96.1	Very high	92.2	Very high	25 Å²	25	65.8 Å²	65.8	13%	0.131	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	141.8	176.3	-67.9	171.2	0	0	0	110.1	D43 Y44 F69 F96 A99 F104	D43-L102 CarbonylContact C-O 3.58Å; D43-L102 WeakPolarHBondContact CA-O 3.27Å; Y44-L102 HydrophobicContact CD1-CB 4.34Å; Y44-L102 HydrophobicContact CD1-CD1 4.46Å; Y44-L102 PolarHBondContact N-O 3.17Å; Y44-L102 PolarHBondContact O-N 3.31Å; F69-L102 HydrophobicContact CE2-CD1 3.62Å; F69-L102 HydrophobicContact CZ-CD1 3.94Å; F96-L102 HydrophobicContact CB-CD1 3.78Å; F96-L102 HydrophobicContact CB-CD2 4.28Å; F96-L102 HydrophobicContact CD1-CD1 4.29Å; F96-L102 HydrophobicContact CD1-CD2 3.92Å; F96-L102 HydrophobicContact CD2-CD1 3.98Å; F96-L102 HydrophobicContact CG-CD1 3.78Å; F96-L102 HydrophobicContact CG-CD2 4.18Å; A99-L102 HydrophobicContact CB-CD1 3.84Å; A99-L102 HydrophobicContact CB-CD2 3.87Å; A99-L102 HydrophobicContact CB-CG 3.86Å; L102-F104 HydrophobicContact CB-CE2 3.77Å; L102-F104 HydrophobicContact CB-CZ 4.28Å; L102-F104 HydrophobicContact CD1-CZ 4.43Å
103	E	96.2	Very high	92.1	Very high	89 Å²	89	66.8 Å²	66.8	42%	0.416	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	129.6	179.4	-168.7	175.9	-174.3	0	0	110.3	D43 Y101 R105	D43-E103 HydrophobicContact CB-CG 4.16Å; Y101-E103 HydrophobicContact CE1-CB 3.92Å; Y101-E103 PolarHBondContact OH-OE2 2.88Å; E103-R105 HydrophobicContact CG-CG 3.8Å; E103-R105 WeakPolarHBondContact OE1-CG 3.29Å; E103-R105 IonicContact OE1-CZ 2.81Å; E103-R105 IonicContact OE1-NE 3.81Å; E103-R105 PolarHBondContact OE1-NE 2.83Å; E103-R105 IonicContact OE1-NH2 3.68Å; E103-R105 PolarHBondContact OE1-NH2 3.13Å; E103-R105 VanDerWaalsContact OE1-NH2 3.13Å
104	F	96.2	Very high	92	Very high	14 Å²	14	65.9 Å²	65.9	6%	0.061	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	96.5	-176.7	-60.6	-95.7	0	0	0	109	E41 W42 F69 F96 L102 D108	E41-F104 WeakPolarHBondContact CB-O 3.34Å; E41-F104 WeakPolarHBondContact CG-O 3.18Å; W42-F104 AromaticContact CD1-CD2 3.8Å; W42-F104 HydrophobicContact CD2-CB 4.03Å; W42-F104 AromaticContact CD2-CD2 3.88Å; W42-F104 HydrophobicContact CD2-CD2 3.88Å; W42-F104 HydrophobicContact CD2-CG 4.07Å; W42-F104 AromaticContact CE2-CD2 3.25Å; W42-F104 AromaticContact CE2-CE2 3.63Å; W42-F104 AromaticContact CE2-CG 3.59Å; W42-F104 HydrophobicContact CE3-CB 4Å; W42-F104 HydrophobicContact CE3-CG 4.38Å; W42-F104 HydrophobicContact CG-CD2 4.19Å; W42-F104 HydrophobicContact CH2-CB 4.05Å; W42-F104 AromaticContact CH2-CD1 3.83Å; W42-F104 HydrophobicContact CH2-CD1 3.83Å; W42-F104 HydrophobicContact CH2-CD2 4.31Å; W42-F104 HydrophobicContact CH2-CE1 4.34Å; W42-F104 AromaticContact CH2-CG 3.8Å; W42-F104 HydrophobicContact CH2-CG 3.8Å; W42-F104 HydrophobicContact CZ2-CB 4.1Å; W42-F104 AromaticContact CZ2-CD1 3.62Å; W42-F104 HydrophobicContact CZ2-CD1 3.62Å; W42-F104 AromaticContact CZ2-CD2 3.52Å; W42-F104 HydrophobicContact CZ2-CD2 3.52Å; W42-F104 AromaticContact CZ2-CE1 3.82Å; W42-F104 HydrophobicContact CZ2-CE1 3.82Å; W42-F104 AromaticContact CZ2-CE2 3.73Å; W42-F104 HydrophobicContact CZ2-CE2 3.73Å; W42-F104 AromaticContact CZ2-CG 3.46Å; W42-F104 HydrophobicContact CZ2-CG 3.46Å; W42-F104 VanDerWaalsContact CZ2-CG 3.46Å; W42-F104 AromaticContact CZ2-CZ 3.88Å; W42-F104 HydrophobicContact CZ2-CZ 3.88Å; W42-F104 HydrophobicContact CZ3-CB 4Å; W42-F104 HydrophobicContact CZ3-CG 4.25Å; W42-F104 PolarHBondContact N-O 2.81Å; W42-F104 AromaticContact NE1-CD2 3.23Å; W42-F104 AromaticContact NE1-CE2 3.33Å; W42-F104 VanDerWaalsContact NE1-CE2 3.33Å; W42-F104 PolarHBondContact O-N 2.73Å; F69-F104 HydrophobicContact CD2-CE2 4.14Å; F69-F104 AromaticContact CD2-CZ 3.86Å; F69-F104 HydrophobicContact CD2-CZ 3.86Å; F69-F104 AromaticContact CE2-CE2 3.71Å; F69-F104 HydrophobicContact CE2-CE2 3.71Å; F69-F104 AromaticContact CE2-CZ 3.65Å; F69-F104 HydrophobicContact CE2-CZ 3.65Å; F69-F104 HydrophobicContact CZ-CE2 4.16Å; F96-F104 HydrophobicContact CE1-CE1 4.32Å; F96-F104 HydrophobicContact CE1-CZ 4.41Å; F96-F104 AromaticContact CE2-CE1 3.95Å; F96-F104 HydrophobicContact CE2-CE1 3.95Å; F96-F104 AromaticContact CE2-CZ 3.77Å; F96-F104 HydrophobicContact CE2-CZ 3.77Å; F96-F104 AromaticContact CZ-CE1 3.54Å; F96-F104 HydrophobicContact CZ-CE1 3.54Å; F96-F104 AromaticContact CZ-CZ 3.74Å; F96-F104 HydrophobicContact CZ-CZ 3.74Å; L102-F104 HydrophobicContact CB-CE2 3.77Å; L102-F104 HydrophobicContact CB-CZ 4.28Å; L102-F104 HydrophobicContact CD1-CZ 4.43Å; F104-D108 HydrophobicContact CB-CB 4.49Å; F104-D108 HydrophobicContact CD1-CB 4.37Å
105	R	94.3	Very high	91.7	Very high	54 Å²	54	60.8 Å²	60.8	20%	0.204	32%	0.322	C	S	.	.			trans	-125.7	157.1	-179.3	-57.5	-62.5	-175.3	-152.4	-13.1	111.3	E41 D43 E103 G107 D108	E41-R105 WeakPolarHBondContact OE2-CD 3.01Å; E41-R105 IonicContact OE2-NE 2.77Å; E41-R105 IonicContact OE2-NH1 2.7Å; E41-R105 PolarHBondContact OE2-NH1 3.4Å; D43-R105 IonicContact OD1-CZ 2.74Å; D43-R105 IonicContact OD1-NH2 3.26Å; D43-R105 PolarHBondContact OD1-NH2 3.32Å; E103-R105 HydrophobicContact CG-CG 3.8Å; E103-R105 WeakPolarHBondContact OE1-CG 3.29Å; E103-R105 IonicContact OE1-CZ 2.81Å; E103-R105 IonicContact OE1-NE 3.81Å; E103-R105 PolarHBondContact OE1-NE 2.83Å; E103-R105 IonicContact OE1-NH2 3.68Å; E103-R105 PolarHBondContact OE1-NH2 3.13Å; E103-R105 VanDerWaalsContact OE1-NH2 3.13Å; R105-G107 PolarHBondContact O-N 3.46Å; R105-D108 PolarHBondContact O-N 3.04Å
106	E	87.6	Confident	91.3	Very high	163 Å²	163	62.1 Å²	62.1	76%	0.762	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	51.5	-108.7	169	-59.1	-175.7	174.7	0	0	112.9	E41 D108 S109	E41-E106 PolarHBondContact OE1-N 3.14Å; E106-D108 PolarHBondContact O-N 3.32Å; E106-S109 VanDerWaalsContact O-CB 3.26Å; E106-S109 WeakPolarHBondContact O-CB 3.46Å; E106-S109 PolarHBondContact O-N 3.22Å; E106-S109 PolarHBondContact O-OG 3.42Å
107	G	84.8	Confident	91.1	Very high	80 Å²	80	66.4 Å²	66.4	83%	0.825	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-63.9	-22.8	-179.4	0	0	0	0	0	114.3	R105	R105-G107 PolarHBondContact O-N 3.46Å
108	D	88.3	Confident	91.2	Very high	115 Å²	115	60.8 Å²	60.8	62%	0.615	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-95	-2.9	175.6	-62.6	-41.1	0	0	0	112.6	F104 R105 E106	F104-D108 HydrophobicContact CB-CB 4.49Å; F104-D108 HydrophobicContact CD1-CB 4.37Å; R105-D108 PolarHBondContact O-N 3.04Å; E106-D108 PolarHBondContact O-N 3.32Å
109	S	91.1	Very high	91.4	Very high	16 Å²	16	58.9 Å²	58.9	11%	0.112	32%	0.316	C	S	.	.	S	Bend	trans	-70.1	149.7	176.3	75.5	0	0	0	0	111.3	E106	E106-S109 VanDerWaalsContact O-CB 3.26Å; E106-S109 WeakPolarHBondContact O-CB 3.46Å; E106-S109 PolarHBondContact O-N 3.22Å; E106-S109 PolarHBondContact O-OG 3.42Å
110	I	94.1	Very high	91.6	Very high	18 Å²	18	63.5 Å²	63.5	9%	0.092	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.6	173.7	-64.4	-179.3	0	0	0	108.6	K39 I40 W42 L71 L89 H91 I112	K39-I110 CarbonylContact C-O 3.44Å; K39-I110 VanDerWaalsContact CA-O 3.29Å; K39-I110 WeakPolarHBondContact CA-O 3.03Å; I40-I110 HydrophobicContact CB-CB 4.35Å; I40-I110 PolarHBondContact N-O 2.71Å; I40-I110 PolarHBondContact O-N 3.33Å; W42-I110 HydrophobicContact CH2-CD1 4.02Å; W42-I110 HydrophobicContact CH2-CG1 4.25Å; W42-I110 HydrophobicContact CZ3-CD1 3.94Å; W42-I110 HydrophobicContact CZ3-CG1 3.99Å; L71-I110 HydrophobicContact CD2-CD1 3.58Å; L89-I110 HydrophobicContact CD1-CG2 4.09Å; L89-I110 HydrophobicContact CD2-CD1 4.36Å; L89-I110 HydrophobicContact CD2-CG2 3.96Å; H91-I110 HydrophobicContact CB-CD1 4.17Å; I110-I112 HydrophobicContact CG2-CG2 4Å
111	E	94.1	Very high	91.9	Very high	113 Å²	113	65.9 Å²	65.9	53%	0.528	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.2	172.3	-54.9	-165.5	-174.1	0	0	109.9	L38 K39	L38-E111 WeakPolarHBondContact O-CA 3.49Å; K39-E111 HydrophobicContact CD-CG 3.96Å; K39-E111 WeakPolarHBondContact CE-OE1 3.35Å; K39-E111 WeakPolarHBondContact CE-OE2 3.43Å; K39-E111 HydrophobicContact CG-CG 3.94Å; K39-E111 VanDerWaalsContact NZ-CD 3.28Å; K39-E111 IonicContact NZ-OE1 3.79Å; K39-E111 PolarHBondContact NZ-OE1 2.9Å; K39-E111 IonicContact NZ-OE2 2.63Å; K39-E111 PolarHBondContact NZ-OE2 3.35Å
112	I	93.3	Very high	91.9	Very high	33 Å²	33	60 Å²	60	17%	0.169	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	158.1	175.1	58	163.7	0	0	0	112.2	L38 L73 L89 I110 V114	L38-I112 HydrophobicContact CB-CG1 3.99Å; L38-I112 HydrophobicContact CD2-CD1 4.07Å; L38-I112 HydrophobicContact CD2-CG1 4.32Å; L38-I112 HydrophobicContact CG-CG1 4.38Å; L38-I112 PolarHBondContact N-O 2.7Å; L38-I112 PolarHBondContact O-N 3.42Å; L73-I112 HydrophobicContact CD2-CD1 3.95Å; L89-I112 HydrophobicContact CB-CD1 3.97Å; L89-I112 HydrophobicContact CD1-CG2 3.81Å; I110-I112 HydrophobicContact CG2-CG2 4Å; I112-V114 HydrophobicContact CD1-CG2 4.48Å
113	F	93	Very high	91.8	Very high	98 Å²	98	59.2 Å²	59.2	43%	0.43	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	124.8	170.3	176.5	-110.7	0	0	0	110.1	Y33 A36 P115 V183	Y33-F113 WeakPolarHBondContact O-CZ 3.43Å; A36-F113 WeakPolarHBondContact O-CD2 3.04Å; F113-P115 HydrophobicContact CE1-CB 3.95Å; F113-V183 HydrophobicContact CD2-CG2 4.05Å; F113-V183 HydrophobicContact CE2-CG2 3.61Å
114	V	92.7	Very high	91.8	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	108.8	173.6	-178.2	0	0	0	0	107.9	G35 A36 L38 L88 I112 V118	G35-V114 CarbonylContact C-O 3.59Å; G35-V114 VanDerWaalsContact CA-O 3.26Å; G35-V114 WeakPolarHBondContact CA-O 3.4Å; A36-V114 HydrophobicContact CB-CB 4.39Å; A36-V114 PolarHBondContact N-O 3.04Å; A36-V114 PolarHBondContact O-N 2.85Å; L38-V114 HydrophobicContact CB-CG2 3.91Å; L38-V114 HydrophobicContact CD2-CG2 4.24Å; L88-V114 HydrophobicContact CD2-CG1 4.34Å; I112-V114 HydrophobicContact CD1-CG2 4.48Å; V114-V118 HydrophobicContact CG1-CG1 4.26Å; V114-V118 HydrophobicContact CG1-CG2 4.44Å
115	P	88	Confident	91.9	Very high	65 Å²	65	55.8 Å²	55.8	42%	0.422	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	159	-178.9	29.9	-35.2	0	0	0	111.5	F113 P117	F113-P115 HydrophobicContact CE1-CB 3.95Å; P115-P117 CarbonylContact O-C 3.58Å
116	Q	85.5	Confident	92.1	Very high	77 Å²	77	53.2 Å²	53.2	36%	0.36	30%	0.299	S	S	.	.	S	Bend	trans	-67.9	146	168.5	-86.3	-175.8	45.3	0	0	112.5	G34 Y186 C191	G34-Q116 VanDerWaalsContact CA-NE2 3.27Å; G34-Q116 WeakPolarHBondContact O-CG 3.37Å; G34-Q116 PolarHBondContact O-N 3.24Å; G34-Q116 VanDerWaalsContact O-N 3.14Å; Q116-Y186 VanDerWaalsContact NE2-CE1 3.35Å; Q116-C191 PolarHBondContact NE2-O 3.46Å
117	P	87.4	Confident	92.5	Very high	117 Å²	117	45.5 Å²	45.5	76%	0.76	26%	0.263	S	S	*	.	S	Bend	cis	-74.2	132.4	-5.9	30.6	-33.5	0	0	0	111.3	P115 P119	P115-P117 CarbonylContact O-C 3.58Å; P117-P119 WeakPolarHBondContact O-CD 3.03Å
118	V	92.2	Very high	93.2	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.03	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-65.9	126.2	176.8	178.2	0	0	0	0	108.6	A36 V114 Y122 L180 H190 C191	A36-V118 HydrophobicContact CB-CG1 4.43Å; A36-V118 HydrophobicContact CB-CG2 4.06Å; V114-V118 HydrophobicContact CG1-CG1 4.26Å; V114-V118 HydrophobicContact CG1-CG2 4.44Å; V118-Y122 VanDerWaalsContact CG1-OH 3.23Å; V118-Y122 WeakPolarHBondContact CG1-OH 3.32Å; V118-L180 HydrophobicContact CG1-CD2 4.38Å; V118-H190 HydrophobicContact CB-CB 4.15Å; V118-H190 WeakPolarHBondContact CB-O 3.49Å; V118-H190 VanDerWaalsContact CG2-O 3.25Å; V118-H190 WeakPolarHBondContact CG2-O 3.25Å; V118-H190 PolarHBondContact O-ND1 3.48Å; V118-C191 HydrophobicContact CG2-CB 4.13Å
119	P	92.7	Very high	93.6	Very high	10 Å²	10	38 Å²	38	7%	0.065	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-55.6	147.2	-175.7	-27.5	33.8	0	0	0	114.2	N75 L88 P117 E121 Y122	N75-P119 HydrophobicContact CB-CB 4.19Å; N75-P119 HydrophobicContact CB-CG 3.97Å; L88-P119 HydrophobicContact CD1-CG 4.11Å; P117-P119 WeakPolarHBondContact O-CD 3.03Å; P119-E121 VanDerWaalsContact C-N 3.35Å; P119-Y122 HydrophobicContact CB-CD1 4.32Å; P119-Y122 HydrophobicContact CB-CE1 3.92Å; P119-Y122 HydrophobicContact CB-CE2 4.17Å; P119-Y122 HydrophobicContact CG-CD1 4.35Å; P119-Y122 HydrophobicContact CG-CE1 3.74Å
120	N	92.6	Very high	93.7	Very high	109 Å²	109	37.2 Å²	37.2	58%	0.583	20%	0.197	S	C	*	.	S	Bend	trans	-71.6	-35.4	170.8	-65.3	-30.1	0	0	0	111.7	S149 H190	N120-S149 WeakPolarHBondContact O-CB 3.44Å; N120-S149 PolarHBondContact O-OG 3.31Å; N120-H190 PolarHBondContact OD1-CE1 3Å; N120-H190 PolarHBondContact OD1-ND1 3.36Å; N120-H190 PolarHBondContact OD1-NE2 3.35Å
121	E	94.2	Very high	93.5	Very high	57 Å²	57	38.8 Å²	38.8	27%	0.266	20%	0.204	S	C	.	.	S	Bend	trans	-145.8	149.9	-175.6	44.8	166.6	-147.4	0	0	110.4	N75 A76 P119 H147 F148	N75-E121 PolarHBondContact OD1-O 3.49Å; A76-E121 HydrophobicContact CB-CB 4.12Å; A76-E121 HydrophobicContact CB-CG 3.84Å; A76-E121 PolarHBondContact N-O 3.32Å; P119-E121 VanDerWaalsContact C-N 3.35Å; E121-H147 IonicContact OE1-CE1 2.93Å; E121-H147 IonicContact OE1-ND1 3.45Å; E121-H147 PolarHBondContact OE1-ND1 3.33Å; E121-H147 WeakPolarHBondContact OE2-CB 3.34Å; E121-H147 IonicContact OE2-CG 3.17Å; E121-H147 IonicContact OE2-ND1 3.88Å; E121-H147 PolarHBondContact OE2-ND1 3.01Å; E121-F148 CarbonylContact C-O 3.6Å; E121-F148 VanDerWaalsContact CA-O 3.27Å; E121-F148 WeakPolarHBondContact CA-O 3.18Å
122	Y	94.7	Very high	92.9	Very high	1 Å²	1	35.3 Å²	35.3	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	152.4	-173.5	-61.5	-96.9	0	0	0	109.9	L73 K74 L88 V118 P119 H147 F148 L150	L73-Y122 HydrophobicContact CD1-CD1 4.23Å; L73-Y122 HydrophobicContact CD2-CD1 4.34Å; L73-Y122 HydrophobicContact CG-CD1 4.34Å; K74-Y122 WeakPolarHBondContact O-CA 3.25Å; L88-Y122 HydrophobicContact CD1-CD1 3.71Å; L88-Y122 HydrophobicContact CD1-CE1 3.73Å; V118-Y122 VanDerWaalsContact CG1-OH 3.23Å; V118-Y122 WeakPolarHBondContact CG1-OH 3.32Å; P119-Y122 HydrophobicContact CB-CD1 4.32Å; P119-Y122 HydrophobicContact CB-CE1 3.92Å; P119-Y122 HydrophobicContact CB-CE2 4.17Å; P119-Y122 HydrophobicContact CG-CD1 4.35Å; P119-Y122 HydrophobicContact CG-CE1 3.74Å; Y122-H147 WeakPolarHBondContact O-CA 3.29Å; Y122-H147 PolarHBondContact O-N 2.96Å; Y122-H147 VanDerWaalsContact O-N 3.1Å; Y122-F148 VanDerWaalsContact CB-CZ 3.46Å; Y122-F148 HydrophobicContact CD2-CE2 4.45Å; Y122-F148 HydrophobicContact CG-CE2 4.38Å; Y122-F148 HydrophobicContact CG-CZ 4.34Å; Y122-F148 PolarHBondContact N-O 3Å; Y122-F148 WeakPolarHBondContact O-CD1 3.45Å; Y122-F148 WeakPolarHBondContact O-CE1 3.47Å; Y122-F148 PolarHBondContact O-N 2.99Å; Y122-L150 HydrophobicContact CD2-CB 4.44Å; Y122-L150 HydrophobicContact CD2-CD1 4.12Å; Y122-L150 HydrophobicContact CD2-CG 4.15Å; Y122-L150 HydrophobicContact CE2-CB 4Å; Y122-L150 HydrophobicContact CE2-CD1 4.01Å; Y122-L150 HydrophobicContact CE2-CG 4.14Å
123	T	94.9	Very high	92	Very high	9 Å²	9	41.2 Å²	41.2	6%	0.055	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	129.8	163.6	-69.3	0	0	0	0	108.3	K74 V144 A145 N146	K74-T123 HydrophobicContact CG-CG2 4.41Å; K74-T123 PolarHBondContact N-O 3.33Å; K74-T123 PolarHBondContact O-N 3.22Å; T123-V144 HydrophobicContact CG2-CG1 4.49Å; T123-A145 WeakPolarHBondContact CA-O 3.33Å; T123-N146 WeakPolarHBondContact CG2-OD1 3.5Å
124	F	96.8	Very high	91.1	Very high	1 Å²	1	46.1 Å²	46.1	0%	0.004	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	130.7	-180	-178.4	-112.3	0	0	0	110.4	I40 L71 C72 L73 L126 V144 A145 F148 M161 V176 M178	I40-F124 HydrophobicContact CD1-CE2 4.31Å; I40-F124 HydrophobicContact CG2-CZ 4.32Å; L71-F124 HydrophobicContact CB-CE2 4.08Å; L71-F124 HydrophobicContact CB-CZ 4.28Å; L71-F124 HydrophobicContact CD2-CE2 4.14Å; L71-F124 HydrophobicContact CD2-CZ 3.75Å; L71-F124 HydrophobicContact CG-CE2 4.19Å; L71-F124 HydrophobicContact CG-CZ 3.87Å; C72-F124 CarbonylContact O-C 3.53Å; C72-F124 WeakPolarHBondContact O-CA 3.44Å; C72-F124 VanDerWaalsContact O-CD2 3.28Å; C72-F124 WeakPolarHBondContact O-CD2 3.05Å; L73-F124 HydrophobicContact CB-CD2 4.17Å; L73-F124 HydrophobicContact CD1-CB 3.83Å; L73-F124 HydrophobicContact CD1-CD2 3.84Å; L73-F124 HydrophobicContact CD1-CG 4.26Å; F124-L126 HydrophobicContact CE1-CB 4.07Å; F124-L126 HydrophobicContact CZ-CB 4.45Å; F124-V144 CarbonylContact O-C 3.52Å; F124-V144 WeakPolarHBondContact O-CA 3.46Å; F124-A145 PolarHBondContact N-O 3.4Å; F124-A145 PolarHBondContact O-N 3.38Å; F124-F148 HydrophobicContact CB-CE1 3.65Å; F124-F148 HydrophobicContact CB-CZ 3.93Å; F124-M161 HydrophobicContact CD1-CE 3.75Å; F124-M161 HydrophobicContact CD1-SD 3.99Å; F124-M161 HydrophobicContact CE1-CE 4.11Å; F124-V176 HydrophobicContact CD1-CG1 4.28Å; F124-V176 HydrophobicContact CE1-CG1 3.84Å; F124-V176 HydrophobicContact CE1-CG2 4.18Å; F124-M178 HydrophobicContact CB-CE 3.95Å; F124-M178 HydrophobicContact CD1-CE 3.61Å; F124-M178 HydrophobicContact CD2-CE 3.68Å; F124-M178 HydrophobicContact CE1-CE 3.97Å; F124-M178 HydrophobicContact CE2-CE 4.02Å; F124-M178 HydrophobicContact CG-CE 3.45Å; F124-M178 VanDerWaalsContact CG-CE 3.45Å; F124-M178 HydrophobicContact CZ-CE 4.16Å
125	T	96.9	Very high	90	Very high	30 Å²	30	48.4 Å²	48.4	18%	0.184	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	131.2	176.2	-57.5	0	0	0	0	109.5	C72 T142 L143 V144	C72-T125 PolarHBondContact N-O 3.48Å; C72-T125 PolarHBondContact O-N 3.48Å; T125-T142 HydrophobicContact CG2-CG2 3.7Å; T125-L143 CarbonylContact C-O 3.59Å; T125-L143 WeakPolarHBondContact CA-O 3.42Å; T125-V144 HydrophobicContact CG2-CG2 3.96Å
126	L	98.4	Very high	89.8	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	110.2	173.6	178.7	67	0	0	0	108.5	F69 T70 L71 F124 I128 L143 M161 V174 V176	F69-L126 HydrophobicContact CB-CD1 4.16Å; F69-L126 HydrophobicContact CD1-CD1 4.06Å; T70-L126 WeakPolarHBondContact O-CA 3.41Å; L71-L126 HydrophobicContact CD1-CD1 3.48Å; L71-L126 VanDerWaalsContact CD1-CD1 3.48Å; L71-L126 HydrophobicContact CD2-CD1 4.43Å; L71-L126 HydrophobicContact CG-CD1 3.68Å; F124-L126 HydrophobicContact CE1-CB 4.07Å; F124-L126 HydrophobicContact CZ-CB 4.45Å; L126-I128 HydrophobicContact CG-CG1 4.37Å; L126-L143 PolarHBondContact N-O 3.1Å; L126-L143 PolarHBondContact O-N 2.94Å; L126-M161 HydrophobicContact CB-CE 4.2Å; L126-V174 HydrophobicContact CD2-CG1 3.64Å; L126-V176 HydrophobicContact CD2-CG2 4.24Å
127	G	97.8	Very high	89.9	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	137.1	171.9	0	0	0	0	0	110.6	F69 T70	F69-G127 CarbonylContact C-O 3.45Å; F69-G127 VanDerWaalsContact CA-O 3.28Å; F69-G127 WeakPolarHBondContact CA-O 3.03Å; T70-G127 PolarHBondContact N-O 3.37Å; T70-G127 PolarHBondContact O-N 3.43Å
128	I	98.3	Very high	90.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	120.4	-178.8	-49.4	172	0	0	0	107.4	Y44 V67 F69 L126 I140 G141 L143 I172 V174	Y44-I128 HydrophobicContact CD2-CD1 3.8Å; Y44-I128 HydrophobicContact CD2-CG2 4.33Å; Y44-I128 HydrophobicContact CE2-CD1 4Å; Y44-I128 HydrophobicContact CE2-CG2 3.82Å; V67-I128 HydrophobicContact CG1-CG2 3.65Å; F69-I128 HydrophobicContact CD1-CB 4.42Å; F69-I128 HydrophobicContact CD1-CG1 3.82Å; F69-I128 HydrophobicContact CD1-CG2 4.25Å; F69-I128 HydrophobicContact CE1-CB 4.41Å; F69-I128 HydrophobicContact CE1-CD1 4.24Å; F69-I128 HydrophobicContact CE1-CG1 3.87Å; F69-I128 HydrophobicContact CE1-CG2 3.86Å; L126-I128 HydrophobicContact CG-CG1 4.37Å; I128-I140 HydrophobicContact CB-CB 4.27Å; I128-I140 HydrophobicContact CG2-CB 3.93Å; I128-I140 HydrophobicContact CG2-CD1 4.18Å; I128-I140 HydrophobicContact CG2-CG2 4.11Å; I128-I140 PolarHBondContact O-N 3.42Å; I128-G141 WeakPolarHBondContact CB-O 3.23Å; I128-G141 PolarHBondContact N-O 3.09Å; I128-G141 PolarHBondContact O-N 3.48Å; I128-G141 VanDerWaalsContact O-N 3.14Å; I128-L143 HydrophobicContact CD1-CD1 3.63Å; I128-L143 HydrophobicContact CG1-CD1 4.33Å; I128-I172 HydrophobicContact CD1-CD1 3.8Å; I128-V174 HydrophobicContact CD1-CG2 3.79Å
129	F	96.8	Very high	90.4	Very high	37 Å²	37	47.4 Å²	47.4	16%	0.162	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	148.2	-170.3	-58.6	-88.7	0	0	0	111.1	V67 Y68 T70 V137 E138 V139	V67-F129 CarbonylContact C-O 3.58Å; V67-F129 WeakPolarHBondContact CA-O 3.01Å; Y68-F129 HydrophobicContact CD1-CB 3.94Å; Y68-F129 HydrophobicContact CD2-CD2 4.43Å; Y68-F129 HydrophobicContact CE1-CB 3.38Å; Y68-F129 HydrophobicContact CE1-CG 4.28Å; Y68-F129 HydrophobicContact CE2-CB 4Å; Y68-F129 AromaticContact CE2-CD2 3.79Å; Y68-F129 HydrophobicContact CE2-CD2 3.79Å; Y68-F129 HydrophobicContact CE2-CG 4.14Å; Y68-F129 HydrophobicContact CG-CB 4.47Å; Y68-F129 VanDerWaalsContact CZ-CB 3.41Å; Y68-F129 AromaticContact CZ-CD2 3.94Å; Y68-F129 AromaticContact CZ-CG 3.79Å; Y68-F129 PolarHBondContact N-O 3.29Å; Y68-F129 PolarHBondContact O-N 3.48Å; T70-F129 HydrophobicContact CG2-CD2 4.09Å; T70-F129 HydrophobicContact CG2-CE2 3.73Å; T70-F129 WeakPolarHBondContact OG1-CE2 3.45Å; F129-V137 HydrophobicContact CB-CG1 4.08Å; F129-V137 HydrophobicContact CD1-CG1 3.78Å; F129-V137 HydrophobicContact CG-CG1 4.19Å; F129-E138 CarbonylContact C-O 3.56Å; F129-E138 VanDerWaalsContact CA-O 3.24Å; F129-E138 WeakPolarHBondContact CA-O 3.49Å; F129-V139 HydrophobicContact CD1-CG2 4.03Å; F129-V139 HydrophobicContact CE1-CG2 3.87Å
130	E	93.4	Very high	90.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	136.6	166.8	-179.5	64	179.2	0	0	109.6	L51 C57 C65 D66 V137 E138 I140	L51-E130 HydrophobicContact CD2-CB 3.73Å; L51-E130 HydrophobicContact CD2-CG 4.19Å; C57-E130 HydrophobicContact CB-CG 4.34Å; C65-E130 VanDerWaalsContact C-OE2 3.25Å; C65-E130 VanDerWaalsContact CA-OE2 3.29Å; C65-E130 WeakPolarHBondContact CA-OE2 3.49Å; C65-E130 WeakPolarHBondContact CB-OE2 3.47Å; D66-E130 WeakPolarHBondContact CA-OE2 3.49Å; D66-E130 PolarHBondContact N-OE1 3.22Å; D66-E130 PolarHBondContact N-OE2 2.93Å; E130-V137 WeakPolarHBondContact O-CA 3.09Å; E130-E138 HydrophobicContact CB-CB 4.22Å; E130-E138 PolarHBondContact N-O 2.78Å; E130-E138 PolarHBondContact O-N 2.98Å; E130-I140 HydrophobicContact CB-CD1 4.28Å; E130-I140 HydrophobicContact CB-CG1 4.37Å
131	Q	90.1	Very high	90.8	Very high	51 Å²	51	41.7 Å²	41.7	24%	0.238	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	103.3	174.7	-178.2	64	82.3	0	0	111.1	D66 Y68 V95 G135 S136	D66-Q131 PolarHBondContact O-N 3.39Å; Y68-Q131 HydrophobicContact CD1-CB 3.92Å; Y68-Q131 HydrophobicContact CE1-CB 3.99Å; V95-Q131 HydrophobicContact CG1-CB 4.28Å; V95-Q131 HydrophobicContact CG2-CB 4.09Å; V95-Q131 HydrophobicContact CG2-CG 4.15Å; Q131-G135 VanDerWaalsContact NE2-C 3.33Å; Q131-G135 VanDerWaalsContact NE2-CA 3.28Å; Q131-S136 PolarHBondContact NE2-O 2.83Å
132	D	82.3	Confident	90.9	Very high	39 Å²	39	40.1 Å²	40.1	21%	0.209	22%	0.221	C	C	.	.			trans	-70.6	155.5	174.3	-71.7	-51.6	0	0	0	112.3	F134 G135 S136	D132-F134 PolarHBondContact O-N 2.76Å; D132-F134 VanDerWaalsContact O-N 3.07Å; D132-G135 PolarHBondContact O-N 3.49Å; D132-S136 VanDerWaalsContact CB-OG 3.27Å; D132-S136 WeakPolarHBondContact CB-OG 3.04Å; D132-S136 PolarHBondContact N-O 3.07Å; D132-S136 WeakPolarHBondContact OD2-CB 3.45Å; D132-S136 PolarHBondContact OD2-OG 3.42Å
133	I	74.3	Confident	91.1	Very high	157 Å²	157	40.7 Å²	40.7	81%	0.805	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-32	174.8	-60.7	172.3	0	0	0	112.8
134	F	73.5	Confident	91.2	Very high	201 Å²	201	40.8 Å²	40.8	88%	0.882	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.2	13.8	179.5	-69.3	-70.6	0	0	0	114.2	D132	D132-F134 PolarHBondContact O-N 2.76Å; D132-F134 VanDerWaalsContact O-N 3.07Å
135	G	69.1	Low	91.2	Very high	48 Å²	48	41 Å²	41	50%	0.495	23%	0.226	S	C	.	.	S	Bend	trans	85.4	2.8	171.4	0	0	0	0	0	115.1	Q131 D132 V137	Q131-G135 VanDerWaalsContact NE2-C 3.33Å; Q131-G135 VanDerWaalsContact NE2-CA 3.28Å; D132-G135 PolarHBondContact O-N 3.49Å; G135-V137 PolarHBondContact O-N 3.22Å
136	S	83.7	Confident	91	Very high	55 Å²	55	44.5 Å²	44.5	39%	0.385	24%	0.244	S	C	.	.			trans	-65.4	125.7	168.4	23.2	0	0	0	0	109.2	Q131 D132	Q131-S136 PolarHBondContact NE2-O 2.83Å; D132-S136 VanDerWaalsContact CB-OG 3.27Å; D132-S136 WeakPolarHBondContact CB-OG 3.04Å; D132-S136 PolarHBondContact N-O 3.07Å; D132-S136 WeakPolarHBondContact OD2-CB 3.45Å; D132-S136 PolarHBondContact OD2-OG 3.42Å
137	V	89.1	Confident	90.8	Very high	72 Å²	72	49.8 Å²	49.8	44%	0.436	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	118.4	172.5	173.9	0	0	0	0	107	Y68 F129 E130 G135	Y68-V137 HydrophobicContact CE1-CG1 4.33Å; Y68-V137 WeakPolarHBondContact OH-CG1 3.36Å; F129-V137 HydrophobicContact CB-CG1 4.08Å; F129-V137 HydrophobicContact CD1-CG1 3.78Å; F129-V137 HydrophobicContact CG-CG1 4.19Å; E130-V137 WeakPolarHBondContact O-CA 3.09Å; G135-V137 PolarHBondContact O-N 3.22Å
