A0A087X3P7_POEFO Loading...

Neuropilin and tolloid like 2

AlphaFold DB , UniProt , Accession A0A087X3P7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 548 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	Y	51.8	Low	57	Low	244 Å²	244	129.1 Å²	129.1	96%	0.957	63%	0.634	S	S	*	*				0	-86.5	0	-80.5	-84.2	0	0	0	112	L3 S4 Q5	Y1-L3 PolarHBondContact O-N 3.39Å; Y1-S4 WeakPolarHBondContact O-CB 3.22Å; Y1-S4 PolarHBondContact O-N 3.22Å; Y1-Q5 PolarHBondContact O-N 3.11Å
2	Y	46.1	Very low	58.2	Low	201 Å²	201	126.2 Å²	126.2	79%	0.788	62%	0.621	S	S	*	*	H	α-helix	trans	-42.8	-48	-169.8	-72.8	-77.6	0	0	0	117.1	S4 Q5 L6	Y2-S4 PolarHBondContact O-N 2.75Å; Y2-Q5 PolarHBondContact O-N 2.95Å; Y2-L6 PolarHBondContact O-N 3.18Å
3	L	47.2	Very low	58.9	Low	153 Å²	153	121.8 Å²	121.8	80%	0.801	61%	0.606	S	S	*	*	H	α-helix	trans	-63	-34.3	178.7	-81.3	91.3	0	0	0	114.5	Y1 Q5 L6 C7	Y1-L3 PolarHBondContact O-N 3.39Å; L3-Q5 VanDerWaalsContact C-N 3.32Å; L3-L6 PolarHBondContact O-N 3.11Å; L3-C7 WeakPolarHBondContact O-CB 3.3Å; L3-C7 PolarHBondContact O-N 3.1Å
4	S	54	Low	59.5	Low	79 Å²	79	125.4 Å²	125.4	55%	0.552	61%	0.61	S	S	*	*	H	α-helix	trans	-67.1	-38.6	176.9	-177.8	0	0	0	0	110.9	Y1 Y2 C7 H8	Y1-S4 WeakPolarHBondContact O-CB 3.22Å; Y1-S4 PolarHBondContact O-N 3.22Å; Y2-S4 PolarHBondContact O-N 2.75Å; S4-C7 PolarHBondContact O-N 2.97Å; S4-H8 PolarHBondContact O-N 3.07Å
5	Q	55.5	Low	60.1	Low	122 Å²	122	123.6 Å²	123.6	57%	0.57	60%	0.603	S	S	*	*	H	α-helix	trans	-70.7	-35.6	178.6	-151.9	158.7	1.9	0	0	111.7	Y1 Y2 L3 L9	Y1-Q5 PolarHBondContact O-N 3.11Å; Y2-Q5 PolarHBondContact O-N 2.95Å; L3-Q5 VanDerWaalsContact C-N 3.32Å; Q5-L9 PolarHBondContact O-N 3.46Å
6	L	57.7	Low	60.6	Low	110 Å²	110	122.1 Å²	122.1	58%	0.576	60%	0.598	S	S	*	*	H	α-helix	trans	-64.2	-41.4	170.9	-142.9	84.1	0	0	0	112	Y2 L3 L9 L10	Y2-L6 PolarHBondContact O-N 3.18Å; L3-L6 PolarHBondContact O-N 3.11Å; L6-L9 PolarHBondContact O-N 2.82Å; L6-L10 WeakPolarHBondContact O-CG 3.46Å; L6-L10 PolarHBondContact O-N 2.87Å
7	C	57.8	Low	60.6	Low	79 Å²	79	123.4 Å²	123.4	53%	0.534	60%	0.599	S	S	.	*	H	α-helix	trans	-64.3	-43.2	177.3	-166.3	0	0	0	0	111.7	L3 S4 L10 N11	L3-C7 WeakPolarHBondContact O-CB 3.3Å; L3-C7 PolarHBondContact O-N 3.1Å; S4-C7 PolarHBondContact O-N 2.97Å; C7-L10 PolarHBondContact O-N 3.04Å; C7-N11 PolarHBondContact O-N 2.81Å
8	H	63.7	Low	60.7	Low	125 Å²	125	123.8 Å²	123.8	58%	0.579	60%	0.598	S	S	*	*	H	α-helix	trans	-61.3	-43	173	-99.2	-76.7	0	0	0	112.9	S4 N11 I12	S4-H8 PolarHBondContact O-N 3.07Å; H8-N11 PolarHBondContact O-N 3.45Å; H8-I12 WeakPolarHBondContact O-CB 3.11Å; H8-I12 WeakPolarHBondContact O-CD1 3.12Å; H8-I12 VanDerWaalsContact O-CG1 3.24Å; H8-I12 WeakPolarHBondContact O-CG1 3.28Å; H8-I12 PolarHBondContact O-N 3.46Å
9	L	62.4	Low	60.4	Low	106 Å²	106	123.3 Å²	123.3	56%	0.555	60%	0.598	S	S	*	*	H	α-helix	trans	-59.8	-46.6	175.1	-89.7	157.6	0	0	0	111.9	Q5 L6 N11 I12 T13	Q5-L9 PolarHBondContact O-N 3.46Å; L6-L9 PolarHBondContact O-N 2.82Å; L9-N11 PolarHBondContact O-N 3.47Å; L9-I12 PolarHBondContact O-N 3.14Å; L9-T13 PolarHBondContact O-N 3.45Å; L9-T13 PolarHBondContact O-OG1 2.51Å
10	L	64.6	Low	60.5	Low	103 Å²	103	121.2 Å²	121.2	54%	0.539	59%	0.589	S	S	.	*	H	α-helix	trans	-60.5	-44.3	177.1	-78.3	163.6	0	0	0	112.3	L6 C7 T13 W14	L6-L10 WeakPolarHBondContact O-CG 3.46Å; L6-L10 PolarHBondContact O-N 2.87Å; C7-L10 PolarHBondContact O-N 3.04Å; L10-T13 WeakPolarHBondContact CA-OG1 3.49Å; L10-T13 PolarHBondContact O-N 3.5Å; L10-T13 PolarHBondContact O-OG1 3.16Å; L10-W14 PolarHBondContact O-N 2.78Å
11	N	66.6	Low	59.9	Low	98 Å²	98	122.3 Å²	122.3	52%	0.524	59%	0.593	S	S	.	*	H	α-helix	trans	-63.6	-41.8	177.3	-125.7	-9	0	0	0	111.8	C7 H8 L9 W14 I15	C7-N11 PolarHBondContact O-N 2.81Å; H8-N11 PolarHBondContact O-N 3.45Å; L9-N11 PolarHBondContact O-N 3.47Å; N11-W14 PolarHBondContact O-N 3.14Å; N11-I15 VanDerWaalsContact O-CG1 3.32Å; N11-I15 WeakPolarHBondContact O-CG1 3.24Å; N11-I15 PolarHBondContact O-N 3.2Å
12	I	70.8	Confident	59.7	Low	94 Å²	94	116.3 Å²	116.3	48%	0.482	57%	0.574	S	S	.	*	H	α-helix	trans	-62.9	-42.1	175.4	-69.7	164.4	0	0	0	110.8	H8 L9 W14 I15 L16	H8-I12 WeakPolarHBondContact O-CB 3.11Å; H8-I12 WeakPolarHBondContact O-CD1 3.12Å; H8-I12 VanDerWaalsContact O-CG1 3.24Å; H8-I12 WeakPolarHBondContact O-CG1 3.28Å; H8-I12 PolarHBondContact O-N 3.46Å; L9-I12 PolarHBondContact O-N 3.14Å; I12-W14 PolarHBondContact O-N 3.08Å; I12-I15 PolarHBondContact O-N 3.19Å; I12-L16 WeakPolarHBondContact O-CB 3.45Å; I12-L16 PolarHBondContact O-N 2.82Å
13	T	67.7	Low	59.7	Low	69 Å²	69	108.5 Å²	108.5	42%	0.423	55%	0.554	S	S	.	*	H	α-helix	trans	-66.5	-34.3	175.8	50.6	0	0	0	0	113.5	L9 L10 L16 F17	L9-T13 PolarHBondContact O-N 3.45Å; L9-T13 PolarHBondContact O-OG1 2.51Å; L10-T13 WeakPolarHBondContact CA-OG1 3.49Å; L10-T13 PolarHBondContact O-N 3.5Å; L10-T13 PolarHBondContact O-OG1 3.16Å; T13-L16 PolarHBondContact O-N 2.93Å; T13-F17 PolarHBondContact O-N 2.03Å
14	W	66.9	Low	59.6	Low	173 Å²	173	108.5 Å²	108.5	66%	0.655	55%	0.548	S	S	*	.	H	α-helix	trans	-67.6	-43.6	174.6	-104.5	78.3	0	0	0	112.2	L10 N11 I12 L16 F17 F18	L10-W14 PolarHBondContact O-N 2.78Å; N11-W14 PolarHBondContact O-N 3.14Å; I12-W14 PolarHBondContact O-N 3.08Å; W14-L16 VanDerWaalsContact C-N 3.31Å; W14-L16 PolarHBondContact O-N 2.84Å; W14-F17 PolarHBondContact O-N 3.38Å; W14-F18 HydrophobicContact CE3-CD2 4.38Å; W14-F18 HydrophobicContact CZ3-CE2 4.25Å; W14-F18 PolarHBondContact O-N 3.37Å
15	I	69.4	Low	59.1	Low	98 Å²	98	108.2 Å²	108.2	50%	0.503	55%	0.551	S	S	.	*	H	α-helix	trans	-63.4	-39	174.6	-67.7	164.4	0	0	0	110.5	N11 I12 F18 L19	N11-I15 VanDerWaalsContact O-CG1 3.32Å; N11-I15 WeakPolarHBondContact O-CG1 3.24Å; N11-I15 PolarHBondContact O-N 3.2Å; I12-I15 PolarHBondContact O-N 3.19Å; I15-F18 PolarHBondContact O-N 2.95Å; I15-L19 HydrophobicContact CG2-CD1 3.93Å; I15-L19 WeakPolarHBondContact O-CB 3.36Å; I15-L19 VanDerWaalsContact O-CG 3.31Å; I15-L19 WeakPolarHBondContact O-CG 3.12Å; I15-L19 PolarHBondContact O-N 3.03Å
16	L	66.8	Low	58.5	Low	100 Å²	100	108.1 Å²	108.1	52%	0.524	55%	0.554	S	S	.	*	H	α-helix	trans	-62.1	-44	174.1	-127.2	78.5	0	0	0	112.1	I12 T13 W14 L19 I20	I12-L16 WeakPolarHBondContact O-CB 3.45Å; I12-L16 PolarHBondContact O-N 2.82Å; T13-L16 PolarHBondContact O-N 2.93Å; W14-L16 VanDerWaalsContact C-N 3.31Å; W14-L16 PolarHBondContact O-N 2.84Å; L16-L19 PolarHBondContact O-N 3.35Å; L16-I20 WeakPolarHBondContact O-CD1 3.32Å; L16-I20 VanDerWaalsContact O-CG1 3.23Å; L16-I20 WeakPolarHBondContact O-CG1 3.28Å; L16-I20 PolarHBondContact O-N 3.48Å
17	F	61.6	Low	57.6	Low	143 Å²	143	106 Å²	106	63%	0.627	55%	0.552	S	S	*	*	H	α-helix	trans	-62.3	-44	177.1	-106.3	-86.1	0	0	0	112.2	T13 W14 L19 I20 E21	T13-F17 PolarHBondContact O-N 2.03Å; W14-F17 PolarHBondContact O-N 3.38Å; F17-L19 VanDerWaalsContact C-N 3.34Å; F17-L19 PolarHBondContact O-N 2.66Å; F17-I20 PolarHBondContact O-N 3.23Å; F17-I20 VanDerWaalsContact O-N 3.14Å; F17-E21 PolarHBondContact O-N 2.89Å
18	F	61.4	Low	56.6	Low	131 Å²	131	111.1 Å²	111.1	58%	0.575	57%	0.568	S	S	*	*	H	α-helix	trans	-61.7	-40.4	176	-116.3	-83.4	0	0	0	112.7	W14 I15 I20 E21 E22	W14-F18 HydrophobicContact CE3-CD2 4.38Å; W14-F18 HydrophobicContact CZ3-CE2 4.25Å; W14-F18 PolarHBondContact O-N 3.37Å; I15-F18 PolarHBondContact O-N 2.95Å; F18-I20 VanDerWaalsContact C-N 3.29Å; F18-I20 PolarHBondContact O-N 2.94Å; F18-E21 PolarHBondContact O-N 2.9Å; F18-E22 WeakPolarHBondContact O-CG 3.34Å; F18-E22 PolarHBondContact O-N 2.97Å; F18-E22 VanDerWaalsContact O-N 3.12Å
19	L	55.6	Low	55.7	Low	115 Å²	115	115.7 Å²	115.7	60%	0.602	58%	0.58	S	S	*	*	H	α-helix	trans	-70	-23.5	175.7	-71.1	169.6	0	0	0	113.2	I15 L16 F17 G23	I15-L19 HydrophobicContact CG2-CD1 3.93Å; I15-L19 WeakPolarHBondContact O-CB 3.36Å; I15-L19 VanDerWaalsContact O-CG 3.31Å; I15-L19 WeakPolarHBondContact O-CG 3.12Å; I15-L19 PolarHBondContact O-N 3.03Å; L16-L19 PolarHBondContact O-N 3.35Å; F17-L19 VanDerWaalsContact C-N 3.34Å; F17-L19 PolarHBondContact O-N 2.66Å; L19-G23 WeakPolarHBondContact O-CA 3.33Å; L19-G23 PolarHBondContact O-N 3.22Å
20	I	61.5	Low	54.6	Low	81 Å²	81	116.5 Å²	116.5	42%	0.415	59%	0.589	S	S	.	*	H	α-helix	trans	-79.1	-43	174.7	-70.9	163.3	0	0	0	110.8	L16 F17 F18 G23 F24	L16-I20 WeakPolarHBondContact O-CD1 3.32Å; L16-I20 VanDerWaalsContact O-CG1 3.23Å; L16-I20 WeakPolarHBondContact O-CG1 3.28Å; L16-I20 PolarHBondContact O-N 3.48Å; F17-I20 PolarHBondContact O-N 3.23Å; F17-I20 VanDerWaalsContact O-N 3.14Å; F18-I20 VanDerWaalsContact C-N 3.29Å; F18-I20 PolarHBondContact O-N 2.94Å; I20-G23 PolarHBondContact O-N 3.04Å; I20-F24 HydrophobicContact CG2-CD2 3.9Å; I20-F24 HydrophobicContact CG2-CE2 4.04Å; I20-F24 WeakPolarHBondContact O-CD2 2.99Å; I20-F24 PolarHBondContact O-N 2.03Å