138	E	92.9	Very high	90.7	Very high	63 Å²	63	51.1 Å²	51.1	29%	0.294	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	152	177.4	-61	-170.9	113.4	0	0	110.7	L51 F129 E130	L51-E138 HydrophobicContact CD1-CB 4.21Å; L51-E138 WeakPolarHBondContact CD1-OE2 3.39Å; L51-E138 HydrophobicContact CD2-CB 3.93Å; F129-E138 CarbonylContact C-O 3.56Å; F129-E138 VanDerWaalsContact CA-O 3.24Å; F129-E138 WeakPolarHBondContact CA-O 3.49Å; E130-E138 HydrophobicContact CB-CB 4.22Å; E130-E138 PolarHBondContact N-O 2.78Å; E130-E138 PolarHBondContact O-N 2.98Å
139	V	95.6	Very high	90.6	Very high	53 Å²	53	55.1 Å²	55.1	32%	0.321	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	126	-176.3	-177.4	0	0	0	0	109.6	E52 F129	E52-V139 HydrophobicContact CB-CG1 4.33Å; E52-V139 VanDerWaalsContact CB-O 3.25Å; E52-V139 WeakPolarHBondContact CB-O 3.42Å; E52-V139 PolarHBondContact N-O 3.43Å; F129-V139 HydrophobicContact CD1-CG2 4.03Å; F129-V139 HydrophobicContact CE1-CG2 3.87Å
140	I	96.2	Very high	90.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-40.4	166.4	-63.8	170.3	0	0	0	109.2	Y44 L51 E52 C65 V67 I128 E130 R163 N170 I172	Y44-I140 HydrophobicContact CE2-CG2 4.4Å; L51-I140 HydrophobicContact CD2-CG1 4.01Å; E52-I140 WeakPolarHBondContact CB-O 3.02Å; C65-I140 HydrophobicContact CB-CD1 3.97Å; V67-I140 HydrophobicContact CG1-CD1 4.4Å; V67-I140 HydrophobicContact CG2-CD1 3.81Å; I128-I140 HydrophobicContact CB-CB 4.27Å; I128-I140 HydrophobicContact CG2-CB 3.93Å; I128-I140 HydrophobicContact CG2-CD1 4.18Å; I128-I140 HydrophobicContact CG2-CG2 4.11Å; I128-I140 PolarHBondContact O-N 3.42Å; E130-I140 HydrophobicContact CB-CD1 4.28Å; E130-I140 HydrophobicContact CB-CG1 4.37Å; I140-R163 PolarHBondContact O-NH1 3.01Å; I140-N170 PolarHBondContact O-ND2 2.95Å; I140-I172 HydrophobicContact CG2-CG2 4.05Å
141	G	97.1	Very high	90.5	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.2	147.6	172.4	0	0	0	0	0	115.7	I128	I128-G141 WeakPolarHBondContact CB-O 3.23Å; I128-G141 PolarHBondContact N-O 3.09Å; I128-G141 PolarHBondContact O-N 3.48Å; I128-G141 VanDerWaalsContact O-N 3.14Å
142	T	97.8	Very high	90.8	Very high	24 Å²	24	57.3 Å²	57.3	15%	0.147	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	123.4	166.5	-52.7	0	0	0	0	109.8	T125 V144 E164	T125-T142 HydrophobicContact CG2-CG2 3.7Å; T142-V144 HydrophobicContact CG2-CG2 4.45Å; T142-E164 HydrophobicContact CG2-CB 4.16Å; T142-E164 VanDerWaalsContact CG2-OE2 3.3Å; T142-E164 WeakPolarHBondContact CG2-OE2 3.35Å; T142-E164 PolarHBondContact O-N 2.94Å
143	L	98.3	Very high	91.3	Very high	13 Å²	13	59 Å²	59	7%	0.068	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	138.7	176.2	-58.6	94.6	0	0	0	110.8	T125 L126 I128 M161 S162 I172 V174	T125-L143 CarbonylContact C-O 3.59Å; T125-L143 WeakPolarHBondContact CA-O 3.42Å; L126-L143 PolarHBondContact N-O 3.1Å; L126-L143 PolarHBondContact O-N 2.94Å; I128-L143 HydrophobicContact CD1-CD1 3.63Å; I128-L143 HydrophobicContact CG1-CD1 4.33Å; L143-M161 HydrophobicContact CB-CB 4.22Å; L143-M161 HydrophobicContact CB-CE 3.79Å; L143-M161 HydrophobicContact CD2-CB 3.97Å; L143-M161 WeakPolarHBondContact O-CE 3.46Å; L143-S162 CarbonylContact C-O 3.4Å; L143-S162 VanDerWaalsContact CA-O 3.28Å; L143-S162 WeakPolarHBondContact CA-O 3.39Å; L143-I172 HydrophobicContact CD1-CD1 4.12Å; L143-V174 HydrophobicContact CD1-CG2 4.07Å; L143-V174 HydrophobicContact CD2-CB 3.93Å; L143-V174 HydrophobicContact CD2-CG1 4.33Å; L143-V174 HydrophobicContact CD2-CG2 4.17Å
144	V	97.1	Very high	92.2	Very high	11 Å²	11	54.9 Å²	54.9	7%	0.067	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	141	-176.7	-175.9	0	0	0	0	110.2	T123 F124 T125 T142 N146 S162 E164	T123-V144 HydrophobicContact CG2-CG1 4.49Å; F124-V144 CarbonylContact O-C 3.52Å; F124-V144 WeakPolarHBondContact O-CA 3.46Å; T125-V144 HydrophobicContact CG2-CG2 3.96Å; T142-V144 HydrophobicContact CG2-CG2 4.45Å; V144-N146 VanDerWaalsContact CG1-OD1 3.26Å; V144-N146 WeakPolarHBondContact CG1-OD1 3.12Å; V144-S162 PolarHBondContact N-O 3.4Å; V144-S162 PolarHBondContact O-N 2.75Å; V144-S162 PolarHBondContact O-OG 3.43Å; V144-S162 VanDerWaalsContact O-OG 3.11Å; V144-E164 HydrophobicContact CG2-CB 3.95Å; V144-E164 HydrophobicContact CG2-CG 4.26Å
145	A	97.7	Very high	93.3	Very high	5 Å²	5	50.2 Å²	50.2	4%	0.041	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	114.5	163.2	0	0	0	0	0	108.7	T123 F124 F148 I159 K160 M161	T123-A145 WeakPolarHBondContact CA-O 3.33Å; F124-A145 PolarHBondContact N-O 3.4Å; F124-A145 PolarHBondContact O-N 3.38Å; A145-F148 HydrophobicContact CB-CD1 3.91Å; A145-F148 HydrophobicContact CB-CE1 4.16Å; A145-I159 HydrophobicContact CB-CG2 3.57Å; A145-K160 WeakPolarHBondContact CB-O 3.38Å; A145-M161 HydrophobicContact CB-SD 3.66Å
146	N	92.8	Very high	94.6	Very high	103 Å²	103	51.8 Å²	51.8	55%	0.551	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	142.2	-177.6	-72.8	-39	0	0	0	111.3	T123 V144 F148	T123-N146 WeakPolarHBondContact CG2-OD1 3.5Å; V144-N146 VanDerWaalsContact CG1-OD1 3.26Å; V144-N146 WeakPolarHBondContact CG1-OD1 3.12Å; N146-F148 VanDerWaalsContact C-N 3.34Å; N146-F148 PolarHBondContact O-N 3.16Å
147	H	93.2	Very high	95.3	Very high	113 Å²	113	51.3 Å²	51.3	52%	0.523	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.4	44.5	172.7	-61.6	-85.1	0	0	0	114.6	E121 Y122	E121-H147 IonicContact OE1-CE1 2.93Å; E121-H147 IonicContact OE1-ND1 3.45Å; E121-H147 PolarHBondContact OE1-ND1 3.33Å; E121-H147 WeakPolarHBondContact OE2-CB 3.34Å; E121-H147 IonicContact OE2-CG 3.17Å; E121-H147 IonicContact OE2-ND1 3.88Å; E121-H147 PolarHBondContact OE2-ND1 3.01Å; Y122-H147 WeakPolarHBondContact O-CA 3.29Å; Y122-H147 PolarHBondContact O-N 2.96Å; Y122-H147 VanDerWaalsContact O-N 3.1Å
148	F	96.1	Very high	95.7	Very high	29 Å²	29	54.4 Å²	54.4	13%	0.127	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	149.7	174.1	71.7	-87.4	0	0	0	111.2	L73 E121 Y122 F124 A145 N146 L150 I159 M178	L73-F148 HydrophobicContact CD1-CZ 4.17Å; E121-F148 CarbonylContact C-O 3.6Å; E121-F148 VanDerWaalsContact CA-O 3.27Å; E121-F148 WeakPolarHBondContact CA-O 3.18Å; Y122-F148 VanDerWaalsContact CB-CZ 3.46Å; Y122-F148 HydrophobicContact CD2-CE2 4.45Å; Y122-F148 HydrophobicContact CG-CE2 4.38Å; Y122-F148 HydrophobicContact CG-CZ 4.34Å; Y122-F148 PolarHBondContact N-O 3Å; Y122-F148 WeakPolarHBondContact O-CD1 3.45Å; Y122-F148 WeakPolarHBondContact O-CE1 3.47Å; Y122-F148 PolarHBondContact O-N 2.99Å; F124-F148 HydrophobicContact CB-CE1 3.65Å; F124-F148 HydrophobicContact CB-CZ 3.93Å; A145-F148 HydrophobicContact CB-CD1 3.91Å; A145-F148 HydrophobicContact CB-CE1 4.16Å; N146-F148 VanDerWaalsContact C-N 3.34Å; N146-F148 PolarHBondContact O-N 3.16Å; F148-L150 HydrophobicContact CD2-CD2 4.24Å; F148-L150 HydrophobicContact CD2-CG 4.16Å; F148-L150 HydrophobicContact CE2-CD1 4.01Å; F148-L150 HydrophobicContact CE2-CD2 3.99Å; F148-L150 HydrophobicContact CE2-CG 3.81Å; F148-I159 HydrophobicContact CD1-CG2 4.3Å; F148-I159 HydrophobicContact CD2-CD1 3.88Å; F148-I159 HydrophobicContact CD2-CG2 4.4Å; F148-I159 HydrophobicContact CE1-CG2 4.33Å; F148-I159 HydrophobicContact CE2-CD1 3.85Å; F148-I159 HydrophobicContact CE2-CG1 4.42Å; F148-I159 HydrophobicContact CE2-CG2 4.41Å; F148-I159 HydrophobicContact CG-CG2 4.34Å; F148-I159 HydrophobicContact CZ-CG2 4.38Å; F148-M178 HydrophobicContact CE2-SD 3.86Å; F148-M178 HydrophobicContact CZ-CE 4.12Å; F148-M178 HydrophobicContact CZ-SD 3.82Å
149	S	95.1	Very high	96	Very high	83 Å²	83	52.2 Å²	52.2	58%	0.58	28%	0.283	S	S	*	.			trans	-108.3	145.6	178.5	-62.3	0	0	0	0	111.7	N120	N120-S149 WeakPolarHBondContact O-CB 3.44Å; N120-S149 PolarHBondContact O-OG 3.31Å
150	L	95.8	Very high	96	Very high	12 Å²	12	59 Å²	59	6%	0.063	31%	0.308	C	S	.	.			trans	-117.4	132.7	174.5	-66.6	174.7	0	0	0	109.4	L38 Y122 F148 T157 I159 M178 L180	L38-L150 HydrophobicContact CD1-CD1 3.72Å; L38-L150 HydrophobicContact CD2-CD1 4.42Å; Y122-L150 HydrophobicContact CD2-CB 4.44Å; Y122-L150 HydrophobicContact CD2-CD1 4.12Å; Y122-L150 HydrophobicContact CD2-CG 4.15Å; Y122-L150 HydrophobicContact CE2-CB 4Å; Y122-L150 HydrophobicContact CE2-CD1 4.01Å; Y122-L150 HydrophobicContact CE2-CG 4.14Å; F148-L150 HydrophobicContact CD2-CD2 4.24Å; F148-L150 HydrophobicContact CD2-CG 4.16Å; F148-L150 HydrophobicContact CE2-CD1 4.01Å; F148-L150 HydrophobicContact CE2-CD2 3.99Å; F148-L150 HydrophobicContact CE2-CG 3.81Å; L150-T157 VanDerWaalsContact CD2-OG1 3.24Å; L150-T157 WeakPolarHBondContact CD2-OG1 3.46Å; L150-I159 HydrophobicContact CD2-CD1 3.94Å; L150-M178 HydrophobicContact CD1-CB 4.41Å; L150-M178 HydrophobicContact CD1-SD 4.19Å; L150-M178 HydrophobicContact CD2-CB 4.07Å; L150-L180 HydrophobicContact CB-CB 4.16Å; L150-L180 HydrophobicContact CB-CD2 3.78Å
151	I	93.8	Very high	96.1	Very high	99 Å²	99	60.4 Å²	60.4	51%	0.508	32%	0.315	S	S	.	.			trans	-104.5	130	176.3	-52.1	176.3	0	0	0	108	T153	I151-T153 HydrophobicContact CB-CG2 4.23Å; I151-T153 HydrophobicContact CG2-CG2 3.69Å; I151-T153 PolarHBondContact O-N 3.2Å
152	P	95.2	Very high	96.1	Very high	24 Å²	24	63.9 Å²	63.9	16%	0.156	34%	0.339	C	S	.	.			trans	-76.6	54	-173.9	32.2	-36.7	0	0	0	113.3	N154 L180 G188 N189	P152-N154 VanDerWaalsContact C-N 3.29Å; P152-L180 CarbonylContact C-O 3.53Å; P152-L180 VanDerWaalsContact CA-O 3.29Å; P152-L180 WeakPolarHBondContact CA-O 3.29Å; P152-L180 HydrophobicContact CB-CD2 4.02Å; P152-L180 HydrophobicContact CB-CG 4.14Å; P152-G188 VanDerWaalsContact CG-O 3.31Å; P152-G188 WeakPolarHBondContact CG-O 2.82Å; P152-N189 VanDerWaalsContact CD-O 3.27Å; P152-N189 WeakPolarHBondContact CD-O 3.37Å; P152-N189 WeakPolarHBondContact CG-O 2.91Å
153	T	92.4	Very high	96.1	Very high	73 Å²	73	64.3 Å²	64.3	45%	0.448	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-2.7	179.6	58	0	0	0	0	113.4	I151 N155	I151-T153 HydrophobicContact CB-CG2 4.23Å; I151-T153 HydrophobicContact CG2-CG2 3.69Å; I151-T153 PolarHBondContact O-N 3.2Å; T153-N155 PolarHBondContact O-N 3.46Å; T153-N155 WeakPolarHBondContact OG1-CB 3.42Å; T153-N155 PolarHBondContact OG1-N 2.93Å
154	N	94	Very high	95.9	Very high	71 Å²	71	69.7 Å²	69.7	38%	0.38	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	58.5	24.5	-170.7	-161.4	27.4	0	0	0	113.3	P152 R179 L180	P152-N154 VanDerWaalsContact C-N 3.29Å; N154-R179 PolarHBondContact ND2-NH2 3.24Å; N154-R179 VanDerWaalsContact ND2-NH2 3.16Å; N154-R179 PolarHBondContact O-NE 3.05Å; N154-R179 PolarHBondContact O-NH2 3.35Å; N154-R179 PolarHBondContact OD1-NE 2.03Å; N154-R179 PolarHBondContact OD1-NH2 2.87Å; N154-R179 VanDerWaalsContact OD1-NH2 3.1Å; N154-L180 WeakPolarHBondContact CA-O 3.03Å; N154-L180 PolarHBondContact N-O 2.94Å
155	N	96.3	Very high	95.7	Very high	103 Å²	103	72.1 Å²	72.1	55%	0.551	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	156.2	172.5	-66.5	-34.2	0	0	0	110.7	T153	T153-N155 PolarHBondContact O-N 3.46Å; T153-N155 WeakPolarHBondContact OG1-CB 3.42Å; T153-N155 PolarHBondContact OG1-N 2.93Å
156	W	97.2	Very high	95.5	Very high	82 Å²	82	78.1 Å²	78.1	31%	0.311	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	132.3	174	-71.8	108.8	0	0	0	111.2	K39 E41 R177 R179	K39-W156 HydrophobicContact CB-CH2 3.99Å; K39-W156 HydrophobicContact CB-CZ3 4.45Å; E41-W156 HydrophobicContact CB-CH2 4.11Å; E41-W156 HydrophobicContact CB-CZ3 4.14Å; E41-W156 VanDerWaalsContact CD-CZ2 3.42Å; E41-W156 HydrophobicContact CG-CH2 3.48Å; E41-W156 VanDerWaalsContact CG-CH2 3.48Å; E41-W156 HydrophobicContact CG-CZ2 4.18Å; E41-W156 HydrophobicContact CG-CZ3 4.02Å; E41-W156 WeakPolarHBondContact OE1-CZ2 2.94Å; E41-W156 WeakPolarHBondContact OE2-CZ2 3.47Å; W156-R177 HydrophobicContact CD2-CG 4.18Å; W156-R177 HydrophobicContact CE3-CB 4.01Å; W156-R177 HydrophobicContact CE3-CG 3.53Å; W156-R177 HydrophobicContact CZ3-CG 3.9Å; W156-R179 HydrophobicContact CD2-CB 3.85Å; W156-R179 HydrophobicContact CE3-CB 3.58Å; W156-R179 HydrophobicContact CH2-CB 4.06Å; W156-R179 HydrophobicContact CZ2-CB 4.33Å; W156-R179 HydrophobicContact CZ3-CB 3.69Å
157	T	97.7	Very high	95.5	Very high	44 Å²	44	80.6 Å²	80.6	27%	0.27	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	122.7	172.8	56.5	0	0	0	0	109.4	L150 R177 M178	L150-T157 VanDerWaalsContact CD2-OG1 3.24Å; L150-T157 WeakPolarHBondContact CD2-OG1 3.46Å; T157-R177 CarbonylContact O-C 3.37Å; T157-R177 VanDerWaalsContact O-CA 3.29Å; T157-R177 WeakPolarHBondContact O-CA 3.42Å; T157-M178 PolarHBondContact N-O 3.31Å; T157-M178 PolarHBondContact O-N 3.13Å; T157-M178 PolarHBondContact OG1-O 3.27Å
158	N	98.1	Very high	95.6	Very high	137 Å²	137	80.3 Å²	80.3	73%	0.733	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	127.4	174.6	-64.7	-24.7	0	0	0	109.6
159	I	97.9	Very high	95.6	Very high	18 Å²	18	86.4 Å²	86.4	9%	0.092	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	123.8	-177.7	-51.1	-52.3	0	0	0	108.5	A145 F148 L150 M161 V176 M178	A145-I159 HydrophobicContact CB-CG2 3.57Å; F148-I159 HydrophobicContact CD1-CG2 4.3Å; F148-I159 HydrophobicContact CD2-CD1 3.88Å; F148-I159 HydrophobicContact CD2-CG2 4.4Å; F148-I159 HydrophobicContact CE1-CG2 4.33Å; F148-I159 HydrophobicContact CE2-CD1 3.85Å; F148-I159 HydrophobicContact CE2-CG1 4.42Å; F148-I159 HydrophobicContact CE2-CG2 4.41Å; F148-I159 HydrophobicContact CG-CG2 4.34Å; F148-I159 HydrophobicContact CZ-CG2 4.38Å; L150-I159 HydrophobicContact CD2-CD1 3.94Å; I159-M161 HydrophobicContact CG2-SD 3.97Å; I159-M161 PolarHBondContact O-N 3.32Å; I159-V176 HydrophobicContact CB-CB 4.32Å; I159-V176 HydrophobicContact CB-CG1 4.25Å; I159-V176 HydrophobicContact CG1-CG1 4.31Å; I159-V176 PolarHBondContact N-O 3.13Å; I159-M178 HydrophobicContact CD1-CB 4.21Å; I159-M178 HydrophobicContact CD1-CG 4.27Å; I159-M178 HydrophobicContact CD1-SD 4.32Å; I159-M178 HydrophobicContact CG1-CB 4.14Å; I159-M178 HydrophobicContact CG1-CE 4.29Å; I159-M178 HydrophobicContact CG1-CG 3.73Å; I159-M178 HydrophobicContact CG1-SD 3.95Å
160	K	97.4	Very high	95.6	Very high	195 Å²	195	82.6 Å²	82.6	85%	0.848	41%	0.409	S	S	*	.			trans	-76.7	107.5	179.3	-173.4	179.8	-179.8	-176.5	0	109.5	A145	A145-K160 WeakPolarHBondContact CB-O 3.38Å
161	M	97.5	Very high	95.5	Very high	30 Å²	30	87.2 Å²	87.2	15%	0.148	43%	0.433	C	S	.	.			trans	-92.9	147.7	177.9	-56.8	-59.2	-69.6	0	0	111.1	F124 L126 L143 A145 I159 V176	F124-M161 HydrophobicContact CD1-CE 3.75Å; F124-M161 HydrophobicContact CD1-SD 3.99Å; F124-M161 HydrophobicContact CE1-CE 4.11Å; L126-M161 HydrophobicContact CB-CE 4.2Å; L143-M161 HydrophobicContact CB-CB 4.22Å; L143-M161 HydrophobicContact CB-CE 3.79Å; L143-M161 HydrophobicContact CD2-CB 3.97Å; L143-M161 WeakPolarHBondContact O-CE 3.46Å; A145-M161 HydrophobicContact CB-SD 3.66Å; I159-M161 HydrophobicContact CG2-SD 3.97Å; I159-M161 PolarHBondContact O-N 3.32Å; M161-V176 HydrophobicContact CE-CG2 4.4Å; M161-V176 HydrophobicContact CG-CB 4.07Å; M161-V176 HydrophobicContact CG-CG2 3.75Å; M161-V176 HydrophobicContact SD-CB 4.22Å; M161-V176 HydrophobicContact SD-CG2 4.02Å
162	S	96.8	Very high	95.6	Very high	72 Å²	72	83.5 Å²	83.5	50%	0.503	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	148.6	171.1	46.2	0	0	0	0	110.8	L143 V144	L143-S162 CarbonylContact C-O 3.4Å; L143-S162 VanDerWaalsContact CA-O 3.28Å; L143-S162 WeakPolarHBondContact CA-O 3.39Å; V144-S162 PolarHBondContact N-O 3.4Å; V144-S162 PolarHBondContact O-N 2.75Å; V144-S162 PolarHBondContact O-OG 3.43Å; V144-S162 VanDerWaalsContact O-OG 3.11Å
163	R	96.9	Very high	95.7	Very high	33 Å²	33	88.5 Å²	88.5	13%	0.125	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	137.5	172.1	-73.7	-73.8	-167.3	142.2	7.3	109.8	E52 I140 Y168 N170 I172	E52-R163 IonicContact OE1-NH1 3.64Å; E52-R163 PolarHBondContact OE1-NH1 3.22Å; I140-R163 PolarHBondContact O-NH1 3.01Å; R163-Y168 HydrophobicContact CB-CD1 4.15Å; R163-Y168 HydrophobicContact CB-CE1 4.04Å; R163-Y168 HydrophobicContact CG-CD1 4Å; R163-Y168 HydrophobicContact CG-CE1 3.85Å; R163-Y168 HydrophobicContact CG-CG 4.42Å; R163-N170 PolarHBondContact NH2-OD1 2.8Å; R163-I172 VanDerWaalsContact CZ-CD1 3.44Å
164	E	94.6	Very high	95.9	Very high	126 Å²	126	86 Å²	86	59%	0.589	42%	0.415	S	S	*	.	S	Bend	trans	-75.4	-41.8	173.9	-174.4	173.7	-123.4	0	0	111.6	T142 V144	T142-E164 HydrophobicContact CG2-CB 4.16Å; T142-E164 VanDerWaalsContact CG2-OE2 3.3Å; T142-E164 WeakPolarHBondContact CG2-OE2 3.35Å; T142-E164 PolarHBondContact O-N 2.94Å; V144-E164 HydrophobicContact CG2-CB 3.95Å; V144-E164 HydrophobicContact CG2-CG 4.26Å
165	N	94.2	Very high	96.1	Very high	62 Å²	62	87.3 Å²	87.3	33%	0.332	42%	0.422	S	S	.	.			trans	-92.3	123.3	175.4	-179.2	4.8	0	0	0	109.7	E52 Q167 Y168	E52-N165 PolarHBondContact OE2-ND2 3.19Å; N165-Q167 PolarHBondContact OD1-N 3.02Å; N165-Y168 WeakPolarHBondContact O-CD1 3.42Å
166	D	91.7	Very high	96.2	Very high	131 Å²	131	82.6 Å²	82.6	70%	0.701	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-8.4	177.9	-71.6	-34.5	0	0	0	114
167	Q	94.3	Very high	96.2	Very high	156 Å²	156	82.1 Å²	82.1	73%	0.729	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	21.2	-176.8	-59.4	-61.6	-62.4	0	0	113.4	N165	N165-Q167 PolarHBondContact OD1-N 3.02Å
168	Y	95	Very high	96.3	Very high	107 Å²	107	80 Å²	80	42%	0.42	38%	0.382	S	S	.	.			trans	-66.6	150.3	178.2	67	-84.1	0	0	0	112.1	R163 N165 N170	R163-Y168 HydrophobicContact CB-CD1 4.15Å; R163-Y168 HydrophobicContact CB-CE1 4.04Å; R163-Y168 HydrophobicContact CG-CD1 4Å; R163-Y168 HydrophobicContact CG-CE1 3.85Å; R163-Y168 HydrophobicContact CG-CG 4.42Å; N165-Y168 WeakPolarHBondContact O-CD1 3.42Å; Y168-N170 WeakPolarHBondContact CD2-O 3.38Å; Y168-N170 WeakPolarHBondContact CE2-O 3.41Å
169	K	95.7	Very high	96.2	Very high	156 Å²	156	76.9 Å²	76.9	68%	0.678	36%	0.36	S	S	*	.			trans	-125.6	12.1	-176.9	-62.4	-177.7	-176.7	174.4	0	113.5	E52	E52-K169 PolarHBondContact O-N 3.01Å
170	N	94.8	Very high	96.1	Very high	3 Å²	3	76.1 Å²	76.1	2%	0.016	36%	0.356	C	S	.	.			trans	-115.9	162.1	171.6	64	-14.7	0	0	0	111.9	L50 L51 I140 R163 Y168	L50-N170 HydrophobicContact CB-CB 3.69Å; L50-N170 PolarHBondContact O-ND2 3.46Å; L51-N170 VanDerWaalsContact O-CB 3.31Å; L51-N170 WeakPolarHBondContact O-CB 3.48Å; L51-N170 PolarHBondContact O-ND2 3.06Å; I140-N170 PolarHBondContact O-ND2 2.95Å; R163-N170 PolarHBondContact NH2-OD1 2.8Å; Y168-N170 WeakPolarHBondContact CD2-O 3.38Å; Y168-N170 WeakPolarHBondContact CE2-O 3.41Å
171	I	94.5	Very high	96.1	Very high	110 Å²	110	67.7 Å²	67.7	56%	0.564	32%	0.322	S	S	*	.			trans	-115.1	121.1	173.1	-59.5	174.3	0	0	0	106.8	Y173	I171-Y173 HydrophobicContact CG2-CE1 4.32Å; I171-Y173 HydrophobicContact CG2-CE2 4.2Å
172	I	95.8	Very high	96	Very high	20 Å²	20	67.5 Å²	67.5	10%	0.103	32%	0.323	C	S	.	.			trans	-128.8	149.4	173.6	73.5	-175.7	0	0	0	108.6	Y44 D45 N46 I128 I140 L143 R163 V174	Y44-I172 HydrophobicContact CE2-CB 4.49Å; D45-I172 CarbonylContact O-C 3.56Å; D45-I172 VanDerWaalsContact O-CA 3.27Å; D45-I172 WeakPolarHBondContact O-CA 2.97Å; N46-I172 HydrophobicContact CB-CG2 3.99Å; I128-I172 HydrophobicContact CD1-CD1 3.8Å; I140-I172 HydrophobicContact CG2-CG2 4.05Å; L143-I172 HydrophobicContact CD1-CD1 4.12Å; R163-I172 VanDerWaalsContact CZ-CD1 3.44Å; I172-V174 HydrophobicContact CD1-CG2 4.2Å; I172-V174 HydrophobicContact CG1-CG2 4.26Å
173	Y	97.2	Very high	95.8	Very high	130 Å²	130	65.7 Å²	65.7	51%	0.51	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	129.7	173.1	-53.9	-77.7	0	0	0	109.1	Y44 D45 P47 I171	Y44-Y173 CarbonylContact C-O 3.4Å; Y44-Y173 WeakPolarHBondContact CA-O 3.38Å; D45-Y173 HydrophobicContact CB-CD2 4.33Å; D45-Y173 PolarHBondContact N-O 2.96Å; D45-Y173 PolarHBondContact O-N 3.15Å; P47-Y173 HydrophobicContact CG-CD2 4.5Å; P47-Y173 HydrophobicContact CG-CE2 4.13Å; I171-Y173 HydrophobicContact CG2-CE1 4.32Å; I171-Y173 HydrophobicContact CG2-CE2 4.2Å
174	V	97.5	Very high	95.6	Very high	19 Å²	19	72 Å²	72	12%	0.115	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	122.1	-179.9	176.6	0	0	0	0	108	D43 Y44 L126 I128 L143 I172 V176	D43-V174 WeakPolarHBondContact O-CA 3.24Å; Y44-V174 HydrophobicContact CD2-CG2 4.14Å; L126-V174 HydrophobicContact CD2-CG1 3.64Å; I128-V174 HydrophobicContact CD1-CG2 3.79Å; L143-V174 HydrophobicContact CD1-CG2 4.07Å; L143-V174 HydrophobicContact CD2-CB 3.93Å; L143-V174 HydrophobicContact CD2-CG1 4.33Å; L143-V174 HydrophobicContact CD2-CG2 4.17Å; I172-V174 HydrophobicContact CD1-CG2 4.2Å; I172-V174 HydrophobicContact CG1-CG2 4.26Å; V174-V176 HydrophobicContact CG1-CG2 4.07Å
175	N	97.7	Very high	95.6	Very high	99 Å²	99	67.4 Å²	67.4	53%	0.529	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.9	169.5	-55.4	-71.7	0	0	0	109.3	W42 D43	W42-N175 CarbonylContact C-O 3.51Å; W42-N175 WeakPolarHBondContact CA-O 3.18Å; W42-N175 WeakPolarHBondContact CB-O 3.36Å; D43-N175 PolarHBondContact N-O 3.05Å; D43-N175 PolarHBondContact O-N 3.44Å; D43-N175 WeakPolarHBondContact OD1-CB 3.39Å; D43-N175 WeakPolarHBondContact OD2-CB 3.44Å; D43-N175 PolarHBondContact OD2-N 3.4Å; D43-N175 PolarHBondContact OD2-ND2 3.06Å
176	V	98.2	Very high	95.6	Very high	4 Å²	4	65.8 Å²	65.8	2%	0.024	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.9	174.9	179.7	0	0	0	0	107.9	I40 W42 F124 L126 I159 M161 V174 M178	I40-V176 HydrophobicContact CG2-CG1 4.37Å; W42-V176 HydrophobicContact CB-CG2 4.03Å; F124-V176 HydrophobicContact CD1-CG1 4.28Å; F124-V176 HydrophobicContact CE1-CG1 3.84Å; F124-V176 HydrophobicContact CE1-CG2 4.18Å; L126-V176 HydrophobicContact CD2-CG2 4.24Å; I159-V176 HydrophobicContact CB-CB 4.32Å; I159-V176 HydrophobicContact CB-CG1 4.25Å; I159-V176 HydrophobicContact CG1-CG1 4.31Å; I159-V176 PolarHBondContact N-O 3.13Å; M161-V176 HydrophobicContact CE-CG2 4.4Å; M161-V176 HydrophobicContact CG-CB 4.07Å; M161-V176 HydrophobicContact CG-CG2 3.75Å; M161-V176 HydrophobicContact SD-CB 4.22Å; M161-V176 HydrophobicContact SD-CG2 4.02Å; V174-V176 HydrophobicContact CG1-CG2 4.07Å; V176-M178 HydrophobicContact CG1-CE 4.03Å; V176-M178 HydrophobicContact CG1-CG 4.48Å
177	R	97.8	Very high	95.7	Very high	72 Å²	72	62.3 Å²	62.3	27%	0.272	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	142.9	170	66.6	177.1	-169.1	-163.2	0.7	110.6	E41 W156 T157	E41-R177 HydrophobicContact CB-CG 3.98Å; E41-R177 PolarHBondContact N-O 3.14Å; E41-R177 PolarHBondContact O-N 2.82Å; E41-R177 VanDerWaalsContact O-O 3.1Å; E41-R177 IonicContact OE2-CZ 3.38Å; E41-R177 IonicContact OE2-NE 3.05Å; E41-R177 PolarHBondContact OE2-NE 3.44Å; E41-R177 IonicContact OE2-NH2 3.13Å; E41-R177 PolarHBondContact OE2-NH2 3.47Å; W156-R177 HydrophobicContact CD2-CG 4.18Å; W156-R177 HydrophobicContact CE3-CB 4.01Å; W156-R177 HydrophobicContact CE3-CG 3.53Å; W156-R177 HydrophobicContact CZ3-CG 3.9Å; T157-R177 CarbonylContact O-C 3.37Å; T157-R177 VanDerWaalsContact O-CA 3.29Å; T157-R177 WeakPolarHBondContact O-CA 3.42Å
178	M	98	Very high	95.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148.3	-178.5	-66	-174	-176.5	0	0	110.2	L38 K39 I40 L73 F124 F148 L150 T157 I159 V176	L38-M178 HydrophobicContact CD1-CB 4Å; K39-M178 CarbonylContact O-C 3.58Å; K39-M178 VanDerWaalsContact O-CA 3.26Å; K39-M178 WeakPolarHBondContact O-CA 3.49Å; I40-M178 HydrophobicContact CD1-CE 4.23Å; I40-M178 HydrophobicContact CG1-CE 4.36Å; I40-M178 HydrophobicContact CG1-CG 4.2Å; I40-M178 HydrophobicContact CG1-SD 4.48Å; I40-M178 HydrophobicContact CG2-CE 4.13Å; I40-M178 HydrophobicContact CG2-CG 4.29Å; L73-M178 HydrophobicContact CD1-CE 4.43Å; F124-M178 HydrophobicContact CB-CE 3.95Å; F124-M178 HydrophobicContact CD1-CE 3.61Å; F124-M178 HydrophobicContact CD2-CE 3.68Å; F124-M178 HydrophobicContact CE1-CE 3.97Å; F124-M178 HydrophobicContact CE2-CE 4.02Å; F124-M178 HydrophobicContact CG-CE 3.45Å; F124-M178 VanDerWaalsContact CG-CE 3.45Å; F124-M178 HydrophobicContact CZ-CE 4.16Å; F148-M178 HydrophobicContact CE2-SD 3.86Å; F148-M178 HydrophobicContact CZ-CE 4.12Å; F148-M178 HydrophobicContact CZ-SD 3.82Å; L150-M178 HydrophobicContact CD1-CB 4.41Å; L150-M178 HydrophobicContact CD1-SD 4.19Å; L150-M178 HydrophobicContact CD2-CB 4.07Å; T157-M178 PolarHBondContact N-O 3.31Å; T157-M178 PolarHBondContact O-N 3.13Å; T157-M178 PolarHBondContact OG1-O 3.27Å; I159-M178 HydrophobicContact CD1-CB 4.21Å; I159-M178 HydrophobicContact CD1-CG 4.27Å; I159-M178 HydrophobicContact CD1-SD 4.32Å; I159-M178 HydrophobicContact CG1-CB 4.14Å; I159-M178 HydrophobicContact CG1-CE 4.29Å; I159-M178 HydrophobicContact CG1-CG 3.73Å; I159-M178 HydrophobicContact CG1-SD 3.95Å; V176-M178 HydrophobicContact CG1-CE 4.03Å; V176-M178 HydrophobicContact CG1-CG 4.48Å