21	E	49.1	Very low	53	Low	144 Å²	144	121.2 Å²	121.2	67%	0.673	61%	0.606	S	S	*	*	H	α-helix	trans	-58.2	-54.4	173.5	-74.6	-78.5	129	0	0	111.5	F17 F18 G23 F24 A25	F17-E21 PolarHBondContact O-N 2.89Å; F18-E21 PolarHBondContact O-N 2.9Å; E21-G23 VanDerWaalsContact C-N 3.27Å; E21-G23 PolarHBondContact O-N 3.11Å; E21-F24 PolarHBondContact O-N 3.12Å; E21-A25 PolarHBondContact O-N 3.39Å
22	E	47.7	Very low	51.2	Low	119 Å²	119	124.5 Å²	124.5	56%	0.556	62%	0.623	S	S	*	*	H	α-helix	trans	-59.1	-38.1	174.6	-73.2	-80.2	147.2	0	0	111.9	F18 A25 L26	F18-E22 WeakPolarHBondContact O-CG 3.34Å; F18-E22 PolarHBondContact O-N 2.97Å; F18-E22 VanDerWaalsContact O-N 3.12Å; E22-A25 PolarHBondContact O-N 3.13Å; E22-L26 PolarHBondContact O-N 3.17Å; E22-L26 VanDerWaalsContact O-N 3.09Å
23	G	46.8	Very low	49.2	Very low	36 Å²	36	125.2 Å²	125.2	37%	0.371	64%	0.637	S	S	.	*	H	α-helix	trans	-62.8	-41.7	177	0	0	0	0	0	113.3	L19 I20 E21 L26 A27	L19-G23 WeakPolarHBondContact O-CA 3.33Å; L19-G23 PolarHBondContact O-N 3.22Å; I20-G23 PolarHBondContact O-N 3.04Å; E21-G23 VanDerWaalsContact C-N 3.27Å; E21-G23 PolarHBondContact O-N 3.11Å; G23-L26 PolarHBondContact O-N 3.37Å; G23-A27 VanDerWaalsContact O-CB 3.29Å; G23-A27 WeakPolarHBondContact O-CB 3.49Å; G23-A27 PolarHBondContact O-N 2.98Å
24	F	44.2	Very low	48.1	Very low	153 Å²	153	128.7 Å²	128.7	67%	0.671	66%	0.66	S	S	*	*	H	α-helix	trans	-71.4	-34.2	175.4	-91	-79.1	0	0	0	112.6	I20 E21 L26 A27	I20-F24 HydrophobicContact CG2-CD2 3.9Å; I20-F24 HydrophobicContact CG2-CE2 4.04Å; I20-F24 WeakPolarHBondContact O-CD2 2.99Å; I20-F24 PolarHBondContact O-N 2.03Å; E21-F24 PolarHBondContact O-N 3.12Å; F24-L26 VanDerWaalsContact C-N 3.31Å; F24-L26 PolarHBondContact O-N 3.42Å; F24-A27 PolarHBondContact O-N 3.34Å
25	A	44	Very low	46.3	Very low	74 Å²	74	123.8 Å²	123.8	61%	0.612	66%	0.664	S	S	*	*	H	α-helix	trans	-63.1	-35.6	173.6	0	0	0	0	0	112.7	E21 E22	E21-A25 PolarHBondContact O-N 3.39Å; E22-A25 PolarHBondContact O-N 3.13Å
26	L	41.6	Very low	44.5	Very low	120 Å²	120	126.6 Å²	126.6	63%	0.628	68%	0.68	S	S	*	*	H	α-helix	trans	-80.4	-32.8	175	-76.7	164.4	0	0	0	113.4	E22 G23 F24 Q28 R29	E22-L26 PolarHBondContact O-N 3.17Å; E22-L26 VanDerWaalsContact O-N 3.09Å; G23-L26 PolarHBondContact O-N 3.37Å; F24-L26 VanDerWaalsContact C-N 3.31Å; F24-L26 PolarHBondContact O-N 3.42Å; L26-Q28 PolarHBondContact O-N 3.09Å; L26-R29 PolarHBondContact O-N 2.89Å; L26-R29 VanDerWaalsContact O-N 3.08Å
27	A	40	Very low	43.2	Very low	66 Å²	66	127.9 Å²	127.9	55%	0.545	69%	0.694	S	S	.	*	H	α-helix	trans	-66.4	-16.6	-176.4	0	0	0	0	0	115	G23 F24 R29	G23-A27 VanDerWaalsContact O-CB 3.29Å; G23-A27 WeakPolarHBondContact O-CB 3.49Å; G23-A27 PolarHBondContact O-N 2.98Å; F24-A27 PolarHBondContact O-N 3.34Å; A27-R29 VanDerWaalsContact C-N 3.32Å
28	Q	37.2	Very low	41.6	Very low	185 Å²	185	123.5 Å²	123.5	86%	0.864	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-0.9	173.1	-71.7	-166.5	-19.4	0	0	114.2	L26	L26-Q28 PolarHBondContact O-N 3.09Å
29	R	43.9	Very low	40.3	Very low	221 Å²	221	121.1 Å²	121.1	83%	0.834	70%	0.702	S	S	*	*	S	Bend	trans	-109	9.7	-170.7	-133	178.8	-169.5	-175.4	4.1	116.5	L26 A27	L26-R29 PolarHBondContact O-N 2.89Å; L26-R29 VanDerWaalsContact O-N 3.08Å; A27-R29 VanDerWaalsContact C-N 3.32Å
30	T	38.6	Very low	39.2	Very low	123 Å²	123	124.7 Å²	124.7	76%	0.755	72%	0.715	S	S	*	*			trans	-140.3	79.2	-179.3	41.8	0	0	0	0	113
31	K	31.1	Very low	38	Very low	203 Å²	203	125.3 Å²	125.3	88%	0.883	73%	0.727	S	S	*	*			trans	-138.3	31.4	162.3	-146.9	-168.6	173.8	-177.7	0	115.3
32	D	28.8	Very low	37.4	Very low	166 Å²	166	124 Å²	124	89%	0.888	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-97.2	128.8	158.6	-67.9	-56.3	0	0	0	109.1
33	S	30.6	Very low	37	Very low	110 Å²	110	121.1 Å²	121.1	77%	0.769	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-101	147	171.4	-68.7	0	0	0	0	109.3	G35	S33-G35 PolarHBondContact O-N 3.31Å
34	P	43.1	Very low	37.1	Very low	141 Å²	141	125.5 Å²	125.5	92%	0.916	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-72	127.3	-166.8	28	-35.1	0	0	0	112.6
35	G	28.6	Very low	37.4	Very low	71 Å²	71	123.6 Å²	123.6	73%	0.732	74%	0.741	S	S	*	*			trans	-161.3	93.5	177.8	0	0	0	0	0	113.6	S33	S33-G35 PolarHBondContact O-N 3.31Å
36	D	32.6	Very low	38.3	Very low	156 Å²	156	126.1 Å²	126.1	83%	0.834	74%	0.744	S	S	*	*			trans	60.6	134.3	159.4	-138.2	41	0	0	0	119.6	G38	D36-G38 PolarHBondContact O-N 2.71Å
37	P	38.5	Very low	39.9	Very low	127 Å²	127	121.6 Å²	121.6	83%	0.825	72%	0.722	S	S	*	*			trans	-83	58.3	-175.2	35.8	-35.8	0	0	0	113
38	G	28.6	Very low	41	Very low	52 Å²	52	120.2 Å²	120.2	54%	0.536	72%	0.715	S	S	.	*			trans	-93.1	102.1	172.4	0	0	0	0	0	111.9	D36 Q40	D36-G38 PolarHBondContact O-N 2.71Å; G38-Q40 PolarHBondContact O-N 2.77Å
39	G	35.1	Very low	41.9	Very low	80 Å²	80	115.6 Å²	115.6	83%	0.825	70%	0.699	S	S	*	*			trans	-68.2	92.6	176.3	0	0	0	0	0	112.1	S41	G39-S41 PolarHBondContact O-N 2.71Å
40	Q	30.8	Very low	42.8	Very low	190 Å²	190	109 Å²	109	89%	0.888	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-72.8	118.5	-179.8	-63.8	-172.4	20.7	0	0	111	G38	G38-Q40 PolarHBondContact O-N 2.77Å
41	S	37.1	Very low	43.6	Very low	95 Å²	95	106.8 Å²	106.8	66%	0.664	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-64.5	152.6	172.7	-49.9	0	0	0	0	111.3	G39	G39-S41 PolarHBondContact O-N 2.71Å
42	P	36.8	Very low	45.1	Very low	115 Å²	115	102.4 Å²	102.4	75%	0.747	64%	0.638	S	S	*	*	S	Bend	trans	-56.2	147.2	157.5	28.3	-34.4	0	0	0	109.5	Q44	P42-Q44 PolarHBondContact O-N 3.08Å
43	G	39.3	Very low	47.1	Very low	59 Å²	59	97.8 Å²	97.8	61%	0.608	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-57.9	126.2	-170.1	0	0	0	0	0	113	N45 D46	G43-N45 PolarHBondContact O-N 2.86Å; G43-D46 PolarHBondContact O-N 3.43Å
44	Q	49.6	Very low	49.1	Very low	129 Å²	129	97 Å²	97	60%	0.603	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-11.6	-169	-62.7	177.3	-80.1	0	0	115.7	P42 N63	P42-Q44 PolarHBondContact O-N 3.08Å; Q44-N63 PolarHBondContact O-N 2.72Å; Q44-N63 PolarHBondContact O-OD1 2.8Å
45	N	50.3	Low	50.9	Low	112 Å²	112	96.9 Å²	96.9	60%	0.599	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-11	-177.8	-67.8	-22.9	0	0	0	114.4	G43 K72	G43-N45 PolarHBondContact O-N 2.86Å; N45-K72 PolarHBondContact O-NZ 2.81Å
46	D	63.1	Low	53.7	Low	128 Å²	128	93.8 Å²	93.8	68%	0.684	56%	0.56	S	S	*	*			trans	-109.6	141.4	-171.2	-160.4	27.9	0	0	0	112.4	G43	G43-D46 PolarHBondContact O-N 3.43Å
47	C	74.8	Confident	56.4	Low	24 Å²	24	87.3 Å²	87.3	16%	0.162	53%	0.53	C	S	.	.			trans	-145.8	155.5	179.1	67.5	0	0	0	0	110.3	P62 C74	C47-P62 HydrophobicContact CB-CG 4.02Å; C47-C74 HydrophobicContact CB-CB 3.66Å; C47-C74 WeakPolarHBondContact CB-SG 3.49Å; C47-C74 VanDerWaalsContact SG-CA 3.57Å; C47-C74 WeakPolarHBondContact SG-CB 3.39Å; C47-C74 CovalentContact SG-SG 2.03Å; C47-C74 PolarHBondContact SG-SG 2.93Å
48	G	62.3	Low	58.9	Low	38 Å²	38	84.3 Å²	84.3	39%	0.392	51%	0.509	S	S	.	.			trans	106.5	8.4	-168.6	0	0	0	0	0	114.1	W50	G48-W50 PolarHBondContact O-N 2.87Å
49	T	56.3	Low	61.8	Low	88 Å²	88	82.7 Å²	82.7	54%	0.54	49%	0.487	S	S	.	.			trans	-61.8	109.9	167.2	-42.7	0	0	0	0	109.9	V51	T49-V51 HydrophobicContact CG2-CG2 4.15Å; T49-V51 PolarHBondContact O-N 2.89Å
50	W	63.2	Low	64.5	Low	82 Å²	82	82.4 Å²	82.4	31%	0.311	47%	0.465	S	S	.	.			trans	-69.5	117.5	171	177.4	77.3	0	0	0	110.2	G48 R52 I77 A250 I251	G48-W50 PolarHBondContact O-N 2.87Å; W50-R52 HydrophobicContact CE3-CB 4.42Å; W50-R52 HydrophobicContact CH2-CB 3.58Å; W50-R52 HydrophobicContact CH2-CG 4.16Å; W50-R52 HydrophobicContact CZ2-CB 3.62Å; W50-R52 HydrophobicContact CZ2-CG 4.11Å; W50-R52 HydrophobicContact CZ3-CB 3.98Å; W50-I77 PolarHBondContact NE1-O 2.88Å; W50-A250 HydrophobicContact CH2-CB 3.67Å; W50-A250 HydrophobicContact CZ2-CB 4.1Å; W50-A250 HydrophobicContact CZ3-CB 4.16Å; W50-I251 HydrophobicContact CZ2-CG2 4.12Å
51	V	55.6	Low	67.4	Low	76 Å²	76	73.4 Å²	73.4	46%	0.461	42%	0.423	S	S	.	.			trans	-117.4	96.7	-177.8	-177.9	0	0	0	0	110.1	T49 N53 Y158	T49-V51 HydrophobicContact CG2-CG2 4.15Å; T49-V51 PolarHBondContact O-N 2.89Å; V51-N53 HydrophobicContact CG1-CB 4.3Å; V51-N53 PolarHBondContact O-N 3.32Å; V51-Y158 PolarHBondContact O-OH 2.75Å
52	R	62.8	Low	70	Confident	112 Å²	112	69.3 Å²	69.3	42%	0.423	39%	0.394	S	S	.	.			trans	-85.8	76.9	171.2	-171.1	179.3	-174	-95	4.6	111.3	W50 E79	W50-R52 HydrophobicContact CE3-CB 4.42Å; W50-R52 HydrophobicContact CH2-CB 3.58Å; W50-R52 HydrophobicContact CH2-CG 4.16Å; W50-R52 HydrophobicContact CZ2-CB 3.62Å; W50-R52 HydrophobicContact CZ2-CG 4.11Å; W50-R52 HydrophobicContact CZ3-CB 3.98Å; R52-E79 IonicContact CZ-OE2 2.76Å; R52-E79 IonicContact NE-OE2 3.69Å; R52-E79 PolarHBondContact NE-OE2 3.04Å; R52-E79 VanDerWaalsContact NE-OE2 3.1Å; R52-E79 IonicContact NH2-OE2 3.38Å; R52-E79 PolarHBondContact NH2-OE2 2.98Å