179	R	96.5	Very high	95.4	Very high	71 Å²	71	55.6 Å²	55.6	27%	0.268	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	115.6	177.2	179	-177.6	-168.9	179.8	6.3	108.7	L38 K39 N154 W156	L38-R179 WeakPolarHBondContact CA-O 3.1Å; K39-R179 HydrophobicContact CB-CB 4.36Å; K39-R179 PolarHBondContact N-O 3.35Å; K39-R179 PolarHBondContact O-N 3.1Å; N154-R179 PolarHBondContact ND2-NH2 3.24Å; N154-R179 VanDerWaalsContact ND2-NH2 3.16Å; N154-R179 PolarHBondContact O-NE 3.05Å; N154-R179 PolarHBondContact O-NH2 3.35Å; N154-R179 PolarHBondContact OD1-NE 2.03Å; N154-R179 PolarHBondContact OD1-NH2 2.87Å; N154-R179 VanDerWaalsContact OD1-NH2 3.1Å; W156-R179 HydrophobicContact CD2-CB 3.85Å; W156-R179 HydrophobicContact CE3-CB 3.58Å; W156-R179 HydrophobicContact CH2-CB 4.06Å; W156-R179 HydrophobicContact CZ2-CB 4.33Å; W156-R179 HydrophobicContact CZ3-CB 3.69Å
180	L	96.8	Very high	95.2	Very high	2 Å²	2	51 Å²	51	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	134.3	177.4	-167.3	74.2	0	0	0	109.7	A36 Q37 L38 V118 L150 P152 N154	A36-L180 HydrophobicContact CB-CD1 3.49Å; A36-L180 VanDerWaalsContact CB-CD1 3.49Å; A36-L180 HydrophobicContact CB-CD2 4.46Å; A36-L180 HydrophobicContact CB-CG 3.94Å; Q37-L180 WeakPolarHBondContact O-CA 3.09Å; L38-L180 HydrophobicContact CB-CD1 3.94Å; L38-L180 HydrophobicContact CD1-CB 4.45Å; L38-L180 HydrophobicContact CD1-CD1 4.1Å; V118-L180 HydrophobicContact CG1-CD2 4.38Å; L150-L180 HydrophobicContact CB-CB 4.16Å; L150-L180 HydrophobicContact CB-CD2 3.78Å; P152-L180 CarbonylContact C-O 3.53Å; P152-L180 VanDerWaalsContact CA-O 3.29Å; P152-L180 WeakPolarHBondContact CA-O 3.29Å; P152-L180 HydrophobicContact CB-CD2 4.02Å; P152-L180 HydrophobicContact CB-CG 4.14Å; N154-L180 WeakPolarHBondContact CA-O 3.03Å; N154-L180 PolarHBondContact N-O 2.94Å
181	S	95.8	Very high	95.2	Very high	19 Å²	19	50.8 Å²	50.8	13%	0.133	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	143.9	171.3	53.7	0	0	0	0	110.3	A36 Q37	A36-S181 CarbonylContact C-O 3.59Å; A36-S181 WeakPolarHBondContact CA-O 3.01Å; A36-S181 WeakPolarHBondContact CB-O 3.37Å; Q37-S181 PolarHBondContact N-O 3.32Å; Q37-S181 PolarHBondContact O-N 3.29Å
182	C	95.7	Very high	95	Very high	25 Å²	25	50 Å²	50	17%	0.169	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	150.2	173.7	-61.5	0	0	0	0	111.2	Y186 C191	C182-Y186 WeakPolarHBondContact CB-O 3.45Å; C182-C191 WeakPolarHBondContact CA-SG 3.41Å; C182-C191 HydrophobicContact CB-CB 3.71Å; C182-C191 WeakPolarHBondContact CB-SG 3.5Å; C182-C191 WeakPolarHBondContact SG-CA 3.06Å; C182-C191 WeakPolarHBondContact SG-CB 3.35Å; C182-C191 CovalentContact SG-SG 2.04Å; C182-C191 PolarHBondContact SG-SG 2.93Å
183	V	93.8	Very high	94.8	Very high	34 Å²	34	52.1 Å²	52.1	21%	0.206	25%	0.249	C	C	.	.			trans	-60	153.4	165.8	174.7	0	0	0	0	109.1	G35 Q37 F113 D185 Y186	G35-V183 PolarHBondContact O-N 3.19Å; Q37-V183 HydrophobicContact CG-CG2 4.26Å; F113-V183 HydrophobicContact CD2-CG2 4.05Å; F113-V183 HydrophobicContact CE2-CG2 3.61Å; V183-D185 PolarHBondContact O-N 3.24Å; V183-Y186 HydrophobicContact CB-CD2 4.42Å; V183-Y186 WeakPolarHBondContact O-CB 3.42Å; V183-Y186 PolarHBondContact O-N 2.03Å
184	K	93	Very high	94.6	Very high	167 Å²	167	50.4 Å²	50.4	73%	0.726	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45.9	136.9	178.6	-173.4	-179.8	176.3	179.9	0	111.7	Y186	K184-Y186 PolarHBondContact O-N 2.85Å
185	D	93.1	Very high	94.5	Very high	29 Å²	29	49.5 Å²	49.5	16%	0.155	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	68	6.4	-179.8	-49.4	-33.5	0	0	0	114.7	V183 F194 C195 K196	V183-D185 PolarHBondContact O-N 3.24Å; D185-F194 HydrophobicContact CB-CD2 4.2Å; D185-F194 HydrophobicContact CB-CE2 3.71Å; D185-F194 HydrophobicContact CB-CZ 4.39Å; D185-F194 CarbonylContact O-C 3.51Å; D185-F194 WeakPolarHBondContact O-CA 3.27Å; D185-F194 WeakPolarHBondContact O-CD2 3.02Å; D185-C195 WeakPolarHBondContact CB-O 3.32Å; D185-C195 PolarHBondContact O-N 2.94Å; D185-K196 HydrophobicContact CB-CB 4.11Å
186	Y	93.9	Very high	94.3	Very high	27 Å²	27	50.5 Å²	50.5	11%	0.106	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	145.8	171.3	-73.4	-89.6	0	0	0	112.4	P32 G34 Q116 C182 V183 K184 C191 I193 F194	P32-Y186 PolarHBondContact O-OH 3.43Å; G34-Y186 VanDerWaalsContact CA-CE2 3.43Å; G34-Y186 PolarHBondContact N-OH 3.32Å; Q116-Y186 VanDerWaalsContact NE2-CE1 3.35Å; C182-Y186 WeakPolarHBondContact CB-O 3.45Å; V183-Y186 HydrophobicContact CB-CD2 4.42Å; V183-Y186 WeakPolarHBondContact O-CB 3.42Å; V183-Y186 PolarHBondContact O-N 2.03Å; K184-Y186 PolarHBondContact O-N 2.85Å; Y186-C191 VanDerWaalsContact CD1-O 3.26Å; Y186-C191 WeakPolarHBondContact CD1-O 3.46Å; Y186-I193 CarbonylContact C-O 3.55Å; Y186-I193 VanDerWaalsContact CA-O 3.3Å; Y186-I193 WeakPolarHBondContact CA-O 3.34Å; Y186-F194 HydrophobicContact CD1-CB 4.1Å; Y186-F194 HydrophobicContact CD1-CD2 4.26Å; Y186-F194 HydrophobicContact CD2-CD2 4.06Å; Y186-F194 HydrophobicContact CE1-CB 3.8Å; Y186-F194 AromaticContact CE1-CD2 3.91Å; Y186-F194 HydrophobicContact CE1-CD2 3.91Å; Y186-F194 HydrophobicContact CE1-CG 4.29Å; Y186-F194 AromaticContact CE2-CD2 3.71Å; Y186-F194 HydrophobicContact CE2-CD2 3.71Å; Y186-F194 HydrophobicContact CE2-CE2 4.2Å; Y186-F194 HydrophobicContact CG-CD2 4.34Å; Y186-F194 AromaticContact CZ-CD2 3.63Å
187	Y	93.9	Very high	94.1	Very high	58 Å²	58	53.4 Å²	53.4	23%	0.227	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	173.3	-171.3	-57.6	-95.9	0	0	0	111.8	C191 Q192 I193 C195 C204 S205 S206 D207 G208	Y187-C191 CarbonylContact O-C 3.56Å; Y187-C191 VanDerWaalsContact O-CA 3.27Å; Y187-C191 WeakPolarHBondContact O-CA 3.41Å; Y187-Q192 PolarHBondContact O-N 3.13Å; Y187-I193 PolarHBondContact N-O 2.84Å; Y187-I193 WeakPolarHBondContact O-CB 3.42Å; Y187-I193 PolarHBondContact O-N 3.29Å; Y187-C195 HydrophobicContact CD2-CB 4.11Å; Y187-C195 HydrophobicContact CE2-CB 3.93Å; Y187-C195 WeakPolarHBondContact CE2-O 3.32Å; Y187-C204 HydrophobicContact CE2-CB 4.29Å; Y187-S205 WeakPolarHBondContact CE1-O 3.18Å; Y187-S206 WeakPolarHBondContact CD1-O 3Å; Y187-D207 WeakPolarHBondContact CB-O 3.17Å; Y187-G208 VanDerWaalsContact CB-CA 3.49Å
188	G	92.1	Very high	93.9	Very high	18 Å²	18	53.7 Å²	53.7	19%	0.186	26%	0.262	C	S	.	.	S	Bend	trans	88.1	165.7	-177.1	0	0	0	0	0	112.5	P152 H190 C191	P152-G188 VanDerWaalsContact CG-O 3.31Å; P152-G188 WeakPolarHBondContact CG-O 2.82Å; G188-H190 PolarHBondContact O-N 3.05Å; G188-H190 VanDerWaalsContact O-N 3.1Å; G188-C191 PolarHBondContact O-N 3.18Å
189	N	91.3	Very high	93.6	Very high	104 Å²	104	59.2 Å²	59.2	56%	0.556	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.5	-174	-67.6	-12.2	0	0	0	113.9	P152	P152-N189 VanDerWaalsContact CD-O 3.27Å; P152-N189 WeakPolarHBondContact CD-O 3.37Å; P152-N189 WeakPolarHBondContact CG-O 2.91Å
190	H	92.1	Very high	93.4	Very high	59 Å²	59	60.6 Å²	60.6	27%	0.273	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119	19.2	177.5	-51.4	-72.5	0	0	0	112.1	V118 N120 G188 Q192	V118-H190 HydrophobicContact CB-CB 4.15Å; V118-H190 WeakPolarHBondContact CB-O 3.49Å; V118-H190 VanDerWaalsContact CG2-O 3.25Å; V118-H190 WeakPolarHBondContact CG2-O 3.25Å; V118-H190 PolarHBondContact O-ND1 3.48Å; N120-H190 PolarHBondContact OD1-CE1 3Å; N120-H190 PolarHBondContact OD1-ND1 3.36Å; N120-H190 PolarHBondContact OD1-NE2 3.35Å; G188-H190 PolarHBondContact O-N 3.05Å; G188-H190 VanDerWaalsContact O-N 3.1Å; H190-Q192 VanDerWaalsContact CA-OE1 3.28Å; H190-Q192 PolarHBondContact O-N 2.04Å; H190-Q192 VanDerWaalsContact O-N 3.1Å
191	C	93.8	Very high	93.3	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.337	C	S	.	.	S	Bend	trans	51.1	34.5	179.3	-53.6	0	0	0	0	113.9	G35 Q116 V118 C182 Y186 Y187 G188	G35-C191 VanDerWaalsContact O-CB 3.3Å; G35-C191 WeakPolarHBondContact O-CB 3.28Å; Q116-C191 PolarHBondContact NE2-O 3.46Å; V118-C191 HydrophobicContact CG2-CB 4.13Å; C182-C191 WeakPolarHBondContact CA-SG 3.41Å; C182-C191 HydrophobicContact CB-CB 3.71Å; C182-C191 WeakPolarHBondContact CB-SG 3.5Å; C182-C191 WeakPolarHBondContact SG-CA 3.06Å; C182-C191 WeakPolarHBondContact SG-CB 3.35Å; C182-C191 CovalentContact SG-SG 2.04Å; C182-C191 PolarHBondContact SG-SG 2.93Å; Y186-C191 VanDerWaalsContact CD1-O 3.26Å; Y186-C191 WeakPolarHBondContact CD1-O 3.46Å; Y187-C191 CarbonylContact O-C 3.56Å; Y187-C191 VanDerWaalsContact O-CA 3.27Å; Y187-C191 WeakPolarHBondContact O-CA 3.41Å; G188-C191 PolarHBondContact O-N 3.18Å
192	Q	91.2	Very high	93.4	Very high	92 Å²	92	66 Å²	66	43%	0.43	34%	0.336	S	S	.	.			trans	-93.2	-16.3	-175	75.7	-76.8	6.8	0	0	113.7	Y187 H190	Y187-Q192 PolarHBondContact O-N 3.13Å; H190-Q192 VanDerWaalsContact CA-OE1 3.28Å; H190-Q192 PolarHBondContact O-N 2.04Å; H190-Q192 VanDerWaalsContact O-N 3.1Å
193	I	92.2	Very high	93.4	Very high	65 Å²	65	68 Å²	68	33%	0.333	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	115.2	-176.8	-58.5	173.2	0	0	0	108.2	Y186 Y187 D207	Y186-I193 CarbonylContact C-O 3.55Å; Y186-I193 VanDerWaalsContact CA-O 3.3Å; Y186-I193 WeakPolarHBondContact CA-O 3.34Å; Y187-I193 PolarHBondContact N-O 2.84Å; Y187-I193 WeakPolarHBondContact O-CB 3.42Å; Y187-I193 PolarHBondContact O-N 3.29Å; I193-D207 WeakPolarHBondContact CD1-O 3.31Å
194	F	92.7	Very high	93.5	Very high	94 Å²	94	67.4 Å²	67.4	41%	0.412	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	123.7	175.9	179.2	-102.3	0	0	0	111	D185 Y186 K196	D185-F194 HydrophobicContact CB-CD2 4.2Å; D185-F194 HydrophobicContact CB-CE2 3.71Å; D185-F194 HydrophobicContact CB-CZ 4.39Å; D185-F194 CarbonylContact O-C 3.51Å; D185-F194 WeakPolarHBondContact O-CA 3.27Å; D185-F194 WeakPolarHBondContact O-CD2 3.02Å; Y186-F194 HydrophobicContact CD1-CB 4.1Å; Y186-F194 HydrophobicContact CD1-CD2 4.26Å; Y186-F194 HydrophobicContact CD2-CD2 4.06Å; Y186-F194 HydrophobicContact CE1-CB 3.8Å; Y186-F194 AromaticContact CE1-CD2 3.91Å; Y186-F194 HydrophobicContact CE1-CD2 3.91Å; Y186-F194 HydrophobicContact CE1-CG 4.29Å; Y186-F194 AromaticContact CE2-CD2 3.71Å; Y186-F194 HydrophobicContact CE2-CD2 3.71Å; Y186-F194 HydrophobicContact CE2-CE2 4.2Å; Y186-F194 HydrophobicContact CG-CD2 4.34Å; Y186-F194 AromaticContact CZ-CD2 3.63Å; F194-K196 HydrophobicContact CE1-CB 4.15Å; F194-K196 HydrophobicContact CZ-CB 3.79Å
195	C	94.6	Very high	93.6	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.321	C	S	.	.			trans	-142	113	171.2	-172.3	0	0	0	0	110.3	D185 Y187 C204 G208 Y210	D185-C195 WeakPolarHBondContact CB-O 3.32Å; D185-C195 PolarHBondContact O-N 2.94Å; Y187-C195 HydrophobicContact CD2-CB 4.11Å; Y187-C195 HydrophobicContact CE2-CB 3.93Å; Y187-C195 WeakPolarHBondContact CE2-O 3.32Å; C195-C204 HydrophobicContact CB-CB 3.76Å; C195-C204 WeakPolarHBondContact CB-SG 3.3Å; C195-C204 PolarHBondContact O-SG 3.16Å; C195-C204 VanDerWaalsContact SG-CA 3.56Å; C195-C204 WeakPolarHBondContact SG-CB 3.4Å; C195-C204 CovalentContact SG-SG 2.03Å; C195-C204 PolarHBondContact SG-SG 3.15Å; C195-G208 VanDerWaalsContact CB-O 3.3Å; C195-G208 WeakPolarHBondContact CB-O 3.49Å; C195-Y210 HydrophobicContact CB-CE1 4.47Å
196	K	94	Very high	93.5	Very high	120 Å²	120	65 Å²	65	52%	0.522	35%	0.351	S	S	.	.			trans	-108.5	119.5	171.6	-176.8	175.6	179.3	-177.6	0	109.2	D185 F194 Y202	D185-K196 HydrophobicContact CB-CB 4.11Å; F194-K196 HydrophobicContact CE1-CB 4.15Å; F194-K196 HydrophobicContact CZ-CB 3.79Å; K196-Y202 WeakPolarHBondContact O-CE2 3.49Å; K196-Y202 PolarHBondContact O-OH 3.03Å
197	P	94.2	Very high	93.4	Very high	66 Å²	66	67.7 Å²	67.7	43%	0.429	37%	0.367	S	S	.	.			trans	-55.4	139.5	-178.5	-26.2	34	0	0	0	112.6	C204	P197-C204 VanDerWaalsContact CD-SG 3.58Å; P197-C204 HydrophobicContact CG-CB 4.34Å
198	E	94	Very high	93.4	Very high	77 Å²	77	65 Å²	65	36%	0.36	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-118.9	111.8	176.7	-176.9	92.2	-106	0	0	108.6	S200 R201 Y202	E198-S200 PolarHBondContact O-N 3.15Å; E198-R201 HydrophobicContact CB-CB 4.25Å; E198-R201 HydrophobicContact CG-CB 4.07Å; E198-R201 HydrophobicContact CG-CG 4.24Å; E198-R201 PolarHBondContact O-N 2.89Å; E198-R201 IonicContact OE2-CZ 2.81Å; E198-R201 IonicContact OE2-NE 2.76Å; E198-R201 IonicContact OE2-NH2 3.9Å; E198-R201 PolarHBondContact OE2-NH2 3.05Å; E198-Y202 CarbonylContact C-O 3.6Å; E198-Y202 HydrophobicContact CB-CD1 4.27Å; E198-Y202 HydrophobicContact CB-CE1 3.97Å; E198-Y202 HydrophobicContact CB-CE2 4.23Å; E198-Y202 PolarHBondContact N-O 3.45Å; E198-Y202 PolarHBondContact O-N 3.24Å
199	P	92	Very high	93.5	Very high	116 Å²	116	66.6 Å²	66.6	75%	0.753	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-28.3	-171.1	-29	34.8	0	0	0	115.8	L213	P199-L213 VanDerWaalsContact O-CD1 3.3Å; P199-L213 WeakPolarHBondContact O-CD1 3.42Å
200	S	91.5	Very high	93.7	Very high	100 Å²	100	65.1 Å²	65.1	70%	0.699	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-0.2	-178.2	-56.2	0	0	0	0	114.1	E198 L213	E198-S200 PolarHBondContact O-N 3.15Å; S200-L213 VanDerWaalsContact C-CD1 3.47Å
201	R	94.8	Very high	93.9	Very high	106 Å²	106	66.1 Å²	66.1	40%	0.4	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.4	-50.2	-176.9	-65.1	-166.5	-66.3	-158.9	-4.8	115.4	E198 L213 L216	E198-R201 HydrophobicContact CB-CB 4.25Å; E198-R201 HydrophobicContact CG-CB 4.07Å; E198-R201 HydrophobicContact CG-CG 4.24Å; E198-R201 PolarHBondContact O-N 2.89Å; E198-R201 IonicContact OE2-CZ 2.81Å; E198-R201 IonicContact OE2-NE 2.76Å; E198-R201 IonicContact OE2-NH2 3.9Å; E198-R201 PolarHBondContact OE2-NH2 3.05Å; R201-L213 WeakPolarHBondContact O-CB 3.02Å; R201-L213 WeakPolarHBondContact O-CG 3.45Å; R201-L213 PolarHBondContact O-N 3.21Å; R201-L216 HydrophobicContact CB-CD1 4.01Å; R201-L216 HydrophobicContact CG-CD1 4.09Å; R201-L216 WeakPolarHBondContact O-CD1 3.25Å
202	Y	96.8	Very high	94.1	Very high	28 Å²	28	68.1 Å²	68.1	11%	0.11	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	158.2	-170.6	60.9	-103.4	0	0	0	113.1	K196 E198 Y210 I211 C221	K196-Y202 WeakPolarHBondContact O-CE2 3.49Å; K196-Y202 PolarHBondContact O-OH 3.03Å; E198-Y202 CarbonylContact C-O 3.6Å; E198-Y202 HydrophobicContact CB-CD1 4.27Å; E198-Y202 HydrophobicContact CB-CE1 3.97Å; E198-Y202 HydrophobicContact CB-CE2 4.23Å; E198-Y202 PolarHBondContact N-O 3.45Å; E198-Y202 PolarHBondContact O-N 3.24Å; Y202-Y210 HydrophobicContact CD1-CD1 4.22Å; Y202-Y210 AromaticContact CD2-CD1 3.49Å; Y202-Y210 HydrophobicContact CD2-CD1 3.49Å; Y202-Y210 VanDerWaalsContact CD2-CD1 3.49Å; Y202-Y210 HydrophobicContact CD2-CE1 4.14Å; Y202-Y210 HydrophobicContact CE1-CD1 4.17Å; Y202-Y210 HydrophobicContact CE1-CE1 4.26Å; Y202-Y210 AromaticContact CE2-CD1 3.43Å; Y202-Y210 HydrophobicContact CE2-CD1 3.43Å; Y202-Y210 VanDerWaalsContact CE2-CD1 3.43Å; Y202-Y210 AromaticContact CE2-CE1 3.57Å; Y202-Y210 HydrophobicContact CE2-CE1 3.57Å; Y202-Y210 AromaticContact CG-CD1 3.91Å; Y202-Y210 HydrophobicContact CG-CD1 3.91Å; Y202-Y210 AromaticContact CZ-CD1 3.8Å; Y202-Y210 AromaticContact CZ-CE1 3.66Å; Y202-I211 CarbonylContact C-O 3.56Å; Y202-I211 WeakPolarHBondContact CA-O 3.44Å; Y202-I211 VanDerWaalsContact CB-O 3.27Å; Y202-I211 WeakPolarHBondContact CB-O 3.45Å; Y202-C221 HydrophobicContact CD1-CB 4.06Å; Y202-C221 HydrophobicContact CG-CB 4.43Å
203	T	97.1	Very high	94.3	Very high	67 Å²	67	66.5 Å²	66.5	41%	0.411	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	174.1	166	63.9	0	0	0	0	110.1	I211	T203-I211 PolarHBondContact N-O 2.93Å; T203-I211 PolarHBondContact O-N 2.78Å; T203-I211 WeakPolarHBondContact OG1-CB 3.15Å
204	C	95.8	Very high	94.5	Very high	23 Å²	23	67.8 Å²	67.8	16%	0.155	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131	-177.6	-59.5	0	0	0	0	110.1	Y187 C195 P197	Y187-C204 HydrophobicContact CE2-CB 4.29Å; C195-C204 HydrophobicContact CB-CB 3.76Å; C195-C204 WeakPolarHBondContact CB-SG 3.3Å; C195-C204 PolarHBondContact O-SG 3.16Å; C195-C204 VanDerWaalsContact SG-CA 3.56Å; C195-C204 WeakPolarHBondContact SG-CB 3.4Å; C195-C204 CovalentContact SG-SG 2.03Å; C195-C204 PolarHBondContact SG-SG 3.15Å; P197-C204 VanDerWaalsContact CD-SG 3.58Å; P197-C204 HydrophobicContact CG-CB 4.34Å
205	S	94.1	Very high	94.6	Very high	31 Å²	31	63.4 Å²	63.4	22%	0.217	36%	0.361	C	S	.	.			trans	-70.3	169.5	169.7	176.1	0	0	0	0	111.3	Y187 D207 G208 S209	Y187-S205 WeakPolarHBondContact CE1-O 3.18Å; S205-D207 WeakPolarHBondContact CB-OD1 3.5Å; S205-D207 PolarHBondContact O-N 3.36Å; S205-D207 PolarHBondContact OG-OD1 3.4Å; S205-G208 PolarHBondContact O-N 2.88Å; S205-S209 WeakPolarHBondContact CB-O 3.42Å; S205-S209 VanDerWaalsContact CB-OG 3.25Å; S205-S209 WeakPolarHBondContact CB-OG 3.27Å; S205-S209 PolarHBondContact N-O 3.11Å
206	S	91.2	Very high	94.7	Very high	114 Å²	114	65 Å²	65	80%	0.797	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-20.5	178.6	54.4	0	0	0	0	114	Y187	Y187-S206 WeakPolarHBondContact CD1-O 3Å
207	D	92.9	Very high	94.7	Very high	83 Å²	83	62.3 Å²	62.3	44%	0.444	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-2.9	172.1	66.5	-20.3	0	0	0	113	Y187 I193 S205 S209	Y187-D207 WeakPolarHBondContact CB-O 3.17Å; I193-D207 WeakPolarHBondContact CD1-O 3.31Å; S205-D207 WeakPolarHBondContact CB-OD1 3.5Å; S205-D207 PolarHBondContact O-N 3.36Å; S205-D207 PolarHBondContact OG-OD1 3.4Å; D207-S209 PolarHBondContact OD1-N 2.03Å; D207-S209 VanDerWaalsContact OD1-N 3.11Å; D207-S209 PolarHBondContact OD1-OG 3.27Å
208	G	93.1	Very high	94.6	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.01	35%	0.35	C	S	.	.	S	Bend	trans	86.1	7.1	-177.7	0	0	0	0	0	114.9	Y187 C195 S205	Y187-G208 VanDerWaalsContact CB-CA 3.49Å; C195-G208 VanDerWaalsContact CB-O 3.3Å; C195-G208 WeakPolarHBondContact CB-O 3.49Å; S205-G208 PolarHBondContact O-N 2.88Å
209	S	94.2	Very high	94.4	Very high	53 Å²	53	62.2 Å²	62.2	37%	0.371	37%	0.367	S	S	.	.			trans	-68.9	148.3	172.2	79.3	0	0	0	0	111.3	S205 D207	S205-S209 WeakPolarHBondContact CB-O 3.42Å; S205-S209 VanDerWaalsContact CB-OG 3.25Å; S205-S209 WeakPolarHBondContact CB-OG 3.27Å; S205-S209 PolarHBondContact N-O 3.11Å; D207-S209 PolarHBondContact OD1-N 2.03Å; D207-S209 VanDerWaalsContact OD1-N 3.11Å; D207-S209 PolarHBondContact OD1-OG 3.27Å
210	Y	95.7	Very high	94.3	Very high	72 Å²	72	62.8 Å²	62.8	28%	0.282	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	131.3	175.5	-57.8	-80.2	0	0	0	110.9	C195 Y202 P219 K220	C195-Y210 HydrophobicContact CB-CE1 4.47Å; Y202-Y210 HydrophobicContact CD1-CD1 4.22Å; Y202-Y210 AromaticContact CD2-CD1 3.49Å; Y202-Y210 HydrophobicContact CD2-CD1 3.49Å; Y202-Y210 VanDerWaalsContact CD2-CD1 3.49Å; Y202-Y210 HydrophobicContact CD2-CE1 4.14Å; Y202-Y210 HydrophobicContact CE1-CD1 4.17Å; Y202-Y210 HydrophobicContact CE1-CE1 4.26Å; Y202-Y210 AromaticContact CE2-CD1 3.43Å; Y202-Y210 HydrophobicContact CE2-CD1 3.43Å; Y202-Y210 VanDerWaalsContact CE2-CD1 3.43Å; Y202-Y210 AromaticContact CE2-CE1 3.57Å; Y202-Y210 HydrophobicContact CE2-CE1 3.57Å; Y202-Y210 AromaticContact CG-CD1 3.91Å; Y202-Y210 HydrophobicContact CG-CD1 3.91Å; Y202-Y210 AromaticContact CZ-CD1 3.8Å; Y202-Y210 AromaticContact CZ-CE1 3.66Å; Y210-P219 WeakPolarHBondContact CD2-O 3.07Å; Y210-K220 HydrophobicContact CE2-CG 4.06Å
211	I	96.6	Very high	94.5	Very high	80 Å²	80	58 Å²	58	41%	0.41	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	106.7	170.5	-58.8	172.2	0	0	0	106.9	Y202 T203	Y202-I211 CarbonylContact C-O 3.56Å; Y202-I211 WeakPolarHBondContact CA-O 3.44Å; Y202-I211 VanDerWaalsContact CB-O 3.27Å; Y202-I211 WeakPolarHBondContact CB-O 3.45Å; T203-I211 PolarHBondContact N-O 2.93Å; T203-I211 PolarHBondContact O-N 2.78Å; T203-I211 WeakPolarHBondContact OG1-CB 3.15Å
212	C	97.3	Very high	94.4	Very high	42 Å²	42	57.6 Å²	57.6	28%	0.284	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	141.9	-176.3	-53	0	0	0	0	111.8	L216 C221	C212-L216 HydrophobicContact CB-CB 4.27Å; C212-L216 WeakPolarHBondContact CB-O 3.41Å; C212-C221 WeakPolarHBondContact CA-SG 3.44Å; C212-C221 HydrophobicContact CB-CB 3.64Å; C212-C221 WeakPolarHBondContact CB-SG 3.3Å; C212-C221 PolarHBondContact N-SG 3.17Å; C212-C221 VanDerWaalsContact N-SG 3.41Å; C212-C221 WeakPolarHBondContact SG-CA 3.41Å; C212-C221 WeakPolarHBondContact SG-CB 3.3Å; C212-C221 CovalentContact SG-SG 2.03Å; C212-C221 PolarHBondContact SG-SG 3.47Å
213	L	95.8	Very high	94.2	Very high	58 Å²	58	59.4 Å²	59.4	30%	0.304	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-68	155.8	167.4	-68.1	177.9	0	0	0	110.6	P199 S200 R201 G215 L216	P199-L213 VanDerWaalsContact O-CD1 3.3Å; P199-L213 WeakPolarHBondContact O-CD1 3.42Å; S200-L213 VanDerWaalsContact C-CD1 3.47Å; R201-L213 WeakPolarHBondContact O-CB 3.02Å; R201-L213 WeakPolarHBondContact O-CG 3.45Å; R201-L213 PolarHBondContact O-N 3.21Å; L213-G215 PolarHBondContact O-N 2.96Å; L213-L216 PolarHBondContact O-N 2.87Å
214	P	95.8	Very high	94	Very high	92 Å²	92	62.5 Å²	62.5	60%	0.597	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	133.1	177.5	-25.2	34.4	0	0	0	112.2	Y228	P214-Y228 HydrophobicContact CB-CD2 4.42Å; P214-Y228 HydrophobicContact CB-CE1 4.25Å; P214-Y228 HydrophobicContact CB-CE2 3.61Å; P214-Y228 WeakPolarHBondContact CB-OH 3.45Å
215	G	94.5	Very high	94	Very high	2 Å²	2	63.2 Å²	63.2	2%	0.021	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-4.2	-175	0	0	0	0	0	114.9	L213 D225 Y229	L213-G215 PolarHBondContact O-N 2.96Å; G215-D225 PolarHBondContact O-N 3.48Å; G215-Y229 VanDerWaalsContact O-CE2 3.27Å; G215-Y229 WeakPolarHBondContact O-CE2 3.37Å
216	L	96.3	Very high	94.1	Very high	34 Å²	34	62.5 Å²	62.5	18%	0.178	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	151.3	175.7	-63.5	171.6	0	0	0	111.2	R201 C212 L213 C221 K223	R201-L216 HydrophobicContact CB-CD1 4.01Å; R201-L216 HydrophobicContact CG-CD1 4.09Å; R201-L216 WeakPolarHBondContact O-CD1 3.25Å; C212-L216 HydrophobicContact CB-CB 4.27Å; C212-L216 WeakPolarHBondContact CB-O 3.41Å; L213-L216 PolarHBondContact O-N 2.87Å; L216-C221 HydrophobicContact CB-CB 4.37Å; L216-K223 CarbonylContact C-O 3.45Å; L216-K223 WeakPolarHBondContact CA-O 3Å
217	R	94.5	Very high	94.4	Very high	64 Å²	64	58.2 Å²	58.2	24%	0.242	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	178.2	-179.2	67.8	177.3	-176.7	96.4	-0.9	111.3	C221 D222 K223 E224 D225	R217-C221 CarbonylContact O-C 3.51Å; R217-C221 VanDerWaalsContact O-CA 3.3Å; R217-C221 WeakPolarHBondContact O-CA 3.05Å; R217-D222 PolarHBondContact O-N 3.48Å; R217-K223 HydrophobicContact CG-CB 3.99Å; R217-K223 PolarHBondContact N-O 3.16Å; R217-K223 PolarHBondContact O-N 2.68Å; R217-E224 PolarHBondContact NE-O 3.18Å; R217-D225 HydrophobicContact CB-CB 4.35Å; R217-D225 HydrophobicContact CG-CB 4.25Å
218	G	92	Very high	94.5	Very high	30 Å²	30	60.5 Å²	60.5	31%	0.309	32%	0.319	S	S	.	.	S	Bend	trans	94.5	170.5	177.6	0	0	0	0	0	112.4	K220 C221	G218-K220 PolarHBondContact O-N 3.39Å; G218-K220 VanDerWaalsContact O-N 3.12Å; G218-C221 PolarHBondContact O-N 3.48Å; G218-C221 VanDerWaalsContact O-N 3.16Å
219	P	90.9	Very high	94.7	Very high	110 Å²	110	66.5 Å²	66.5	71%	0.714	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.3	-171.5	26.4	-35.2	0	0	0	113.5	Y210	Y210-P219 WeakPolarHBondContact CD2-O 3.07Å
220	K	89.8	Confident	94.7	Very high	128 Å²	128	68.6 Å²	68.6	56%	0.557	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.8	15.8	176.7	-65.8	-174.4	176.9	-178.7	0	112.8	Y210 G218 D222	Y210-K220 HydrophobicContact CE2-CG 4.06Å; G218-K220 PolarHBondContact O-N 3.39Å; G218-K220 VanDerWaalsContact O-N 3.12Å; K220-D222 PolarHBondContact O-N 3.2Å
221	C	95.3	Very high	94.6	Very high	0 Å²	0	69 Å²	69	0%	0	36%	0.358	C	S	.	.	S	Bend	trans	52.8	37.1	-178.4	-47.6	0	0	0	0	112.8	Y202 C212 L216 R217 G218	Y202-C221 HydrophobicContact CD1-CB 4.06Å; Y202-C221 HydrophobicContact CG-CB 4.43Å; C212-C221 WeakPolarHBondContact CA-SG 3.44Å; C212-C221 HydrophobicContact CB-CB 3.64Å; C212-C221 WeakPolarHBondContact CB-SG 3.3Å; C212-C221 PolarHBondContact N-SG 3.17Å; C212-C221 VanDerWaalsContact N-SG 3.41Å; C212-C221 WeakPolarHBondContact SG-CA 3.41Å; C212-C221 WeakPolarHBondContact SG-CB 3.3Å; C212-C221 CovalentContact SG-SG 2.03Å; C212-C221 PolarHBondContact SG-SG 3.47Å; L216-C221 HydrophobicContact CB-CB 4.37Å; R217-C221 CarbonylContact O-C 3.51Å; R217-C221 VanDerWaalsContact O-CA 3.3Å; R217-C221 WeakPolarHBondContact O-CA 3.05Å; G218-C221 PolarHBondContact O-N 3.48Å; G218-C221 VanDerWaalsContact O-N 3.16Å
222	D	92	Very high	94.6	Very high	98 Å²	98	65.9 Å²	65.9	52%	0.524	34%	0.343	S	S	.	.			trans	-100.5	-9.3	-175.1	57.6	-27.3	0	0	0	112.9	R217 K220	R217-D222 PolarHBondContact O-N 3.48Å; K220-D222 PolarHBondContact O-N 3.2Å
223	K	93.3	Very high	94.4	Very high	65 Å²	65	64.7 Å²	64.7	28%	0.283	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	139.2	179	-58.8	-175.4	-178.5	-124.6	0	110.3	L216 R217 E244	L216-K223 CarbonylContact C-O 3.45Å; L216-K223 WeakPolarHBondContact CA-O 3Å; R217-K223 HydrophobicContact CG-CB 3.99Å; R217-K223 PolarHBondContact N-O 3.16Å; R217-K223 PolarHBondContact O-N 2.68Å; K223-E244 WeakPolarHBondContact CD-OE1 3.43Å; K223-E244 WeakPolarHBondContact CE-OE1 3.3Å; K223-E244 IonicContact NZ-OE1 3.88Å; K223-E244 PolarHBondContact NZ-OE1 2.87Å
224	E	93.7	Very high	94.2	Very high	133 Å²	133	69.6 Å²	69.6	62%	0.621	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	143.3	170.3	-67.2	-177.7	179.2	0	0	110.6	R217 Y229	R217-E224 PolarHBondContact NE-O 3.18Å; E224-Y229 HydrophobicContact CB-CE2 4.37Å
225	D	96.1	Very high	93.9	Very high	38 Å²	38	68 Å²	68	20%	0.203	35%	0.346	C	S	.	.			trans	-96.7	92.3	171.3	-170.2	-5.8	0	0	0	109	G215 R217 C227 Y228 Y229 N240	G215-D225 PolarHBondContact O-N 3.48Å; R217-D225 HydrophobicContact CB-CB 4.35Å; R217-D225 HydrophobicContact CG-CB 4.25Å; D225-C227 PolarHBondContact O-N 2.91Å; D225-C227 VanDerWaalsContact OD1-CB 3.28Å; D225-C227 WeakPolarHBondContact OD1-CB 3.31Å; D225-C227 PolarHBondContact OD1-N 3.45Å; D225-C227 VanDerWaalsContact OD1-N 3.11Å; D225-Y228 WeakPolarHBondContact O-CB 3.25Å; D225-Y228 PolarHBondContact O-N 2.72Å; D225-Y228 PolarHBondContact OD1-N 3.29Å; D225-Y229 VanDerWaalsContact O-CD2 3.31Å; D225-Y229 WeakPolarHBondContact O-CD2 3.49Å; D225-Y229 PolarHBondContact O-N 3.05Å; D225-N240 PolarHBondContact OD1-ND2 3.03Å; D225-N240 PolarHBondContact OD1-OD1 3.07Å
226	S	96.1	Very high	94	Very high	15 Å²	15	68.7 Å²	68.7	11%	0.105	35%	0.352	C	S	.	.	H	α-helix	trans	-61.3	-27.5	177	-51.4	0	0	0	0	112.2	Y228 E230 N240 G246	S226-Y228 PolarHBondContact O-N 3.14Å; S226-E230 CarbonylContact O-C 3.4Å; S226-E230 PolarHBondContact O-N 2.88Å; S226-E230 VanDerWaalsContact O-O 3.11Å; S226-N240 WeakPolarHBondContact CA-OD1 3.26Å; S226-N240 WeakPolarHBondContact CB-OD1 3.39Å; S226-N240 PolarHBondContact N-OD1 3.1Å; S226-G246 VanDerWaalsContact CB-C 3.47Å; S226-G246 VanDerWaalsContact OG-CA 3.32Å; S226-G246 WeakPolarHBondContact OG-CA 3.44Å; S226-G246 PolarHBondContact OG-O 3.23Å
227	C	96.7	Very high	94	Very high	24 Å²	24	71.7 Å²	71.7	16%	0.162	37%	0.372	C	S	.	.	H	α-helix	trans	-67.8	-26.3	173.9	-70.9	0	0	0	0	113.2	D225 C238 N240	D225-C227 PolarHBondContact O-N 2.91Å; D225-C227 VanDerWaalsContact OD1-CB 3.28Å; D225-C227 WeakPolarHBondContact OD1-CB 3.31Å; D225-C227 PolarHBondContact OD1-N 3.45Å; D225-C227 VanDerWaalsContact OD1-N 3.11Å; C227-C238 WeakPolarHBondContact CA-SG 3.45Å; C227-C238 HydrophobicContact CB-CB 3.73Å; C227-C238 WeakPolarHBondContact CB-SG 3.37Å; C227-C238 WeakPolarHBondContact SG-CB 3.4Å; C227-C238 CovalentContact SG-SG 2.03Å; C227-C238 PolarHBondContact SG-SG 3.5Å; C227-N240 PolarHBondContact N-OD1 3.49Å
228	Y	95.8	Very high	94.1	Very high	131 Å²	131	70.5 Å²	70.5	51%	0.514	37%	0.373	S	S	.	.	H	α-helix	trans	-78.2	-47.6	174.6	179.8	-91.8	0	0	0	111.5	P214 D225 S226	P214-Y228 HydrophobicContact CB-CD2 4.42Å; P214-Y228 HydrophobicContact CB-CE1 4.25Å; P214-Y228 HydrophobicContact CB-CE2 3.61Å; P214-Y228 WeakPolarHBondContact CB-OH 3.45Å; D225-Y228 WeakPolarHBondContact O-CB 3.25Å; D225-Y228 PolarHBondContact O-N 2.72Å; D225-Y228 PolarHBondContact OD1-N 3.29Å; S226-Y228 PolarHBondContact O-N 3.14Å
229	Y	95.5	Very high	94.3	Very high	128 Å²	128	72.3 Å²	72.3	50%	0.502	38%	0.378	S	S	.	.	H	α-helix	trans	-73.3	-31.5	-177.5	-69.5	-61.8	0	0	0	113.5	G215 E224 D225	G215-Y229 VanDerWaalsContact O-CE2 3.27Å; G215-Y229 WeakPolarHBondContact O-CE2 3.37Å; E224-Y229 HydrophobicContact CB-CE2 4.37Å; D225-Y229 VanDerWaalsContact O-CD2 3.31Å; D225-Y229 WeakPolarHBondContact O-CD2 3.49Å; D225-Y229 PolarHBondContact O-N 3.05Å
230	E	94.1	Very high	94.6	Very high	97 Å²	97	68.5 Å²	68.5	45%	0.453	35%	0.352	S	S	.	.	S	Bend	trans	-131.9	92.8	178.9	-50.8	178.7	82.2	0	0	107.5	S226 R247	S226-E230 CarbonylContact O-C 3.4Å; S226-E230 PolarHBondContact O-N 2.88Å; S226-E230 VanDerWaalsContact O-O 3.11Å; E230-R247 VanDerWaalsContact C-CZ 3.49Å; E230-R247 WeakPolarHBondContact O-CD 3.44Å; E230-R247 PolarHBondContact O-NE 2.88Å; E230-R247 PolarHBondContact O-NH2 3.31Å; E230-R247 IonicContact OE1-NH1 2.86Å; E230-R247 PolarHBondContact OE1-NH1 2.03Å; E230-R247 IonicContact OE2-NH1 3.27Å; E230-R247 PolarHBondContact OE2-NH1 2.7Å
231	P	94.9	Very high	94.8	Very high	81 Å²	81	65.7 Å²	65.7	53%	0.526	34%	0.339	S	S	.	.			trans	-69.5	154.3	179.9	25.1	-32.6	0	0	0	111.6	R247	P231-R247 PolarHBondContact O-NH2 3.34Å
232	C	96.2	Very high	94.5	Very high	14 Å²	14	73.3 Å²	73.3	10%	0.095	38%	0.38	C	S	.	.			trans	-79.1	177.4	167.6	-64.1	0	0	0	0	110.6	A236 C238 C249	C232-A236 HydrophobicContact CB-CB 3.95Å; C232-C238 HydrophobicContact CB-CB 4.29Å; C232-C238 VanDerWaalsContact SG-CB 3.52Å; C232-C238 PolarHBondContact SG-SG 3.39Å; C232-C249 VanDerWaalsContact CA-SG 3.59Å; C232-C249 HydrophobicContact CB-CB 3.72Å; C232-C249 WeakPolarHBondContact CB-SG 3.39Å; C232-C249 WeakPolarHBondContact SG-CA 3.48Å; C232-C249 WeakPolarHBondContact SG-CB 3.28Å; C232-C249 CovalentContact SG-SG 2.03Å; C232-C249 PolarHBondContact SG-SG 3.25Å
233	A	93.4	Very high	94.5	Very high	16 Å²	16	73.5 Å²	73.5	13%	0.132	38%	0.381	C	S	.	.			trans	-61	151.1	168.4	0	0	0	0	0	110.9	H235 A236 C259	A233-H235 PolarHBondContact O-N 2.95Å; A233-A236 HydrophobicContact CB-CB 4.48Å; A233-A236 WeakPolarHBondContact O-CB 3.44Å; A233-A236 PolarHBondContact O-N 2.03Å; A233-C259 WeakPolarHBondContact CB-O 3.31Å; A233-C259 PolarHBondContact N-O 3.32Å
234	D	91.4	Very high	94.2	Very high	161 Å²	161	75.7 Å²	75.7	86%	0.861	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-26.3	-173.2	-65.4	-25.3	0	0	0	114.4
235	H	90.5	Very high	94	Very high	59 Å²	59	73.7 Å²	73.7	27%	0.273	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	1.3	179.4	66.6	-87.9	0	0	0	113.3	A233 E258 Y283	A233-H235 PolarHBondContact O-N 2.95Å; H235-E258 PolarHBondContact NE2-O 2.8Å; H235-Y283 HydrophobicContact CB-CD1 4.34Å; H235-Y283 HydrophobicContact CB-CD2 3.67Å; H235-Y283 HydrophobicContact CB-CE1 4.26Å; H235-Y283 HydrophobicContact CB-CE2 3.59Å; H235-Y283 HydrophobicContact CB-CG 4.05Å; H235-Y283 AromaticContact CG-CD2 3.87Å; H235-Y283 AromaticContact ND1-CG 3.71Å
236	A	95.3	Very high	93.9	Very high	17 Å²	17	72.2 Å²	72.2	14%	0.14	38%	0.383	C	S	.	.	S	Bend	trans	-105.1	149.4	-179.3	0	0	0	0	0	111.4	C232 A233 C249 L250 C259	C232-A236 HydrophobicContact CB-CB 3.95Å; A233-A236 HydrophobicContact CB-CB 4.48Å; A233-A236 WeakPolarHBondContact O-CB 3.44Å; A233-A236 PolarHBondContact O-N 2.03Å; A236-C249 HydrophobicContact CB-CB 4.5Å; A236-L250 WeakPolarHBondContact CA-O 3.2Å; A236-C259 HydrophobicContact CB-CB 3.85Å
237	T	96.6	Very high	93.8	Very high	96 Å²	96	72.8 Å²	72.8	59%	0.589	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	127.3	170.5	-56.7	0	0	0	0	109.4	L250	T237-L250 PolarHBondContact N-O 2.9Å; T237-L250 PolarHBondContact O-N 3.43Å
238	C	97.1	Very high	93.8	Very high	40 Å²	40	74 Å²	74	27%	0.27	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	134.5	177.4	-168.3	0	0	0	0	112.1	C227 C232	C227-C238 WeakPolarHBondContact CA-SG 3.45Å; C227-C238 HydrophobicContact CB-CB 3.73Å; C227-C238 WeakPolarHBondContact CB-SG 3.37Å; C227-C238 WeakPolarHBondContact SG-CB 3.4Å; C227-C238 CovalentContact SG-SG 2.03Å; C227-C238 PolarHBondContact SG-SG 3.5Å; C232-C238 HydrophobicContact CB-CB 4.29Å; C232-C238 VanDerWaalsContact SG-CB 3.52Å; C232-C238 PolarHBondContact SG-SG 3.39Å
239	V	96.7	Very high	93.9	Very high	68 Å²	68	67.8 Å²	67.8	41%	0.412	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	125.4	175	-176.7	0	0	0	0	109.3	R247 I248 L250	V239-R247 CarbonylContact O-C 3.54Å; V239-R247 VanDerWaalsContact O-CA 3.29Å; V239-R247 WeakPolarHBondContact O-CA 3.35Å; V239-I248 PolarHBondContact N-O 3.11Å; V239-I248 PolarHBondContact O-N 2.82Å; V239-L250 HydrophobicContact CG2-CD1 3.92Å
240	N	95.7	Very high	94	Very high	30 Å²	30	63.8 Å²	63.8	16%	0.16	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	138.1	171.6	-75.4	-73.1	0	0	0	110.2	D225 S226 C227	D225-N240 PolarHBondContact OD1-ND2 3.03Å; D225-N240 PolarHBondContact OD1-OD1 3.07Å; S226-N240 WeakPolarHBondContact CA-OD1 3.26Å; S226-N240 WeakPolarHBondContact CB-OD1 3.39Å; S226-N240 PolarHBondContact N-OD1 3.1Å; C227-N240 PolarHBondContact N-OD1 3.49Å
241	K	94.5	Very high	93.9	Very high	68 Å²	68	59.4 Å²	59.4	30%	0.296	33%	0.33	S	S	.	.			trans	-72.7	145.5	175.1	-65.7	179	176.3	178.2	0	111	D243 E244 T245 G246 R247 I248	K241-D243 VanDerWaalsContact C-N 3.25Å; K241-D243 WeakPolarHBondContact CB-OD1 3.48Å; K241-D243 PolarHBondContact O-N 3.17Å; K241-E244 PolarHBondContact O-N 2.83Å; K241-T245 WeakPolarHBondContact CD-OG1 3.44Å; K241-G246 WeakPolarHBondContact CB-O 3.27Å; K241-G246 PolarHBondContact N-O 3.37Å; K241-R247 WeakPolarHBondContact CE-O 3.44Å; K241-I248 HydrophobicContact CD-CG1 4.32Å; K241-I248 HydrophobicContact CG-CD1 4.01Å; K241-I248 HydrophobicContact CG-CG1 3.82Å
242	D	90.2	Very high	93.7	Very high	161 Å²	161	63.6 Å²	63.6	86%	0.861	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-28.2	178.8	-68	-37.4	0	0	0	112.9	E244	D242-E244 PolarHBondContact O-N 3.25Å
243	D	90.9	Very high	93.6	Very high	102 Å²	102	65.9 Å²	65.9	55%	0.545	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	3.5	178	67.3	-3.4	0	0	0	113.7	K241 T245	K241-D243 VanDerWaalsContact C-N 3.25Å; K241-D243 WeakPolarHBondContact CB-OD1 3.48Å; K241-D243 PolarHBondContact O-N 3.17Å; D243-T245 HydrophobicContact CB-CG2 4.14Å; D243-T245 VanDerWaalsContact CG-CG2 3.41Å; D243-T245 PolarHBondContact O-N 3.05Å; D243-T245 VanDerWaalsContact O-N 3.1Å; D243-T245 WeakPolarHBondContact OD1-CB 3.4Å; D243-T245 PolarHBondContact OD1-N 2.68Å; D243-T245 PolarHBondContact OD1-OG1 3.04Å; D243-T245 WeakPolarHBondContact OD2-CG2 3.26Å; D243-T245 PolarHBondContact OD2-OG1 3.38Å
244	E	87.4	Confident	93.6	Very high	111 Å²	111	70.9 Å²	70.9	52%	0.519	40%	0.395	S	S	.	.	S	Bend	trans	61.3	16.1	179.7	-56.4	173.2	-176.3	0	0	113.3	K223 K241 D242 G246	K223-E244 WeakPolarHBondContact CD-OE1 3.43Å; K223-E244 WeakPolarHBondContact CE-OE1 3.3Å; K223-E244 IonicContact NZ-OE1 3.88Å; K223-E244 PolarHBondContact NZ-OE1 2.87Å; K241-E244 PolarHBondContact O-N 2.83Å; D242-E244 PolarHBondContact O-N 3.25Å; E244-G246 VanDerWaalsContact C-N 3.27Å; E244-G246 PolarHBondContact O-N 3.4Å
245	T	89.7	Confident	93.8	Very high	91 Å²	91	68.4 Å²	68.4	56%	0.558	38%	0.378	S	S	*	.	S	Bend	trans	-86.2	9.6	-179.3	67.3	0	0	0	0	114.2	K241 D243	K241-T245 WeakPolarHBondContact CD-OG1 3.44Å; D243-T245 HydrophobicContact CB-CG2 4.14Å; D243-T245 VanDerWaalsContact CG-CG2 3.41Å; D243-T245 PolarHBondContact O-N 3.05Å; D243-T245 VanDerWaalsContact O-N 3.1Å; D243-T245 WeakPolarHBondContact OD1-CB 3.4Å; D243-T245 PolarHBondContact OD1-N 2.68Å; D243-T245 PolarHBondContact OD1-OG1 3.04Å; D243-T245 WeakPolarHBondContact OD2-CG2 3.26Å; D243-T245 PolarHBondContact OD2-OG1 3.38Å
246	G	92.7	Very high	93.9	Very high	7 Å²	7	69 Å²	69	7%	0.072	38%	0.38	C	S	.	.			trans	132.6	-142.5	-179.9	0	0	0	0	0	113	S226 K241 E244	S226-G246 VanDerWaalsContact CB-C 3.47Å; S226-G246 VanDerWaalsContact OG-CA 3.32Å; S226-G246 WeakPolarHBondContact OG-CA 3.44Å; S226-G246 PolarHBondContact OG-O 3.23Å; K241-G246 WeakPolarHBondContact CB-O 3.27Å; K241-G246 PolarHBondContact N-O 3.37Å; E244-G246 VanDerWaalsContact C-N 3.27Å; E244-G246 PolarHBondContact O-N 3.4Å
247	R	95.5	Very high	93.7	Very high	27 Å²	27	72.4 Å²	72.4	10%	0.102	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	164.8	-175.6	78.4	-165.5	-172.8	-91	26.5	113.2	E230 P231 V239 K241	E230-R247 VanDerWaalsContact C-CZ 3.49Å; E230-R247 WeakPolarHBondContact O-CD 3.44Å; E230-R247 PolarHBondContact O-NE 2.88Å; E230-R247 PolarHBondContact O-NH2 3.31Å; E230-R247 IonicContact OE1-NH1 2.86Å; E230-R247 PolarHBondContact OE1-NH1 2.03Å; E230-R247 IonicContact OE2-NH1 3.27Å; E230-R247 PolarHBondContact OE2-NH1 2.7Å; P231-R247 PolarHBondContact O-NH2 3.34Å; V239-R247 CarbonylContact O-C 3.54Å; V239-R247 VanDerWaalsContact O-CA 3.29Å; V239-R247 WeakPolarHBondContact O-CA 3.35Å; K241-R247 WeakPolarHBondContact CE-O 3.44Å
248	I	96.1	Very high	93.4	Very high	49 Å²	49	70.3 Å²	70.3	25%	0.251	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	134.9	167.4	-64.1	169.5	0	0	0	107.7	V239 K241 L250 E255	V239-I248 PolarHBondContact N-O 3.11Å; V239-I248 PolarHBondContact O-N 2.82Å; K241-I248 HydrophobicContact CD-CG1 4.32Å; K241-I248 HydrophobicContact CG-CD1 4.01Å; K241-I248 HydrophobicContact CG-CG1 3.82Å; I248-L250 HydrophobicContact CG2-CD2 3.64Å; I248-L250 HydrophobicContact CG2-CG 4.17Å; I248-E255 HydrophobicContact CG2-CB 3.94Å; I248-E255 HydrophobicContact CG2-CG 3.85Å
249	C	97.4	Very high	93.3	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	122.5	176.1	-61.5	0	0	0	0	110	C232 A236 E255 C259 Y260	C232-C249 VanDerWaalsContact CA-SG 3.59Å; C232-C249 HydrophobicContact CB-CB 3.72Å; C232-C249 WeakPolarHBondContact CB-SG 3.39Å; C232-C249 WeakPolarHBondContact SG-CA 3.48Å; C232-C249 WeakPolarHBondContact SG-CB 3.28Å; C232-C249 CovalentContact SG-SG 2.03Å; C232-C249 PolarHBondContact SG-SG 3.25Å; A236-C249 HydrophobicContact CB-CB 4.5Å; C249-E255 WeakPolarHBondContact O-CA 3.25Å; C249-C259 HydrophobicContact CB-CB 3.59Å; C249-C259 WeakPolarHBondContact CB-O 3.2Å; C249-C259 WeakPolarHBondContact O-CB 3.27Å; C249-Y260 HydrophobicContact CB-CD1 4.31Å; C249-Y260 HydrophobicContact CB-CD2 4.31Å; C249-Y260 HydrophobicContact CB-CE1 4.08Å; C249-Y260 HydrophobicContact CB-CE2 4.07Å; C249-Y260 HydrophobicContact CB-CG 4.42Å; C249-Y260 PolarHBondContact N-OH 3.18Å
250	L	97.1	Very high	93.2	Very high	45 Å²	45	68.1 Å²	68.1	24%	0.236	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	126.3	-174.7	-58.2	176.5	0	0	0	111.7	A236 T237 V239 I248 Q254 E255	A236-L250 WeakPolarHBondContact CA-O 3.2Å; T237-L250 PolarHBondContact N-O 2.9Å; T237-L250 PolarHBondContact O-N 3.43Å; V239-L250 HydrophobicContact CG2-CD1 3.92Å; I248-L250 HydrophobicContact CG2-CD2 3.64Å; I248-L250 HydrophobicContact CG2-CG 4.17Å; L250-Q254 WeakPolarHBondContact CA-O 3.34Å; L250-E255 HydrophobicContact CD2-CB 4.09Å
251	C	92.1	Very high	93	Very high	5 Å²	5	69.3 Å²	69.3	3%	0.034	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.7	169.3	-54.2	0	0	0	0	108.3	G253 Q254 C259	C251-G253 PolarHBondContact O-N 3.38Å; C251-G253 VanDerWaalsContact O-N 3.14Å; C251-Q254 PolarHBondContact N-O 3.22Å; C251-Q254 PolarHBondContact O-N 2.75Å; C251-C259 VanDerWaalsContact CA-SG 3.58Å; C251-C259 HydrophobicContact CB-CB 4.37Å; C251-C259 WeakPolarHBondContact CB-SG 3.26Å; C251-C259 PolarHBondContact N-SG 3.42Å; C251-C259 WeakPolarHBondContact SG-CA 3.43Å; C251-C259 WeakPolarHBondContact SG-CB 3.5Å; C251-C259 CovalentContact SG-SG 2.03Å; C251-C259 PolarHBondContact SG-SG 3.16Å
252	N	91	Very high	92.7	Very high	168 Å²	168	73.8 Å²	73.8	90%	0.898	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	37.7	-175.9	-58.6	-30.8	0	0	0	112.6	Q254	N252-Q254 PolarHBondContact O-N 3.37Å
253	G	93.3	Very high	92.8	Very high	63 Å²	63	70.3 Å²	70.3	65%	0.649	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	3.6	178.8	0	0	0	0	0	116.1	C251	C251-G253 PolarHBondContact O-N 3.38Å; C251-G253 VanDerWaalsContact O-N 3.14Å
254	Q	94.9	Very high	92.9	Very high	121 Å²	121	68 Å²	68	57%	0.565	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	142.1	179	-66.1	-176.1	-20.4	0	0	111.9	L250 C251 N252 K256	L250-Q254 WeakPolarHBondContact CA-O 3.34Å; C251-Q254 PolarHBondContact N-O 3.22Å; C251-Q254 PolarHBondContact O-N 2.75Å; N252-Q254 PolarHBondContact O-N 3.37Å; Q254-K256 HydrophobicContact CB-CG 4.46Å; Q254-K256 PolarHBondContact O-N 2.83Å
255	E	95	Very high	93	Very high	109 Å²	109	62.8 Å²	62.8	51%	0.509	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	117.3	171.4	-174.1	179.6	-176.2	0	0	109.3	I248 C249 L250 Y260	I248-E255 HydrophobicContact CG2-CB 3.94Å; I248-E255 HydrophobicContact CG2-CG 3.85Å; C249-E255 WeakPolarHBondContact O-CA 3.25Å; L250-E255 HydrophobicContact CD2-CB 4.09Å; E255-Y260 HydrophobicContact CG-CE2 4.22Å; E255-Y260 PolarHBondContact OE1-OH 3.05Å
256	K	92.1	Very high	93.3	Very high	71 Å²	71	59.6 Å²	59.6	31%	0.309	32%	0.32	S	S	.	.			trans	-136.8	153.9	177.9	-66.1	179.1	-178.9	177.8	0	109.9	Q254 E258 C259 Y260	Q254-K256 HydrophobicContact CB-CG 4.46Å; Q254-K256 PolarHBondContact O-N 2.83Å; K256-E258 HydrophobicContact CB-CG 3.86Å; K256-E258 HydrophobicContact CD-CG 4.3Å; K256-E258 WeakPolarHBondContact CD-OE1 3.45Å; K256-E258 IonicContact NZ-OE1 2.93Å; K256-E258 PolarHBondContact NZ-OE1 3Å; K256-E258 PolarHBondContact O-N 3.01Å; K256-E258 VanDerWaalsContact O-N 3.16Å; K256-C259 VanDerWaalsContact O-CB 3.29Å; K256-C259 WeakPolarHBondContact O-CB 3.4Å; K256-C259 PolarHBondContact O-N 2.84Å; K256-C259 PolarHBondContact O-SG 3.45Å; K256-C259 VanDerWaalsContact O-SG 3.36Å; K256-Y260 WeakPolarHBondContact O-CD2 3.49Å
257	P	91.5	Very high	93.3	Very high	89 Å²	89	64.8 Å²	64.8	58%	0.578	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-55.4	-33.7	177.3	-26.9	36	0	0	0	113.5	C259 Y260 Y263	P257-C259 PolarHBondContact O-N 3.21Å; P257-Y260 PolarHBondContact O-N 3.12Å; P257-Y260 VanDerWaalsContact O-N 3.17Å; P257-Y263 HydrophobicContact CB-CD2 3.86Å; P257-Y263 HydrophobicContact CB-CE2 3.64Å; P257-Y263 WeakPolarHBondContact O-CB 3.04Å; P257-Y263 WeakPolarHBondContact O-CD2 3.3Å
258	E	90.5	Very high	93.1	Very high	51 Å²	51	68 Å²	68	24%	0.238	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-63.2	-19	178.3	67.2	-161.4	-169	0	0	114.8	H235 K256 Y260 Y263 E285	H235-E258 PolarHBondContact NE2-O 2.8Å; K256-E258 HydrophobicContact CB-CG 3.86Å; K256-E258 HydrophobicContact CD-CG 4.3Å; K256-E258 WeakPolarHBondContact CD-OE1 3.45Å; K256-E258 IonicContact NZ-OE1 2.93Å; K256-E258 PolarHBondContact NZ-OE1 3Å; K256-E258 PolarHBondContact O-N 3.01Å; K256-E258 VanDerWaalsContact O-N 3.16Å; E258-Y260 VanDerWaalsContact C-N 3.28Å; E258-Y260 PolarHBondContact O-N 3.42Å; E258-Y263 HydrophobicContact CB-CD1 3.67Å; E258-Y263 HydrophobicContact CB-CE1 3.66Å; E258-Y263 HydrophobicContact CB-CG 4.3Å; E258-E285 HydrophobicContact CB-CB 4.34Å
259	C	94.6	Very high	93	Very high	0 Å²	0	74 Å²	74	0%	0	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-79.6	-12.9	178.5	-48.8	0	0	0	0	113.4	A233 A236 C249 C251 K256 P257	A233-C259 WeakPolarHBondContact CB-O 3.31Å; A233-C259 PolarHBondContact N-O 3.32Å; A236-C259 HydrophobicContact CB-CB 3.85Å; C249-C259 HydrophobicContact CB-CB 3.59Å; C249-C259 WeakPolarHBondContact CB-O 3.2Å; C249-C259 WeakPolarHBondContact O-CB 3.27Å; C251-C259 VanDerWaalsContact CA-SG 3.58Å; C251-C259 HydrophobicContact CB-CB 4.37Å; C251-C259 WeakPolarHBondContact CB-SG 3.26Å; C251-C259 PolarHBondContact N-SG 3.42Å; C251-C259 WeakPolarHBondContact SG-CA 3.43Å; C251-C259 WeakPolarHBondContact SG-CB 3.5Å; C251-C259 CovalentContact SG-SG 2.03Å; C251-C259 PolarHBondContact SG-SG 3.16Å; K256-C259 VanDerWaalsContact O-CB 3.29Å; K256-C259 WeakPolarHBondContact O-CB 3.4Å; K256-C259 PolarHBondContact O-N 2.84Å; K256-C259 PolarHBondContact O-SG 3.45Å; K256-C259 VanDerWaalsContact O-SG 3.36Å; P257-C259 PolarHBondContact O-N 3.21Å
260	Y	94.3	Very high	92.9	Very high	63 Å²	63	74.6 Å²	74.6	25%	0.247	40%	0.4	C	S	.	.	S	Bend	trans	-90.6	146.9	-179.1	-70.5	-89.2	0	0	0	110.8	C249 E255 K256 P257 E258 Y263	C249-Y260 HydrophobicContact CB-CD1 4.31Å; C249-Y260 HydrophobicContact CB-CD2 4.31Å; C249-Y260 HydrophobicContact CB-CE1 4.08Å; C249-Y260 HydrophobicContact CB-CE2 4.07Å; C249-Y260 HydrophobicContact CB-CG 4.42Å; C249-Y260 PolarHBondContact N-OH 3.18Å; E255-Y260 HydrophobicContact CG-CE2 4.22Å; E255-Y260 PolarHBondContact OE1-OH 3.05Å; K256-Y260 WeakPolarHBondContact O-CD2 3.49Å; P257-Y260 PolarHBondContact O-N 3.12Å; P257-Y260 VanDerWaalsContact O-N 3.17Å; E258-Y260 VanDerWaalsContact C-N 3.28Å; E258-Y260 PolarHBondContact O-N 3.42Å; Y260-Y263 WeakPolarHBondContact O-CB 3.29Å; Y260-Y263 PolarHBondContact O-N 2.03Å
261	P	91.4	Very high	92.9	Very high	55 Å²	55	73.2 Å²	73.2	36%	0.357	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	150.9	-179.9	28.1	-36.2	0	0	0	111.1	Y263	P261-Y263 PolarHBondContact O-N 3.37Å; P261-Y263 VanDerWaalsContact O-N 3.16Å
262	N	88.9	Confident	93.1	Very high	161 Å²	161	77.7 Å²	77.7	86%	0.861	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	16.4	-178.4	-49.2	-50.7	0	0	0	114.6	N264	N262-N264 PolarHBondContact O-N 2.81Å
263	Y	91.6	Very high	93.3	Very high	88 Å²	88	73 Å²	73	35%	0.345	39%	0.389	S	S	.	.			trans	-61.5	124.5	170.7	176.3	-102.7	0	0	0	110.1	P257 E258 Y260 P261 P265 E285	P257-Y263 HydrophobicContact CB-CD2 3.86Å; P257-Y263 HydrophobicContact CB-CE2 3.64Å; P257-Y263 WeakPolarHBondContact O-CB 3.04Å; P257-Y263 WeakPolarHBondContact O-CD2 3.3Å; E258-Y263 HydrophobicContact CB-CD1 3.67Å; E258-Y263 HydrophobicContact CB-CE1 3.66Å; E258-Y263 HydrophobicContact CB-CG 4.3Å; Y260-Y263 WeakPolarHBondContact O-CB 3.29Å; Y260-Y263 PolarHBondContact O-N 2.03Å; P261-Y263 PolarHBondContact O-N 3.37Å; P261-Y263 VanDerWaalsContact O-N 3.16Å; Y263-P265 HydrophobicContact CE1-CB 3.81Å; Y263-P265 HydrophobicContact CE1-CG 4.17Å; Y263-E285 WeakPolarHBondContact CE1-O 3.35Å
264	N	92.9	Very high	93.3	Very high	54 Å²	54	73.2 Å²	73.2	29%	0.289	39%	0.392	S	S	.	.			trans	-123.4	111.7	173.1	177.6	-11.4	0	0	0	109.1	N262 C266 D267 L279	N262-N264 PolarHBondContact O-N 2.81Å; N264-C266 PolarHBondContact O-N 3.33Å; N264-C266 VanDerWaalsContact O-N 3.15Å; N264-C266 WeakPolarHBondContact OD1-CB 3.42Å; N264-C266 PolarHBondContact OD1-N 3.48Å; N264-D267 HydrophobicContact CB-CB 4.5Å; N264-D267 WeakPolarHBondContact CB-OD2 3.5Å; N264-D267 PolarHBondContact ND2-OD1 3.38Å; N264-D267 PolarHBondContact O-N 3.43Å; N264-D267 VanDerWaalsContact O-N 3.15Å; N264-L279 WeakPolarHBondContact OD1-CD2 3.5Å
265	P	91.3	Very high	93.4	Very high	1 Å²	1	68.1 Å²	68.1	1%	0.006	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.2	-177.9	22.9	-31.8	0	0	0	113.3	Y263 S268 P270 L279 N284 S286 F287	Y263-P265 HydrophobicContact CE1-CB 3.81Å; Y263-P265 HydrophobicContact CE1-CG 4.17Å; P265-S268 PolarHBondContact O-OG 3.34Å; P265-S268 VanDerWaalsContact O-OG 3.13Å; P265-P270 WeakPolarHBondContact O-CD 3.03Å; P265-L279 HydrophobicContact CG-CD2 3.75Å; P265-N284 WeakPolarHBondContact CD-O 3.07Å; P265-S286 VanDerWaalsContact CG-O 3.23Å; P265-S286 WeakPolarHBondContact CG-O 3.21Å; P265-F287 HydrophobicContact CB-CB 4.03Å; P265-F287 HydrophobicContact CB-CD1 3.79Å; P265-F287 HydrophobicContact CB-CG 4.31Å; P265-F287 HydrophobicContact CG-CB 4.09Å
266	C	94.9	Very high	93.4	Very high	24 Å²	24	69.6 Å²	69.6	16%	0.162	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-16.2	178.8	-68.1	0	0	0	0	114.3	N264 S268 K269 C277	N264-C266 PolarHBondContact O-N 3.33Å; N264-C266 VanDerWaalsContact O-N 3.15Å; N264-C266 WeakPolarHBondContact OD1-CB 3.42Å; N264-C266 PolarHBondContact OD1-N 3.48Å; C266-S268 PolarHBondContact O-N 3.32Å; C266-K269 WeakPolarHBondContact O-CA 3.27Å; C266-K269 PolarHBondContact O-N 3.45Å; C266-C277 WeakPolarHBondContact CA-SG 3.14Å; C266-C277 HydrophobicContact CB-CB 3.77Å; C266-C277 WeakPolarHBondContact CB-SG 3.15Å; C266-C277 WeakPolarHBondContact SG-CB 3.47Å; C266-C277 CovalentContact SG-SG 2.04Å; C266-C277 PolarHBondContact SG-SG 3.3Å
267	D	93.6	Very high	93.7	Very high	117 Å²	117	68 Å²	68	63%	0.626	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-31.8	-178.6	-75.2	-6.7	0	0	0	112.3	N264 K269	N264-D267 HydrophobicContact CB-CB 4.5Å; N264-D267 WeakPolarHBondContact CB-OD2 3.5Å; N264-D267 PolarHBondContact ND2-OD1 3.38Å; N264-D267 PolarHBondContact O-N 3.43Å; N264-D267 VanDerWaalsContact O-N 3.15Å; D267-K269 PolarHBondContact O-N 3.41Å
268	S	91.5	Very high	93.9	Very high	93 Å²	93	69.9 Å²	69.9	65%	0.65	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-3.2	174.5	69	0	0	0	0	114	P265 C266	P265-S268 PolarHBondContact O-OG 3.34Å; P265-S268 VanDerWaalsContact O-OG 3.13Å; C266-S268 PolarHBondContact O-N 3.32Å
269	K	94	Very high	94.1	Very high	177 Å²	177	71 Å²	71	77%	0.77	38%	0.379	S	S	*	.			trans	48.6	59.8	-172.9	-59.7	-180	-177.6	178.3	0	111.8	C266 D267 C271	C266-K269 WeakPolarHBondContact O-CA 3.27Å; C266-K269 PolarHBondContact O-N 3.45Å; D267-K269 PolarHBondContact O-N 3.41Å; K269-C271 VanDerWaalsContact C-N 3.27Å; K269-C271 PolarHBondContact O-N 3.3Å
270	P	95.4	Very high	94	Very high	11 Å²	11	72.3 Å²	72.3	7%	0.071	39%	0.389	C	S	.	.			trans	-71.3	-21.9	-171.9	30.7	-36.9	0	0	0	113.6	P265 F287 K299	P265-P270 WeakPolarHBondContact O-CD 3.03Å; P270-F287 HydrophobicContact CB-CD2 4.13Å; P270-F287 HydrophobicContact CB-CE1 4.16Å; P270-F287 HydrophobicContact CB-CE2 3.56Å; P270-F287 HydrophobicContact CB-CZ 3.57Å; P270-F287 HydrophobicContact CG-CD1 4.23Å; P270-F287 HydrophobicContact CG-CD2 3.55Å; P270-F287 HydrophobicContact CG-CE1 4.2Å; P270-F287 HydrophobicContact CG-CE2 3.53Å; P270-F287 HydrophobicContact CG-CG 3.92Å; P270-F287 HydrophobicContact CG-CZ 3.87Å; P270-K299 WeakPolarHBondContact O-CB 3.33Å