53	N	70.6	Confident	72.6	Confident	68 Å²	68	66 Å²	66	36%	0.364	37%	0.37	S	S	.	.			trans	-95	117.3	169.9	-172.8	-13	0	0	0	110.4	V51 N55 G56 F160	V51-N53 HydrophobicContact CG1-CB 4.3Å; V51-N53 PolarHBondContact O-N 3.32Å; N53-N55 PolarHBondContact O-N 2.99Å; N53-N55 VanDerWaalsContact O-N 3.17Å; N53-N55 PolarHBondContact OD1-N 2.87Å; N53-G56 VanDerWaalsContact CB-O 3.31Å; N53-G56 WeakPolarHBondContact CB-O 3.41Å; N53-G56 PolarHBondContact ND2-O 3.24Å; N53-G56 VanDerWaalsContact ND2-O 3.07Å; N53-G56 PolarHBondContact O-N 3.18Å; N53-F160 VanDerWaalsContact O-CE2 3.25Å; N53-F160 WeakPolarHBondContact O-CE2 3.4Å
54	I	72.6	Confident	75.1	Confident	93 Å²	93	64.6 Å²	64.6	48%	0.477	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.1	-179.2	59.8	169.7	0	0	0	114.3	F160	I54-F160 WeakPolarHBondContact O-CD2 3.44Å; I54-F160 WeakPolarHBondContact O-CE2 3.25Å
55	N	80.3	Confident	77.1	Confident	140 Å²	140	62.2 Å²	62.2	75%	0.749	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	10.4	179.5	-62.4	-36.8	0	0	0	113.1	N53	N53-N55 PolarHBondContact O-N 2.99Å; N53-N55 VanDerWaalsContact O-N 3.17Å; N53-N55 PolarHBondContact OD1-N 2.87Å
56	G	86.8	Confident	79.1	Confident	6 Å²	6	61.8 Å²	61.8	6%	0.062	34%	0.34	C	S	.	.			trans	82.2	-176.8	-167.3	0	0	0	0	0	112.3	N53 Y158	N53-G56 VanDerWaalsContact CB-O 3.31Å; N53-G56 WeakPolarHBondContact CB-O 3.41Å; N53-G56 PolarHBondContact ND2-O 3.24Å; N53-G56 VanDerWaalsContact ND2-O 3.07Å; N53-G56 PolarHBondContact O-N 3.18Å; G56-Y158 CarbonylContact C-O 3.49Å; G56-Y158 VanDerWaalsContact CA-O 3.24Å; G56-Y158 WeakPolarHBondContact CA-O 3.25Å
57	G	90.1	Very high	80.5	Confident	20 Å²	20	59.5 Å²	59.5	21%	0.206	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.4	-167.3	-175.8	0	0	0	0	0	113.8	Q157 Y158	G57-Q157 CarbonylContact O-C 3.53Å; G57-Q157 WeakPolarHBondContact O-CA 3.32Å; G57-Y158 PolarHBondContact N-O 3.2Å; G57-Y158 WeakPolarHBondContact O-CD1 3.26Å; G57-Y158 PolarHBondContact O-N 2.72Å
58	V	90.1	Very high	81.4	Confident	63 Å²	63	58.4 Å²	58.4	38%	0.382	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	137.9	177.7	177.9	0	0	0	0	109	M60 R155 I156 Q157	V58-M60 HydrophobicContact CG1-CE 4.26Å; V58-R155 HydrophobicContact CG1-CG 3.81Å; V58-I156 VanDerWaalsContact CA-O 3.31Å; V58-I156 WeakPolarHBondContact CA-O 3.41Å; V58-Q157 HydrophobicContact CG2-CB 4.09Å; V58-Q157 HydrophobicContact CG2-CG 4.09Å
59	F	90.3	Very high	82.9	Confident	18 Å²	18	57.7 Å²	57.7	8%	0.079	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	163.9	165.4	64.3	-80	0	0	0	109.6	Y76 L78 L88 I141 F154 I156 Y158	F59-Y76 HydrophobicContact CB-CD1 4.19Å; F59-Y76 HydrophobicContact CB-CE1 3.88Å; F59-Y76 AromaticContact CD2-CD1 3.98Å; F59-Y76 HydrophobicContact CD2-CD1 3.98Å; F59-Y76 AromaticContact CD2-CD2 3.86Å; F59-Y76 HydrophobicContact CD2-CD2 3.86Å; F59-Y76 AromaticContact CD2-CE1 3.86Å; F59-Y76 HydrophobicContact CD2-CE1 3.86Å; F59-Y76 AromaticContact CD2-CE2 3.75Å; F59-Y76 HydrophobicContact CD2-CE2 3.75Å; F59-Y76 AromaticContact CD2-CG 3.98Å; F59-Y76 HydrophobicContact CD2-CG 3.98Å; F59-Y76 AromaticContact CD2-CZ 3.75Å; F59-Y76 AromaticContact CE2-CD2 3.92Å; F59-Y76 HydrophobicContact CE2-CD2 3.92Å; F59-Y76 HydrophobicContact CE2-CE2 4.1Å; F59-Y76 HydrophobicContact CE2-CG 4.23Å; F59-Y76 HydrophobicContact CG-CD1 4.13Å; F59-Y76 HydrophobicContact CG-CE1 4.13Å; F59-Y76 HydrophobicContact CG-CG 4.44Å; F59-L78 HydrophobicContact CE1-CD1 4.49Å; F59-L88 HydrophobicContact CE1-CD2 4.29Å; F59-I141 HydrophobicContact CE1-CD1 4.39Å; F59-I141 HydrophobicContact CE2-CG2 4.22Å; F59-I141 HydrophobicContact CZ-CD1 3.88Å; F59-I141 HydrophobicContact CZ-CG2 4.36Å; F59-F154 AromaticContact CD2-CE2 3.92Å; F59-F154 HydrophobicContact CD2-CE2 3.92Å; F59-F154 AromaticContact CE2-CE2 3.88Å; F59-F154 HydrophobicContact CE2-CE2 3.88Å; F59-I156 HydrophobicContact CD1-CB 4.42Å; F59-I156 HydrophobicContact CD1-CG2 4.49Å; F59-I156 HydrophobicContact CE1-CB 3.9Å; F59-I156 HydrophobicContact CE1-CG2 3.64Å; F59-I156 HydrophobicContact CE2-CB 4.16Å; F59-I156 HydrophobicContact CE2-CD1 3.73Å; F59-I156 HydrophobicContact CZ-CB 3.74Å; F59-I156 HydrophobicContact CZ-CD1 3.71Å; F59-I156 HydrophobicContact CZ-CG1 4.34Å; F59-I156 HydrophobicContact CZ-CG2 3.66Å; F59-I156 PolarHBondContact N-O 2.77Å; F59-I156 PolarHBondContact O-N 2.93Å; F59-Y158 AromaticContact CD1-CD1 3.88Å; F59-Y158 HydrophobicContact CD1-CD1 3.88Å; F59-Y158 HydrophobicContact CD1-CE1 4.36Å; F59-Y158 HydrophobicContact CE1-CD1 4.1Å
60	M	91.8	Very high	84.7	Confident	75 Å²	75	55.7 Å²	55.7	37%	0.369	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	161.7	-175.7	60.5	-166.5	75.8	0	0	110.1	V58 Y64 Y76 F154 R155	V58-M60 HydrophobicContact CG1-CE 4.26Å; M60-Y64 HydrophobicContact CB-CD1 4.22Å; M60-Y64 HydrophobicContact CB-CG 4.08Å; M60-Y64 HydrophobicContact SD-CD1 3.87Å; M60-Y64 HydrophobicContact SD-CG 4.34Å; M60-Y76 PolarHBondContact O-OH 2.83Å; M60-F154 CarbonylContact C-O 3.57Å; M60-F154 WeakPolarHBondContact CA-O 3.21Å; M60-F154 VanDerWaalsContact CB-O 3.27Å; M60-F154 WeakPolarHBondContact CB-O 3.16Å; M60-R155 HydrophobicContact CB-CB 4.2Å; M60-R155 HydrophobicContact CB-CG 4.47Å
61	S	92.7	Very high	86.1	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.007	31%	0.311	C	S	.	.			trans	-59	154.1	167.8	49.9	0	0	0	0	110.8	Y64 G153 F154	S61-Y64 WeakPolarHBondContact O-CB 3.08Å; S61-Y64 PolarHBondContact O-N 3.34Å; S61-G153 WeakPolarHBondContact OG-CA 3.4Å; S61-F154 PolarHBondContact N-O 2.71Å; S61-F154 PolarHBondContact OG-N 2.88Å; S61-F154 VanDerWaalsContact OG-N 3.12Å; S61-F154 PolarHBondContact OG-O 2.94Å
62	P	91.3	Very high	87.8	Confident	8 Å²	8	55.7 Å²	55.7	5%	0.052	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	152.7	174.9	-7.7	18.2	0	0	0	110.3	C47 Y64 Y68 P69 K72	C47-P62 HydrophobicContact CB-CG 4.02Å; P62-Y64 PolarHBondContact O-N 2.9Å; P62-Y68 WeakPolarHBondContact O-CA 3.47Å; P62-P69 HydrophobicContact CB-CG 4.13Å; P62-K72 HydrophobicContact CG-CG 4.42Å
63	N	91.2	Very high	89.2	Confident	46 Å²	46	55.8 Å²	55.8	25%	0.246	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	-5.4	-175.4	-65.4	-22	0	0	0	118.7	Q44 N66 T67	Q44-N63 PolarHBondContact O-N 2.72Å; Q44-N63 PolarHBondContact O-OD1 2.8Å; N63-N66 HydrophobicContact CB-CB 4.43Å; N63-N66 WeakPolarHBondContact O-CB 3.08Å; N63-N66 PolarHBondContact O-N 3.42Å; N63-N66 PolarHBondContact O-ND2 3.15Å; N63-N66 VanDerWaalsContact O-ND2 3.09Å; N63-T67 VanDerWaalsContact CB-O 3.28Å; N63-T67 WeakPolarHBondContact CB-O 3.45Å
64	Y	90.9	Very high	90.2	Very high	29 Å²	29	52.5 Å²	52.5	11%	0.114	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	133.8	179.8	-177.4	-83	0	0	0	111.7	M60 S61 P62 L152 F154 R155	M60-Y64 HydrophobicContact CB-CD1 4.22Å; M60-Y64 HydrophobicContact CB-CG 4.08Å; M60-Y64 HydrophobicContact SD-CD1 3.87Å; M60-Y64 HydrophobicContact SD-CG 4.34Å; S61-Y64 WeakPolarHBondContact O-CB 3.08Å; S61-Y64 PolarHBondContact O-N 3.34Å; P62-Y64 PolarHBondContact O-N 2.9Å; Y64-L152 WeakPolarHBondContact CD2-O 3.23Å; Y64-L152 HydrophobicContact CE2-CD2 3.92Å; Y64-F154 WeakPolarHBondContact CD2-O 3.47Å; Y64-R155 HydrophobicContact CD1-CB 4.04Å; Y64-R155 HydrophobicContact CD2-CB 4.45Å; Y64-R155 HydrophobicContact CE1-CB 3.54Å; Y64-R155 HydrophobicContact CE1-CG 4.21Å; Y64-R155 HydrophobicContact CE2-CB 3.99Å; Y64-R155 HydrophobicContact CG-CB 4.48Å
65	P	92	Very high	91	Very high	80 Å²	80	50.1 Å²	50.1	52%	0.519	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.2	11.7	12.4	37.5	-38.5	0	0	0	115.5	L152	P65-L152 VanDerWaalsContact O-CD1 3.31Å; P65-L152 WeakPolarHBondContact O-CD1 3.38Å
66	N	92	Very high	91.4	Very high	103 Å²	103	44.4 Å²	44.4	55%	0.551	25%	0.247	S	C	*	.	S	Bend	trans	-80.4	175.3	169.1	-47.2	-75	0	0	0	110.1	N63	N63-N66 HydrophobicContact CB-CB 4.43Å; N63-N66 WeakPolarHBondContact O-CB 3.08Å; N63-N66 PolarHBondContact O-N 3.42Å; N63-N66 PolarHBondContact O-ND2 3.15Å; N63-N66 VanDerWaalsContact O-ND2 3.09Å
67	T	93.1	Very high	91.5	Very high	79 Å²	79	45.6 Å²	45.6	49%	0.485	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-62.3	141.5	176.5	49.1	0	0	0	0	111.8	N63 G151	N63-T67 VanDerWaalsContact CB-O 3.28Å; N63-T67 WeakPolarHBondContact CB-O 3.45Å; T67-G151 WeakPolarHBondContact CA-O 3.23Å; T67-G151 WeakPolarHBondContact CB-O 3.31Å
68	Y	94.1	Very high	91.4	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.008	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-70.2	158.5	174.2	50.6	-101.5	0	0	0	111.2	P62 I96 E97 D105 F143 E150 G151 G153	P62-Y68 WeakPolarHBondContact O-CA 3.47Å; Y68-I96 HydrophobicContact CE1-CG1 4.46Å; Y68-E97 PolarHBondContact OH-N 3.14Å; Y68-E97 VanDerWaalsContact OH-N 3.16Å; Y68-D105 WeakPolarHBondContact CE2-OD2 3.02Å; Y68-D105 PolarHBondContact OH-OD2 2.69Å; Y68-F143 AromaticContact CD1-CZ 3.86Å; Y68-F143 HydrophobicContact CD1-CZ 3.86Å; Y68-F143 HydrophobicContact CD2-CE1 4.25Å; Y68-F143 AromaticContact CD2-CZ 3.77Å; Y68-F143 HydrophobicContact CD2-CZ 3.77Å; Y68-F143 HydrophobicContact CE1-CE2 4.43Å; Y68-F143 AromaticContact CE1-CZ 3.93Å; Y68-F143 HydrophobicContact CE1-CZ 3.93Å; Y68-F143 AromaticContact CE2-CZ 3.85Å; Y68-F143 HydrophobicContact CE2-CZ 3.85Å; Y68-F143 HydrophobicContact CG-CE1 4.14Å; Y68-F143 AromaticContact CG-CZ 3.77Å; Y68-F143 HydrophobicContact CG-CZ 3.77Å; Y68-F143 AromaticContact CZ-CZ 3.93Å; Y68-E150 HydrophobicContact CD2-CB 3.95Å; Y68-E150 HydrophobicContact CD2-CG 4.35Å; Y68-E150 HydrophobicContact CE2-CB 3.79Å; Y68-E150 HydrophobicContact CE2-CG 4.3Å; Y68-E150 WeakPolarHBondContact O-CB 3.37Å; Y68-E150 WeakPolarHBondContact O-CG 3.37Å; Y68-G151 WeakPolarHBondContact CD1-O 3.49Å; Y68-G151 WeakPolarHBondContact CE1-O 3.22Å; Y68-G151 PolarHBondContact N-O 3.05Å; Y68-G151 PolarHBondContact OH-N 2.85Å; Y68-G151 VanDerWaalsContact OH-N 3.08Å; Y68-G153 VanDerWaalsContact CD1-CA 3.41Å
69	P	93.5	Very high	91.2	Very high	22 Å²	22	42.8 Å²	42.8	14%	0.143	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-73.3	152.9	173	-10.5	25.6	0	0	0	111.9	P62 K72 S145	P62-P69 HydrophobicContact CB-CG 4.13Å; P69-K72 HydrophobicContact CB-CG 3.85Å; P69-K72 HydrophobicContact CG-CG 4.08Å; P69-S145 PolarHBondContact O-OG 2.96Å
70	P	94.1	Very high	91	Very high	46 Å²	46	42 Å²	42	30%	0.299	23%	0.225	S	C	.	.	S	Bend	trans	-69.8	162.7	167.3	31.2	-31.8	0	0	0	110.3	K72 D146 E150	P70-K72 PolarHBondContact O-N 3.34Å; P70-D146 CarbonylContact C-O 3.44Å; P70-D146 VanDerWaalsContact CA-O 3.24Å; P70-D146 WeakPolarHBondContact CA-O 3.49Å; P70-D146 WeakPolarHBondContact CB-O 3.39Å; P70-E150 HydrophobicContact CB-CG 4.31Å; P70-E150 VanDerWaalsContact CD-OE1 3.28Å; P70-E150 WeakPolarHBondContact CD-OE1 3.2Å; P70-E150 WeakPolarHBondContact CG-OE1 3.47Å
71	N	92.4	Very high	90.5	Very high	102 Å²	102	41.8 Å²	41.8	55%	0.545	23%	0.225	S	C	.	.	S	Bend	trans	53.9	48.3	178.7	-67.6	-75.1	0	0	0	113.6	S145 D146	N71-S145 WeakPolarHBondContact CA-O 3.49Å; N71-S145 PolarHBondContact N-O 3.29Å; N71-S145 PolarHBondContact N-OG 3.06Å; N71-D146 PolarHBondContact N-O 3.29Å
72	K	91.6	Very high	89.9	Confident	57 Å²	57	42 Å²	42	25%	0.248	23%	0.227	C	C	.	.			trans	-114.8	126.8	177.7	-68.9	-73.3	170.5	172.3	0	111.8	N45 P62 P69 P70 T144 S145	N45-K72 PolarHBondContact O-NZ 2.81Å; P62-K72 HydrophobicContact CG-CG 4.42Å; P69-K72 HydrophobicContact CB-CG 3.85Å; P69-K72 HydrophobicContact CG-CG 4.08Å; P70-K72 PolarHBondContact O-N 3.34Å; K72-T144 CarbonylContact O-C 3.35Å; K72-T144 VanDerWaalsContact O-CA 3.28Å; K72-T144 WeakPolarHBondContact O-CA 3.2Å; K72-S145 WeakPolarHBondContact CB-OG 3.37Å; K72-S145 PolarHBondContact N-O 3.1Å; K72-S145 PolarHBondContact N-OG 2.84Å; K72-S145 PolarHBondContact O-N 2.87Å
73	E	91.6	Very high	89.5	Confident	113 Å²	113	42.7 Å²	42.7	53%	0.528	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.5	165.6	174.6	158.4	173.1	0	0	109.1	V75 K142 F143	E73-V75 HydrophobicContact CG-CG2 4.25Å; E73-K142 HydrophobicContact CG-CD 4.33Å; E73-K142 VanDerWaalsContact OE1-CE 3.3Å; E73-K142 WeakPolarHBondContact OE1-CE 3.32Å; E73-K142 IonicContact OE1-NZ 2.71Å; E73-K142 PolarHBondContact OE1-NZ 2.82Å; E73-K142 WeakPolarHBondContact OE2-CE 3.09Å; E73-K142 IonicContact OE2-NZ 3.47Å; E73-K142 PolarHBondContact OE2-NZ 3.09Å; E73-F143 WeakPolarHBondContact CA-O 3.21Å
74	C	91.2	Very high	89.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	114.1	-179.9	-49.4	0	0	0	0	109.3	C47 Y76 K142 F143	C47-C74 HydrophobicContact CB-CB 3.66Å; C47-C74 WeakPolarHBondContact CB-SG 3.49Å; C47-C74 VanDerWaalsContact SG-CA 3.57Å; C47-C74 WeakPolarHBondContact SG-CB 3.39Å; C47-C74 CovalentContact SG-SG 2.03Å; C47-C74 PolarHBondContact SG-SG 2.93Å; C74-Y76 HydrophobicContact CB-CE2 3.78Å; C74-K142 WeakPolarHBondContact O-CA 3.47Å; C74-F143 HydrophobicContact CB-CB 4.25Å; C74-F143 HydrophobicContact CB-CD1 4.48Å; C74-F143 PolarHBondContact N-O 2.81Å; C74-F143 PolarHBondContact O-N 2.81Å
75	V	90.3	Very high	89.3	Confident	42 Å²	42	42.8 Å²	42.8	26%	0.255	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.9	179.7	179.8	0	0	0	0	110.8	E73 I77 W140 I141 K142	E73-V75 HydrophobicContact CG-CG2 4.25Å; V75-I77 HydrophobicContact CG1-CG1 4.21Å; V75-W140 HydrophobicContact CG1-CZ2 4.15Å; V75-W140 HydrophobicContact CG2-CZ2 4.35Å; V75-I141 CarbonylContact C-O 3.56Å; V75-I141 WeakPolarHBondContact CA-O 3.42Å; V75-K142 HydrophobicContact CG2-CB 4.32Å; V75-K142 HydrophobicContact CG2-CD 4.45Å; V75-K142 HydrophobicContact CG2-CG 4.32Å
76	Y	89.5	Confident	89.4	Confident	21 Å²	21	39 Å²	39	8%	0.082	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	130.7	176.4	-48	-94.4	0	0	0	109.3	F59 M60 C74 I141	F59-Y76 HydrophobicContact CB-CD1 4.19Å; F59-Y76 HydrophobicContact CB-CE1 3.88Å; F59-Y76 AromaticContact CD2-CD1 3.98Å; F59-Y76 HydrophobicContact CD2-CD1 3.98Å; F59-Y76 AromaticContact CD2-CD2 3.86Å; F59-Y76 HydrophobicContact CD2-CD2 3.86Å; F59-Y76 AromaticContact CD2-CE1 3.86Å; F59-Y76 HydrophobicContact CD2-CE1 3.86Å; F59-Y76 AromaticContact CD2-CE2 3.75Å; F59-Y76 HydrophobicContact CD2-CE2 3.75Å; F59-Y76 AromaticContact CD2-CG 3.98Å; F59-Y76 HydrophobicContact CD2-CG 3.98Å; F59-Y76 AromaticContact CD2-CZ 3.75Å; F59-Y76 AromaticContact CE2-CD2 3.92Å; F59-Y76 HydrophobicContact CE2-CD2 3.92Å; F59-Y76 HydrophobicContact CE2-CE2 4.1Å; F59-Y76 HydrophobicContact CE2-CG 4.23Å; F59-Y76 HydrophobicContact CG-CD1 4.13Å; F59-Y76 HydrophobicContact CG-CE1 4.13Å; F59-Y76 HydrophobicContact CG-CG 4.44Å; M60-Y76 PolarHBondContact O-OH 2.83Å; C74-Y76 HydrophobicContact CB-CE2 3.78Å; Y76-I141 HydrophobicContact CD2-CG2 4.3Å; Y76-I141 PolarHBondContact N-O 2.93Å; Y76-I141 PolarHBondContact O-N 3.26Å
77	I	87.5	Confident	89.6	Confident	31 Å²	31	36.7 Å²	36.7	16%	0.159	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	109.8	179.8	-42	-177.4	0	0	0	109.1	W50 V75 P113 I251	W50-I77 PolarHBondContact NE1-O 2.88Å; V75-I77 HydrophobicContact CG1-CG1 4.21Å; I77-P113 HydrophobicContact CG2-CB 4.26Å; I77-P113 WeakPolarHBondContact CG2-O 3.38Å; I77-I251 HydrophobicContact CB-CG2 3.86Å; I77-I251 HydrophobicContact CG2-CB 4.43Å; I77-I251 HydrophobicContact CG2-CG1 3.92Å; I77-I251 HydrophobicContact CG2-CG2 3.6Å
78	L	88.5	Confident	89.8	Confident	9 Å²	9	32.9 Å²	32.9	5%	0.047	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	137	-176.1	-62.2	178.1	0	0	0	110.7	F59 I86 L88 F138 M139 I141 Y158	F59-L78 HydrophobicContact CE1-CD1 4.49Å; L78-I86 HydrophobicContact CB-CD1 3.7Å; L78-I86 HydrophobicContact CB-CG1 4.45Å; L78-I86 HydrophobicContact CB-CG2 4.42Å; L78-I86 HydrophobicContact CD1-CG2 3.84Å; L78-I86 WeakPolarHBondContact O-CD1 3.19Å; L78-L88 HydrophobicContact CD1-CD2 3.89Å; L78-F138 WeakPolarHBondContact O-CA 3.46Å; L78-M139 PolarHBondContact N-O 2.92Å; L78-M139 PolarHBondContact O-N 3.1Å; L78-M139 VanDerWaalsContact O-N 3.14Å; L78-I141 HydrophobicContact CD1-CD1 3.73Å; L78-I141 HydrophobicContact CG-CD1 4.21Å; L78-Y158 HydrophobicContact CD1-CD1 4.24Å; L78-Y158 HydrophobicContact CD1-CD2 4.18Å; L78-Y158 HydrophobicContact CD1-CG 3.86Å; L78-Y158 HydrophobicContact CD2-CD1 4.14Å; L78-Y158 HydrophobicContact CD2-CD2 4.16Å; L78-Y158 HydrophobicContact CD2-CE1 3.94Å; L78-Y158 HydrophobicContact CD2-CE2 4Å; L78-Y158 HydrophobicContact CD2-CG 4.23Å
79	E	85.9	Confident	89.9	Confident	14 Å²	14	34.4 Å²	34.4	7%	0.065	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.2	169.3	174.6	-178.2	-121.3	0	0	109.2	R52 R137 F138 F160 R276	R52-E79 IonicContact CZ-OE2 2.76Å; R52-E79 IonicContact NE-OE2 3.69Å; R52-E79 PolarHBondContact NE-OE2 3.04Å; R52-E79 VanDerWaalsContact NE-OE2 3.1Å; R52-E79 IonicContact NH2-OE2 3.38Å; R52-E79 PolarHBondContact NH2-OE2 2.98Å; E79-R137 WeakPolarHBondContact CA-O 3.28Å; E79-R137 IonicContact OE1-CZ 3.05Å; E79-R137 IonicContact OE1-NE 3.1Å; E79-R137 IonicContact OE1-NH2 2.74Å; E79-R137 PolarHBondContact OE1-NH2 2.74Å; E79-F138 HydrophobicContact CB-CD1 3.95Å; E79-F138 HydrophobicContact CB-CE1 3.8Å; E79-F138 HydrophobicContact CG-CD1 4.11Å; E79-F138 HydrophobicContact CG-CE1 3.6Å; E79-F138 HydrophobicContact CG-CZ 4.47Å; E79-F138 WeakPolarHBondContact OE1-CE1 3.41Å; E79-F160 WeakPolarHBondContact O-CZ 3.36Å; E79-R276 IonicContact OE1-CZ 2.63Å; E79-R276 IonicContact OE1-NH1 2.69Å; E79-R276 PolarHBondContact OE1-NH1 2.88Å; E79-R276 IonicContact OE1-NH2 2.97Å; E79-R276 IonicContact OE2-NH1 2.67Å; E79-R276 PolarHBondContact OE2-NH1 3.19Å
80	A	86.4	Confident	90.1	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.008	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-93.9	165.9	164.7	0	0	0	0	0	111.4	Q84 I86 R137 F160	A80-Q84 HydrophobicContact CB-CB 3.82Å; A80-I86 HydrophobicContact CB-CG1 3.93Å; A80-R137 HydrophobicContact CB-CB 4.19Å; A80-R137 PolarHBondContact N-O 3.05Å; A80-R137 WeakPolarHBondContact O-CD 3.42Å; A80-F160 HydrophobicContact CB-CB 4.31Å; A80-F160 HydrophobicContact CB-CD1 3.39Å; A80-F160 HydrophobicContact CB-CE1 3.8Å; A80-F160 HydrophobicContact CB-CG 3.88Å