271	C	96.9	Very high	93.6	Very high	17 Å²	17	71.4 Å²	71.4	12%	0.115	40%	0.399	C	S	.	.			trans	-81.4	119	178.8	-51.8	0	0	0	0	110.7	K269 G275 C277 C289	K269-C271 VanDerWaalsContact C-N 3.27Å; K269-C271 PolarHBondContact O-N 3.3Å; C271-G275 WeakPolarHBondContact CB-O 3.35Å; C271-C277 WeakPolarHBondContact SG-CA 3.23Å; C271-C277 VanDerWaalsContact SG-CB 3.52Å; C271-C289 WeakPolarHBondContact CA-SG 3.41Å; C271-C289 HydrophobicContact CB-CB 3.76Å; C271-C289 WeakPolarHBondContact CB-SG 3.46Å; C271-C289 WeakPolarHBondContact SG-CA 3.29Å; C271-C289 WeakPolarHBondContact SG-CB 3.37Å; C271-C289 CovalentContact SG-SG 2.03Å; C271-C289 PolarHBondContact SG-SG 3.39Å
272	Q	95.7	Very high	93.4	Very high	99 Å²	99	76.1 Å²	76.1	46%	0.463	42%	0.416	S	S	.	.			trans	-92.2	173.1	-178.7	-60.3	-177.7	-2.9	0	0	111.4	G274 G275 K299 C300 N301	Q272-G274 VanDerWaalsContact C-N 3.3Å; Q272-G274 PolarHBondContact O-N 3.41Å; Q272-G275 PolarHBondContact O-N 2.88Å; Q272-K299 PolarHBondContact N-O 3.21Å; Q272-C300 WeakPolarHBondContact O-CB 3.44Å; Q272-N301 VanDerWaalsContact OE1-CB 3.28Å
273	N	94.7	Very high	93.3	Very high	68 Å²	68	74.3 Å²	74.3	36%	0.364	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	39.3	171.3	-57.3	-55.2	0	0	0	115.3	G275 T292 W295 C300	N273-G275 VanDerWaalsContact C-N 3.27Å; N273-G275 PolarHBondContact O-N 2.83Å; N273-T292 PolarHBondContact O-OG1 2.92Å; N273-W295 HydrophobicContact CB-CB 4.43Å; N273-W295 HydrophobicContact CB-CD2 3.57Å; N273-W295 HydrophobicContact CB-CE3 4.27Å; N273-W295 HydrophobicContact CB-CG 3.61Å; N273-W295 HydrophobicContact CB-CZ2 4.13Å; N273-W295 VanDerWaalsContact CG-CD2 3.45Å; N273-W295 VanDerWaalsContact CG-CZ2 3.45Å; N273-W295 VanDerWaalsContact ND2-CD2 3.31Å; N273-W295 WeakPolarHBondContact ND2-CZ3 3.15Å; N273-W295 WeakPolarHBondContact OD1-CZ2 3.22Å; N273-C300 PolarHBondContact ND2-O 3.44Å
274	G	93.4	Very high	93.1	Very high	68 Å²	68	74.1 Å²	74.1	70%	0.701	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.6	12.4	-179.4	0	0	0	0	0	114.2	Q272	Q272-G274 VanDerWaalsContact C-N 3.3Å; Q272-G274 PolarHBondContact O-N 3.41Å
275	G	96.5	Very high	92.8	Very high	14 Å²	14	73.8 Å²	73.8	14%	0.144	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-65	139.6	176.2	0	0	0	0	0	112.6	C271 Q272 N273 H290	C271-G275 WeakPolarHBondContact CB-O 3.35Å; Q272-G275 PolarHBondContact O-N 2.88Å; N273-G275 VanDerWaalsContact C-N 3.27Å; N273-G275 PolarHBondContact O-N 2.83Å; G275-H290 CarbonylContact C-O 3.34Å; G275-H290 WeakPolarHBondContact CA-O 3.49Å
276	Q	96.6	Very high	92.7	Very high	141 Å²	141	76 Å²	76	66%	0.659	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	123.3	178	-170.5	178.5	12.3	0	0	110.4	H290	Q276-H290 HydrophobicContact CB-CB 4.32Å; Q276-H290 PolarHBondContact N-O 3.25Å; Q276-H290 PolarHBondContact O-N 3.03Å
277	C	97.3	Very high	92.7	Very high	36 Å²	36	76.4 Å²	76.4	24%	0.243	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	134.1	176.2	-164.8	0	0	0	0	110.8	C266 C271	C266-C277 WeakPolarHBondContact CA-SG 3.14Å; C266-C277 HydrophobicContact CB-CB 3.77Å; C266-C277 WeakPolarHBondContact CB-SG 3.15Å; C266-C277 WeakPolarHBondContact SG-CB 3.47Å; C266-C277 CovalentContact SG-SG 2.04Å; C266-C277 PolarHBondContact SG-SG 3.3Å; C271-C277 WeakPolarHBondContact SG-CA 3.23Å; C271-C277 VanDerWaalsContact SG-CB 3.52Å
278	R	96.5	Very high	92.9	Very high	129 Å²	129	74.9 Å²	74.9	49%	0.487	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	144.7	167.5	73.5	-176.2	98.2	169.8	-0.6	109.7	F287 I288	R278-F287 WeakPolarHBondContact O-CA 3.24Å; R278-I288 VanDerWaalsContact CD-CG2 3.46Å; R278-I288 HydrophobicContact CG-CB 4.45Å; R278-I288 HydrophobicContact CG-CG2 3.15Å; R278-I288 WeakPolarHBondContact CG-O 3.41Å; R278-I288 PolarHBondContact N-O 2.99Å; R278-I288 PolarHBondContact O-N 3.5Å
279	L	94.4	Very high	93.2	Very high	75 Å²	75	71.2 Å²	71.2	39%	0.393	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	146	176.3	-62.3	175.2	0	0	0	110.6	N264 P265 N284	N264-L279 WeakPolarHBondContact OD1-CD2 3.5Å; P265-L279 HydrophobicContact CG-CD2 3.75Å; L279-N284 HydrophobicContact CB-CB 4.07Å; L279-N284 HydrophobicContact CD1-CB 4.1Å; L279-N284 HydrophobicContact CG-CB 4.49Å
280	A	91.6	Very high	93.3	Very high	27 Å²	27	68 Å²	68	22%	0.223	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	168.8	179.2	0	0	0	0	0	110.3	N284 E285 S286 I288	A280-N284 CarbonylContact O-C 3.52Å; A280-N284 WeakPolarHBondContact O-CA 3.43Å; A280-E285 PolarHBondContact O-N 2.92Å; A280-S286 WeakPolarHBondContact CB-OG 3.43Å; A280-S286 PolarHBondContact N-O 3.49Å; A280-S286 CarbonylContact O-C 3.57Å; A280-S286 WeakPolarHBondContact O-CA 3.01Å; A280-S286 PolarHBondContact O-N 3.33Å; A280-S286 PolarHBondContact O-OG 3.03Å; A280-I288 HydrophobicContact CB-CG2 4.24Å
281	G	87.3	Confident	93.3	Very high	44 Å²	44	68.9 Å²	68.9	45%	0.454	37%	0.373	S	S	.	.	S	Bend	trans	94.4	169.2	-174.1	0	0	0	0	0	111.9	Y283 S286	G281-Y283 VanDerWaalsContact C-N 3.32Å; G281-S286 PolarHBondContact N-OG 3.32Å
282	H	87.4	Confident	93.1	Very high	155 Å²	155	70.7 Å²	70.7	72%	0.718	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-30.7	-176.5	-177.5	-82.2	0	0	0	111.8	E285	H282-E285 PolarHBondContact N-OE2 2.94Å
283	Y	85.3	Confident	92.6	Very high	122 Å²	122	72.5 Å²	72.5	48%	0.478	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	18.8	-178	-58.8	-78.5	0	0	0	112.3	H235 G281 E285	H235-Y283 HydrophobicContact CB-CD1 4.34Å; H235-Y283 HydrophobicContact CB-CD2 3.67Å; H235-Y283 HydrophobicContact CB-CE1 4.26Å; H235-Y283 HydrophobicContact CB-CE2 3.59Å; H235-Y283 HydrophobicContact CB-CG 4.05Å; H235-Y283 AromaticContact CG-CD2 3.87Å; H235-Y283 AromaticContact ND1-CG 3.71Å; G281-Y283 VanDerWaalsContact C-N 3.32Å; Y283-E285 WeakPolarHBondContact CA-OE2 3.07Å; Y283-E285 WeakPolarHBondContact CB-OE2 3.13Å; Y283-E285 PolarHBondContact N-OE2 2.96Å; Y283-E285 PolarHBondContact O-N 3.03Å
284	N	88.8	Confident	92.3	Very high	85 Å²	85	73.4 Å²	73.4	46%	0.455	39%	0.394	S	S	.	.	S	Bend	trans	55.6	26.8	-174.6	-63.6	-43.7	0	0	0	114.4	P265 L279 A280 S286	P265-N284 WeakPolarHBondContact CD-O 3.07Å; L279-N284 HydrophobicContact CB-CB 4.07Å; L279-N284 HydrophobicContact CD1-CB 4.1Å; L279-N284 HydrophobicContact CG-CB 4.49Å; A280-N284 CarbonylContact O-C 3.52Å; A280-N284 WeakPolarHBondContact O-CA 3.43Å; N284-S286 VanDerWaalsContact C-N 3.31Å
285	E	85.3	Confident	92.3	Very high	47 Å²	47	72.7 Å²	72.7	22%	0.22	37%	0.37	C	S	.	.			trans	-76.8	-17.1	-178.3	70.8	-82.6	-156.2	0	0	113	E258 Y263 A280 H282 Y283	E258-E285 HydrophobicContact CB-CB 4.34Å; Y263-E285 WeakPolarHBondContact CE1-O 3.35Å; A280-E285 PolarHBondContact O-N 2.92Å; H282-E285 PolarHBondContact N-OE2 2.94Å; Y283-E285 WeakPolarHBondContact CA-OE2 3.07Å; Y283-E285 WeakPolarHBondContact CB-OE2 3.13Å; Y283-E285 PolarHBondContact N-OE2 2.96Å; Y283-E285 PolarHBondContact O-N 3.03Å
286	S	90.6	Very high	92	Very high	47 Å²	47	75 Å²	75	33%	0.329	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	174	-179	74.2	0	0	0	0	112	P265 A280 G281 N284	P265-S286 VanDerWaalsContact CG-O 3.23Å; P265-S286 WeakPolarHBondContact CG-O 3.21Å; A280-S286 WeakPolarHBondContact CB-OG 3.43Å; A280-S286 PolarHBondContact N-O 3.49Å; A280-S286 CarbonylContact O-C 3.57Å; A280-S286 WeakPolarHBondContact O-CA 3.01Å; A280-S286 PolarHBondContact O-N 3.33Å; A280-S286 PolarHBondContact O-OG 3.03Å; G281-S286 PolarHBondContact N-OG 3.32Å; N284-S286 VanDerWaalsContact C-N 3.31Å
287	F	94.5	Very high	91.9	Very high	33 Å²	33	69.5 Å²	69.5	15%	0.145	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	153.2	179.2	69.3	-80.3	0	0	0	110.9	P265 P270 R278 H298 K299	P265-F287 HydrophobicContact CB-CB 4.03Å; P265-F287 HydrophobicContact CB-CD1 3.79Å; P265-F287 HydrophobicContact CB-CG 4.31Å; P265-F287 HydrophobicContact CG-CB 4.09Å; P270-F287 HydrophobicContact CB-CD2 4.13Å; P270-F287 HydrophobicContact CB-CE1 4.16Å; P270-F287 HydrophobicContact CB-CE2 3.56Å; P270-F287 HydrophobicContact CB-CZ 3.57Å; P270-F287 HydrophobicContact CG-CD1 4.23Å; P270-F287 HydrophobicContact CG-CD2 3.55Å; P270-F287 HydrophobicContact CG-CE1 4.2Å; P270-F287 HydrophobicContact CG-CE2 3.53Å; P270-F287 HydrophobicContact CG-CG 3.92Å; P270-F287 HydrophobicContact CG-CZ 3.87Å; R278-F287 WeakPolarHBondContact O-CA 3.24Å; F287-H298 AromaticContact CE1-CE1 3.82Å; F287-H298 AromaticContact CE2-CE1 3.44Å; F287-H298 VanDerWaalsContact CE2-CE1 3.44Å; F287-H298 WeakPolarHBondContact CE2-CE1 3.33Å; F287-H298 AromaticContact CE2-ND1 3.52Å; F287-H298 AromaticContact CZ-CE1 3.32Å; F287-H298 WeakPolarHBondContact CZ-CE1 3.47Å; F287-H298 AromaticContact CZ-ND1 3.54Å; F287-K299 HydrophobicContact CE2-CG 4.26Å; F287-K299 HydrophobicContact CZ-CG 4.2Å
288	I	96.5	Very high	91.8	Very high	85 Å²	85	73.7 Å²	73.7	44%	0.436	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	135.5	167.7	-174.5	174.1	0	0	0	109.1	R278 A280	R278-I288 VanDerWaalsContact CD-CG2 3.46Å; R278-I288 HydrophobicContact CG-CB 4.45Å; R278-I288 HydrophobicContact CG-CG2 3.15Å; R278-I288 WeakPolarHBondContact CG-O 3.41Å; R278-I288 PolarHBondContact N-O 2.99Å; R278-I288 PolarHBondContact O-N 3.5Å; A280-I288 HydrophobicContact CB-CG2 4.24Å
289	C	97.7	Very high	91.8	Very high	16 Å²	16	72.2 Å²	72.2	11%	0.108	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	131.6	179.3	-65.6	0	0	0	0	111	C271 H298 C300	C271-C289 WeakPolarHBondContact CA-SG 3.41Å; C271-C289 HydrophobicContact CB-CB 3.76Å; C271-C289 WeakPolarHBondContact CB-SG 3.46Å; C271-C289 WeakPolarHBondContact SG-CA 3.29Å; C271-C289 WeakPolarHBondContact SG-CB 3.37Å; C271-C289 CovalentContact SG-SG 2.03Å; C271-C289 PolarHBondContact SG-SG 3.39Å; C289-H298 WeakPolarHBondContact CB-O 3.26Å; C289-H298 PolarHBondContact SG-O 3.12Å; C289-C300 WeakPolarHBondContact CB-SG 3.29Å
290	H	96.9	Very high	91.9	Very high	108 Å²	108	68.6 Å²	68.6	50%	0.5	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	106	166.9	-164.5	-143.4	0	0	0	109.2	G275 Q276	G275-H290 CarbonylContact C-O 3.34Å; G275-H290 WeakPolarHBondContact CA-O 3.49Å; Q276-H290 HydrophobicContact CB-CB 4.32Å; Q276-H290 PolarHBondContact N-O 3.25Å; Q276-H290 PolarHBondContact O-N 3.03Å
291	C	95.2	Very high	92	Very high	31 Å²	31	71 Å²	71	21%	0.209	37%	0.366	C	S	.	.			trans	-79.8	148.7	-174.9	-53.3	0	0	0	0	112.3	W295 C300	C291-W295 HydrophobicContact CB-CB 4.38Å; C291-W295 VanDerWaalsContact CB-O 3.29Å; C291-W295 WeakPolarHBondContact CB-O 3.4Å; C291-C300 WeakPolarHBondContact CA-SG 2.98Å; C291-C300 HydrophobicContact CB-CB 3.75Å; C291-C300 WeakPolarHBondContact CB-SG 3.05Å; C291-C300 WeakPolarHBondContact SG-CA 3.49Å; C291-C300 WeakPolarHBondContact SG-CB 3.44Å; C291-C300 CovalentContact SG-SG 2.03Å; C291-C300 PolarHBondContact SG-SG 3.44Å
292	T	92.9	Very high	92.2	Very high	55 Å²	55	74.2 Å²	74.2	34%	0.337	37%	0.369	S	S	.	.			trans	-67.4	162.7	167.6	52	0	0	0	0	110.4	N273 Q294 W295	N273-T292 PolarHBondContact O-OG1 2.92Å; T292-Q294 PolarHBondContact O-N 3Å; T292-W295 PolarHBondContact O-N 3.3Å; T292-W295 VanDerWaalsContact OG1-CD1 3.27Å
293	E	86.2	Confident	92.3	Very high	137 Å²	137	71.8 Å²	71.8	64%	0.64	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-34.9	-169.4	-170.8	177.8	-180	0	0	114.2	R304	E293-R304 PolarHBondContact O-NE 3.18Å; E293-R304 PolarHBondContact O-NH2 3.42Å
294	Q	87.3	Confident	92.4	Very high	86 Å²	86	69.8 Å²	69.8	40%	0.402	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-1.7	-175.2	-59.1	-179.5	-8	0	0	114.4	T292 R304 F348	T292-Q294 PolarHBondContact O-N 3Å; Q294-R304 PolarHBondContact O-N 3.27Å; Q294-F348 HydrophobicContact CB-CD2 4.28Å; Q294-F348 HydrophobicContact CB-CG 4.41Å; Q294-F348 HydrophobicContact CG-CB 3.84Å; Q294-F348 HydrophobicContact CG-CD1 4.1Å; Q294-F348 HydrophobicContact CG-CD2 4.14Å; Q294-F348 HydrophobicContact CG-CG 3.77Å
295	W	92.9	Very high	92.3	Very high	53 Å²	53	66.9 Å²	66.9	20%	0.201	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	155.2	-171.2	-62.4	91	0	0	0	112.5	N273 C291 T292 C300 E302 R303	N273-W295 HydrophobicContact CB-CB 4.43Å; N273-W295 HydrophobicContact CB-CD2 3.57Å; N273-W295 HydrophobicContact CB-CE3 4.27Å; N273-W295 HydrophobicContact CB-CG 3.61Å; N273-W295 HydrophobicContact CB-CZ2 4.13Å; N273-W295 VanDerWaalsContact CG-CD2 3.45Å; N273-W295 VanDerWaalsContact CG-CZ2 3.45Å; N273-W295 VanDerWaalsContact ND2-CD2 3.31Å; N273-W295 WeakPolarHBondContact ND2-CZ3 3.15Å; N273-W295 WeakPolarHBondContact OD1-CZ2 3.22Å; C291-W295 HydrophobicContact CB-CB 4.38Å; C291-W295 VanDerWaalsContact CB-O 3.29Å; C291-W295 WeakPolarHBondContact CB-O 3.4Å; T292-W295 PolarHBondContact O-N 3.3Å; T292-W295 VanDerWaalsContact OG1-CD1 3.27Å; W295-C300 HydrophobicContact CB-CB 4.29Å; W295-E302 CarbonylContact C-O 3.35Å; W295-E302 WeakPolarHBondContact CA-O 3.14Å; W295-R303 HydrophobicContact CE3-CB 4.38Å; W295-R303 HydrophobicContact CZ3-CB 4.26Å
296	T	91.8	Very high	92.4	Very high	63 Å²	63	64.9 Å²	64.9	39%	0.387	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	179.3	-178.3	-165.9	0	0	0	0	111.2	C300 N301 E302	T296-C300 CarbonylContact O-C 3.49Å; T296-C300 WeakPolarHBondContact O-CA 3.11Å; T296-N301 PolarHBondContact O-N 3.01Å; T296-E302 HydrophobicContact CG2-CB 3.86Å; T296-E302 PolarHBondContact N-O 3.39Å; T296-E302 PolarHBondContact O-N 3.41Å; T296-E302 VanDerWaalsContact O-N 3.13Å
297	G	93.7	Very high	92.2	Very high	25 Å²	25	63.4 Å²	63.4	26%	0.258	31%	0.313	S	S	.	.	S	Bend	trans	90.6	165.7	-175.9	0	0	0	0	0	113	K299 C300	G297-K299 PolarHBondContact O-N 3.44Å; G297-K299 VanDerWaalsContact O-N 3.1Å; G297-C300 PolarHBondContact O-N 3.34Å
298	H	94.5	Very high	91.7	Very high	125 Å²	125	68 Å²	68	58%	0.579	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-30.1	-175.2	-173.3	-67.2	0	0	0	113.2	F287 C289	F287-H298 AromaticContact CE1-CE1 3.82Å; F287-H298 AromaticContact CE2-CE1 3.44Å; F287-H298 VanDerWaalsContact CE2-CE1 3.44Å; F287-H298 WeakPolarHBondContact CE2-CE1 3.33Å; F287-H298 AromaticContact CE2-ND1 3.52Å; F287-H298 AromaticContact CZ-CE1 3.32Å; F287-H298 WeakPolarHBondContact CZ-CE1 3.47Å; F287-H298 AromaticContact CZ-ND1 3.54Å; C289-H298 WeakPolarHBondContact CB-O 3.26Å; C289-H298 PolarHBondContact SG-O 3.12Å
299	K	96.4	Very high	91.1	Very high	97 Å²	97	66.4 Å²	66.4	42%	0.422	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	11.1	179	-68.5	-173.4	177.8	-177.9	0	113.4	P270 Q272 F287 G297 N301	P270-K299 WeakPolarHBondContact O-CB 3.33Å; Q272-K299 PolarHBondContact N-O 3.21Å; F287-K299 HydrophobicContact CE2-CG 4.26Å; F287-K299 HydrophobicContact CZ-CG 4.2Å; G297-K299 PolarHBondContact O-N 3.44Å; G297-K299 VanDerWaalsContact O-N 3.1Å; K299-N301 PolarHBondContact O-N 3.35Å
300	C	96.1	Very high	90.3	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.334	C	S	.	.	S	Bend	trans	57.2	30.1	-175.4	-49.6	0	0	0	0	114	Q272 N273 C289 C291 W295 T296 G297	Q272-C300 WeakPolarHBondContact O-CB 3.44Å; N273-C300 PolarHBondContact ND2-O 3.44Å; C289-C300 WeakPolarHBondContact CB-SG 3.29Å; C291-C300 WeakPolarHBondContact CA-SG 2.98Å; C291-C300 HydrophobicContact CB-CB 3.75Å; C291-C300 WeakPolarHBondContact CB-SG 3.05Å; C291-C300 WeakPolarHBondContact SG-CA 3.49Å; C291-C300 WeakPolarHBondContact SG-CB 3.44Å; C291-C300 CovalentContact SG-SG 2.03Å; C291-C300 PolarHBondContact SG-SG 3.44Å; W295-C300 HydrophobicContact CB-CB 4.29Å; T296-C300 CarbonylContact O-C 3.49Å; T296-C300 WeakPolarHBondContact O-CA 3.11Å; G297-C300 PolarHBondContact O-N 3.34Å
301	N	94.5	Very high	89.6	Confident	78 Å²	78	63.4 Å²	63.4	42%	0.417	32%	0.317	S	S	.	.			trans	-95.1	-4.1	-176	63.9	-51.2	0	0	0	113.4	Q272 T296 K299	Q272-N301 VanDerWaalsContact OE1-CB 3.28Å; T296-N301 PolarHBondContact O-N 3.01Å; K299-N301 PolarHBondContact O-N 3.35Å
302	E	92	Very high	88.9	Confident	110 Å²	110	64 Å²	64	51%	0.514	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.9	179.6	-67.2	168.4	-157.6	0	0	109.2	W295 T296 R304	W295-E302 CarbonylContact C-O 3.35Å; W295-E302 WeakPolarHBondContact CA-O 3.14Å; T296-E302 HydrophobicContact CG2-CB 3.86Å; T296-E302 PolarHBondContact N-O 3.39Å; T296-E302 PolarHBondContact O-N 3.41Å; T296-E302 VanDerWaalsContact O-N 3.13Å; E302-R304 PolarHBondContact O-N 3.43Å
303	R	88.2	Confident	88.4	Confident	105 Å²	105	65 Å²	65	40%	0.396	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	132.1	175.6	-169.9	-177.2	-75.5	-161.6	-2.6	108.6	W295 H344 P345 I346	W295-R303 HydrophobicContact CE3-CB 4.38Å; W295-R303 HydrophobicContact CZ3-CB 4.26Å; R303-H344 PolarHBondContact NH1-O 2.99Å; R303-P345 VanDerWaalsContact NH1-C 3.28Å; R303-P345 PolarHBondContact NH1-O 3.48Å; R303-P345 PolarHBondContact NH2-O 3.44Å; R303-I346 PolarHBondContact NH1-O 3.45Å; R303-I346 VanDerWaalsContact NH1-O 3.13Å
304	R	88.9	Confident	87.9	Confident	79 Å²	79	60.6 Å²	60.6	30%	0.298	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-63.5	142.4	170.2	-170.6	-178.8	-61.6	-174.8	9.6	108.9	E293 Q294 E302 A306 E309 F348	E293-R304 PolarHBondContact O-NE 3.18Å; E293-R304 PolarHBondContact O-NH2 3.42Å; Q294-R304 PolarHBondContact O-N 3.27Å; E302-R304 PolarHBondContact O-N 3.43Å; R304-A306 PolarHBondContact O-N 3.24Å; R304-E309 WeakPolarHBondContact CD-OE2 3.28Å; R304-E309 IonicContact CZ-OE2 3.69Å; R304-E309 IonicContact NH1-OE2 2.65Å; R304-E309 PolarHBondContact NH1-OE2 3.19Å; R304-F348 HydrophobicContact CB-CE2 3.99Å; R304-F348 HydrophobicContact CB-CZ 4.4Å; R304-F348 HydrophobicContact CG-CE2 4.37Å; R304-F348 HydrophobicContact CG-CZ 4.4Å; R304-F348 VanDerWaalsContact O-CE2 3.32Å; R304-F348 WeakPolarHBondContact O-CE2 3.35Å
305	S	87.1	Confident	87.2	Confident	25 Å²	25	61.5 Å²	61.5	18%	0.175	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-78.5	120.8	172	58.5	0	0	0	0	110.2	C307 L308 E309 D343	S305-C307 PolarHBondContact O-N 3.11Å; S305-L308 PolarHBondContact O-N 2.82Å; S305-L308 WeakPolarHBondContact OG-CB 3.29Å; S305-L308 WeakPolarHBondContact OG-CD1 3.26Å; S305-L308 WeakPolarHBondContact OG-CG 3.48Å; S305-L308 PolarHBondContact OG-N 2.89Å; S305-E309 PolarHBondContact O-N 3.25Å; S305-D343 WeakPolarHBondContact CA-OD1 3.38Å; S305-D343 VanDerWaalsContact CA-OD2 3.25Å; S305-D343 WeakPolarHBondContact CA-OD2 3.16Å; S305-D343 WeakPolarHBondContact CB-OD2 3.49Å
306	A	86.5	Confident	86	Confident	4 Å²	4	67.9 Å²	67.9	3%	0.033	33%	0.334	C	S	.	.	H	α-helix	trans	-59.4	-34.5	170.1	0	0	0	0	0	110.8	R304 E309 E310 D343 F348 V350	R304-A306 PolarHBondContact O-N 3.24Å; A306-E309 PolarHBondContact O-N 2.03Å; A306-E310 WeakPolarHBondContact O-CB 3.42Å; A306-E310 WeakPolarHBondContact O-CG 3.35Å; A306-E310 PolarHBondContact O-N 2.92Å; A306-D343 WeakPolarHBondContact CA-OD1 3.45Å; A306-D343 PolarHBondContact N-OD1 2.04Å; A306-F348 HydrophobicContact CB-CD2 4.14Å; A306-F348 HydrophobicContact CB-CE2 4.03Å; A306-F348 HydrophobicContact CB-CZ 4.33Å; A306-V350 HydrophobicContact CB-CG2 3.93Å
307	C	86.8	Confident	84.7	Confident	17 Å²	17	72.8 Å²	72.8	12%	0.115	35%	0.352	C	S	.	.	H	α-helix	trans	-58.3	-47.6	176.2	-76.1	0	0	0	0	113.6	S305 A311 V334 C341 F342 D343	S305-C307 PolarHBondContact O-N 3.11Å; C307-A311 WeakPolarHBondContact O-CB 3.49Å; C307-A311 PolarHBondContact O-N 3.39Å; C307-V334 WeakPolarHBondContact O-CG2 3.19Å; C307-C341 VanDerWaalsContact CA-SG 3.53Å; C307-C341 HydrophobicContact CB-CB 3.95Å; C307-C341 WeakPolarHBondContact CB-SG 3.28Å; C307-C341 WeakPolarHBondContact SG-CB 3.42Å; C307-C341 CovalentContact SG-SG 2.04Å; C307-C341 PolarHBondContact SG-SG 3.04Å; C307-F342 PolarHBondContact SG-N 3.1Å; C307-F342 VanDerWaalsContact SG-N 3.43Å; C307-D343 PolarHBondContact N-OD1 2.98Å
308	L	83.8	Confident	83.3	Confident	129 Å²	129	76 Å²	76	68%	0.675	36%	0.364	S	S	*	.	H	α-helix	trans	-70.4	-37.5	179.2	-61.6	176.6	0	0	0	112	S305 A311 A312	S305-L308 PolarHBondContact O-N 2.82Å; S305-L308 WeakPolarHBondContact OG-CB 3.29Å; S305-L308 WeakPolarHBondContact OG-CD1 3.26Å; S305-L308 WeakPolarHBondContact OG-CG 3.48Å; S305-L308 PolarHBondContact OG-N 2.89Å; L308-A311 PolarHBondContact O-N 2.81Å; L308-A312 WeakPolarHBondContact O-CB 3.45Å; L308-A312 PolarHBondContact O-N 3.45Å
309	E	83	Confident	81.5	Confident	52 Å²	52	74.5 Å²	74.5	24%	0.243	36%	0.36	C	S	.	.	H	α-helix	trans	-65.7	-44.4	178.9	-171.4	68.9	-137.4	0	0	111.1	R304 S305 A306 A312 K313 F348	R304-E309 WeakPolarHBondContact CD-OE2 3.28Å; R304-E309 IonicContact CZ-OE2 3.69Å; R304-E309 IonicContact NH1-OE2 2.65Å; R304-E309 PolarHBondContact NH1-OE2 3.19Å; S305-E309 PolarHBondContact O-N 3.25Å; A306-E309 PolarHBondContact O-N 2.03Å; E309-A312 PolarHBondContact O-N 2.82Å; E309-K313 WeakPolarHBondContact O-CG 3.46Å; E309-K313 PolarHBondContact O-N 2.8Å; E309-F348 HydrophobicContact CB-CZ 4.49Å
310	E	82.7	Confident	79.5	Confident	44 Å²	44	77.9 Å²	77.9	21%	0.206	38%	0.382	C	S	.	.	H	α-helix	trans	-66.4	-36.7	175.2	-71.3	-62.7	121.4	0	0	111.9	A306 A312 K313 V314 V334 V350 R362	A306-E310 WeakPolarHBondContact O-CB 3.42Å; A306-E310 WeakPolarHBondContact O-CG 3.35Å; A306-E310 PolarHBondContact O-N 2.92Å; E310-A312 VanDerWaalsContact C-N 3.34Å; E310-A312 PolarHBondContact O-N 3.06Å; E310-K313 PolarHBondContact O-N 2.82Å; E310-K313 WeakPolarHBondContact OE1-CD 3.32Å; E310-K313 IonicContact OE1-NZ 3.77Å; E310-K313 PolarHBondContact OE1-NZ 3.33Å; E310-V314 VanDerWaalsContact O-CG2 3.31Å; E310-V314 WeakPolarHBondContact O-CG2 3.41Å; E310-V314 PolarHBondContact O-N 2.78Å; E310-V334 HydrophobicContact CB-CB 4.48Å; E310-V334 HydrophobicContact CB-CG1 3.74Å; E310-V334 HydrophobicContact CB-CG2 3.79Å; E310-V350 HydrophobicContact CB-CG2 4.05Å; E310-V350 HydrophobicContact CG-CG2 3.66Å; E310-R362 IonicContact OE2-CZ 3.35Å; E310-R362 IonicContact OE2-NH2 3.79Å; E310-R362 PolarHBondContact OE2-NH2 3.16Å
311	A	81.8	Confident	77.4	Confident	17 Å²	17	82.6 Å²	82.6	14%	0.14	42%	0.415	C	S	.	.	H	α-helix	trans	-62.3	-42.6	174.7	0	0	0	0	0	111.4	C307 L308 V314 Q315 V334	C307-A311 WeakPolarHBondContact O-CB 3.49Å; C307-A311 PolarHBondContact O-N 3.39Å; L308-A311 PolarHBondContact O-N 2.81Å; A311-V314 PolarHBondContact O-N 2.81Å; A311-Q315 PolarHBondContact O-N 3.37Å; A311-V334 VanDerWaalsContact CA-CG2 3.48Å; A311-V334 HydrophobicContact CB-CG2 3.71Å
312	A	80.1	Confident	75.1	Confident	44 Å²	44	84.2 Å²	84.2	36%	0.364	43%	0.427	S	S	.	.	H	α-helix	trans	-66.5	-37.1	177.5	0	0	0	0	0	112.6	L308 E309 E310 Q315 R316	L308-A312 WeakPolarHBondContact O-CB 3.45Å; L308-A312 PolarHBondContact O-N 3.45Å; E309-A312 PolarHBondContact O-N 2.82Å; E310-A312 VanDerWaalsContact C-N 3.34Å; E310-A312 PolarHBondContact O-N 3.06Å; A312-Q315 PolarHBondContact O-N 2.92Å; A312-R316 PolarHBondContact O-N 3.21Å
313	K	82	Confident	73.1	Confident	75 Å²	75	86.4 Å²	86.4	33%	0.326	44%	0.442	S	S	.	.	H	α-helix	trans	-63.2	-44.3	172.8	-71.7	175.1	-169.3	167.5	0	111.6	E309 E310 Q315 R316 H317	E309-K313 WeakPolarHBondContact O-CG 3.46Å; E309-K313 PolarHBondContact O-N 2.8Å; E310-K313 PolarHBondContact O-N 2.82Å; E310-K313 WeakPolarHBondContact OE1-CD 3.32Å; E310-K313 IonicContact OE1-NZ 3.77Å; E310-K313 PolarHBondContact OE1-NZ 3.33Å; K313-Q315 VanDerWaalsContact C-N 3.34Å; K313-Q315 PolarHBondContact O-N 3.33Å; K313-R316 PolarHBondContact O-N 2.95Å; K313-H317 PolarHBondContact O-CD2 2.93Å; K313-H317 PolarHBondContact O-N 3.23Å; K313-H317 VanDerWaalsContact O-N 3.16Å
314	V	76.9	Confident	71.4	Confident	45 Å²	45	89.1 Å²	89.1	27%	0.273	46%	0.459	S	S	.	.	H	α-helix	trans	-61.1	-43.9	176.1	173.3	0	0	0	0	110.6	E310 A311 R316 H317 N318 T332	E310-V314 VanDerWaalsContact O-CG2 3.31Å; E310-V314 WeakPolarHBondContact O-CG2 3.41Å; E310-V314 PolarHBondContact O-N 2.78Å; A311-V314 PolarHBondContact O-N 2.81Å; V314-R316 PolarHBondContact O-N 2.64Å; V314-H317 PolarHBondContact O-N 2.81Å; V314-N318 PolarHBondContact O-N 3.41Å; V314-T332 HydrophobicContact CG1-CG2 4.41Å
315	Q	71	Confident	69.4	Low	105 Å²	105	96.4 Å²	96.4	49%	0.491	49%	0.488	S	S	.	.	H	α-helix	trans	-63.1	-41.1	177.7	-166.9	178.3	5.6	0	0	112.5	A311 A312 K313 H317 N318 N319	A311-Q315 PolarHBondContact O-N 3.37Å; A312-Q315 PolarHBondContact O-N 2.92Å; K313-Q315 VanDerWaalsContact C-N 3.34Å; K313-Q315 PolarHBondContact O-N 3.33Å; Q315-H317 VanDerWaalsContact C-N 3.29Å; Q315-H317 PolarHBondContact O-N 2.85Å; Q315-N318 PolarHBondContact O-N 3Å; Q315-N318 VanDerWaalsContact O-N 3.1Å; Q315-N319 PolarHBondContact O-N 3.18Å; Q315-N319 VanDerWaalsContact O-N 3.09Å; Q315-N319 PolarHBondContact O-OD1 2.94Å