81	L	81.7	Confident	90.2	Very high	71 Å²	71	34.5 Å²	34.5	37%	0.372	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-68.5	164.2	174.1	-58	178.3	0	0	0	111	Q84	L81-Q84 VanDerWaalsContact N-OE1 3.15Å; L81-Q84 WeakPolarHBondContact O-CB 3.35Å; L81-Q84 PolarHBondContact O-N 2.85Å
82	P	79	Confident	90.2	Very high	7 Å²	7	38.4 Å²	38.4	5%	0.045	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	143.5	174.9	-19.6	30.2	0	0	0	112.3	Q84 I177 D209 W278	P82-Q84 VanDerWaalsContact C-N 3.25Å; P82-Q84 PolarHBondContact O-N 2.92Å; P82-I177 HydrophobicContact CB-CD1 3.81Å; P82-I177 HydrophobicContact CG-CD1 3.84Å; P82-D209 HydrophobicContact CG-CB 4.09Å; P82-D209 WeakPolarHBondContact CG-OD2 3.48Å; P82-W278 HydrophobicContact CB-CD2 3.69Å; P82-W278 HydrophobicContact CB-CE3 3.42Å; P82-W278 VanDerWaalsContact CB-CE3 3.42Å; P82-W278 HydrophobicContact CB-CH2 3.51Å; P82-W278 HydrophobicContact CB-CZ2 3.73Å; P82-W278 HydrophobicContact CB-CZ3 3.35Å; P82-W278 HydrophobicContact CG-CD2 4.16Å; P82-W278 HydrophobicContact CG-CE3 3.64Å; P82-W278 HydrophobicContact CG-CH2 4.47Å; P82-W278 HydrophobicContact CG-CZ3 3.84Å
83	R	82.9	Confident	90.3	Very high	21 Å²	21	40.5 Å²	40.5	8%	0.079	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	23.7	-173.7	-44	173.2	-66.3	-169.1	1	114.3	D163 F166 L174 N175 I177 W278 E281	R83-D163 VanDerWaalsContact O-CB 3.26Å; R83-D163 WeakPolarHBondContact O-CB 3.47Å; R83-D163 PolarHBondContact O-N 3.35Å; R83-F166 HydrophobicContact CB-CB 4.06Å; R83-F166 HydrophobicContact CB-CD1 4.36Å; R83-F166 HydrophobicContact CB-CD2 3.82Å; R83-F166 HydrophobicContact CB-CE2 4.26Å; R83-F166 HydrophobicContact CB-CG 3.83Å; R83-F166 HydrophobicContact CG-CB 4.07Å; R83-F166 HydrophobicContact CG-CD1 3.6Å; R83-F166 HydrophobicContact CG-CD2 3.91Å; R83-F166 HydrophobicContact CG-CE1 3.88Å; R83-F166 HydrophobicContact CG-CE2 4.15Å; R83-F166 HydrophobicContact CG-CG 3.59Å; R83-F166 HydrophobicContact CG-CZ 4.13Å; R83-L174 HydrophobicContact CB-CD2 4.27Å; R83-N175 PolarHBondContact NH2-O 3.42Å; R83-I177 VanDerWaalsContact NH2-CG1 3.33Å; R83-W278 HydrophobicContact CG-CH2 3.84Å; R83-W278 HydrophobicContact CG-CZ2 3.7Å; R83-E281 IonicContact NH1-OE1 3.98Å
84	Q	86.7	Confident	90.5	Very high	39 Å²	39	35.9 Å²	35.9	18%	0.182	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	154.1	168.3	-64.3	178.5	-26.1	0	0	111.6	A80 L81 P82 R137 F160 V161	A80-Q84 HydrophobicContact CB-CB 3.82Å; L81-Q84 VanDerWaalsContact N-OE1 3.15Å; L81-Q84 WeakPolarHBondContact O-CB 3.35Å; L81-Q84 PolarHBondContact O-N 2.85Å; P82-Q84 VanDerWaalsContact C-N 3.25Å; P82-Q84 PolarHBondContact O-N 2.92Å; Q84-R137 WeakPolarHBondContact O-CA 3.23Å; Q84-R137 WeakPolarHBondContact O-CB 3.4Å; Q84-F160 HydrophobicContact CB-CB 4.35Å; Q84-V161 CarbonylContact C-O 3.47Å; Q84-V161 WeakPolarHBondContact CA-O 3.31Å; Q84-V161 WeakPolarHBondContact CB-O 3.29Å
85	R	92.2	Very high	90.7	Very high	39 Å²	39	41 Å²	41	15%	0.147	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	161.1	167.4	-60.3	176.5	-172.9	-168.5	12.9	109.7	T133 S134 T135 F160 V161 D163 D165	R85-T133 HydrophobicContact CB-CG2 4.3Å; R85-S134 VanDerWaalsContact CD-O 3.31Å; R85-S134 WeakPolarHBondContact CD-O 3.31Å; R85-T135 PolarHBondContact NE-O 2.9Å; R85-F160 WeakPolarHBondContact O-CA 3.31Å; R85-V161 HydrophobicContact CB-CG2 4.02Å; R85-V161 PolarHBondContact N-O 2.87Å; R85-V161 PolarHBondContact O-N 2.64Å; R85-D163 HydrophobicContact CG-CB 4.03Å; R85-D163 WeakPolarHBondContact CG-OD2 3.03Å; R85-D163 IonicContact CZ-OD1 2.77Å; R85-D163 IonicContact CZ-OD2 3.41Å; R85-D163 IonicContact NE-OD1 3.76Å; R85-D163 PolarHBondContact NE-OD1 3.05Å; R85-D163 VanDerWaalsContact NE-OD1 3.1Å; R85-D163 IonicContact NE-OD2 3.21Å; R85-D163 PolarHBondContact NE-OD2 2.64Å; R85-D163 IonicContact NH2-OD1 2.71Å; R85-D163 PolarHBondContact NH2-OD1 2.94Å; R85-D163 IonicContact NH2-OD2 2.72Å; R85-D165 IonicContact NH2-OD1 3.24Å; R85-D165 PolarHBondContact NH2-OD1 2.82Å; R85-D165 IonicContact NH2-OD2 3.71Å; R85-D165 PolarHBondContact NH2-OD2 2.72Å; R85-D165 VanDerWaalsContact NH2-OD2 3.1Å
86	I	94	Very high	91.1	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	128.4	177.4	-62.6	155.4	0	0	0	108.1	L78 A80 L88 T133 S134 R137 M139 F160	L78-I86 HydrophobicContact CB-CD1 3.7Å; L78-I86 HydrophobicContact CB-CG1 4.45Å; L78-I86 HydrophobicContact CB-CG2 4.42Å; L78-I86 HydrophobicContact CD1-CG2 3.84Å; L78-I86 WeakPolarHBondContact O-CD1 3.19Å; A80-I86 HydrophobicContact CB-CG1 3.93Å; I86-L88 HydrophobicContact CG2-CD2 4.14Å; I86-T133 WeakPolarHBondContact O-CA 3.5Å; I86-T133 WeakPolarHBondContact O-CG2 3.38Å; I86-S134 PolarHBondContact N-OG 2.85Å; I86-S134 PolarHBondContact O-N 2.87Å; I86-S134 PolarHBondContact O-OG 2.79Å; I86-R137 VanDerWaalsContact CD1-O 3.32Å; I86-R137 WeakPolarHBondContact CD1-O 3.28Å; I86-M139 HydrophobicContact CB-CB 4.38Å; I86-M139 HydrophobicContact CB-CE 4.14Å; I86-M139 HydrophobicContact CD1-CB 3.7Å; I86-M139 HydrophobicContact CG2-CB 4.33Å; I86-M139 HydrophobicContact CG2-CE 4.03Å; I86-M139 HydrophobicContact CG2-SD 4.22Å; I86-F160 HydrophobicContact CG1-CD1 3.98Å; I86-F160 HydrophobicContact CG1-CE1 3.97Å
87	Q	96	Very high	91.4	Very high	54 Å²	54	38.8 Å²	38.8	25%	0.252	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.4	171.7	179.7	163	96.3	0	0	109.5	L131 V132 T133 Y158 T159 V161	Q87-L131 HydrophobicContact CG-CD2 4.22Å; Q87-V132 CarbonylContact C-O 3.39Å; Q87-V132 WeakPolarHBondContact CA-O 3.4Å; Q87-T133 HydrophobicContact CB-CG2 4.31Å; Q87-T133 PolarHBondContact NE2-OG1 2.94Å; Q87-Y158 CarbonylContact O-C 3.56Å; Q87-Y158 WeakPolarHBondContact O-CA 3.37Å; Q87-T159 PolarHBondContact N-O 3.24Å; Q87-T159 PolarHBondContact O-N 2.91Å; Q87-V161 HydrophobicContact CB-CG1 4.06Å; Q87-V161 HydrophobicContact CB-CG2 4.4Å
88	L	96.8	Very high	91.8	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	133.3	171.3	-55.4	-174.9	0	0	0	109.3	F59 L78 I86 F90 I109 L131 V132 M139 I141 I156	F59-L88 HydrophobicContact CE1-CD2 4.29Å; L78-L88 HydrophobicContact CD1-CD2 3.89Å; I86-L88 HydrophobicContact CG2-CD2 4.14Å; L88-F90 HydrophobicContact CB-CE2 4.49Å; L88-I109 HydrophobicContact CD1-CD1 3.68Å; L88-I109 HydrophobicContact CD1-CG2 4.4Å; L88-L131 WeakPolarHBondContact O-CA 3.4Å; L88-V132 HydrophobicContact CB-CB 4.37Å; L88-V132 PolarHBondContact N-O 3.47Å; L88-V132 PolarHBondContact O-N 2.97Å; L88-M139 HydrophobicContact CD1-SD 3.5Å; L88-M139 WeakPolarHBondContact CD1-SD 3.16Å; L88-M139 HydrophobicContact CD2-SD 4.12Å; L88-M139 HydrophobicContact CG-CE 4.24Å; L88-M139 HydrophobicContact CG-SD 3.67Å; L88-I141 HydrophobicContact CD1-CD1 4Å; L88-I141 HydrophobicContact CD1-CG1 4.36Å; L88-I141 HydrophobicContact CD2-CD1 4.28Å; L88-I156 HydrophobicContact CB-CG2 3.82Å; L88-I156 HydrophobicContact CD1-CG2 4.32Å; L88-I156 HydrophobicContact CD2-CG2 3.92Å; L88-I156 HydrophobicContact CG-CG2 4.23Å
89	A	97	Very high	92.2	Very high	34 Å²	34	41.3 Å²	41.3	28%	0.281	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	114.1	168	0	0	0	0	0	108.9	L131 I156 Q157	A89-L131 HydrophobicContact CB-CD2 3.76Å; A89-I156 WeakPolarHBondContact O-CA 3.47Å; A89-Q157 PolarHBondContact N-O 3.49Å; A89-Q157 PolarHBondContact O-N 2.82Å
90	F	96.9	Very high	92.6	Very high	18 Å²	18	47.3 Å²	47.3	8%	0.079	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	130.2	173.2	-77.7	-106.3	0	0	0	109.7	L88 Y94 I107 I109 F123 N128 P129 G130 V132 I156	L88-F90 HydrophobicContact CB-CE2 4.49Å; F90-Y94 AromaticContact CD1-CD2 3.81Å; F90-Y94 HydrophobicContact CD1-CD2 3.81Å; F90-Y94 HydrophobicContact CD1-CE2 4Å; F90-Y94 HydrophobicContact CE1-CD2 4.18Å; F90-Y94 AromaticContact CE1-CE2 3.91Å; F90-Y94 HydrophobicContact CE1-CE2 3.91Å; F90-I107 HydrophobicContact CE1-CD1 4.41Å; F90-I107 HydrophobicContact CE1-CG2 4.22Å; F90-I107 HydrophobicContact CZ-CD1 4.27Å; F90-I107 HydrophobicContact CZ-CG2 4.34Å; F90-I109 HydrophobicContact CE2-CD1 4.21Å; F90-I109 HydrophobicContact CZ-CD1 4.02Å; F90-F123 HydrophobicContact CZ-CD2 4.38Å; F90-N128 VanDerWaalsContact CB-OD1 3.28Å; F90-N128 WeakPolarHBondContact CB-OD1 3.02Å; F90-P129 HydrophobicContact CD1-CB 4.49Å; F90-P129 HydrophobicContact CD1-CG 3.93Å; F90-P129 HydrophobicContact CD2-CB 3.86Å; F90-P129 HydrophobicContact CD2-CG 4.17Å; F90-P129 HydrophobicContact CE1-CG 3.81Å; F90-P129 HydrophobicContact CE2-CB 3.9Å; F90-P129 HydrophobicContact CE2-CG 4.07Å; F90-P129 HydrophobicContact CG-CB 4.17Å; F90-P129 HydrophobicContact CG-CG 4.11Å; F90-P129 HydrophobicContact CZ-CB 4.23Å; F90-P129 HydrophobicContact CZ-CG 3.88Å; F90-G130 PolarHBondContact N-O 3.37Å; F90-V132 HydrophobicContact CD2-CG2 4.48Å; F90-V132 HydrophobicContact CE2-CG2 3.98Å; F90-I156 HydrophobicContact CD1-CD1 4.04Å; F90-I156 HydrophobicContact CD1-CG1 3.76Å; F90-I156 HydrophobicContact CD2-CG1 4.27Å; F90-I156 HydrophobicContact CE1-CD1 3.49Å; F90-I156 VanDerWaalsContact CE1-CD1 3.49Å; F90-I156 HydrophobicContact CE1-CG1 3.77Å; F90-I156 HydrophobicContact CE2-CD1 4.09Å; F90-I156 HydrophobicContact CE2-CG1 4.26Å; F90-I156 HydrophobicContact CG-CG1 4.02Å; F90-I156 HydrophobicContact CZ-CD1 3.51Å; F90-I156 HydrophobicContact CZ-CG1 4.02Å