316	R	68.1	Low	67.6	Low	186 Å²	186	100.9 Å²	100.9	70%	0.702	51%	0.51	S	S	*	.	H	α-helix	trans	-62.5	-34.6	175.9	-79	-157.9	-71.3	167	-5.8	113.1	A312 K313 V314	A312-R316 PolarHBondContact O-N 3.21Å; K313-R316 PolarHBondContact O-N 2.95Å; V314-R316 PolarHBondContact O-N 2.64Å
317	H	65.7	Low	65.7	Low	166 Å²	166	108.8 Å²	108.8	77%	0.769	55%	0.552	S	S	*	*	H	α-helix	trans	-74	-27	173.7	-86.2	-84	0	0	0	113.1	K313 V314 Q315	K313-H317 PolarHBondContact O-CD2 2.93Å; K313-H317 PolarHBondContact O-N 3.23Å; K313-H317 VanDerWaalsContact O-N 3.16Å; V314-H317 PolarHBondContact O-N 2.81Å; Q315-H317 VanDerWaalsContact C-N 3.29Å; Q315-H317 PolarHBondContact O-N 2.85Å
318	N	62.9	Low	63.8	Low	93 Å²	93	111.3 Å²	111.3	50%	0.497	57%	0.57	S	S	.	*	H	α-helix	trans	-82.2	-15.9	177.3	-93.7	0.4	0	0	0	114.5	V314 Q315 L320 S321	V314-N318 PolarHBondContact O-N 3.41Å; Q315-N318 PolarHBondContact O-N 3Å; Q315-N318 VanDerWaalsContact O-N 3.1Å; N318-L320 PolarHBondContact O-N 3.1Å; N318-S321 PolarHBondContact O-N 3.05Å
319	N	58.2	Low	62.1	Low	94 Å²	94	111.8 Å²	111.8	50%	0.503	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.6	22.4	-178.5	-75.7	-5.9	0	0	0	114.7	Q315	Q315-N319 PolarHBondContact O-N 3.18Å; Q315-N319 VanDerWaalsContact O-N 3.09Å; Q315-N319 PolarHBondContact O-OD1 2.94Å
320	L	53.3	Low	60.5	Low	168 Å²	168	116.8 Å²	116.8	88%	0.88	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	0.3	161.9	-166	58.8	0	0	0	112.8	N318	N318-L320 PolarHBondContact O-N 3.1Å
321	S	52.3	Low	59.1	Low	99 Å²	99	120.1 Å²	120.1	69%	0.692	63%	0.625	S	S	*	*			trans	-146.9	74.3	-179	37.5	0	0	0	0	111.7	N318	N318-S321 PolarHBondContact O-N 3.05Å
322	T	47.1	Very low	58.1	Low	111 Å²	111	121.3 Å²	121.3	68%	0.681	63%	0.63	S	S	*	*			trans	-91	84.8	158.3	51.9	0	0	0	0	108.9
323	D	49.1	Very low	57.8	Low	156 Å²	156	121.8 Å²	121.8	83%	0.834	63%	0.631	S	S	*	*			trans	-137	132.1	150.9	-79.9	-39.2	0	0	0	104.5
324	H	52.9	Low	58	Low	162 Å²	162	118.5 Å²	118.5	75%	0.75	62%	0.617	S	S	*	*			trans	73.3	96.7	-171.5	-102.9	46.1	0	0	0	113.4	N326	H324-N326 VanDerWaalsContact C-OD1 3.29Å; H324-N326 PolarHBondContact O-OD1 2.72Å
325	Y	45.5	Very low	58.6	Low	232 Å²	232	116.3 Å²	116.3	91%	0.91	60%	0.604	S	S	*	*				38.6	63.3	66.9	-149.8	-96.2	0	0	0	115
326	N	49.6	Very low	59.4	Low	119 Å²	119	115.4 Å²	115.4	64%	0.636	60%	0.602	S	S	*	*			trans	-132.7	125.2	160.1	8	-7	0	0	0	107.5	H324 S328	H324-N326 VanDerWaalsContact C-OD1 3.29Å; H324-N326 PolarHBondContact O-OD1 2.72Å; N326-S328 PolarHBondContact O-N 3.34Å
327	N	46	Very low	60.4	Low	170 Å²	170	110 Å²	110	91%	0.909	59%	0.587	S	S	*	*	S	Bend	trans	-68	43.3	-171	-171.1	18.4	0	0	0	113.8
328	S	47.4	Very low	61.3	Low	71 Å²	71	104.8 Å²	104.8	50%	0.497	58%	0.578	S	S	.	*			trans	-117.7	98.5	168.9	-175.6	0	0	0	0	104.2	N326 E330	N326-S328 PolarHBondContact O-N 3.34Å; S328-E330 PolarHBondContact O-N 2.83Å; S328-E330 WeakPolarHBondContact OG-CB 3.33Å; S328-E330 PolarHBondContact OG-N 3.31Å; S328-E330 PolarHBondContact OG-OE2 2.8Å
329	T	47.7	Very low	62.6	Low	138 Å²	138	100.6 Å²	100.6	85%	0.847	56%	0.558	S	S	*	*			trans	-62.6	65.6	151.4	44.4	0	0	0	0	107.1	V331	T329-V331 PolarHBondContact O-N 2.76Å
330	E	51.2	Low	64.1	Low	158 Å²	158	99.8 Å²	99.8	74%	0.738	56%	0.556	S	S	*	*			trans	-71.5	88.4	164.4	-153.9	147.4	177.4	0	0	102.5	S328 T332	S328-E330 PolarHBondContact O-N 2.83Å; S328-E330 WeakPolarHBondContact OG-CB 3.33Å; S328-E330 PolarHBondContact OG-N 3.31Å; S328-E330 PolarHBondContact OG-OE2 2.8Å; E330-T332 PolarHBondContact O-N 2.74Å
331	V	52.5	Low	65.9	Low	113 Å²	113	93.6 Å²	93.6	69%	0.685	53%	0.526	S	S	*	.			trans	-44.5	110.8	168.8	176.6	0	0	0	0	104.6	T329 S333	T329-V331 PolarHBondContact O-N 2.76Å; V331-S333 PolarHBondContact O-N 2.75Å
332	T	60.7	Low	67.7	Low	42 Å²	42	94 Å²	94	26%	0.258	52%	0.516	S	S	.	.			trans	-57	98.7	176.2	36.9	0	0	0	0	106.1	V314 E330 V334	V314-T332 HydrophobicContact CG1-CG2 4.41Å; E330-T332 PolarHBondContact O-N 2.74Å; T332-V334 PolarHBondContact O-N 3.27Å
333	S	73.7	Confident	69.6	Low	54 Å²	54	92 Å²	92	38%	0.378	50%	0.501	S	S	.	.			trans	-77.8	121.7	-167.4	176.3	0	0	0	0	108	V331 C335	V331-S333 PolarHBondContact O-N 2.75Å; S333-C335 WeakPolarHBondContact CB-O 3.28Å; S333-C335 PolarHBondContact O-N 3.02Å; S333-C335 PolarHBondContact OG-N 3.41Å; S333-C335 PolarHBondContact OG-O 3.14Å
334	V	86.1	Confident	71.4	Confident	6 Å²	6	86.3 Å²	86.3	4%	0.036	47%	0.469	C	S	.	.	S	Bend	trans	-56	-33.5	175	-177.5	0	0	0	0	111.3	C307 E310 A311 T332 V350 R362	C307-V334 WeakPolarHBondContact O-CG2 3.19Å; E310-V334 HydrophobicContact CB-CB 4.48Å; E310-V334 HydrophobicContact CB-CG1 3.74Å; E310-V334 HydrophobicContact CB-CG2 3.79Å; A311-V334 VanDerWaalsContact CA-CG2 3.48Å; A311-V334 HydrophobicContact CB-CG2 3.71Å; T332-V334 PolarHBondContact O-N 3.27Å; V334-V350 HydrophobicContact CG1-CB 4.41Å; V334-V350 HydrophobicContact CG1-CG1 3.84Å; V334-V350 HydrophobicContact CG1-CG2 4.15Å; V334-R362 VanDerWaalsContact CG1-NH1 3.27Å
335	C	89.8	Confident	72.7	Confident	0 Å²	0	83 Å²	83	0%	0	46%	0.462	C	S	.	.	S	Bend	trans	-98.4	114.1	175.4	-55.3	0	0	0	0	109.5	S333 G339 C341 C352	S333-C335 WeakPolarHBondContact CB-O 3.28Å; S333-C335 PolarHBondContact O-N 3.02Å; S333-C335 PolarHBondContact OG-N 3.41Å; S333-C335 PolarHBondContact OG-O 3.14Å; C335-G339 WeakPolarHBondContact CB-O 3.47Å; C335-C341 WeakPolarHBondContact SG-CA 3.32Å; C335-C341 VanDerWaalsContact SG-CB 3.58Å; C335-C352 WeakPolarHBondContact CA-SG 3.26Å; C335-C352 HydrophobicContact CB-CB 3.69Å; C335-C352 WeakPolarHBondContact CB-SG 3.3Å; C335-C352 WeakPolarHBondContact SG-CA 3.14Å; C335-C352 WeakPolarHBondContact SG-CB 3.35Å; C335-C352 CovalentContact SG-SG 2.03Å; C335-C352 PolarHBondContact SG-SG 3.23Å
336	L	88	Confident	74.5	Confident	85 Å²	85	78.3 Å²	78.3	45%	0.445	45%	0.451	S	S	.	.	S	Bend	trans	-71.6	170.1	-176	-56.8	176.4	0	0	0	111.4	G338 G339 R362 C363 E364	L336-G338 PolarHBondContact O-N 3.33Å; L336-G338 VanDerWaalsContact O-N 3.15Å; L336-G339 PolarHBondContact O-N 2.82Å; L336-R362 WeakPolarHBondContact CB-O 3.48Å; L336-R362 PolarHBondContact N-O 3.41Å; L336-C363 WeakPolarHBondContact O-CB 3.15Å; L336-E364 HydrophobicContact CD1-CB 4.1Å
337	N	87.9	Confident	76.2	Confident	73 Å²	73	79.7 Å²	79.7	39%	0.39	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	36.8	174	-57.4	-54.5	0	0	0	114.2	G339 W358 C363	N337-G339 VanDerWaalsContact C-N 3.3Å; N337-G339 PolarHBondContact O-N 3.37Å; N337-W358 HydrophobicContact CB-CD2 3.7Å; N337-W358 HydrophobicContact CB-CE3 4.19Å; N337-W358 HydrophobicContact CB-CG 3.99Å; N337-W358 HydrophobicContact CB-CH2 4.48Å; N337-W358 HydrophobicContact CB-CZ2 4.03Å; N337-W358 WeakPolarHBondContact ND2-CH2 3.41Å; N337-W358 WeakPolarHBondContact ND2-CZ3 3.28Å; N337-C363 PolarHBondContact ND2-O 3.35Å
338	G	86.2	Confident	78.1	Confident	56 Å²	56	73.9 Å²	73.9	58%	0.577	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	10.1	179.9	0	0	0	0	0	114.8	L336 L355	L336-G338 PolarHBondContact O-N 3.33Å; L336-G338 VanDerWaalsContact O-N 3.15Å; G338-L355 WeakPolarHBondContact O-CD1 3.29Å
339	G	89.6	Confident	80.1	Confident	6 Å²	6	73.8 Å²	73.8	6%	0.062	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-58.1	147.8	178.2	0	0	0	0	0	112.9	C335 L336 N337 V353	C335-G339 WeakPolarHBondContact CB-O 3.47Å; L336-G339 PolarHBondContact O-N 2.82Å; N337-G339 VanDerWaalsContact C-N 3.3Å; N337-G339 PolarHBondContact O-N 3.37Å; G339-V353 WeakPolarHBondContact CA-O 3.24Å
340	T	90.2	Very high	82.1	Confident	77 Å²	77	68.8 Å²	68.8	47%	0.472	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	129.6	176.6	-54.7	0	0	0	0	110.3	F342 V353	T340-F342 HydrophobicContact CG2-CD2 4.27Å; T340-F342 HydrophobicContact CG2-CE1 4.43Å; T340-F342 HydrophobicContact CG2-CE2 3.54Å; T340-F342 HydrophobicContact CG2-CZ 3.64Å; T340-V353 PolarHBondContact N-O 2.92Å; T340-V353 PolarHBondContact O-N 3.28Å
341	C	90.6	Very high	84	Confident	37 Å²	37	68.5 Å²	68.5	25%	0.25	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128	179.7	-163.9	0	0	0	0	111.3	C307 C335 V350	C307-C341 VanDerWaalsContact CA-SG 3.53Å; C307-C341 HydrophobicContact CB-CB 3.95Å; C307-C341 WeakPolarHBondContact CB-SG 3.28Å; C307-C341 WeakPolarHBondContact SG-CB 3.42Å; C307-C341 CovalentContact SG-SG 2.04Å; C307-C341 PolarHBondContact SG-SG 3.04Å; C335-C341 WeakPolarHBondContact SG-CA 3.32Å; C335-C341 VanDerWaalsContact SG-CB 3.58Å; C341-V350 WeakPolarHBondContact SG-CG1 3.38Å
342	F	90.8	Very high	85.9	Confident	108 Å²	108	64.1 Å²	64.1	47%	0.474	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.5	170.1	-64.1	-82.7	0	0	0	110.2	C307 T340 R351 V353	C307-F342 PolarHBondContact SG-N 3.1Å; C307-F342 VanDerWaalsContact SG-N 3.43Å; T340-F342 HydrophobicContact CG2-CD2 4.27Å; T340-F342 HydrophobicContact CG2-CE1 4.43Å; T340-F342 HydrophobicContact CG2-CE2 3.54Å; T340-F342 HydrophobicContact CG2-CZ 3.64Å; F342-R351 PolarHBondContact N-O 2.77Å; F342-R351 WeakPolarHBondContact O-CA 3.37Å; F342-R351 WeakPolarHBondContact O-CB 3.13Å; F342-R351 PolarHBondContact O-N 3.14Å; F342-V353 HydrophobicContact CD2-CB 4.42Å; F342-V353 HydrophobicContact CD2-CG2 3.74Å; F342-V353 HydrophobicContact CE2-CB 4.15Å; F342-V353 HydrophobicContact CE2-CG2 3.74Å
343	D	86.9	Confident	87.4	Confident	70 Å²	70	65.5 Å²	65.5	37%	0.374	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	135.7	170.7	-62.9	-48.9	0	0	0	109.9	S305 A306 C307	S305-D343 WeakPolarHBondContact CA-OD1 3.38Å; S305-D343 VanDerWaalsContact CA-OD2 3.25Å; S305-D343 WeakPolarHBondContact CA-OD2 3.16Å; S305-D343 WeakPolarHBondContact CB-OD2 3.49Å; A306-D343 WeakPolarHBondContact CA-OD1 3.45Å; A306-D343 PolarHBondContact N-OD1 2.04Å; C307-D343 PolarHBondContact N-OD1 2.98Å
344	H	85.7	Confident	88.3	Confident	36 Å²	36	64.7 Å²	64.7	17%	0.167	34%	0.344	C	S	.	.			trans	-67.9	138.1	175.8	-177.3	-79.7	0	0	0	110.8	R303 I346 R347 E349	R303-H344 PolarHBondContact NH1-O 2.99Å; H344-I346 VanDerWaalsContact C-N 3.3Å; H344-I346 PolarHBondContact ND1-N 3.24Å; H344-I346 PolarHBondContact O-N 3.11Å; H344-R347 WeakPolarHBondContact CB-O 3.45Å; H344-R347 PolarHBondContact ND1-N 3.02Å; H344-R347 VanDerWaalsContact O-O 3.14Å; H344-E349 HydrophobicContact CB-CG 3.32Å; H344-E349 VanDerWaalsContact CB-O 3.3Å; H344-E349 WeakPolarHBondContact CB-O 3.44Å; H344-E349 IonicContact CD2-OE1 2.93Å; H344-E349 PolarHBondContact CD2-OE1 3.45Å; H344-E349 IonicContact CE1-OE1 3.52Å; H344-E349 IonicContact CG-OE1 3.62Å; H344-E349 VanDerWaalsContact CG-OE1 3.27Å; H344-E349 PolarHBondContact N-O 3.12Å; H344-E349 IonicContact ND1-OE1 3Å; H344-E349 IonicContact NE2-OE1 3Å; H344-E349 PolarHBondContact NE2-OE1 3.02Å
345	P	81.4	Confident	88.5	Confident	91 Å²	91	68.6 Å²	68.6	59%	0.591	36%	0.364	S	S	*	.	S	Bend	trans	-67.2	-25	-169.4	23.9	-35.1	0	0	0	114.4	R303	R303-P345 VanDerWaalsContact NH1-C 3.28Å; R303-P345 PolarHBondContact NH1-O 3.48Å; R303-P345 PolarHBondContact NH2-O 3.44Å
346	I	83	Confident	88.5	Confident	134 Å²	134	74.7 Å²	74.7	69%	0.687	40%	0.404	S	S	*	.	S	Bend	trans	-116	-63.9	-175.4	-56	174.8	0	0	0	111.2	R303 H344	R303-I346 PolarHBondContact NH1-O 3.45Å; R303-I346 VanDerWaalsContact NH1-O 3.13Å; H344-I346 VanDerWaalsContact C-N 3.3Å; H344-I346 PolarHBondContact ND1-N 3.24Å; H344-I346 PolarHBondContact O-N 3.11Å
347	R	85.6	Confident	88.5	Confident	148 Å²	148	72.6 Å²	72.6	56%	0.558	40%	0.402	S	S	*	.	S	Bend	trans	-71.6	149.5	174.8	-61.2	-174.2	-66.2	-117.9	-1.8	112.2	H344 E349	H344-R347 WeakPolarHBondContact CB-O 3.45Å; H344-R347 PolarHBondContact ND1-N 3.02Å; H344-R347 VanDerWaalsContact O-O 3.14Å; R347-E349 HydrophobicContact CB-CG 3.91Å; R347-E349 IonicContact CZ-OE1 3.25Å; R347-E349 VanDerWaalsContact CZ-OE1 3.25Å; R347-E349 IonicContact CZ-OE2 3.64Å; R347-E349 IonicContact NE-OE1 3.05Å; R347-E349 PolarHBondContact NE-OE1 2.95Å; R347-E349 IonicContact NE-OE2 2.92Å; R347-E349 PolarHBondContact NE-OE2 2.84Å; R347-E349 IonicContact NH2-OE1 2.72Å; R347-E349 PolarHBondContact NH2-OE1 3.05Å; R347-E349 IonicContact NH2-OE2 3.69Å; R347-E349 PolarHBondContact O-N 3Å
348	F	86.2	Confident	88.7	Confident	49 Å²	49	73.3 Å²	73.3	22%	0.215	40%	0.399	C	S	.	.	S	Bend	trans	-81.9	70.5	171.7	-174.1	-110.8	0	0	0	109.9	Q294 R304 A306 E309	Q294-F348 HydrophobicContact CB-CD2 4.28Å; Q294-F348 HydrophobicContact CB-CG 4.41Å; Q294-F348 HydrophobicContact CG-CB 3.84Å; Q294-F348 HydrophobicContact CG-CD1 4.1Å; Q294-F348 HydrophobicContact CG-CD2 4.14Å; Q294-F348 HydrophobicContact CG-CG 3.77Å; R304-F348 HydrophobicContact CB-CE2 3.99Å; R304-F348 HydrophobicContact CB-CZ 4.4Å; R304-F348 HydrophobicContact CG-CE2 4.37Å; R304-F348 HydrophobicContact CG-CZ 4.4Å; R304-F348 VanDerWaalsContact O-CE2 3.32Å; R304-F348 WeakPolarHBondContact O-CE2 3.35Å; A306-F348 HydrophobicContact CB-CD2 4.14Å; A306-F348 HydrophobicContact CB-CE2 4.03Å; A306-F348 HydrophobicContact CB-CZ 4.33Å; E309-F348 HydrophobicContact CB-CZ 4.49Å
349	E	87.6	Confident	88.8	Confident	68 Å²	68	75 Å²	75	32%	0.318	39%	0.394	S	S	.	.			trans	-136.5	158.8	-178.8	68	-173.2	-169.1	0	0	110.7	H344 R347	H344-E349 HydrophobicContact CB-CG 3.32Å; H344-E349 VanDerWaalsContact CB-O 3.3Å; H344-E349 WeakPolarHBondContact CB-O 3.44Å; H344-E349 IonicContact CD2-OE1 2.93Å; H344-E349 PolarHBondContact CD2-OE1 3.45Å; H344-E349 IonicContact CE1-OE1 3.52Å; H344-E349 IonicContact CG-OE1 3.62Å; H344-E349 VanDerWaalsContact CG-OE1 3.27Å; H344-E349 PolarHBondContact N-O 3.12Å; H344-E349 IonicContact ND1-OE1 3Å; H344-E349 IonicContact NE2-OE1 3Å; H344-E349 PolarHBondContact NE2-OE1 3.02Å; R347-E349 HydrophobicContact CB-CG 3.91Å; R347-E349 IonicContact CZ-OE1 3.25Å; R347-E349 VanDerWaalsContact CZ-OE1 3.25Å; R347-E349 IonicContact CZ-OE2 3.64Å; R347-E349 IonicContact NE-OE1 3.05Å; R347-E349 PolarHBondContact NE-OE1 2.95Å; R347-E349 IonicContact NE-OE2 2.92Å; R347-E349 PolarHBondContact NE-OE2 2.84Å; R347-E349 IonicContact NH2-OE1 2.72Å; R347-E349 PolarHBondContact NH2-OE1 3.05Å; R347-E349 IonicContact NH2-OE2 3.69Å; R347-E349 PolarHBondContact O-N 3Å
350	V	90	Very high	88.9	Confident	34 Å²	34	76.2 Å²	76.2	21%	0.206	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	135	177	169.2	0	0	0	0	110.4	A306 E310 V334 C341	A306-V350 HydrophobicContact CB-CG2 3.93Å; E310-V350 HydrophobicContact CB-CG2 4.05Å; E310-V350 HydrophobicContact CG-CG2 3.66Å; V334-V350 HydrophobicContact CG1-CB 4.41Å; V334-V350 HydrophobicContact CG1-CG1 3.84Å; V334-V350 HydrophobicContact CG1-CG2 4.15Å; C341-V350 WeakPolarHBondContact SG-CG1 3.38Å
351	R	91.1	Very high	88.8	Confident	152 Å²	152	76.2 Å²	76.2	57%	0.574	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	113.5	170.4	-178	-177.8	-178.1	-167.3	1	109.8	F342	F342-R351 PolarHBondContact N-O 2.77Å; F342-R351 WeakPolarHBondContact O-CA 3.37Å; F342-R351 WeakPolarHBondContact O-CB 3.13Å; F342-R351 PolarHBondContact O-N 3.14Å
352	C	92.6	Very high	88.8	Confident	21 Å²	21	78.6 Å²	78.6	14%	0.142	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	134	174.6	-65.5	0	0	0	0	111.5	C335	C335-C352 WeakPolarHBondContact CA-SG 3.26Å; C335-C352 HydrophobicContact CB-CB 3.69Å; C335-C352 WeakPolarHBondContact CB-SG 3.3Å; C335-C352 WeakPolarHBondContact SG-CA 3.14Å; C335-C352 WeakPolarHBondContact SG-CB 3.35Å; C335-C352 CovalentContact SG-SG 2.03Å; C335-C352 PolarHBondContact SG-SG 3.23Å
353	V	92.1	Very high	88.9	Confident	71 Å²	71	73.5 Å²	73.5	43%	0.43	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	116	166.7	178.5	0	0	0	0	107.9	G339 T340 F342	G339-V353 WeakPolarHBondContact CA-O 3.24Å; T340-V353 PolarHBondContact N-O 2.92Å; T340-V353 PolarHBondContact O-N 3.28Å; F342-V353 HydrophobicContact CD2-CB 4.42Å; F342-V353 HydrophobicContact CD2-CG2 3.74Å; F342-V353 HydrophobicContact CE2-CB 4.15Å; F342-V353 HydrophobicContact CE2-CG2 3.74Å
354	C	92	Very high	89	Confident	37 Å²	37	74.2 Å²	74.2	25%	0.25	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-88.3	147.9	-173	-51.7	0	0	0	0	112	W358 C363	C354-W358 HydrophobicContact CB-CB 4.1Å; C354-W358 WeakPolarHBondContact CB-O 3.22Å; C354-C363 WeakPolarHBondContact CA-SG 3.27Å; C354-C363 HydrophobicContact CB-CB 3.72Å; C354-C363 WeakPolarHBondContact CB-SG 3.49Å; C354-C363 WeakPolarHBondContact SG-CA 3.3Å; C354-C363 WeakPolarHBondContact SG-CB 3.31Å; C354-C363 CovalentContact SG-SG 2.03Å; C354-C363 PolarHBondContact SG-SG 3.3Å
355	L	91.9	Very high	89.2	Confident	88 Å²	88	76.4 Å²	76.4	46%	0.461	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-66.9	156.7	168	-82.4	89.8	0	0	0	110.6	G338 G357 W358	G338-L355 WeakPolarHBondContact O-CD1 3.29Å; L355-G357 PolarHBondContact O-N 2.75Å; L355-W358 PolarHBondContact O-N 2.78Å; L355-W358 VanDerWaalsContact O-N 3.15Å
356	P	89	Confident	89.5	Confident	128 Å²	128	75.3 Å²	75.3	83%	0.831	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	132.2	175.5	-26.3	34.4	0	0	0	112.1
357	G	87.3	Confident	89.6	Confident	40 Å²	40	72.2 Å²	72.2	41%	0.412	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.6	-1.4	-177.7	0	0	0	0	0	115	L355 P366 V367	L355-G357 PolarHBondContact O-N 2.75Å; G357-P366 CarbonylContact O-C 3.54Å; G357-P366 WeakPolarHBondContact O-CA 3.5Å; G357-V367 PolarHBondContact O-N 2.96Å
358	W	91.9	Very high	89.3	Confident	88 Å²	88	73.1 Å²	73.1	33%	0.333	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	139	176.1	-61.3	93	0	0	0	111.7	N337 C354 L355 C363 I365 P366	N337-W358 HydrophobicContact CB-CD2 3.7Å; N337-W358 HydrophobicContact CB-CE3 4.19Å; N337-W358 HydrophobicContact CB-CG 3.99Å; N337-W358 HydrophobicContact CB-CH2 4.48Å; N337-W358 HydrophobicContact CB-CZ2 4.03Å; N337-W358 WeakPolarHBondContact ND2-CH2 3.41Å; N337-W358 WeakPolarHBondContact ND2-CZ3 3.28Å; C354-W358 HydrophobicContact CB-CB 4.1Å; C354-W358 WeakPolarHBondContact CB-O 3.22Å; L355-W358 PolarHBondContact O-N 2.78Å; L355-W358 VanDerWaalsContact O-N 3.15Å; W358-C363 HydrophobicContact CB-CB 4.33Å; W358-I365 CarbonylContact C-O 3.55Å; W358-I365 WeakPolarHBondContact CA-O 3.34Å; W358-P366 HydrophobicContact CE3-CB 4.26Å; W358-P366 HydrophobicContact CZ3-CB 4.09Å; W358-P366 HydrophobicContact CZ3-CG 4.46Å
359	I	90.2	Very high	88.5	Confident	92 Å²	92	76.6 Å²	76.6	47%	0.472	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	179	173.2	61	175.2	0	0	0	109.5	C363 E364 I365 V367	I359-C363 CarbonylContact O-C 3.58Å; I359-C363 WeakPolarHBondContact O-CA 3.25Å; I359-E364 PolarHBondContact O-N 3.1Å; I359-I365 HydrophobicContact CD1-CG2 4.34Å; I359-I365 HydrophobicContact CG1-CB 3.84Å; I359-I365 HydrophobicContact CG1-CG2 3.99Å; I359-I365 PolarHBondContact N-O 2.95Å; I359-I365 PolarHBondContact O-N 3Å; I359-V367 HydrophobicContact CB-CG2 4.26Å; I359-V367 HydrophobicContact CD1-CG2 4.28Å; I359-V367 HydrophobicContact CG1-CG2 4.05Å; I359-V367 HydrophobicContact CG2-CG2 3.48Å; I359-V367 VanDerWaalsContact CG2-CG2 3.48Å
360	G	90.5	Very high	87.5	Confident	32 Å²	32	81.8 Å²	81.8	33%	0.33	45%	0.449	S	S	.	.	S	Bend	trans	107.5	167.4	-176	0	0	0	0	0	112.5	R362 C363	G360-R362 PolarHBondContact O-N 2.93Å; G360-C363 PolarHBondContact O-N 3.06Å
361	A	88.9	Confident	86	Confident	77 Å²	77	85.1 Å²	85.1	64%	0.636	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-26.8	-175	0	0	0	0	0	112.3	E364	A361-E364 PolarHBondContact N-OE1 3.02Å; A361-E364 PolarHBondContact N-OE2 3.07Å
362	R	89.9	Confident	84.1	Confident	86 Å²	86	83.8 Å²	83.8	33%	0.325	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.9	21.2	179.2	-63.2	-176.8	174.1	-116.7	1.6	111.9	E310 V334 L336 G360 E364	E310-R362 IonicContact OE2-CZ 3.35Å; E310-R362 IonicContact OE2-NH2 3.79Å; E310-R362 PolarHBondContact OE2-NH2 3.16Å; V334-R362 VanDerWaalsContact CG1-NH1 3.27Å; L336-R362 WeakPolarHBondContact CB-O 3.48Å; L336-R362 PolarHBondContact N-O 3.41Å; G360-R362 PolarHBondContact O-N 2.93Å; R362-E364 VanDerWaalsContact C-N 3.32Å; R362-E364 VanDerWaalsContact CA-OE2 3.23Å; R362-E364 WeakPolarHBondContact CA-OE2 3.36Å; R362-E364 PolarHBondContact N-OE2 3.01Å; R362-E364 PolarHBondContact O-N 2.65Å
363	C	93.1	Very high	82.6	Confident	1 Å²	1	89.3 Å²	89.3	1%	0.007	51%	0.509	C	S	.	.	S	Bend	trans	61.9	34.1	-178.1	-49.7	0	0	0	0	114.3	L336 N337 C354 W358 I359 G360	L336-C363 WeakPolarHBondContact O-CB 3.15Å; N337-C363 PolarHBondContact ND2-O 3.35Å; C354-C363 WeakPolarHBondContact CA-SG 3.27Å; C354-C363 HydrophobicContact CB-CB 3.72Å; C354-C363 WeakPolarHBondContact CB-SG 3.49Å; C354-C363 WeakPolarHBondContact SG-CA 3.3Å; C354-C363 WeakPolarHBondContact SG-CB 3.31Å; C354-C363 CovalentContact SG-SG 2.03Å; C354-C363 PolarHBondContact SG-SG 3.3Å; W358-C363 HydrophobicContact CB-CB 4.33Å; I359-C363 CarbonylContact O-C 3.58Å; I359-C363 WeakPolarHBondContact O-CA 3.25Å; G360-C363 PolarHBondContact O-N 3.06Å
364	E	88.8	Confident	81	Confident	86 Å²	86	90.4 Å²	90.4	40%	0.402	52%	0.52	S	S	.	.			trans	-86.4	-18.5	-173.8	68.8	-77.4	-173.5	0	0	115	L336 I359 A361 R362	L336-E364 HydrophobicContact CD1-CB 4.1Å; I359-E364 PolarHBondContact O-N 3.1Å; A361-E364 PolarHBondContact N-OE1 3.02Å; A361-E364 PolarHBondContact N-OE2 3.07Å; R362-E364 VanDerWaalsContact C-N 3.32Å; R362-E364 VanDerWaalsContact CA-OE2 3.23Å; R362-E364 WeakPolarHBondContact CA-OE2 3.36Å; R362-E364 PolarHBondContact N-OE2 3.01Å; R362-E364 PolarHBondContact O-N 2.65Å
365	I	90.2	Very high	79.6	Confident	81 Å²	81	93.3 Å²	93.3	42%	0.415	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.4	-172.1	-49.9	175	0	0	0	109.5	W358 I359	W358-I365 CarbonylContact C-O 3.55Å; W358-I365 WeakPolarHBondContact CA-O 3.34Å; I359-I365 HydrophobicContact CD1-CG2 4.34Å; I359-I365 HydrophobicContact CG1-CB 3.84Å; I359-I365 HydrophobicContact CG1-CG2 3.99Å; I359-I365 PolarHBondContact N-O 2.95Å; I359-I365 PolarHBondContact O-N 3Å
366	P	87.6	Confident	78.2	Confident	69 Å²	69	98.1 Å²	98.1	45%	0.448	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	139.5	172.3	29.4	-32.5	0	0	0	110.9	G357 W358 E368	G357-P366 CarbonylContact O-C 3.54Å; G357-P366 WeakPolarHBondContact O-CA 3.5Å; W358-P366 HydrophobicContact CE3-CB 4.26Å; W358-P366 HydrophobicContact CZ3-CB 4.09Å; W358-P366 HydrophobicContact CZ3-CG 4.46Å; P366-E368 PolarHBondContact O-N 2.79Å
367	V	85.3	Confident	77.4	Confident	68 Å²	68	96.3 Å²	96.3	41%	0.412	53%	0.527	S	S	.	.			trans	-76.1	105.9	174.5	-180	0	0	0	0	108.7	G357 I359 V369	G357-V367 PolarHBondContact O-N 2.96Å; I359-V367 HydrophobicContact CB-CG2 4.26Å; I359-V367 HydrophobicContact CD1-CG2 4.28Å; I359-V367 HydrophobicContact CG1-CG2 4.05Å; I359-V367 HydrophobicContact CG2-CG2 3.48Å; I359-V367 VanDerWaalsContact CG2-CG2 3.48Å; V367-V369 PolarHBondContact O-N 3.25Å
368	E	79	Confident	76.6	Confident	167 Å²	167	99.4 Å²	99.4	78%	0.78	53%	0.534	S	S	*	.			trans	-70.9	111.4	172.5	-64	-176.3	-172.7	0	0	109.2	P366 E370	P366-E368 PolarHBondContact O-N 2.79Å; E368-E370 PolarHBondContact O-N 3.11Å
369	V	68.7	Low	75.6	Confident	123 Å²	123	100.9 Å²	100.9	75%	0.745	55%	0.547	S	S	*	.			trans	-75	97.3	176	-173.7	0	0	0	0	107.7	V367 T371	V367-V369 PolarHBondContact O-N 3.25Å; V369-T371 PolarHBondContact O-N 3.49Å
370	E	66.7	Low	74.8	Confident	177 Å²	177	100.2 Å²	100.2	83%	0.827	55%	0.548	S	S	*	.			trans	-67.6	102.3	170.7	-69.3	-153.4	-174	0	0	109.5	E368	E368-E370 PolarHBondContact O-N 3.11Å
371	T	59	Low	74.2	Confident	103 Å²	103	104.7 Å²	104.7	63%	0.632	56%	0.563	S	S	*	*			trans	-63.9	126.4	169.8	50.3	0	0	0	0	108.9	V369 N373	V369-T371 PolarHBondContact O-N 3.49Å; T371-N373 PolarHBondContact O-N 3.16Å
372	P	52.4	Low	73.8	Confident	124 Å²	124	107 Å²	107	81%	0.805	56%	0.564	S	S	*	*			trans	-60.7	113	-177.2	-17	27.4	0	0	0	110.3	S374	P372-S374 PolarHBondContact O-N 3.08Å
373	N	59.2	Low	73.4	Confident	137 Å²	137	106.1 Å²	106.1	73%	0.733	57%	0.571	S	S	*	*			trans	-65.5	108	177.7	-85.2	-23.5	0	0	0	109.5	T371 N375	T371-N373 PolarHBondContact O-N 3.16Å; N373-N375 PolarHBondContact O-N 3.2Å
374	S	59.1	Low	73.1	Confident	95 Å²	95	110.4 Å²	110.4	66%	0.664	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	21.6	178	-178	0	0	0	0	115.4	P372	P372-S374 PolarHBondContact O-N 3.08Å
375	N	62	Low	72.9	Confident	98 Å²	98	108.4 Å²	108.4	52%	0.524	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	-17.3	-173.1	-146.8	12.9	0	0	0	113.4	N373 I377 L378	N373-N375 PolarHBondContact O-N 3.2Å; N375-I377 PolarHBondContact O-N 3.44Å; N375-L378 PolarHBondContact O-N 2.89Å
376	W	64.4	Low	72.7	Confident	189 Å²	189	106.3 Å²	106.3	72%	0.716	60%	0.597	S	S	*	*	H	α-helix	trans	-63	-27.2	177.1	69.7	-66.9	0	0	0	113.3	T380	W376-T380 PolarHBondContact O-OG1 3.16Å; W376-T380 VanDerWaalsContact O-OG1 3.06Å
377	I	70.5	Confident	72.7	Confident	89 Å²	89	108.3 Å²	108.3	46%	0.456	60%	0.603	S	S	.	*	H	α-helix	trans	-71.8	-30.8	178.7	-58.4	171.8	0	0	0	111.7	N375 T380	N375-I377 PolarHBondContact O-N 3.44Å; I377-T380 PolarHBondContact O-OG1 2.9Å; I377-T380 VanDerWaalsContact O-OG1 3.05Å