91	D	95.1	Very high	92.9	Very high	51 Å²	51	54 Å²	54	27%	0.273	26%	0.262	S	S	.	.			trans	-64.1	153	172.3	-157.7	-16.9	0	0	0	110.1	N93 N128 R155	D91-N93 PolarHBondContact O-N 3.01Å; D91-N128 PolarHBondContact O-ND2 3.19Å; D91-R155 HydrophobicContact CB-CB 3.95Å; D91-R155 HydrophobicContact CB-CG 4.29Å; D91-R155 VanDerWaalsContact CB-O 3.29Å; D91-R155 WeakPolarHBondContact CB-O 3.29Å; D91-R155 PolarHBondContact N-O 3.34Å; D91-R155 WeakPolarHBondContact OD2-CD 3.47Å; D91-R155 IonicContact OD2-CZ 3.73Å; D91-R155 IonicContact OD2-NE 2.77Å; D91-R155 IonicContact OD2-NH1 2.73Å; D91-R155 PolarHBondContact OD2-NH1 3.15Å
92	K	93.6	Very high	93.6	Very high	184 Å²	184	51.4 Å²	51.4	80%	0.8	25%	0.249	S	C	*	.	S	Bend	trans	-61.1	-35.3	-173.2	-68.5	-176.2	179.8	178.8	0	112.3	Y94 N128	K92-Y94 PolarHBondContact O-N 3.33Å; K92-Y94 VanDerWaalsContact O-N 3.13Å; K92-N128 PolarHBondContact O-ND2 3.07Å
93	N	92.7	Very high	94.3	Very high	102 Å²	102	58.6 Å²	58.6	55%	0.545	28%	0.276	S	S	.	.			trans	-80	90.4	177.5	-63.8	-1.9	0	0	0	108.9	D91 L152	D91-N93 PolarHBondContact O-N 3.01Å; N93-L152 HydrophobicContact CB-CD2 3.9Å
94	Y	95.9	Very high	94.9	Very high	15 Å²	15	62.6 Å²	62.6	6%	0.059	29%	0.294	C	S	.	.			trans	-133.4	124.9	-179	170.4	-93.8	0	0	0	109.4	F90 K92 I96 F123 C124 G125 N128 G153 F154	F90-Y94 AromaticContact CD1-CD2 3.81Å; F90-Y94 HydrophobicContact CD1-CD2 3.81Å; F90-Y94 HydrophobicContact CD1-CE2 4Å; F90-Y94 HydrophobicContact CE1-CD2 4.18Å; F90-Y94 AromaticContact CE1-CE2 3.91Å; F90-Y94 HydrophobicContact CE1-CE2 3.91Å; K92-Y94 PolarHBondContact O-N 3.33Å; K92-Y94 VanDerWaalsContact O-N 3.13Å; Y94-I96 HydrophobicContact CE2-CD1 3.74Å; Y94-I96 HydrophobicContact CE2-CG1 3.98Å; Y94-F123 WeakPolarHBondContact OH-CB 3.47Å; Y94-F123 PolarHBondContact OH-O 2.91Å; Y94-C124 PolarHBondContact OH-N 3.36Å; Y94-G125 WeakPolarHBondContact CE1-O 3.45Å; Y94-N128 HydrophobicContact CD1-CB 4.28Å; Y94-G153 WeakPolarHBondContact CA-O 3.34Å; Y94-F154 HydrophobicContact CD2-CB 3.77Å; Y94-F154 HydrophobicContact CE2-CB 4.12Å
95	Y	96.6	Very high	95.5	Very high	107 Å²	107	60.8 Å²	60.8	42%	0.42	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-157.9	111.7	170.9	-175.1	-89.4	0	0	0	110.7	G151 L152 G153	Y95-G151 CarbonylContact O-C 3.48Å; Y95-G151 WeakPolarHBondContact O-CA 3.01Å; Y95-L152 PolarHBondContact O-N 3.33Å; Y95-L152 VanDerWaalsContact O-N 3.14Å; Y95-G153 PolarHBondContact N-O 2.77Å; Y95-G153 WeakPolarHBondContact O-CA 3.37Å; Y95-G153 PolarHBondContact O-N 2.87Å
96	I	97.1	Very high	95.7	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.282	C	S	.	.			trans	-107.4	159.7	169.4	-64.5	179.1	0	0	0	107.7	Y68 Y94 D105 I107 C124 G125 F143 F154	Y68-I96 HydrophobicContact CE1-CG1 4.46Å; Y94-I96 HydrophobicContact CE2-CD1 3.74Å; Y94-I96 HydrophobicContact CE2-CG1 3.98Å; I96-D105 HydrophobicContact CG2-CB 3.48Å; I96-D105 VanDerWaalsContact CG2-CB 3.48Å; I96-I107 HydrophobicContact CD1-CB 4.22Å; I96-I107 HydrophobicContact CD1-CG2 3.89Å; I96-C124 HydrophobicContact CG2-CB 4.12Å; I96-G125 PolarHBondContact N-O 3.26Å; I96-G125 VanDerWaalsContact N-O 3.11Å; I96-G125 CarbonylContact O-C 3.54Å; I96-G125 WeakPolarHBondContact O-CA 3.43Å; I96-G125 PolarHBondContact O-N 3.12Å; I96-F143 HydrophobicContact CD1-CD2 4.22Å; I96-F143 HydrophobicContact CD1-CE2 4.02Å; I96-F143 HydrophobicContact CG1-CE2 4.4Å; I96-F143 HydrophobicContact CG2-CE2 4.43Å; I96-F154 HydrophobicContact CD1-CD1 4.06Å
97	E	97.2	Very high	95.8	Very high	17 Å²	17	59.7 Å²	59.7	8%	0.079	28%	0.282	C	S	.	.			trans	-50.1	135.5	174.1	-167.3	-78.3	155.7	0	0	111.7	Y68 S99 D105 C124 G125 L149	Y68-E97 PolarHBondContact OH-N 3.14Å; Y68-E97 VanDerWaalsContact OH-N 3.16Å; E97-S99 PolarHBondContact O-N 3Å; E97-S99 WeakPolarHBondContact OE2-CB 3.39Å; E97-S99 PolarHBondContact OE2-N 2.96Å; E97-S99 PolarHBondContact OE2-OG 2.84Å; E97-S99 VanDerWaalsContact OE2-OG 3.1Å; E97-D105 HydrophobicContact CB-CB 3.81Å; E97-D105 WeakPolarHBondContact CB-OD2 3.4Å; E97-C124 WeakPolarHBondContact O-CB 3.08Å; E97-G125 PolarHBondContact O-N 2.78Å; E97-G125 VanDerWaalsContact O-N 3.14Å; E97-L149 HydrophobicContact CG-CB 3.86Å
98	P	96.4	Very high	95.9	Very high	78 Å²	78	57.7 Å²	57.7	51%	0.506	27%	0.273	S	S	.	.			trans	-95.9	78.1	-174.9	35.7	-34.6	0	0	0	114.2
99	S	95.7	Very high	95.9	Very high	15 Å²	15	57.7 Å²	57.7	11%	0.105	27%	0.273	C	S	.	.			trans	-94.6	154.7	177.4	51.3	0	0	0	0	115.6	E97 Q101 C102 R103 F104	E97-S99 PolarHBondContact O-N 3Å; E97-S99 WeakPolarHBondContact OE2-CB 3.39Å; E97-S99 PolarHBondContact OE2-N 2.96Å; E97-S99 PolarHBondContact OE2-OG 2.84Å; E97-S99 VanDerWaalsContact OE2-OG 3.1Å; S99-Q101 PolarHBondContact O-N 2.8Å; S99-C102 PolarHBondContact O-N 2.95Å; S99-R103 PolarHBondContact OG-N 3.27Å; S99-R103 VanDerWaalsContact OG-N 3.11Å; S99-F104 VanDerWaalsContact CB-CD2 3.41Å; S99-F104 PolarHBondContact OG-N 3.06Å; S99-F104 VanDerWaalsContact OG-N 3.11Å
100	F	94.4	Very high	95.9	Very high	141 Å²	141	58.3 Å²	58.3	62%	0.618	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	119.1	176.6	177.4	-90.9	0	0	0	111	C102 R103	F100-C102 PolarHBondContact O-N 2.86Å; F100-R103 WeakPolarHBondContact O-CG 3.28Å; F100-R103 PolarHBondContact O-NE 2.55Å
101	Q	93.2	Very high	95.7	Very high	141 Å²	141	59 Å²	59	66%	0.659	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	22.8	-172	-65.6	176	-26.4	0	0	114.3	S99 R103	S99-Q101 PolarHBondContact O-N 2.8Å; Q101-R103 HydrophobicContact CB-CG 4.41Å
102	C	95.7	Very high	95.5	Very high	16 Å²	16	57 Å²	57	11%	0.108	26%	0.264	C	S	.	.	S	Bend	trans	52.3	59.2	179.9	-53.5	0	0	0	0	111.1	S99 F100 H106 R122 C124	S99-C102 PolarHBondContact O-N 2.95Å; F100-C102 PolarHBondContact O-N 2.86Å; C102-H106 HydrophobicContact CB-CB 3.9Å; C102-R122 HydrophobicContact CB-CG 3.9Å; C102-R122 WeakPolarHBondContact O-CD 3.29Å; C102-R122 PolarHBondContact O-NH1 2.94Å; C102-C124 WeakPolarHBondContact CA-SG 3.28Å; C102-C124 HydrophobicContact CB-CB 3.56Å; C102-C124 WeakPolarHBondContact CB-SG 3.47Å; C102-C124 WeakPolarHBondContact SG-CB 3.37Å; C102-C124 PolarHBondContact SG-N 3.22Å; C102-C124 VanDerWaalsContact SG-N 3.38Å; C102-C124 CovalentContact SG-SG 2.03Å; C102-C124 PolarHBondContact SG-SG 2.87Å
103	R	95.1	Very high	95.1	Very high	158 Å²	158	49 Å²	49	60%	0.596	23%	0.231	S	C	*	.			trans	-94.4	-28.3	-174.6	-78.2	-173.7	-64.6	156.6	3.6	113.3	S99 F100 Q101	S99-R103 PolarHBondContact OG-N 3.27Å; S99-R103 VanDerWaalsContact OG-N 3.11Å; F100-R103 WeakPolarHBondContact O-CG 3.28Å; F100-R103 PolarHBondContact O-NE 2.55Å; Q101-R103 HydrophobicContact CB-CG 4.41Å
104	F	95.4	Very high	94.8	Very high	105 Å²	105	47.1 Å²	47.1	46%	0.461	22%	0.218	S	C	.	.	S	Bend	trans	-85.6	-128.6	167.2	-54.1	-30.2	0	0	0	107.2	S99 H106 D146	S99-F104 VanDerWaalsContact CB-CD2 3.41Å; S99-F104 PolarHBondContact OG-N 3.06Å; S99-F104 VanDerWaalsContact OG-N 3.11Å; F104-H106 PolarHBondContact O-N 2.04Å; F104-H106 PolarHBondContact O-ND1 3.43Å; F104-D146 WeakPolarHBondContact CA-OD2 3.2Å; F104-D146 WeakPolarHBondContact CB-OD2 3.39Å; F104-D146 VanDerWaalsContact CD1-OD2 3.22Å; F104-D146 WeakPolarHBondContact CD1-OD2 3.45Å; F104-D146 VanDerWaalsContact CG-OD2 3.3Å; F104-D146 WeakPolarHBondContact CG-OD2 3.26Å
105	D	97.6	Very high	94.4	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	23%	0.23	C	C	.	.	S	Bend	trans	-60.2	137.6	-179.5	-52.3	-14.5	0	0	0	113.1	Y68 I96 E97 C124 T144 S145 D146	Y68-D105 WeakPolarHBondContact CE2-OD2 3.02Å; Y68-D105 PolarHBondContact OH-OD2 2.69Å; I96-D105 HydrophobicContact CG2-CB 3.48Å; I96-D105 VanDerWaalsContact CG2-CB 3.48Å; E97-D105 HydrophobicContact CB-CB 3.81Å; E97-D105 WeakPolarHBondContact CB-OD2 3.4Å; D105-C124 WeakPolarHBondContact O-CB 3.2Å; D105-T144 VanDerWaalsContact CA-O 3.28Å; D105-T144 WeakPolarHBondContact CA-O 3.11Å; D105-S145 WeakPolarHBondContact OD1-CA 3.31Å; D105-S145 WeakPolarHBondContact OD1-CB 3.34Å; D105-D146 PolarHBondContact OD1-N 2.86Å
106	H	97.3	Very high	94	Very high	16 Å²	16	50.9 Å²	50.9	7%	0.074	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	155.4	179	61	-87.9	0	0	0	113	C102 F104 R122 F123 F143 T144	C102-H106 HydrophobicContact CB-CB 3.9Å; F104-H106 PolarHBondContact O-N 2.04Å; F104-H106 PolarHBondContact O-ND1 3.43Å; H106-R122 HydrophobicContact CB-CG 3.68Å; H106-F123 WeakPolarHBondContact CA-O 3.04Å; H106-F143 WeakPolarHBondContact O-CA 3.49Å; H106-F143 VanDerWaalsContact O-CD2 3.28Å; H106-F143 WeakPolarHBondContact O-CD2 3.43Å; H106-T144 PolarHBondContact CE1-OG1 2.84Å; H106-T144 PolarHBondContact N-O 3.17Å; H106-T144 PolarHBondContact NE2-OG1 2.89Å; H106-T144 PolarHBondContact O-N 2.89Å
107	I	96.6	Very high	93.8	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	117.8	159.1	-172.4	174.3	0	0	0	109.8	F90 I96 I109 R122 F123 I141 K142 F143 F154 I156	F90-I107 HydrophobicContact CE1-CD1 4.41Å; F90-I107 HydrophobicContact CE1-CG2 4.22Å; F90-I107 HydrophobicContact CZ-CD1 4.27Å; F90-I107 HydrophobicContact CZ-CG2 4.34Å; I96-I107 HydrophobicContact CD1-CB 4.22Å; I96-I107 HydrophobicContact CD1-CG2 3.89Å; I107-I109 HydrophobicContact CG1-CG1 4.39Å; I107-R122 WeakPolarHBondContact O-CA 3.45Å; I107-F123 HydrophobicContact CG2-CB 3.87Å; I107-F123 HydrophobicContact CG2-CD2 4.28Å; I107-F123 PolarHBondContact N-O 2.89Å; I107-F123 PolarHBondContact O-N 2.82Å; I107-I141 HydrophobicContact CD1-CG2 3.75Å; I107-I141 HydrophobicContact CG1-CG2 3.87Å; I107-K142 CarbonylContact C-O 3.47Å; I107-K142 WeakPolarHBondContact CA-O 3.24Å; I107-F143 HydrophobicContact CB-CD2 4.48Å; I107-F154 HydrophobicContact CD1-CD2 4.39Å; I107-F154 HydrophobicContact CD1-CE1 4.32Å; I107-F154 HydrophobicContact CD1-CE2 4.13Å; I107-F154 HydrophobicContact CD1-CZ 4.1Å; I107-I156 HydrophobicContact CD1-CD1 3.48Å; I107-I156 VanDerWaalsContact CD1-CD1 3.48Å
108	E	96.9	Very high	93.7	Very high	13 Å²	13	55 Å²	55	6%	0.061	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	135.3	176.9	-179.6	168.9	107.2	0	0	110.1	R110 I119 R122 I141 K142	E108-R110 HydrophobicContact CG-CG 4.4Å; E108-R110 IonicContact OE1-CZ 2.68Å; E108-R110 IonicContact OE1-NE 3.31Å; E108-R110 PolarHBondContact OE1-NE 2.63Å; E108-R110 IonicContact OE1-NH2 2.78Å; E108-R110 PolarHBondContact OE1-NH2 3.43Å; E108-R110 IonicContact OE2-NH2 2.85Å; E108-I119 HydrophobicContact CG-CD1 3.83Å; E108-I119 HydrophobicContact CG-CG1 4.28Å; E108-R122 HydrophobicContact CB-CG 4.37Å; E108-R122 IonicContact OE2-CZ 3.32Å; E108-R122 IonicContact OE2-NE 3.16Å; E108-R122 PolarHBondContact OE2-NE 2.91Å; E108-R122 VanDerWaalsContact OE2-NE 3.08Å; E108-R122 IonicContact OE2-NH2 2.66Å; E108-R122 PolarHBondContact OE2-NH2 3.37Å; E108-I141 WeakPolarHBondContact O-CA 3.41Å; E108-K142 PolarHBondContact N-O 2.89Å; E108-K142 PolarHBondContact O-N 3.36Å
109	I	97.4	Very high	93.7	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	131	-175.2	-47.8	-165.5	0	0	0	109.7	L88 F90 I107 I120 D121 F123 V132 M139 I141	L88-I109 HydrophobicContact CD1-CD1 3.68Å; L88-I109 HydrophobicContact CD1-CG2 4.4Å; F90-I109 HydrophobicContact CE2-CD1 4.21Å; F90-I109 HydrophobicContact CZ-CD1 4.02Å; I107-I109 HydrophobicContact CG1-CG1 4.39Å; I109-I120 HydrophobicContact CG2-CD1 4.12Å; I109-I120 PolarHBondContact O-N 2.94Å; I109-D121 PolarHBondContact N-O 2.83Å; I109-D121 VanDerWaalsContact N-O 3.09Å; I109-F123 HydrophobicContact CD1-CD2 4.1Å; I109-F123 HydrophobicContact CD1-CE2 3.8Å; I109-F123 HydrophobicContact CG1-CD2 4.36Å; I109-F123 HydrophobicContact CG1-CE2 4.19Å; I109-V132 HydrophobicContact CD1-CG1 4.46Å; I109-V132 HydrophobicContact CG2-CG1 4.48Å; I109-M139 HydrophobicContact CG2-CE 4.46Å; I109-M139 HydrophobicContact CG2-CG 3.74Å; I109-M139 HydrophobicContact CG2-SD 3.5Å; I109-M139 VanDerWaalsContact CG2-SD 3.5Å; I109-I141 HydrophobicContact CG2-CG1 4.09Å
110	R	96.1	Very high	93.7	Very high	47 Å²	47	57.6 Å²	57.6	18%	0.177	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	142.2	-174.3	-58	-175.6	169.8	-102.5	1.9	112.4	E108 G112 G115 S117 P118 M139 W140	E108-R110 HydrophobicContact CG-CG 4.4Å; E108-R110 IonicContact OE1-CZ 2.68Å; E108-R110 IonicContact OE1-NE 3.31Å; E108-R110 PolarHBondContact OE1-NE 2.63Å; E108-R110 IonicContact OE1-NH2 2.78Å; E108-R110 PolarHBondContact OE1-NH2 3.43Å; E108-R110 IonicContact OE2-NH2 2.85Å; R110-G112 PolarHBondContact O-N 2.99Å; R110-G112 VanDerWaalsContact O-N 3.15Å; R110-G115 WeakPolarHBondContact CD-O 3.43Å; R110-G115 PolarHBondContact NE-O 3.15Å; R110-G115 PolarHBondContact NH1-O 3.42Å; R110-S117 WeakPolarHBondContact CD-O 3.48Å; R110-S117 PolarHBondContact NH1-O 3.31Å; R110-P118 CarbonylContact C-O 3.58Å; R110-P118 VanDerWaalsContact CA-O 3.23Å; R110-P118 WeakPolarHBondContact CA-O 3.27Å; R110-P118 WeakPolarHBondContact CB-O 3.34Å; R110-M139 WeakPolarHBondContact O-CA 3.32Å; R110-M139 WeakPolarHBondContact O-CG 3.46Å; R110-W140 HydrophobicContact CB-CB 4.41Å; R110-W140 HydrophobicContact CB-CE3 4.19Å; R110-W140 HydrophobicContact CG-CE3 3.87Å; R110-W140 HydrophobicContact CG-CZ3 4.24Å; R110-W140 PolarHBondContact N-O 2.76Å; R110-W140 PolarHBondContact O-N 2.72Å
111	D	94.2	Very high	93.8	Very high	33 Å²	33	54.8 Å²	54.8	18%	0.176	27%	0.273	C	S	.	.	S	Bend	trans	-88.8	73.4	-174.9	-162.5	13	0	0	0	111	P118 I120 S134 T135 G136	D111-P118 PolarHBondContact N-O 3.26Å; D111-I120 HydrophobicContact CB-CD1 3.96Å; D111-I120 HydrophobicContact CB-CG1 3.8Å; D111-S134 VanDerWaalsContact OD1-CB 3.23Å; D111-S134 WeakPolarHBondContact OD1-CB 3.32Å; D111-T135 VanDerWaalsContact CG-N 3.35Å; D111-T135 PolarHBondContact OD1-N 2.94Å; D111-T135 WeakPolarHBondContact OD2-CB 3.45Å; D111-T135 WeakPolarHBondContact OD2-CG2 3.42Å; D111-T135 PolarHBondContact OD2-N 2.98Å; D111-T135 PolarHBondContact OD2-OG1 2.79Å; D111-G136 PolarHBondContact OD1-N 2.03Å
112	G	89.8	Confident	94	Very high	9 Å²	9	52 Å²	52	9%	0.093	26%	0.256	C	S	.	.	S	Bend	trans	162.3	178.7	-176.5	0	0	0	0	0	111.3	R110 S117 F138 M139 W140	R110-G112 PolarHBondContact O-N 2.99Å; R110-G112 VanDerWaalsContact O-N 3.15Å; G112-S117 WeakPolarHBondContact CA-OG 3.28Å; G112-F138 PolarHBondContact N-O 2.94Å; G112-M139 CarbonylContact O-C 3.58Å; G112-M139 VanDerWaalsContact O-C 3.25Å; G112-M139 WeakPolarHBondContact O-CA 3.3Å; G112-W140 VanDerWaalsContact O-CB 3.28Å; G112-W140 WeakPolarHBondContact O-CB 3.36Å; G112-W140 PolarHBondContact O-N 2.85Å
113	P	85.5	Confident	94.1	Very high	16 Å²	16	52.7 Å²	52.7	10%	0.104	26%	0.257	C	S	.	.	S	Bend	trans	-87.4	-5.2	-175.4	33	-33.1	0	0	0	114.6	I77 F138 I251 L254	I77-P113 HydrophobicContact CG2-CB 4.26Å; I77-P113 WeakPolarHBondContact CG2-O 3.38Å; P113-F138 HydrophobicContact CB-CB 4.17Å; P113-F138 HydrophobicContact CB-CD1 4.2Å; P113-F138 HydrophobicContact CB-CG 4.11Å; P113-F138 HydrophobicContact CG-CB 4.46Å; P113-F138 HydrophobicContact CG-CD2 4.35Å; P113-F138 HydrophobicContact CG-CG 4.32Å; P113-I251 HydrophobicContact CB-CD1 3.62Å; P113-I251 HydrophobicContact CB-CG1 3.59Å; P113-I251 HydrophobicContact CG-CD1 4.3Å; P113-L254 HydrophobicContact CG-CD2 3.94Å
114	F	86.3	Confident	94.2	Very high	62 Å²	62	46.1 Å²	46.1	27%	0.272	24%	0.235	S	C	.	.	S	Bend	trans	-122.1	155.5	-171.3	-51.1	-61.4	0	0	0	113.4	F116 S117 L254	F114-F116 HydrophobicContact CB-CD1 3.87Å; F114-F116 HydrophobicContact CB-CD2 4.18Å; F114-F116 HydrophobicContact CB-CE1 3.56Å; F114-F116 HydrophobicContact CB-CE2 3.89Å; F114-F116 HydrophobicContact CB-CG 4.16Å; F114-F116 HydrophobicContact CB-CZ 3.58Å; F114-F116 HydrophobicContact CD1-CE1 4.39Å; F114-F116 HydrophobicContact CD1-CZ 4.24Å; F114-F116 HydrophobicContact CD2-CE1 4.14Å; F114-F116 AromaticContact CD2-CE2 3.53Å; F114-F116 HydrophobicContact CD2-CE2 3.53Å; F114-F116 AromaticContact CD2-CZ 3.3Å; F114-F116 HydrophobicContact CD2-CZ 3.3Å; F114-F116 HydrophobicContact CE2-CE2 4.32Å; F114-F116 AromaticContact CE2-CZ 3.95Å; F114-F116 HydrophobicContact CE2-CZ 3.95Å; F114-F116 AromaticContact CG-CE1 3.81Å; F114-F116 HydrophobicContact CG-CE1 3.81Å; F114-F116 AromaticContact CG-CE2 3.98Å; F114-F116 HydrophobicContact CG-CE2 3.98Å; F114-F116 AromaticContact CG-CZ 3.46Å; F114-F116 HydrophobicContact CG-CZ 3.46Å; F114-F116 VanDerWaalsContact CG-CZ 3.46Å; F114-F116 PolarHBondContact O-N 2.79Å; F114-F116 VanDerWaalsContact O-N 3.15Å; F114-S117 PolarHBondContact N-OG 2.82Å; F114-S117 VanDerWaalsContact O-CB 3.23Å; F114-S117 WeakPolarHBondContact O-CB 3.39Å; F114-S117 PolarHBondContact O-N 3.23Å; F114-S117 PolarHBondContact O-OG 3.17Å; F114-L254 HydrophobicContact CE1-CB 4.44Å; F114-L254 HydrophobicContact CE1-CD2 4.38Å; F114-L254 HydrophobicContact CE2-CD2 4.3Å; F114-L254 HydrophobicContact CZ-CB 4.31Å; F114-L254 HydrophobicContact CZ-CD2 3.69Å; F114-L254 HydrophobicContact CZ-CG 3.94Å
115	G	88.5	Confident	94.2	Very high	31 Å²	31	41.4 Å²	41.4	32%	0.32	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-13.8	174.5	0	0	0	0	0	115.4	R110 W140	R110-G115 WeakPolarHBondContact CD-O 3.43Å; R110-G115 PolarHBondContact NE-O 3.15Å; R110-G115 PolarHBondContact NH1-O 3.42Å; G115-W140 VanDerWaalsContact CA-CE2 3.48Å