378	L	72.3	Confident	72.8	Confident	106 Å²	106	110.4 Å²	110.4	56%	0.555	61%	0.612	S	S	*	*	H	α-helix	trans	-77.4	-36.7	-176.8	-165.8	70.9	0	0	0	112.1	N375 L381	N375-L378 PolarHBondContact O-N 2.89Å; L378-L381 PolarHBondContact O-N 2.91Å
379	I	70.5	Confident	73.3	Confident	118 Å²	118	109.6 Å²	109.6	61%	0.605	61%	0.606	S	S	*	*	H	α-helix	trans	-70.3	-34.4	-176.8	-61.5	172.2	0	0	0	111.2
380	T	73.1	Confident	74.2	Confident	79 Å²	79	108.6 Å²	108.6	49%	0.485	60%	0.595	S	S	.	*	H	α-helix	trans	-70.7	-29.1	179	38.3	0	0	0	0	113.2	W376 I377 S383	W376-T380 PolarHBondContact O-OG1 3.16Å; W376-T380 VanDerWaalsContact O-OG1 3.06Å; I377-T380 PolarHBondContact O-OG1 2.9Å; I377-T380 VanDerWaalsContact O-OG1 3.05Å; T380-S383 PolarHBondContact O-OG 3.1Å
381	L	77.3	Confident	75.2	Confident	126 Å²	126	103.3 Å²	103.3	66%	0.66	58%	0.575	S	S	*	*	H	α-helix	trans	-73.7	-32.8	177.9	-73	170.6	0	0	0	113.4	L378	L378-L381 PolarHBondContact O-N 2.91Å
382	I	81.1	Confident	76.7	Confident	125 Å²	125	102.1 Å²	102.1	64%	0.641	57%	0.567	S	S	*	*	H	α-helix	trans	-73.4	-36	-176.5	-63.5	170.1	0	0	0	111.4	G386	I382-G386 PolarHBondContact O-N 2.76Å
383	S	81.7	Confident	78.5	Confident	67 Å²	67	98.9 Å²	98.9	47%	0.469	55%	0.545	S	S	.	.	H	α-helix	trans	-69	-39.4	-178.1	65.9	0	0	0	0	112.8	T380 G386 I387	T380-S383 PolarHBondContact O-OG 3.1Å; S383-G386 PolarHBondContact O-N 3.43Å; S383-I387 WeakPolarHBondContact O-CG1 3.14Å; S383-I387 PolarHBondContact O-N 2.91Å
384	V	85.5	Confident	80	Confident	91 Å²	91	97.7 Å²	97.7	55%	0.552	54%	0.538	S	S	*	.	H	α-helix	trans	-67.3	-39.7	179.8	179	0	0	0	0	111.3	L388	V384-L388 PolarHBondContact O-N 2.84Å
385	G	84.7	Confident	81.4	Confident	45 Å²	45	98.8 Å²	98.8	46%	0.464	54%	0.536	S	S	.	.	H	α-helix	trans	-64.7	-40	177.5	0	0	0	0	0	113.5	L388 F389	G385-L388 PolarHBondContact O-N 2.78Å; G385-F389 PolarHBondContact O-N 2.99Å
386	G	87.5	Confident	82.6	Confident	36 Å²	36	97.3 Å²	97.3	37%	0.371	53%	0.531	S	S	.	.	H	α-helix	trans	-64.9	-41.5	179.3	0	0	0	0	0	113.4	I382 S383 L388 F389 I390	I382-G386 PolarHBondContact O-N 2.76Å; S383-G386 PolarHBondContact O-N 3.43Å; G386-L388 VanDerWaalsContact C-N 3.33Å; G386-L388 PolarHBondContact O-N 3Å; G386-F389 PolarHBondContact O-N 2.01Å; G386-I390 WeakPolarHBondContact O-CG1 3.02Å; G386-I390 PolarHBondContact O-N 2.83Å; G386-I390 VanDerWaalsContact O-N 3.17Å
387	I	87.8	Confident	83.7	Confident	112 Å²	112	92.9 Å²	92.9	57%	0.574	52%	0.52	S	S	*	.	H	α-helix	trans	-63.7	-42.3	178.5	-65.7	167.5	0	0	0	110.4	S383 F389 I390 T391	S383-I387 WeakPolarHBondContact O-CG1 3.14Å; S383-I387 PolarHBondContact O-N 2.91Å; I387-F389 VanDerWaalsContact C-N 3.33Å; I387-F389 PolarHBondContact O-N 2.9Å; I387-I390 PolarHBondContact O-N 2.63Å; I387-T391 WeakPolarHBondContact O-CG2 3.42Å; I387-T391 PolarHBondContact O-N 2.63Å; I387-T391 VanDerWaalsContact O-N 3.14Å
388	L	87.6	Confident	84.3	Confident	112 Å²	112	90.3 Å²	90.3	59%	0.586	52%	0.516	S	S	*	.	H	α-helix	trans	-64	-39.1	-179.9	-135.7	138.9	0	0	0	111.6	V384 G385 G386 T391 V392	V384-L388 PolarHBondContact O-N 2.84Å; G385-L388 PolarHBondContact O-N 2.78Å; G386-L388 VanDerWaalsContact C-N 3.33Å; G386-L388 PolarHBondContact O-N 3Å; L388-T391 PolarHBondContact O-OG1 2.96Å; L388-V392 WeakPolarHBondContact O-CG2 3.47Å; L388-V392 PolarHBondContact O-N 2.88Å
389	F	87.5	Confident	84.9	Confident	149 Å²	149	90.6 Å²	90.6	65%	0.654	52%	0.517	S	S	*	.	H	α-helix	trans	-64.6	-44	176.1	-170.4	-100.8	0	0	0	112.9	G385 G386 I387 T391 V392 V393	G385-F389 PolarHBondContact O-N 2.99Å; G386-F389 PolarHBondContact O-N 2.01Å; I387-F389 VanDerWaalsContact C-N 3.33Å; I387-F389 PolarHBondContact O-N 2.9Å; F389-T391 VanDerWaalsContact C-N 3.35Å; F389-T391 PolarHBondContact O-N 2.97Å; F389-V392 PolarHBondContact O-N 2.89Å; F389-V393 HydrophobicContact CD1-CG2 4.25Å; F389-V393 HydrophobicContact CE1-CG2 3.94Å; F389-V393 HydrophobicContact CZ-CG2 4.27Å; F389-V393 WeakPolarHBondContact O-CG2 3.39Å; F389-V393 PolarHBondContact O-N 2.78Å; F389-V393 VanDerWaalsContact O-N 3.13Å
390	I	89.6	Confident	85.5	Confident	102 Å²	102	90.2 Å²	90.2	52%	0.523	52%	0.515	S	S	.	.	H	α-helix	trans	-63.3	-41.2	-179.8	-68	170.3	0	0	0	111.1	G386 I387 V392 V393 L394	G386-I390 WeakPolarHBondContact O-CG1 3.02Å; G386-I390 PolarHBondContact O-N 2.83Å; G386-I390 VanDerWaalsContact O-N 3.17Å; I387-I390 PolarHBondContact O-N 2.63Å; I390-V392 VanDerWaalsContact C-N 3.34Å; I390-V392 PolarHBondContact O-N 3.11Å; I390-V393 PolarHBondContact O-N 2.84Å; I390-L394 HydrophobicContact CG2-CD1 3.99Å; I390-L394 HydrophobicContact CG2-CG 4.4Å; I390-L394 WeakPolarHBondContact O-CG 3.09Å; I390-L394 PolarHBondContact O-N 2.8Å
391	T	86.1	Confident	85.7	Confident	66 Å²	66	95.2 Å²	95.2	41%	0.405	53%	0.525	S	S	.	.	H	α-helix	trans	-63.3	-38.9	178.7	61.7	0	0	0	0	112.7	I387 L388 F389 L394 L395	I387-T391 WeakPolarHBondContact O-CG2 3.42Å; I387-T391 PolarHBondContact O-N 2.63Å; I387-T391 VanDerWaalsContact O-N 3.14Å; L388-T391 PolarHBondContact O-OG1 2.96Å; F389-T391 VanDerWaalsContact C-N 3.35Å; F389-T391 PolarHBondContact O-N 2.97Å; T391-L394 PolarHBondContact O-N 2.68Å; T391-L395 WeakPolarHBondContact O-CG 3.49Å; T391-L395 PolarHBondContact O-N 3.2Å; T391-L395 VanDerWaalsContact O-N 3.08Å
392	V	90.5	Very high	85.7	Confident	78 Å²	78	97.2 Å²	97.2	47%	0.473	53%	0.528	S	S	.	.	H	α-helix	trans	-65.4	-44.7	176.7	173.2	0	0	0	0	110.9	L388 F389 I390 L394 L395 T396	L388-V392 WeakPolarHBondContact O-CG2 3.47Å; L388-V392 PolarHBondContact O-N 2.88Å; F389-V392 PolarHBondContact O-N 2.89Å; I390-V392 VanDerWaalsContact C-N 3.34Å; I390-V392 PolarHBondContact O-N 3.11Å; V392-L394 PolarHBondContact O-N 3Å; V392-L395 PolarHBondContact O-N 2.83Å; V392-T396 WeakPolarHBondContact O-CG2 3.2Å; V392-T396 PolarHBondContact O-N 2.97Å
393	V	90.6	Very high	85.2	Confident	56 Å²	56	94.9 Å²	94.9	34%	0.339	52%	0.522	S	S	.	.	H	α-helix	trans	-60.7	-46	178	173.2	0	0	0	0	110.9	F389 I390 L395 T396 I397	F389-V393 HydrophobicContact CD1-CG2 4.25Å; F389-V393 HydrophobicContact CE1-CG2 3.94Å; F389-V393 HydrophobicContact CZ-CG2 4.27Å; F389-V393 WeakPolarHBondContact O-CG2 3.39Å; F389-V393 PolarHBondContact O-N 2.78Å; F389-V393 VanDerWaalsContact O-N 3.13Å; I390-V393 PolarHBondContact O-N 2.84Å; V393-L395 VanDerWaalsContact C-N 3.32Å; V393-L395 PolarHBondContact O-N 2.87Å; V393-T396 PolarHBondContact O-N 2.78Å; V393-T396 PolarHBondContact O-OG1 3.01Å; V393-I397 HydrophobicContact CG1-CD1 3.83Å; V393-I397 WeakPolarHBondContact O-CG1 3.29Å; V393-I397 PolarHBondContact O-N 2.72Å
394	L	90.1	Very high	84.7	Confident	113 Å²	113	98.5 Å²	98.5	59%	0.592	53%	0.529	S	S	*	.	H	α-helix	trans	-62.9	-37.4	178.7	-69.3	175	0	0	0	112.8	I390 T391 V392 I397 G398	I390-L394 HydrophobicContact CG2-CD1 3.99Å; I390-L394 HydrophobicContact CG2-CG 4.4Å; I390-L394 WeakPolarHBondContact O-CG 3.09Å; I390-L394 PolarHBondContact O-N 2.8Å; T391-L394 PolarHBondContact O-N 2.68Å; V392-L394 PolarHBondContact O-N 3Å; L394-I397 PolarHBondContact O-N 3.47Å; L394-G398 PolarHBondContact O-N 2.63Å
395	L	89.9	Confident	84	Confident	117 Å²	117	98.3 Å²	98.3	61%	0.613	53%	0.525	S	S	*	.	H	α-helix	trans	-65.6	-40.9	175.2	-74.9	169.2	0	0	0	112.1	T391 V392 V393 G398 I399	T391-L395 WeakPolarHBondContact O-CG 3.49Å; T391-L395 PolarHBondContact O-N 3.2Å; T391-L395 VanDerWaalsContact O-N 3.08Å; V392-L395 PolarHBondContact O-N 2.83Å; V393-L395 VanDerWaalsContact C-N 3.32Å; V393-L395 PolarHBondContact O-N 2.87Å; L395-G398 PolarHBondContact O-N 2.82Å; L395-I399 VanDerWaalsContact O-CG1 3.3Å; L395-I399 WeakPolarHBondContact O-CG1 3.32Å; L395-I399 PolarHBondContact O-N 2.92Å; L395-I399 VanDerWaalsContact O-N 3.07Å
396	T	86	Confident	82.8	Confident	68 Å²	68	104.2 Å²	104.2	42%	0.417	53%	0.533	S	S	.	.	H	α-helix	trans	-64.2	-42.2	177.1	62.3	0	0	0	0	112.1	V392 V393 G398 I399 I400	V392-T396 WeakPolarHBondContact O-CG2 3.2Å; V392-T396 PolarHBondContact O-N 2.97Å; V393-T396 PolarHBondContact O-N 2.78Å; V393-T396 PolarHBondContact O-OG1 3.01Å; T396-G398 VanDerWaalsContact C-N 3.35Å; T396-G398 PolarHBondContact O-N 2.86Å; T396-I399 PolarHBondContact O-N 2.88Å; T396-I400 VanDerWaalsContact O-CG1 3.31Å; T396-I400 WeakPolarHBondContact O-CG1 3.48Å; T396-I400 PolarHBondContact O-N 3.49Å; T396-I400 VanDerWaalsContact O-N 3.13Å
397	I	87.1	Confident	81.5	Confident	96 Å²	96	106.9 Å²	106.9	49%	0.492	53%	0.534	S	S	.	.	H	α-helix	trans	-62.3	-43.4	176.3	-65.4	167.4	0	0	0	110.5	V393 L394 I399 I400 W401	V393-I397 HydrophobicContact CG1-CD1 3.83Å; V393-I397 WeakPolarHBondContact O-CG1 3.29Å; V393-I397 PolarHBondContact O-N 2.72Å; L394-I397 PolarHBondContact O-N 3.47Å; I397-I399 PolarHBondContact O-N 3.03Å; I397-I400 PolarHBondContact O-N 2.93Å; I397-W401 WeakPolarHBondContact O-CB 3.22Å; I397-W401 PolarHBondContact O-N 3.27Å
398	G	83.7	Confident	80.2	Confident	35 Å²	35	110.9 Å²	110.9	36%	0.361	54%	0.542	S	S	.	.	H	α-helix	trans	-61.5	-40	177.7	0	0	0	0	0	113.6	L394 L395 T396 W401 K402	L394-G398 PolarHBondContact O-N 2.63Å; L395-G398 PolarHBondContact O-N 2.82Å; T396-G398 VanDerWaalsContact C-N 3.35Å; T396-G398 PolarHBondContact O-N 2.86Å; G398-W401 PolarHBondContact O-N 3.03Å; G398-K402 WeakPolarHBondContact O-CB 3.15Å; G398-K402 PolarHBondContact O-N 2.78Å
399	I	85.5	Confident	78.7	Confident	112 Å²	112	113.1 Å²	113.1	57%	0.574	55%	0.547	S	S	*	.	H	α-helix	trans	-66.4	-43.9	177.9	-66.4	164.5	0	0	0	110.8	L395 T396 I397 W401 K402 C403	L395-I399 VanDerWaalsContact O-CG1 3.3Å; L395-I399 WeakPolarHBondContact O-CG1 3.32Å; L395-I399 PolarHBondContact O-N 2.92Å; L395-I399 VanDerWaalsContact O-N 3.07Å; T396-I399 PolarHBondContact O-N 2.88Å; I397-I399 PolarHBondContact O-N 3.03Å; I399-W401 VanDerWaalsContact C-N 3.32Å; I399-W401 PolarHBondContact O-N 3.27Å; I399-K402 PolarHBondContact O-N 2.95Å; I399-C403 PolarHBondContact O-N 3Å; I399-C403 VanDerWaalsContact O-N 3.09Å
400	I	81.9	Confident	77.3	Confident	110 Å²	110	110.3 Å²	110.3	56%	0.564	54%	0.542	S	S	*	.	H	α-helix	trans	-61.2	-44	178	-67.1	164.9	0	0	0	110.4	T396 I397 K402 C403 F404	T396-I400 VanDerWaalsContact O-CG1 3.31Å; T396-I400 WeakPolarHBondContact O-CG1 3.48Å; T396-I400 PolarHBondContact O-N 3.49Å; T396-I400 VanDerWaalsContact O-N 3.13Å; I397-I400 PolarHBondContact O-N 2.93Å; I400-K402 PolarHBondContact O-N 2.86Å; I400-C403 WeakPolarHBondContact O-CB 3.32Å; I400-C403 PolarHBondContact O-N 3.03Å; I400-F404 PolarHBondContact O-N 2.94Å
401	W	78.2	Confident	75.7	Confident	184 Å²	184	112.2 Å²	112.2	70%	0.697	55%	0.549	S	S	*	.	H	α-helix	trans	-65.6	-39.6	-179.7	-167.5	37.1	0	0	0	112.8	I397 G398 I399 C403 F404 I405	I397-W401 WeakPolarHBondContact O-CB 3.22Å; I397-W401 PolarHBondContact O-N 3.27Å; G398-W401 PolarHBondContact O-N 3.03Å; I399-W401 VanDerWaalsContact C-N 3.32Å; I399-W401 PolarHBondContact O-N 3.27Å; W401-C403 VanDerWaalsContact C-N 3.33Å; W401-C403 PolarHBondContact O-N 2.77Å; W401-F404 WeakPolarHBondContact O-CB 3.41Å; W401-F404 PolarHBondContact O-N 2.93Å; W401-F404 VanDerWaalsContact O-N 3.11Å; W401-I405 HydrophobicContact CD2-CD1 4.42Å; W401-I405 WeakPolarHBondContact O-CG1 3.48Å; W401-I405 PolarHBondContact O-N 3.42Å; W401-I405 VanDerWaalsContact O-N 3.07Å
402	K	77.4	Confident	74.1	Confident	168 Å²	168	116.1 Å²	116.1	73%	0.73	56%	0.557	S	S	*	*	H	α-helix	trans	-65.4	-35.9	176.7	-154.5	177	-172.7	177.2	0	112.1	G398 I399 I400 R406	G398-K402 WeakPolarHBondContact O-CB 3.15Å; G398-K402 PolarHBondContact O-N 2.78Å; I399-K402 PolarHBondContact O-N 2.95Å; I400-K402 PolarHBondContact O-N 2.86Å; K402-R406 PolarHBondContact O-N 2.88Å
403	C	71.1	Confident	72.3	Confident	76 Å²	76	118.2 Å²	118.2	51%	0.514	57%	0.565	S	S	.	*	H	α-helix	trans	-66.1	-36.9	171.5	-79.5	0	0	0	0	112.3	I399 I400 W401 K407	I399-C403 PolarHBondContact O-N 3Å; I399-C403 VanDerWaalsContact O-N 3.09Å; I400-C403 WeakPolarHBondContact O-CB 3.32Å; I400-C403 PolarHBondContact O-N 3.03Å; W401-C403 VanDerWaalsContact C-N 3.33Å; W401-C403 PolarHBondContact O-N 2.77Å; C403-K407 PolarHBondContact O-N 2.93Å
404	F	69.6	Low	70.7	Confident	142 Å²	142	122.4 Å²	122.4	62%	0.623	59%	0.586	S	S	*	*	H	α-helix	trans	-66.1	-43.7	178.8	-133.7	-88.2	0	0	0	112.4	I400 W401 R406 K407 R408	I400-F404 PolarHBondContact O-N 2.94Å; W401-F404 WeakPolarHBondContact O-CB 3.41Å; W401-F404 PolarHBondContact O-N 2.93Å; W401-F404 VanDerWaalsContact O-N 3.11Å; F404-R406 VanDerWaalsContact C-N 3.32Å; F404-R406 PolarHBondContact O-N 2.89Å; F404-K407 PolarHBondContact O-N 2.87Å; F404-R408 PolarHBondContact O-N 3.13Å
405	I	71	Confident	68.9	Low	88 Å²	88	125 Å²	125	45%	0.451	59%	0.592	S	S	.	*	H	α-helix	trans	-64.4	-37.7	-180	-66	170.2	0	0	0	111.4	W401 K407 R408	W401-I405 HydrophobicContact CD2-CD1 4.42Å; W401-I405 WeakPolarHBondContact O-CG1 3.48Å; W401-I405 PolarHBondContact O-N 3.42Å; W401-I405 VanDerWaalsContact O-N 3.07Å; I405-K407 PolarHBondContact O-N 3.26Å; I405-R408 PolarHBondContact O-N 2.74Å
406	R	60.4	Low	67.1	Low	169 Å²	169	124.6 Å²	124.6	64%	0.638	59%	0.587	S	S	*	*	H	α-helix	trans	-67.8	-34.9	-177.5	-153.9	169.6	-173.8	162.8	-0.3	112.6	K402 F404	K402-R406 PolarHBondContact O-N 2.88Å; F404-R406 VanDerWaalsContact C-N 3.32Å; F404-R406 PolarHBondContact O-N 2.89Å
407	K	60.1	Low	65.1	Low	91 Å²	91	123 Å²	123	40%	0.396	58%	0.584	S	S	.	*	H	α-helix	trans	-69.5	-37	176.2	-81.3	178.6	-179.7	155.7	0	113.1	C403 F404 I405 K409 V410 Q411 S452	C403-K407 PolarHBondContact O-N 2.93Å; F404-K407 PolarHBondContact O-N 2.87Å; I405-K407 PolarHBondContact O-N 3.26Å; K407-K409 VanDerWaalsContact C-N 3.32Å; K407-K409 PolarHBondContact O-N 2.95Å; K407-V410 PolarHBondContact O-N 2.86Å; K407-Q411 PolarHBondContact O-N 2.82Å; K407-S452 VanDerWaalsContact NZ-CA 3.3Å
408	R	61.1	Low	63.3	Low	196 Å²	196	124 Å²	124	74%	0.74	60%	0.597	S	S	*	*	H	α-helix	trans	-64.3	-33.7	179.8	-117.4	-178.6	179.5	173.6	0.3	113.3	F404 I405 V410 Y412	F404-R408 PolarHBondContact O-N 3.13Å; I405-R408 PolarHBondContact O-N 2.74Å; R408-V410 VanDerWaalsContact C-N 3.3Å; R408-V410 PolarHBondContact O-N 3.14Å; R408-Y412 PolarHBondContact O-N 2.89Å
409	K	54.7	Low	61.9	Low	159 Å²	159	127.5 Å²	127.5	69%	0.691	61%	0.606	S	S	*	*	H	α-helix	trans	-66.5	-28.2	176.6	-79.4	-172.3	175	-176.3	0	113.6	K407	K407-K409 VanDerWaalsContact C-N 3.32Å; K407-K409 PolarHBondContact O-N 2.95Å
410	V	59.2	Low	60	Low	91 Å²	91	127.1 Å²	127.1	55%	0.552	61%	0.608	S	S	*	*	H	α-helix	trans	-80.7	-41.8	-177.5	-180	0	0	0	0	111.6	K407 R408 Y412 N414	K407-V410 PolarHBondContact O-N 2.86Å; R408-V410 VanDerWaalsContact C-N 3.3Å; R408-V410 PolarHBondContact O-N 3.14Å; V410-Y412 PolarHBondContact O-N 2.92Å; V410-N414 PolarHBondContact O-N 2.85Å
411	Q	55.3	Low	58.1	Low	142 Å²	142	129.3 Å²	129.3	66%	0.664	62%	0.621	S	S	*	*	H	α-helix	trans	-70.6	-32.9	-178.3	-78.3	-177	-26.5	0	0	113.5	K407 K415	K407-Q411 PolarHBondContact O-N 2.82Å; Q411-K415 PolarHBondContact O-N 2.92Å
412	Y	53.9	Low	56	Low	147 Å²	147	130.3 Å²	130.3	58%	0.576	63%	0.626	S	S	*	*	H	α-helix	trans	-69.7	-37.2	-179.7	-156.8	-93.8	0	0	0	112.4	R408 V410 H416 I419	R408-Y412 PolarHBondContact O-N 2.89Å; V410-Y412 PolarHBondContact O-N 2.92Å; Y412-H416 PolarHBondContact O-N 2.87Å; Y412-I419 HydrophobicContact CE1-CD1 4.45Å
413	L	52.1	Low	53.9	Low	123 Å²	123	130.9 Å²	130.9	64%	0.644	63%	0.631	S	S	*	*	H	α-helix	trans	-69.2	-37.6	177.7	-105.1	92.4	0	0	0	113	K415 G417	L413-K415 VanDerWaalsContact C-N 3.31Å; L413-K415 PolarHBondContact O-N 3Å; L413-G417 PolarHBondContact O-N 2.92Å
414	N	56.1	Low	52.3	Low	144 Å²	144	133.8 Å²	133.8	77%	0.77	64%	0.641	S	S	*	*	H	α-helix	trans	-71.1	-25.5	-179.4	-81.8	-3.9	0	0	0	113.4	V410	V410-N414 PolarHBondContact O-N 2.85Å
415	K	52.7	Low	50.6	Low	168 Å²	168	132 Å²	132	73%	0.73	64%	0.643	S	S	*	*	H	α-helix	trans	-97.4	-26.6	-174.3	-154.6	173.7	-174.4	179.6	0	114.1	Q411 L413	Q411-K415 PolarHBondContact O-N 2.92Å; L413-K415 VanDerWaalsContact C-N 3.31Å; L413-K415 PolarHBondContact O-N 3Å
416	H	53.1	Low	48.8	Very low	108 Å²	108	137.8 Å²	137.8	50%	0.5	66%	0.66	S	S	.	*	H	α-helix	trans	-119.5	-3.6	-173	-66	-61.6	0	0	0	114.9	Y412	Y412-H416 PolarHBondContact O-N 2.87Å
417	G	43.7	Very low	47.7	Very low	35 Å²	35	136.2 Å²	136.2	36%	0.361	66%	0.664	S	S	.	*			trans	55.5	175.6	-173.2	0	0	0	0	0	111.7	L413 I419	L413-G417 PolarHBondContact O-N 2.92Å; G417-I419 PolarHBondContact O-N 2.78Å
418	P	49	Very low	46.3	Very low	116 Å²	116	136.6 Å²	136.6	75%	0.753	68%	0.678	S	S	*	*			trans	-66.3	119.8	174.1	26.2	-31	0	0	0	109.8	V420	P418-V420 PolarHBondContact O-N 2.85Å; P418-V420 VanDerWaalsContact O-N 3.14Å
419	I	54.4	Low	45.1	Very low	108 Å²	108	130.9 Å²	130.9	55%	0.554	67%	0.673	S	S	*	*			trans	-71.7	104.4	170.3	-62.8	169.5	0	0	0	107.4	Y412 G417 L421	Y412-I419 HydrophobicContact CE1-CD1 4.45Å; G417-I419 PolarHBondContact O-N 2.78Å; I419-L421 HydrophobicContact CG2-CD1 3.84Å; I419-L421 HydrophobicContact CG2-CG 3.79Å; I419-L421 PolarHBondContact O-N 2.96Å
420	V	44.3	Very low	44.2	Very low	104 Å²	104	131.6 Å²	131.6	63%	0.63	68%	0.679	S	S	*	*			trans	-86.8	93.7	172.1	-177	0	0	0	0	107.8	P418 Y422	P418-V420 PolarHBondContact O-N 2.85Å; P418-V420 VanDerWaalsContact O-N 3.14Å; V420-Y422 HydrophobicContact CB-CE2 4.49Å; V420-Y422 HydrophobicContact CG1-CD2 4.18Å; V420-Y422 HydrophobicContact CG1-CE2 3.76Å; V420-Y422 PolarHBondContact O-N 2.79Å
421	L	42.4	Very low	42.7	Very low	157 Å²	157	131.7 Å²	131.7	82%	0.822	68%	0.683	S	S	*	*			trans	-82.1	109.9	174.8	-86	152.7	0	0	0	109.6	I419	I419-L421 HydrophobicContact CG2-CD1 3.84Å; I419-L421 HydrophobicContact CG2-CG 3.79Å; I419-L421 PolarHBondContact O-N 2.96Å
422	Y	34.8	Very low	41.7	Very low	205 Å²	205	131.8 Å²	131.8	80%	0.804	69%	0.688	S	S	*	*			trans	-73.6	148.9	171.6	-76.6	-94.4	0	0	0	111.5	V420	V420-Y422 HydrophobicContact CB-CE2 4.49Å; V420-Y422 HydrophobicContact CG1-CD2 4.18Å; V420-Y422 HydrophobicContact CG1-CE2 3.76Å; V420-Y422 PolarHBondContact O-N 2.79Å
423	H	32.3	Very low	40.8	Very low	180 Å²	180	136 Å²	136	83%	0.833	71%	0.705	S	S	*	*			trans	-51.8	142.8	178.7	-69.5	-78.1	0	0	0	114.9
424	N	37.6	Very low	39.7	Very low	136 Å²	136	133.5 Å²	133.5	73%	0.727	71%	0.708	S	S	*	*				-156.3	116.1	120.6	-159	-9.8	0	0	0	111.9
425	P	34.2	Very low	38.6	Very low	104 Å²	104	131.8 Å²	131.8	68%	0.675	71%	0.708	S	S	*	*			trans	-81.3	114.1	170.7	30.7	-28.7	0	0	0	109.8
426	R	34.1	Very low	37.4	Very low	211 Å²	211	128.9 Å²	128.9	80%	0.796	71%	0.709	S	S	*	*			trans	-162	133.6	157.4	-110.4	175.1	-133.8	-160.6	2.7	111.8
427	N	35.7	Very low	36.4	Very low	136 Å²	136	130.1 Å²	130.1	73%	0.727	73%	0.728	S	S	*	*			trans	75.7	100.8	150.6	-64.2	-0	0	0	0	116.2
428	S	32.5	Very low	36	Very low	98 Å²	98	133.7 Å²	133.7	69%	0.685	74%	0.744	S	S	*	*				74.5	120.4	67.8	72	0	0	0	0	112.4
429	A	34.6	Very low	35	Very low	76 Å²	76	135.6 Å²	135.6	63%	0.628	75%	0.748	S	S	*	*			trans	73.2	125.9	143.8	0	0	0	0	0	115.6
430	Q	35.3	Very low	33.9	Very low	175 Å²	175	137.2 Å²	137.2	82%	0.818	76%	0.757	S	S	*	*				109.6	102.3	110.2	-97.3	162.9	-11.4	0	0	108.2
431	S	29.5	Very low	33.6	Very low	92 Å²	92	141.9 Å²	141.9	64%	0.643	77%	0.772	S	S	*	*				95.7	125.9	79.6	66.2	0	0	0	0	109.9
432	N	32.7	Very low	32.9	Very low	145 Å²	145	141.8 Å²	141.8	78%	0.775	77%	0.767	S	S	*	*			trans	42.4	103.6	144.6	-70.6	-9.8	0	0	0	117.3
433	Y	35.4	Very low	32.6	Very low	236 Å²	236	140.7 Å²	140.7	93%	0.925	77%	0.767	S	S	*	*				-149.2	120.9	127.1	-93.3	-75.7	0	0	0	108.6
434	G	30	Very low	32.6	Very low	69 Å²	69	140.7 Å²	140.7	71%	0.711	77%	0.769	S	S	*	*			trans	-70.4	146.6	158.1	0	0	0	0	0	109.7
435	S	31.5	Very low	32	Very low	109 Å²	109	141.7 Å²	141.7	76%	0.762	78%	0.775	S	S	*	*			trans	177.1	122.5	140.6	37.2	0	0	0	0	109.8
436	S	28.8	Very low	32	Very low	107 Å²	107	144.5 Å²	144.5	75%	0.748	78%	0.783	S	S	*	*			trans	4.9	124	146.2	54.5	0	0	0	0	118.9
437	C	31.2	Very low	31.6	Very low	133 Å²	133	139.6 Å²	139.6	90%	0.899	78%	0.776	S	S	*	*			trans	-149.6	106.7	141.8	-108.2	0	0	0	0	109.8
438	P	34.9	Very low	31.2	Very low	110 Å²	110	142.2 Å²	142.2	71%	0.714	78%	0.777	S	S	*	*			trans	-97.8	119.2	157.9	31.8	-21.2	0	0	0	109.4
439	L	29.4	Very low	31	Very low	157 Å²	157	145.2 Å²	145.2	82%	0.822	78%	0.78	S	S	*	*			trans	173.6	127.1	134.7	-118.9	83.8	0	0	0	111.3
440	N	31.5	Very low	31	Very low	141 Å²	141	147.9 Å²	147.9	75%	0.754	78%	0.784	S	S	*	*			trans	14.3	112.6	146.9	-76	-16.4	0	0	0	119.3
441	Q	36.5	Very low	30.8	Very low	203 Å²	203	144 Å²	144	95%	0.949	77%	0.772	S	S	*	*			trans	-128.8	113.2	139.7	-73.3	-167.7	-21	0	0	109.6
442	H	28.7	Very low	30.7	Very low	155 Å²	155	142.5 Å²	142.5	72%	0.718	76%	0.762	S	S	*	*			trans	-86.9	161.9	172.2	-108.9	-46.6	0	0	0	110.6
443	F	28.7	Very low	30.7	Very low	182 Å²	182	141.9 Å²	141.9	80%	0.798	76%	0.758	S	S	*	*			trans	84.1	111.5	162.6	-60.4	-74	0	0	0	117.7
444	M	31.8	Very low	30.9	Very low	179 Å²	179	137.8 Å²	137.8	88%	0.882	75%	0.751	S	S	*	*				-166	138.2	79.2	-83.6	-149.2	-87.3	0	0	112
445	N	26.2	Very low	30.9	Very low	157 Å²	157	139.8 Å²	139.8	84%	0.84	75%	0.751	S	S	*	*			trans	-84	133.6	168.8	-89.3	-21	0	0	0	109.7
446	I	33.3	Very low	31.2	Very low	164 Å²	164	138.3 Å²	138.3	84%	0.841	74%	0.739	S	S	*	*			trans	-135.5	118.4	154.9	-58.8	179.2	0	0	0	107.5
447	T	26.1	Very low	31.3	Very low	107 Å²	107	141.4 Å²	141.4	66%	0.656	75%	0.747	S	S	*	*			trans	-106.3	-179.5	178.1	45.7	0	0	0	0	111
448	Y	26.8	Very low	31.3	Very low	192 Å²	192	142 Å²	142	75%	0.753	74%	0.739	S	S	*	*			trans	89.2	104.1	-175.8	-71.7	-89.9	0	0	0	113.5
449	E	29.1	Very low	30.9	Very low	160 Å²	160	142.3 Å²	142.3	75%	0.748	74%	0.74	S	S	*	*				57.4	131.8	79.4	-62.4	-176.9	163.4	0	0	110.1
450	D	33.8	Very low	30.9	Very low	133 Å²	133	144 Å²	144	71%	0.711	74%	0.74	S	S	*	*			cis	-176.3	170.7	43.3	-160.9	-4.1	0	0	0	108.9
451	T	30.3	Very low	31.1	Very low	93 Å²	93	142.5 Å²	142.5	57%	0.571	74%	0.741	S	S	*	*			trans	79	100.5	154.5	67.2	0	0	0	0	120.8
452	S	29.2	Very low	31	Very low	60 Å²	60	137.5 Å²	137.5	42%	0.42	73%	0.726	S	S	.	*				20.1	126.3	114.1	50.6	0	0	0	0	119.6	K407	K407-S452 VanDerWaalsContact NZ-CA 3.3Å
453	N	31.6	Very low	31.2	Very low	132 Å²	132	137.7 Å²	137.7	71%	0.706	73%	0.732	S	S	*	*				179.7	136.6	94.4	-75.3	-45.3	0	0	0	106.4
454	I	39.3	Very low	31.2	Very low	150 Å²	150	133.9 Å²	133.9	77%	0.769	73%	0.734	S	S	*	*				177	152	81	-78.7	-175.4	0	0	0	105.7
455	P	31	Very low	31.4	Very low	111 Å²	111	130.1 Å²	130.1	72%	0.721	73%	0.732	S	S	*	*			trans	-100.3	170.5	-156.1	37.9	-28.5	0	0	0	113.7
456	P	38.3	Very low	31.6	Very low	78 Å²	78	133 Å²	133	51%	0.506	73%	0.732	S	S	.	*			trans	-124.7	120.6	153.2	30.1	-13.4	0	0	0	111.9
457	L	29.1	Very low	31.3	Very low	173 Å²	173	129.8 Å²	129.8	91%	0.906	72%	0.724	S	S	*	*			trans	31.8	116.6	143.1	-123.3	72.4	0	0	0	120.2
458	I	31	Very low	31.7	Very low	145 Å²	145	135.8 Å²	135.8	74%	0.744	74%	0.735	S	S	*	*			trans	-88.5	166.7	170.7	-53.1	171.6	0	0	0	109
459	T	28.4	Very low	32	Very low	117 Å²	117	134.1 Å²	134.1	72%	0.718	73%	0.734	S	S	*	*			trans	97.4	134.4	152.3	74.2	0	0	0	0	114.7
460	K	28.9	Very low	32.2	Very low	192 Å²	192	133.4 Å²	133.4	84%	0.835	73%	0.734	S	S	*	*			cis	-160.9	140.6	22.8	-123.2	156.9	-174	-174.1	0	109.1
461	S	35.8	Very low	32	Very low	109 Å²	109	135.4 Å²	135.4	76%	0.762	74%	0.74	S	S	*	*			trans	-80.1	146.3	152.1	-179.6	0	0	0	0	107.6
462	P	34.2	Very low	32.4	Very low	99 Å²	99	136.5 Å²	136.5	64%	0.643	75%	0.748	S	S	*	*				-153.9	147.6	96.8	36.1	-16.6	0	0	0	114.4
463	N	32.8	Very low	32.6	Very low	158 Å²	158	138.6 Å²	138.6	85%	0.845	76%	0.763	S	S	*	*				178.8	118.9	120.8	-85.4	-21	0	0	0	110.8
464	A	28.3	Very low	32.4	Very low	102 Å²	102	139 Å²	139	84%	0.843	77%	0.77	S	S	*	*			trans	-97.1	142.9	165.5	0	0	0	0	0	108.8
465	A	36.2	Very low	32.3	Very low	100 Å²	100	139 Å²	139	83%	0.826	77%	0.77	S	S	*	*			trans	-167.2	99.1	154.1	0	0	0	0	0	107.4
466	Y	30.1	Very low	32.4	Very low	219 Å²	219	139.1 Å²	139.1	86%	0.859	77%	0.771	S	S	*	*				78.3	100.8	85.3	-140.3	-89.8	0	0	0	115.1
467	S	27.8	Very low	32.1	Very low	95 Å²	95	142.6 Å²	142.6	66%	0.664	79%	0.785	S	S	*	*			trans	27.5	124.6	138.3	-47.1	0	0	0	0	121.7
468	R	34.3	Very low	32.6	Very low	234 Å²	234	143.1 Å²	143.1	88%	0.883	78%	0.783	S	S	*	*			trans	-149.3	122.2	140.9	-92.6	-168.4	-160.2	163.6	8.3	110.9
469	Q	33.4	Very low	32.6	Very low	156 Å²	156	146.2 Å²	146.2	73%	0.729	79%	0.787	S	S	*	*				76.2	96	111.7	-59.4	-78	-38.3	0	0	112.8
470	L	32.3	Very low	32.9	Very low	145 Å²	145	147.4 Å²	147.4	76%	0.759	79%	0.789	S	S	*	*				76	107.9	93.3	-97.2	104.5	0	0	0	114.4
471	E	29.6	Very low	33.1	Very low	176 Å²	176	146.9 Å²	146.9	82%	0.822	79%	0.789	S	S	*	*			trans	14.1	165.2	142.2	-64.3	-180	-179.6	0	0	122
472	P	39	Very low	33.1	Very low	115 Å²	115	146.8 Å²	146.8	75%	0.747	79%	0.787	S	S	*	*			cis	-133.3	149.4	-43.4	35.8	-19.9	0	0	0	111.4
473	S	32.6	Very low	33.4	Very low	104 Å²	104	148.5 Å²	148.5	73%	0.727	79%	0.791	S	S	*	*			trans	-134.6	100	171.1	63	0	0	0	0	111.7	I475	S473-I475 PolarHBondContact O-N 3.11Å
474	T	28.3	Very low	33.5	Very low	142 Å²	142	146.3 Å²	146.3	87%	0.871	79%	0.786	S	S	*	*			trans	16.9	99.1	135.3	-19.9	0	0	0	0	116.6
475	I	37.4	Very low	33.6	Very low	148 Å²	148	147.7 Å²	147.7	76%	0.759	78%	0.778	S	S	*	*			trans	-138.7	131.4	153.8	-56.4	-180	0	0	0	107.7	S473	S473-I475 PolarHBondContact O-N 3.11Å
476	P	33.1	Very low	33.5	Very low	115 Å²	115	146.8 Å²	146.8	75%	0.747	78%	0.779	S	S	*	*			trans	-82	142.8	-171	-2.8	22.9	0	0	0	112.2	E478	P476-E478 PolarHBondContact O-N 3.36Å
477	D	31.9	Very low	33.6	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	77%	0.772	S	S	*	*			trans	-70.2	101.1	173.2	-55.3	-50.8	0	0	0	110.4
478	E	39.4	Very low	33.7	Very low	184 Å²	184	149.6 Å²	149.6	86%	0.86	78%	0.784	S	S	*	*			trans	-101.7	104.5	166.3	-169.3	95.4	-158.1	0	0	107.6	P476 D480	P476-E478 PolarHBondContact O-N 3.36Å; E478-D480 PolarHBondContact O-N 2.85Å
479	Y	31.9	Very low	33.8	Very low	211 Å²	211	143.4 Å²	143.4	83%	0.827	78%	0.783	S	S	*	*			trans	-68.8	116.8	177.2	-90.4	-101.3	0	0	0	110.9
480	D	33.2	Very low	33.6	Very low	141 Å²	141	138.6 Å²	138.6	75%	0.754	78%	0.775	S	S	*	*			trans	-144.8	84.1	161.8	-160.2	8.3	0	0	0	109.4	E478	E478-D480 PolarHBondContact O-N 2.85Å
481	E	34.2	Very low	33.6	Very low	181 Å²	181	139.1 Å²	139.1	85%	0.846	79%	0.785	S	S	*	*			trans	-113.5	88.1	171.3	-77	-177.5	167.4	0	0	108.9	D483	E481-D483 PolarHBondContact O-N 3.38Å
482	C	34.7	Very low	33.6	Very low	107 Å²	107	133.3 Å²	133.3	72%	0.723	77%	0.772	S	S	*	*			trans	-65.4	105.8	154.2	-69	0	0	0	0	108.1	P484	C482-P484 WeakPolarHBondContact O-CD 3.27Å
483	D	41.5	Very low	33.1	Very low	135 Å²	135	135.9 Å²	135.9	72%	0.722	78%	0.777	S	S	*	*			trans	-76.2	113.1	172.6	-174.1	1.7	0	0	0	110.4	E481 L485	E481-D483 PolarHBondContact O-N 3.38Å; D483-L485 PolarHBondContact OD1-N 3Å
484	P	34.4	Very low	33	Very low	113 Å²	113	141.2 Å²	141.2	73%	0.734	78%	0.783	S	S	*	*			trans	-107.1	64.9	177.2	36	-17.8	0	0	0	109.2	C482	C482-P484 WeakPolarHBondContact O-CD 3.27Å
485	L	31	Very low	33.1	Very low	130 Å²	130	143.6 Å²	143.6	68%	0.681	78%	0.784	S	S	*	*			trans	-127.3	73.2	166.5	-70.9	177.4	0	0	0	110.6	D483 I487	D483-L485 PolarHBondContact OD1-N 3Å; L485-I487 VanDerWaalsContact C-N 3.28Å; L485-I487 PolarHBondContact O-N 2.89Å
486	G	34.3	Very low	32.9	Very low	82 Å²	82	142.3 Å²	142.3	85%	0.845	78%	0.784	S	S	*	*			trans	-60	91.6	157.3	0	0	0	0	0	109.9
487	I	32.2	Very low	33	Very low	137 Å²	137	140.1 Å²	140.1	70%	0.703	78%	0.782	S	S	*	*			trans	-120.4	108.3	167.4	-55.1	-178.9	0	0	0	107.7	L485 A489	L485-I487 VanDerWaalsContact C-N 3.28Å; L485-I487 PolarHBondContact O-N 2.89Å; I487-A489 PolarHBondContact O-N 3.22Å
488	Y	30	Very low	32.9	Very low	235 Å²	235	142.2 Å²	142.2	92%	0.922	79%	0.785	S	S	*	*			trans	-41.1	113.2	168.4	-83.6	-103.9	0	0	0	112.3
489	A	35.4	Very low	32.8	Very low	105 Å²	105	138.8 Å²	138.8	87%	0.868	78%	0.778	S	S	*	*			trans	-98.1	94.8	154.3	0	0	0	0	0	107.6	I487	I487-A489 PolarHBondContact O-N 3.22Å
490	G	30.1	Very low	33.1	Very low	55 Å²	55	134.6 Å²	134.6	57%	0.567	78%	0.777	S	S	*	*			trans	-76.6	155.1	169.9	0	0	0	0	0	111.9
491	T	31.2	Very low	33.2	Very low	156 Å²	156	135.7 Å²	135.7	96%	0.957	78%	0.783	S	S	*	*			trans	87.9	119.7	159.3	71.8	0	0	0	0	118.5
492	G	30.5	Very low	33.3	Very low	53 Å²	53	135.3 Å²	135.3	55%	0.546	78%	0.781	S	S	.	*			trans	135.5	59.7	167	0	0	0	0	0	113.5
493	I	27.7	Very low	33.2	Very low	169 Å²	169	138.3 Å²	138.3	87%	0.867	79%	0.79	S	S	*	*				47.7	91.3	101.9	-43.7	174.1	0	0	0	113.8
494	Y	30.4	Very low	32.9	Very low	217 Å²	217	138.4 Å²	138.4	85%	0.851	79%	0.789	S	S	*	*			trans	-151.9	99.9	141.6	43	-86.6	0	0	0	107.6
495	E	30.5	Very low	32.8	Very low	191 Å²	191	140.9 Å²	140.9	89%	0.893	79%	0.791	S	S	*	*			trans	-107	106.2	176.5	-166	174.5	-155.1	0	0	106.5	G497	E495-G497 PolarHBondContact O-N 3.22Å
496	T	33.6	Very low	32.7	Very low	121 Å²	121	138.8 Å²	138.8	74%	0.742	80%	0.801	S	S	*	*			trans	-88.7	93.7	171.3	51.7	0	0	0	0	108.1	F498	T496-F498 PolarHBondContact O-N 3.33Å
497	G	34.4	Very low	32.8	Very low	70 Å²	70	140.4 Å²	140.4	72%	0.722	79%	0.794	S	S	*	*			trans	-71.8	116	170	0	0	0	0	0	110.8	E495	E495-G497 PolarHBondContact O-N 3.22Å
498	F	31.1	Very low	32.7	Very low	193 Å²	193	141.2 Å²	141.2	85%	0.846	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-89.4	126	160.7	-84.2	-92.4	0	0	0	108.3	T496	T496-F498 PolarHBondContact O-N 3.33Å
499	P	37.3	Very low	32.9	Very low	112 Å²	112	137.5 Å²	137.5	73%	0.727	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.7	145	178.6	30	-31.7	0	0	0	111.2
500	P	37.3	Very low	32.7	Very low	124 Å²	124	141.4 Å²	141.4	81%	0.805	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-78.9	143	-179.4	30.3	-32.1	0	0	0	112.5	E502	P500-E502 PolarHBondContact O-N 2.81Å
501	D	35.6	Very low	32.9	Very low	163 Å²	163	146.6 Å²	146.6	87%	0.872	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-54.5	127	179.1	-71.9	-49.7	0	0	0	113
502	E	35.3	Very low	32.8	Very low	174 Å²	174	146.1 Å²	146.1	81%	0.813	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-75	121.5	170.8	-77.4	-176.3	155.7	0	0	110.6	P500 I504	P500-E502 PolarHBondContact O-N 2.81Å; E502-I504 PolarHBondContact O-N 3Å
503	N	34	Very low	33.1	Very low	170 Å²	170	149.2 Å²	149.2	91%	0.909	81%	0.81	S	S	*	*			trans	-69.7	106.1	170.8	-76.5	-54.8	0	0	0	110.1
504	I	33.9	Very low	33.4	Very low	136 Å²	136	147.8 Å²	147.8	70%	0.697	80%	0.803	S	S	*	*			trans	-94.3	113.9	175	-69.9	176.8	0	0	0	110.4	E502	E502-I504 PolarHBondContact O-N 3Å
505	E	33.3	Very low	33.3	Very low	165 Å²	165	142.9 Å²	142.9	77%	0.771	80%	0.796	S	S	*	*			trans	60.2	97.9	138.3	-61.1	178.7	166.9	0	0	119.9
506	G	29.2	Very low	33.3	Very low	87 Å²	87	140.5 Å²	140.5	90%	0.897	80%	0.795	S	S	*	*			trans	-87.4	111.9	142	0	0	0	0	0	109.6
507	V	35.5	Very low	33.3	Very low	115 Å²	115	141.7 Å²	141.7	70%	0.697	80%	0.802	S	S	*	*			trans	-118.7	106.4	165.9	176.3	0	0	0	0	107.9	N509	V507-N509 PolarHBondContact O-N 3.32Å
508	D	30.8	Very low	33.2	Very low	154 Å²	154	141.5 Å²	141.5	82%	0.824	80%	0.8	S	S	*	*			trans	-53.8	124.8	161.3	-89.1	-43.9	0	0	0	109.7
509	N	34.2	Very low	33.1	Very low	157 Å²	157	144.2 Å²	144.2	84%	0.84	81%	0.805	S	S	*	*			trans	-143.7	113.4	144.1	-105.5	-25.6	0	0	0	111.3	V507	V507-N509 PolarHBondContact O-N 3.32Å
510	K	30.3	Very low	33	Very low	187 Å²	187	146 Å²	146	81%	0.813	81%	0.807	S	S	*	*			trans	-50.4	133.1	162.4	-67	164.4	174	170.4	0	109.4
511	D	34.9	Very low	32.8	Very low	165 Å²	165	145.5 Å²	145.5	88%	0.882	81%	0.806	S	S	*	*			trans	-159.3	101.3	133	-90.2	-32.6	0	0	0	108.4
512	N	29.3	Very low	33	Very low	145 Å²	145	145 Å²	145	78%	0.775	80%	0.803	S	S	*	*			trans	-109.6	105.7	177.2	-172.5	15.5	0	0	0	107.3
513	P	37.3	Very low	33.2	Very low	118 Å²	118	141.9 Å²	141.9	77%	0.766	80%	0.799	S	S	*	*			trans	-87.3	123.7	164.5	18	-3.4	0	0	0	109.5
514	L	32.6	Very low	33.3	Very low	139 Å²	139	143.4 Å²	143.4	73%	0.728	80%	0.797	S	S	*	*			trans	-57.3	141.3	175.8	-82.3	93.2	0	0	0	113.7
515	T	28.5	Very low	33.5	Very low	114 Å²	114	144 Å²	144	70%	0.699	80%	0.802	S	S	*	*			trans	50.7	112	135.6	65.2	0	0	0	0	119.6
516	T	31.5	Very low	33.9	Very low	142 Å²	142	144.5 Å²	144.5	87%	0.871	80%	0.804	S	S	*	*			trans	-142	99.7	137.3	-43.9	0	0	0	0	109.9	G518	T516-G518 PolarHBondContact O-N 2.9Å
517	T	32.7	Very low	34.4	Very low	145 Å²	145	145 Å²	145	89%	0.89	79%	0.794	S	S	*	*			trans	-72.2	95.6	163.7	41.6	0	0	0	0	109
518	G	32	Very low	34.6	Very low	66 Å²	66	144.1 Å²	144.1	68%	0.68	80%	0.799	S	S	*	*			trans	-102.8	94.4	171.8	0	0	0	0	0	110.9	T516 I520	T516-G518 PolarHBondContact O-N 2.9Å; G518-I520 PolarHBondContact O-N 3.26Å
519	R	29.9	Very low	35.9	Very low	250 Å²	250	142.3 Å²	142.3	94%	0.943	80%	0.796	S	S	*	*			trans	-67.1	114.1	159.2	-99.1	179.3	177.3	167.6	-0.9	107.5
520	I	34.7	Very low	36.7	Very low	149 Å²	149	140.8 Å²	140.8	76%	0.764	80%	0.795	S	S	*	*			trans	-127.8	110.2	155.7	-60.8	-178.6	0	0	0	106.6	G518	G518-I520 PolarHBondContact O-N 3.26Å
521	S	33.5	Very low	37.2	Very low	114 Å²	114	139.9 Å²	139.9	80%	0.797	80%	0.798	S	S	*	*			trans	-69.5	112.3	166.6	44.2	0	0	0	0	108.9
522	D	40.1	Very low	37.8	Very low	152 Å²	152	137.9 Å²	137.9	81%	0.813	79%	0.793	S	S	*	*			trans	-89.1	129.8	166.1	-97	-35.3	0	0	0	110.1
523	P	39.5	Very low	38.3	Very low	110 Å²	110	138.8 Å²	138.8	71%	0.714	80%	0.798	S	S	*	*			trans	-85.2	144.4	-177.8	18.4	-5.3	0	0	0	112.7	N525	P523-N525 PolarHBondContact O-N 3Å
524	F	36.3	Very low	38.1	Very low	201 Å²	201	144.2 Å²	144.2	88%	0.882	80%	0.803	S	S	*	*			trans	-30.5	117.5	163.2	-73.2	-101.4	0	0	0	113.5
525	N	38.4	Very low	38.4	Very low	149 Å²	149	142.6 Å²	142.6	80%	0.797	80%	0.804	S	S	*	*			trans	-116.6	87.6	159.1	-165	10.3	0	0	0	108.3	P523 S527	P523-N525 PolarHBondContact O-N 3Å; N525-S527 PolarHBondContact O-N 2.89Å
526	E	40.2	Very low	38.6	Very low	175 Å²	175	146 Å²	146	82%	0.818	81%	0.812	S	S	*	*			trans	-69.6	108.4	165.3	-79.9	-179.6	149.5	0	0	108.6
527	S	40.9	Very low	38.8	Very low	98 Å²	98	145.2 Å²	145.2	69%	0.685	81%	0.807	S	S	*	*			trans	-148.8	83.2	158.2	-72.4	0	0	0	0	107	N525 P529	N525-S527 PolarHBondContact O-N 2.89Å; S527-P529 WeakPolarHBondContact O-CD 3.07Å
528	A	39.5	Very low	38.9	Very low	97 Å²	97	149.9 Å²	149.9	80%	0.802	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-64.9	125.1	169	0	0	0	0	0	108.3
529	P	57.9	Low	39	Very low	115 Å²	115	150.1 Å²	150.1	75%	0.747	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-66.6	146.3	-178.6	22.9	-30.1	0	0	0	111.8	S527	S527-P529 WeakPolarHBondContact O-CD 3.07Å
530	P	50.4	Low	39.1	Very low	126 Å²	126	143.7 Å²	143.7	82%	0.818	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-67.3	139.8	-176.2	25.4	-32.5	0	0	0	112.5
531	L	40.7	Very low	39.1	Very low	168 Å²	168	142.3 Å²	142.3	88%	0.88	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-63.9	136.8	177.7	-75.3	157.4	0	0	0	111.2
532	P	47.3	Very low	39	Very low	122 Å²	122	142 Å²	142	79%	0.792	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-70.5	140.9	179.4	26.4	-31.7	0	0	0	112.4
533	D	40.2	Very low	38.6	Very low	164 Å²	164	141.7 Å²	141.7	88%	0.877	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.6	133	-176.9	-157.6	-0.3	0	0	0	111.8	S535	D533-S535 PolarHBondContact O-N 3.07Å
534	R	33.4	Very low	38.1	Very low	232 Å²	232	144.7 Å²	144.7	88%	0.875	81%	0.806	S	S	*	*			trans	-86	100.7	-170.8	-170.5	-178.7	-158.9	-178.6	6.2	109.5	E536	R534-E536 PolarHBondContact O-N 2.78Å
535	S	38	Very low	38	Very low	105 Å²	105	143.3 Å²	143.3	73%	0.734	80%	0.804	S	S	*	*			trans	-65.6	116.5	176	62	0	0	0	0	111.9	D533 T537	D533-S535 PolarHBondContact O-N 3.07Å; S535-T537 PolarHBondContact O-N 2.95Å
536	E	33.4	Very low	37.7	Very low	187 Å²	187	142.3 Å²	142.3	87%	0.874	80%	0.803	S	S	*	*			trans	-72.9	110.9	167.8	-64.3	-175.8	163.4	0	0	109.8	R534	R534-E536 PolarHBondContact O-N 2.78Å
537	T	35	Very low	37	Very low	125 Å²	125	143.5 Å²	143.5	77%	0.767	80%	0.802	S	S	*	*			trans	-161.8	81.4	162.4	6.8	0	0	0	0	109.9	S535	S535-T537 PolarHBondContact O-N 2.95Å
538	Y	35.6	Very low	36.5	Very low	243 Å²	243	145.4 Å²	145.4	95%	0.953	80%	0.804	S	S	*	*			trans	-93.8	90	161.4	-84.3	-83.2	0	0	0	108.4
539	G	34.3	Very low	36.1	Very low	70 Å²	70	148.7 Å²	148.7	72%	0.722	80%	0.8	S	S	*	*			trans	-95.8	110.6	164.9	0	0	0	0	0	109.4
540	S	31.5	Very low	34.8	Very low	116 Å²	116	151.5 Å²	151.5	81%	0.811	81%	0.809	S	S	*	*			trans	-61.7	130.5	-179.6	-54.6	0	0	0	0	112	S542	S540-S542 PolarHBondContact O-N 3.23Å
541	P	34.3	Very low	34	Very low	119 Å²	119	152.9 Å²	152.9	77%	0.773	81%	0.805	S	S	*	*			trans	-82.1	117.9	-175.9	30.8	-31.4	0	0	0	111.4	I543	P541-I543 PolarHBondContact O-N 3.03Å
542	S	31.6	Very low	33.4	Very low	109 Å²	109	149.5 Å²	149.5	76%	0.762	80%	0.795	S	S	*	*			trans	-74.1	108.3	166.7	49.2	0	0	0	0	110	S540 Q544	S540-S542 PolarHBondContact O-N 3.23Å; S542-Q544 PolarHBondContact O-N 2.81Å
543	I	31.8	Very low	32.7	Very low	145 Å²	145	151.5 Å²	151.5	74%	0.744	80%	0.797	S	S	*	*			trans	-73.1	110.8	174	-67.3	171.4	0	0	0	108.6	P541 M545	P541-I543 PolarHBondContact O-N 3.03Å; I543-M545 HydrophobicContact CG2-CE 4.46Å; I543-M545 HydrophobicContact CG2-CG 3.97Å
544	Q	30.8	Very low	32.3	Very low	173 Å²	173	150.5 Å²	150.5	81%	0.808	79%	0.792	S	S	*	*			trans	-114.8	89.4	173.9	-146	167.3	1.6	0	0	107.5	S542 V546	S542-Q544 PolarHBondContact O-N 2.81Å; Q544-V546 PolarHBondContact O-N 3.34Å
545	M	32.7	Very low	32.1	Very low	171 Å²	171	148.8 Å²	148.8	84%	0.842	79%	0.791	S	S	*	*			trans	-79.8	111.4	172.8	-73.5	-169	-72.2	0	0	108.9	I543	I543-M545 HydrophobicContact CG2-CE 4.46Å; I543-M545 HydrophobicContact CG2-CG 3.97Å
546	V	31.8	Very low	31.8	Very low	129 Å²	129	153.5 Å²	153.5	78%	0.782	80%	0.801	S	S	*	*			trans	-91.6	133.9	176.5	174.7	0	0	0	0	109.5	Q544	Q544-V546 PolarHBondContact O-N 3.34Å
547	Y	27.1	Very low	31.4	Very low	200 Å²	200	156 Å²	156	78%	0.784	80%	0.803	S	S	*	*			trans	-47.7	148.4	173.3	-84.4	-112.2	0	0	0	114.3
548	D	30.4	Very low	31.1	Very low	138 Å²	138	155.5 Å²	155.5	74%	0.738	80%	0.802	S	S	*	*				174.6	157.7	112	-92.2	-28.3	0	0	0	113.9
549	F	30.7	Very low	30.9	Very low	165 Å²	165	152.5 Å²	152.5	72%	0.724	80%	0.796	S	S	*	*			trans	88.4	78.9	167.8	-73.8	-85.7	0	0	0	119.7
550	N	30.6	Very low	30.6	Very low	174 Å²	174	154.2 Å²	154.2	93%	0.93	80%	0.797	S	S	*	*			trans	-113.6	114	145.6	-88.8	-30.2	0	0	0	109.4
551	Q	33.2	Very low	30.8	Very low	156 Å²	156	153.9 Å²	153.9	73%	0.729	79%	0.792	S	S	*	*			trans	-106.1	115.7	174	-103.9	-171.3	43.2	0	0	111.1
552	S	28.1	Very low	30.6	Very low	97 Å²	97	152.7 Å²	152.7	68%	0.678	79%	0.787	S	S	*	*			trans	51	99.1	134.2	52.2	0	0	0	0	120.2
553	I	33.4	Very low	30.6	Very low	163 Å²	163	155.5 Å²	155.5	84%	0.836	79%	0.794	S	S	*	*			trans	-136.1	111.7	142.7	-62.4	-175.1	0	0	0	110.9
554	N	31.3	Very low	30.4	Very low	144 Å²	144	155 Å²	155	77%	0.77	80%	0.797	S	S	*	*			trans	34.7	104.7	148.3	-74.3	-37.1	0	0	0	122.4
555	K	28.4	Very low	30.5	Very low	196 Å²	196	151.3 Å²	151.3	85%	0.852	79%	0.79	S	S	*	*				2.9	117.2	127.7	-65.9	176.5	178.7	175.1	0	116.8
556	Q	32.8	Very low	30.2	Very low	203 Å²	203	149.3 Å²	149.3	95%	0.949	79%	0.788	S	S	*	*			trans	-150.8	120.7	134.6	-102.7	172.3	19	0	0	108.9
557	R	23.5	Very low	30.2	Very low	239 Å²	239	152.1 Å²	152.1	90%	0.902	79%	0.79	S	S	*	*			trans	-116.6	128.8	179.8	-172.8	-175.8	-154.1	178.1	7.5	106.3
558	P	30.2	Very low	30.4	Very low	115 Å²	115	147.9 Å²	147.9	75%	0.747	79%	0.785	S	S	*	*				-146.2	138.2	117.4	27.5	-7.1	0	0	0	115.3
559	Q	31.5	Very low	30.4	Very low	180 Å²	180	148.6 Å²	148.6	84%	0.841	79%	0.789	S	S	*	*			trans	64.2	105.2	137.7	-57.9	-168.5	-4.6	0	0	121.7
560	S	26.4	Very low	30.5	Very low	106 Å²	106	147.9 Å²	147.9	74%	0.741	79%	0.793	S	S	*	*			trans	-48.4	165.5	142.2	53.2	0	0	0	0	113.6
561	P	35.3	Very low	30.3	Very low	109 Å²	109	148.7 Å²	148.7	71%	0.708	79%	0.788	S	S	*	*			cis	-150.4	163	33.6	43.8	-22.8	0	0	0	119.1
562	S	30	Very low	30.3	Very low	94 Å²	94	148 Å²	148	66%	0.657	79%	0.79	S	S	*	*			trans	32.4	120.8	142.3	62.1	0	0	0	0	121
563	N	32.3	Very low	30.4	Very low	169 Å²	169	149.9 Å²	149.9	90%	0.904	79%	0.792	S	S	*	*			trans	-146.2	109.6	131.9	-96.2	-23.8	0	0	0	109.8
564	V	28.1	Very low	30.1	Very low	133 Å²	133	147.5 Å²	147.5	81%	0.806	79%	0.79	S	S	*	*			trans	-93.3	115.1	169.7	172.8	0	0	0	0	106
565	S	31.7	Very low	30	Very low	97 Å²	97	146.7 Å²	146.7	68%	0.678	79%	0.79	S	S	*	*			trans	-133.1	97.8	164.8	60.6	0	0	0	0	108.9	F567	S565-F567 PolarHBondContact O-N 2.82Å
566	T	28.2	Very low	30.3	Very low	128 Å²	128	142.9 Å²	142.9	79%	0.785	78%	0.784	S	S	*	*			trans	-62.7	113.7	166.9	-28.3	0	0	0	0	108
567	F	31.8	Very low	29.9	Very low	189 Å²	189	144.3 Å²	144.3	83%	0.829	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-102.7	120.6	169.8	-108.4	-89.2	0	0	0	109.4	S565	S565-F567 PolarHBondContact O-N 2.82Å
568	T	31.3	Very low	30.3	Very low	111 Å²	111	143.9 Å²	143.9	68%	0.681	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-70.7	143.1	-176	35.6	0	0	0	0	113	N570	T568-N570 PolarHBondContact O-N 3.47Å
569	N	29.5	Very low	30.2	Very low	152 Å²	152	143 Å²	143	81%	0.813	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-56.3	118.1	170.4	-69.3	-35.3	0	0	0	111.6
570	N	32.8	Very low	30.2	Very low	151 Å²	151	142.3 Å²	142.3	81%	0.807	78%	0.777	S	S	*	*			trans	-101.1	102.3	162.8	-84.3	-20.6	0	0	0	108.8	T568	T568-N570 PolarHBondContact O-N 3.47Å
571	F	27	Very low	30.2	Very low	191 Å²	191	144.8 Å²	144.8	84%	0.838	78%	0.779	S	S	*	*			trans	-63.9	126.5	153	-93.1	-102.6	0	0	0	107.8
572	N	32.9	Very low	30	Very low	142 Å²	142	146.7 Å²	146.7	76%	0.759	78%	0.783	S	S	*	*			trans	-152.9	119.9	157.1	-97.2	-8.3	0	0	0	110.8
573	D	29.8	Very low	30	Very low	135 Å²	135	152.3 Å²	152.3	72%	0.722	79%	0.79	S	S	*	*			trans	68.4	101.7	137.3	-61.5	-21.2	0	0	0	121.9
574	S	26.4	Very low	29.9	Very low	114 Å²	114	151 Å²	151	80%	0.797	78%	0.783	S	S	*	*			trans	-48.9	116.9	143.8	52.5	0	0	0	0	113.9
575	T	30.3	Very low	30.1	Very low	126 Å²	126	151.9 Å²	151.9	77%	0.773	78%	0.783	S	S	*	*			trans	-158	127.5	146.7	45.6	0	0	0	0	105.1
576	T	34	Very low	30.1	Very low	117 Å²	117	154 Å²	154	72%	0.718	79%	0.785	S	S	*	*				-178.3	117.1	74.6	-50.5	0	0	0	0	107.1
577	Y	25.3	Very low	30.2	Very low	232 Å²	232	153.2 Å²	153.2	91%	0.91	78%	0.78	S	S	*	*			trans	-94.8	113.3	169.5	-148.4	-98	0	0	0	106.7
578	R	31.4	Very low	30.3	Very low	231 Å²	231	152 Å²	152	87%	0.872	78%	0.783	S	S	*	*			trans	-135.1	108.3	166.5	-97	-167.4	-171	-160	3.9	111
579	S	27.5	Very low	30.4	Very low	97 Å²	97	153.3 Å²	153.3	68%	0.678	79%	0.79	S	S	*	*			trans	-60	129.9	162.8	171.3	0	0	0	0	111
580	I	32.3	Very low	30.6	Very low	165 Å²	165	150.8 Å²	150.8	85%	0.846	78%	0.784	S	S	*	*			trans	-133.1	104.5	155.4	-61.6	-179.5	0	0	0	107.2
581	M	26.5	Very low	30.6	Very low	157 Å²	157	149.3 Å²	149.3	77%	0.773	78%	0.781	S	S	*	*			trans	-73.4	131.5	158.8	-70.9	-86.6	-129.7	0	0	108.9
582	N	30.9	Very low	31	Very low	149 Å²	149	147.4 Å²	147.4	80%	0.797	78%	0.778	S	S	*	*				173.7	135.2	128.9	-98	-29.7	0	0	0	114.9
583	R	29.8	Very low	31.1	Very low	212 Å²	212	147.3 Å²	147.3	80%	0.8	78%	0.777	S	S	*	*			trans	77.2	101.1	143.9	-85.9	179.7	166.6	155	-2.7	121.2
584	D	30	Very low	31.2	Very low	143 Å²	143	146 Å²	146	77%	0.765	78%	0.779	S	S	*	*				38.7	108.5	111.2	-53.7	-28.7	0	0	0	118.9
585	N	33	Very low	31.7	Very low	150 Å²	150	146 Å²	146	80%	0.802	78%	0.776	S	S	*	*			trans	-158.5	101.7	136	-107.3	-15.5	0	0	0	112.4
586	I	32.5	Very low	31.9	Very low	142 Å²	142	146.2 Å²	146.2	73%	0.728	78%	0.777	S	S	*	*				50.9	104.7	124.8	-59.1	177.2	0	0	0	118.2
587	T	28.6	Very low	32	Very low	111 Å²	111	150.2 Å²	150.2	68%	0.681	79%	0.785	S	S	*	*			trans	30.2	118.4	138.1	56.4	0	0	0	0	120.6
588	N	34	Very low	32.5	Very low	165 Å²	165	146.4 Å²	146.4	88%	0.882	78%	0.776	S	S	*	*			trans	-153.5	94.1	130.9	-94.7	-25	0	0	0	108.6	S590	N588-S590 PolarHBondContact O-N 2.69Å
589	V	33.9	Very low	32.7	Very low	138 Å²	138	143.3 Å²	143.3	84%	0.836	78%	0.776	S	S	*	*			trans	-88.5	96.2	173.4	178	0	0	0	0	107.2
590	S	33.9	Very low	33	Very low	98 Å²	98	148.8 Å²	148.8	69%	0.685	78%	0.782	S	S	*	*			trans	-76.5	119.3	166.6	53.2	0	0	0	0	109.2	N588 I592	N588-S590 PolarHBondContact O-N 2.69Å; S590-I592 PolarHBondContact O-N 3.43Å
591	V	32.7	Very low	33.1	Very low	121 Å²	121	146.3 Å²	146.3	73%	0.733	78%	0.777	S	S	*	*			trans	-59.7	111.4	173.4	176.9	0	0	0	0	109.2	N593	V591-N593 PolarHBondContact O-N 2.89Å
592	I	35.7	Very low	33.6	Very low	150 Å²	150	147.6 Å²	147.6	77%	0.769	78%	0.778	S	S	*	*			trans	-86.4	106.5	170	-61.2	177.6	0	0	0	106.8	S590 S594	S590-I592 PolarHBondContact O-N 3.43Å; I592-S594 PolarHBondContact O-N 2.88Å
593	N	34	Very low	33.8	Very low	140 Å²	140	147.9 Å²	147.9	75%	0.749	78%	0.778	S	S	*	*			trans	-65.4	115.1	171.3	-76.7	-27.3	0	0	0	109.6	V591 P595	V591-N593 PolarHBondContact O-N 2.89Å; N593-P595 WeakPolarHBondContact O-CD 2.92Å
594	S	32.9	Very low	34.1	Very low	108 Å²	108	147.9 Å²	147.9	76%	0.755	78%	0.779	S	S	*	*			trans	-73	121.4	168.9	-50.7	0	0	0	0	109.7	I592 T596	I592-S594 PolarHBondContact O-N 2.88Å; S594-T596 PolarHBondContact O-N 3.29Å
595	P	37.8	Very low	34.2	Very low	114 Å²	114	152.1 Å²	152.1	74%	0.74	79%	0.785	S	S	*	*			trans	-78.5	114.3	174.8	28.8	-29.1	0	0	0	109.9	N593 F597	N593-P595 WeakPolarHBondContact O-CD 2.92Å; P595-F597 PolarHBondContact O-N 2.82Å
596	T	34.3	Very low	34.3	Very low	131 Å²	131	156.5 Å²	156.5	80%	0.804	79%	0.79	S	S	*	*			trans	-67.3	108.2	165.6	44.9	0	0	0	0	109.2	S594 E598	S594-T596 PolarHBondContact O-N 3.29Å; T596-E598 PolarHBondContact O-N 3.33Å; T596-E598 VanDerWaalsContact O-N 3.15Å
597	F	34.9	Very low	34.4	Very low	201 Å²	201	155.9 Å²	155.9	88%	0.882	79%	0.793	S	S	*	*			trans	-74.1	98.3	171.2	-118.8	-97.7	0	0	0	108.7	P595 N599	P595-F597 PolarHBondContact O-N 2.82Å; F597-N599 PolarHBondContact O-N 2.55Å
598	E	36.5	Very low	34.8	Very low	152 Å²	152	155.7 Å²	155.7	71%	0.71	80%	0.796	S	S	*	*			trans	-69.1	114.7	170.9	-81.2	-171.1	160.3	0	0	110.3	T596 R600	T596-E598 PolarHBondContact O-N 3.33Å; T596-E598 VanDerWaalsContact O-N 3.15Å; E598-R600 PolarHBondContact O-N 3.09Å
599	N	35.7	Very low	35	Very low	165 Å²	165	153.5 Å²	153.5	88%	0.882	79%	0.794	S	S	*	*			trans	-57.3	93.7	165.2	-87.1	-30.3	0	0	0	110.5	F597 P601	F597-N599 PolarHBondContact O-N 2.55Å; N599-P601 WeakPolarHBondContact O-CD 3.01Å
600	R	33.6	Very low	35.1	Very low	212 Å²	212	152.7 Å²	152.7	80%	0.8	79%	0.789	S	S	*	*			trans	-91.5	116.7	162.7	-81.5	-168	-170.5	-150.4	2.7	110.5	E598 K602	E598-R600 PolarHBondContact O-N 3.09Å; R600-K602 PolarHBondContact O-N 3.26Å
601	P	35	Very low	35.1	Very low	114 Å²	114	153.7 Å²	153.7	74%	0.74	80%	0.795	S	S	*	*			trans	-66.8	126.6	176.3	25	-30.4	0	0	0	110.4	N599 I603	N599-P601 WeakPolarHBondContact O-CD 3.01Å; P601-I603 PolarHBondContact O-N 2.04Å
602	K	36.3	Very low	35.5	Very low	183 Å²	183	156.3 Å²	156.3	80%	0.796	81%	0.805	S	S	*	*			trans	-68.3	99.6	173.4	-72.6	179.9	178.9	176.4	0	109	R600 Y604	R600-K602 PolarHBondContact O-N 3.26Å; K602-Y604 PolarHBondContact O-N 3.26Å; K602-Y604 VanDerWaalsContact O-N 3.14Å
603	I	35.9	Very low	35.7	Very low	156 Å²	156	157.5 Å²	157.5	80%	0.8	84%	0.837	S	S	*	*			trans	-70.8	105.3	169.5	-64	170.8	0	0	0	107.4	P601 R605	P601-I603 PolarHBondContact O-N 2.04Å; I603-R605 PolarHBondContact O-N 3.4Å
604	Y	34.3	Very low	35.7	Very low	211 Å²	211	158.4 Å²	158.4	83%	0.827	84%	0.841	S	S	*	*			trans	-64.8	103.1	171.5	-82.1	-94.6	0	0	0	109.2	K602 R606	K602-Y604 PolarHBondContact O-N 3.26Å; K602-Y604 VanDerWaalsContact O-N 3.14Å; Y604-R606 PolarHBondContact O-N 2.98Å; Y604-R606 VanDerWaalsContact O-N 3.13Å
605	R	33.6	Very low	35.9	Very low	232 Å²	232	161 Å²	161	88%	0.875	85%	0.845	S	S	*	*			trans	-75	99.4	171.4	-144.1	-179.3	-133.7	170.4	2.9	107.5	I603 T607	I603-R605 PolarHBondContact O-N 3.4Å; R605-T607 PolarHBondContact O-N 2.79Å; R605-T607 VanDerWaalsContact O-N 3.07Å
606	R	34.7	Very low	35.8	Very low	242 Å²	242	163.6 Å²	163.6	91%	0.913	85%	0.851	S	S	*	*			trans	-67.9	98.9	176.3	-157.4	-175.2	-80	-172.5	-4.5	107.8	Y604 S608	Y604-R606 PolarHBondContact O-N 2.98Å; Y604-R606 VanDerWaalsContact O-N 3.13Å; R606-S608 PolarHBondContact O-N 3.28Å
607	T	35.3	Very low	35.9	Very low	129 Å²	129	165.5 Å²	165.5	79%	0.791	85%	0.854	S	S	*	*			trans	-75.4	101.3	175.2	48.8	0	0	0	0	108.8	R605 S609	R605-T607 PolarHBondContact O-N 2.79Å; R605-T607 VanDerWaalsContact O-N 3.07Å; T607-S609 PolarHBondContact O-N 3.09Å
608	S	36.9	Very low	35.9	Very low	107 Å²	107	163.3 Å²	163.3	75%	0.748	85%	0.852	S	S	*	*			trans	-79.9	104.9	165.9	59.2	0	0	0	0	108.6	R606 V610	R606-S608 PolarHBondContact O-N 3.28Å; S608-V610 PolarHBondContact O-N 3.45Å
609	S	37.5	Very low	35.9	Very low	120 Å²	120	164.1 Å²	164.1	84%	0.839	86%	0.862	S	S	*	*			trans	-82.1	94.9	167.4	53.4	0	0	0	0	108.5	T607	T607-S609 PolarHBondContact O-N 3.09Å
610	V	36.2	Very low	35.9	Very low	121 Å²	121	164 Å²	164	73%	0.733	86%	0.86	S	S	*	*			trans	-134.5	133.3	166.7	-175.3	0	0	0	0	106.5	S608	S608-V610 PolarHBondContact O-N 3.45Å
611	C	33.5	Very low	36.1	Very low	118 Å²	118	160.3 Å²	160.3	80%	0.797	87%	0.865	S	S	*	*			trans	85.3	91.2	179.2	-52.4	0	0	0	0	115.8
612	D	40.6	Very low	36.2	Very low	177 Å²	177	164.2 Å²	164.2	95%	0.947	88%	0.875	S	S	*	*			trans	-118.2	140.8	134.1	-97.3	-31.7	0	0	0	107.9
613	A	39.6	Very low	36.2	Very low	174 Å²	174	162.5 Å²	162.5	100%	1.438	88%	0.883	S	S	*	*			trans	-78.2	0	-163.6	0	0	0	0	0	114.8

Retrieved 613 of 613 residues in 87.3 ms (Link to these results)

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