116	F	88.8	Confident	94.1	Very high	169 Å²	169	43.7 Å²	43.7	74%	0.741	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	4.3	171.3	58	-101	0	0	0	113.6	F114	F114-F116 HydrophobicContact CB-CD1 3.87Å; F114-F116 HydrophobicContact CB-CD2 4.18Å; F114-F116 HydrophobicContact CB-CE1 3.56Å; F114-F116 HydrophobicContact CB-CE2 3.89Å; F114-F116 HydrophobicContact CB-CG 4.16Å; F114-F116 HydrophobicContact CB-CZ 3.58Å; F114-F116 HydrophobicContact CD1-CE1 4.39Å; F114-F116 HydrophobicContact CD1-CZ 4.24Å; F114-F116 HydrophobicContact CD2-CE1 4.14Å; F114-F116 AromaticContact CD2-CE2 3.53Å; F114-F116 HydrophobicContact CD2-CE2 3.53Å; F114-F116 AromaticContact CD2-CZ 3.3Å; F114-F116 HydrophobicContact CD2-CZ 3.3Å; F114-F116 HydrophobicContact CE2-CE2 4.32Å; F114-F116 AromaticContact CE2-CZ 3.95Å; F114-F116 HydrophobicContact CE2-CZ 3.95Å; F114-F116 AromaticContact CG-CE1 3.81Å; F114-F116 HydrophobicContact CG-CE1 3.81Å; F114-F116 AromaticContact CG-CE2 3.98Å; F114-F116 HydrophobicContact CG-CE2 3.98Å; F114-F116 AromaticContact CG-CZ 3.46Å; F114-F116 HydrophobicContact CG-CZ 3.46Å; F114-F116 VanDerWaalsContact CG-CZ 3.46Å; F114-F116 PolarHBondContact O-N 2.79Å; F114-F116 VanDerWaalsContact O-N 3.15Å
117	S	91.8	Very high	93.9	Very high	9 Å²	9	51.6 Å²	51.6	6%	0.063	27%	0.274	C	S	.	.	S	Bend	trans	-65.4	158.7	174.9	-44	0	0	0	0	110.8	R110 G112 F114 I119	R110-S117 WeakPolarHBondContact CD-O 3.48Å; R110-S117 PolarHBondContact NH1-O 3.31Å; G112-S117 WeakPolarHBondContact CA-OG 3.28Å; F114-S117 PolarHBondContact N-OG 2.82Å; F114-S117 VanDerWaalsContact O-CB 3.23Å; F114-S117 WeakPolarHBondContact O-CB 3.39Å; F114-S117 PolarHBondContact O-N 3.23Å; F114-S117 PolarHBondContact O-OG 3.17Å; S117-I119 PolarHBondContact O-N 3.09Å
118	P	94.9	Very high	93.8	Very high	94 Å²	94	54 Å²	54	61%	0.61	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-52.4	132	177	-26.5	35.6	0	0	0	111.8	R110 D111	R110-P118 CarbonylContact C-O 3.58Å; R110-P118 VanDerWaalsContact CA-O 3.23Å; R110-P118 WeakPolarHBondContact CA-O 3.27Å; R110-P118 WeakPolarHBondContact CB-O 3.34Å; D111-P118 PolarHBondContact N-O 3.26Å
119	I	96.3	Very high	93.7	Very high	88 Å²	88	54.8 Å²	54.8	45%	0.451	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	133.8	176.2	-168.5	168.5	0	0	0	110	E108 S117 R122	E108-I119 HydrophobicContact CG-CD1 3.83Å; E108-I119 HydrophobicContact CG-CG1 4.28Å; S117-I119 PolarHBondContact O-N 3.09Å; I119-R122 HydrophobicContact CD1-CB 4.39Å
120	I	96.9	Very high	93.6	Very high	60 Å²	60	56.3 Å²	56.3	31%	0.308	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-57.5	169.8	-60.2	-177.5	0	0	0	108	I109 D111 V132 M139	I109-I120 HydrophobicContact CG2-CD1 4.12Å; I109-I120 PolarHBondContact O-N 2.94Å; D111-I120 HydrophobicContact CB-CD1 3.96Å; D111-I120 HydrophobicContact CB-CG1 3.8Å; I120-V132 HydrophobicContact CG2-CG1 3.84Å; I120-M139 HydrophobicContact CD1-CE 4.16Å
121	D	96.4	Very high	93.7	Very high	83 Å²	83	59.4 Å²	59.4	44%	0.444	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166	176	173.3	-150.4	-15.3	0	0	0	110.4	I109 F123	I109-D121 PolarHBondContact N-O 2.83Å; I109-D121 VanDerWaalsContact N-O 3.09Å; D121-F123 HydrophobicContact CB-CD1 4.48Å; D121-F123 HydrophobicContact CB-CE1 3.73Å; D121-F123 HydrophobicContact CB-CE2 3.94Å; D121-F123 HydrophobicContact CB-CZ 3.44Å; D121-F123 VanDerWaalsContact CB-CZ 3.44Å; D121-F123 WeakPolarHBondContact OD2-CE1 3.2Å
122	R	96.9	Very high	93.8	Very high	81 Å²	81	58.4 Å²	58.4	31%	0.306	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.2	168.8	-175.2	-172.3	-73	-165	-3.1	109.9	C102 H106 I107 E108 I119	C102-R122 HydrophobicContact CB-CG 3.9Å; C102-R122 WeakPolarHBondContact O-CD 3.29Å; C102-R122 PolarHBondContact O-NH1 2.94Å; H106-R122 HydrophobicContact CB-CG 3.68Å; I107-R122 WeakPolarHBondContact O-CA 3.45Å; E108-R122 HydrophobicContact CB-CG 4.37Å; E108-R122 IonicContact OE2-CZ 3.32Å; E108-R122 IonicContact OE2-NE 3.16Å; E108-R122 PolarHBondContact OE2-NE 2.91Å; E108-R122 VanDerWaalsContact OE2-NE 3.08Å; E108-R122 IonicContact OE2-NH2 2.66Å; E108-R122 PolarHBondContact OE2-NH2 3.37Å; I119-R122 HydrophobicContact CD1-CB 4.39Å
123	F	97.2	Very high	94.1	Very high	32 Å²	32	60.6 Å²	60.6	14%	0.14	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.6	-173.2	-50.1	-73.9	0	0	0	112.9	F90 Y94 H106 I107 I109 D121 P129 V132	F90-F123 HydrophobicContact CZ-CD2 4.38Å; Y94-F123 WeakPolarHBondContact OH-CB 3.47Å; Y94-F123 PolarHBondContact OH-O 2.91Å; H106-F123 WeakPolarHBondContact CA-O 3.04Å; I107-F123 HydrophobicContact CG2-CB 3.87Å; I107-F123 HydrophobicContact CG2-CD2 4.28Å; I107-F123 PolarHBondContact N-O 2.89Å; I107-F123 PolarHBondContact O-N 2.82Å; I109-F123 HydrophobicContact CD1-CD2 4.1Å; I109-F123 HydrophobicContact CD1-CE2 3.8Å; I109-F123 HydrophobicContact CG1-CD2 4.36Å; I109-F123 HydrophobicContact CG1-CE2 4.19Å; D121-F123 HydrophobicContact CB-CD1 4.48Å; D121-F123 HydrophobicContact CB-CE1 3.73Å; D121-F123 HydrophobicContact CB-CE2 3.94Å; D121-F123 HydrophobicContact CB-CZ 3.44Å; D121-F123 VanDerWaalsContact CB-CZ 3.44Å; D121-F123 WeakPolarHBondContact OD2-CE1 3.2Å; F123-P129 HydrophobicContact CB-CG 3.74Å; F123-P129 HydrophobicContact CD1-CB 3.88Å; F123-P129 HydrophobicContact CD1-CG 3.59Å; F123-P129 HydrophobicContact CD2-CB 4.19Å; F123-P129 HydrophobicContact CD2-CG 3.82Å; F123-P129 HydrophobicContact CE1-CB 3.81Å; F123-P129 HydrophobicContact CE1-CG 4.07Å; F123-P129 HydrophobicContact CE2-CB 4.12Å; F123-P129 HydrophobicContact CE2-CG 4.27Å; F123-P129 HydrophobicContact CG-CB 4.05Å; F123-P129 HydrophobicContact CG-CG 3.43Å; F123-P129 VanDerWaalsContact CG-CG 3.43Å; F123-P129 HydrophobicContact CZ-CB 3.91Å; F123-P129 HydrophobicContact CZ-CG 4.36Å; F123-V132 HydrophobicContact CE2-CG2 3.91Å; F123-V132 HydrophobicContact CZ-CG2 3.83Å
124	C	96.7	Very high	94.6	Very high	20 Å²	20	60 Å²	60	14%	0.135	33%	0.331	C	S	.	.			trans	-153.3	176.9	174.7	69	0	0	0	0	110.8	Y94 I96 E97 C102 D105	Y94-C124 PolarHBondContact OH-N 3.36Å; I96-C124 HydrophobicContact CG2-CB 4.12Å; E97-C124 WeakPolarHBondContact O-CB 3.08Å; C102-C124 WeakPolarHBondContact CA-SG 3.28Å; C102-C124 HydrophobicContact CB-CB 3.56Å; C102-C124 WeakPolarHBondContact CB-SG 3.47Å; C102-C124 WeakPolarHBondContact SG-CB 3.37Å; C102-C124 PolarHBondContact SG-N 3.22Å; C102-C124 VanDerWaalsContact SG-N 3.38Å; C102-C124 CovalentContact SG-SG 2.03Å; C102-C124 PolarHBondContact SG-SG 2.87Å; D105-C124 WeakPolarHBondContact O-CB 3.2Å
125	G	95.9	Very high	94.9	Very high	6 Å²	6	61.1 Å²	61.1	6%	0.062	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	-165.4	-175.9	0	0	0	0	0	114.6	Y94 I96 E97	Y94-G125 WeakPolarHBondContact CE1-O 3.45Å; I96-G125 PolarHBondContact N-O 3.26Å; I96-G125 VanDerWaalsContact N-O 3.11Å; I96-G125 CarbonylContact O-C 3.54Å; I96-G125 WeakPolarHBondContact O-CA 3.43Å; I96-G125 PolarHBondContact O-N 3.12Å; E97-G125 PolarHBondContact O-N 2.78Å; E97-G125 VanDerWaalsContact O-N 3.14Å
126	G	95.1	Very high	94.9	Very high	48 Å²	48	60.5 Å²	60.5	50%	0.495	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	4.4	177.5	0	0	0	0	0	115.6	N128	G126-N128 PolarHBondContact O-N 3.03Å
127	K	94.8	Very high	94.8	Very high	182 Å²	182	53.6 Å²	53.6	79%	0.791	31%	0.306	S	S	*	.			trans	-85.2	94.1	179.6	-173.4	-161.7	169.7	-162.5	0	109.8
128	N	93.6	Very high	94.7	Very high	52 Å²	52	53.8 Å²	53.8	28%	0.278	31%	0.306	S	S	.	.			trans	-52.5	126.8	178.1	-165.4	-46.8	0	0	0	112.6	F90 D91 K92 Y94 G126 G130	F90-N128 VanDerWaalsContact CB-OD1 3.28Å; F90-N128 WeakPolarHBondContact CB-OD1 3.02Å; D91-N128 PolarHBondContact O-ND2 3.19Å; K92-N128 PolarHBondContact O-ND2 3.07Å; Y94-N128 HydrophobicContact CD1-CB 4.28Å; G126-N128 PolarHBondContact O-N 3.03Å; N128-G130 VanDerWaalsContact C-N 3.31Å; N128-G130 PolarHBondContact O-N 3.17Å; N128-G130 PolarHBondContact OD1-N 3.08Å
129	P	94.9	Very high	94.6	Very high	29 Å²	29	49.3 Å²	49.3	19%	0.188	28%	0.276	C	S	.	.			trans	-67.3	-24.3	177.7	-24.5	36.5	0	0	0	114.9	F90 F123 L131 V132	F90-P129 HydrophobicContact CD1-CB 4.49Å; F90-P129 HydrophobicContact CD1-CG 3.93Å; F90-P129 HydrophobicContact CD2-CB 3.86Å; F90-P129 HydrophobicContact CD2-CG 4.17Å; F90-P129 HydrophobicContact CE1-CG 3.81Å; F90-P129 HydrophobicContact CE2-CB 3.9Å; F90-P129 HydrophobicContact CE2-CG 4.07Å; F90-P129 HydrophobicContact CG-CB 4.17Å; F90-P129 HydrophobicContact CG-CG 4.11Å; F90-P129 HydrophobicContact CZ-CB 4.23Å; F90-P129 HydrophobicContact CZ-CG 3.88Å; F123-P129 HydrophobicContact CB-CG 3.74Å; F123-P129 HydrophobicContact CD1-CB 3.88Å; F123-P129 HydrophobicContact CD1-CG 3.59Å; F123-P129 HydrophobicContact CD2-CB 4.19Å; F123-P129 HydrophobicContact CD2-CG 3.82Å; F123-P129 HydrophobicContact CE1-CB 3.81Å; F123-P129 HydrophobicContact CE1-CG 4.07Å; F123-P129 HydrophobicContact CE2-CB 4.12Å; F123-P129 HydrophobicContact CE2-CG 4.27Å; F123-P129 HydrophobicContact CG-CB 4.05Å; F123-P129 HydrophobicContact CG-CG 3.43Å; F123-P129 VanDerWaalsContact CG-CG 3.43Å; F123-P129 HydrophobicContact CZ-CB 3.91Å; F123-P129 HydrophobicContact CZ-CG 4.36Å; P129-L131 PolarHBondContact O-N 3.19Å; P129-V132 HydrophobicContact CB-CG2 4.17Å
130	G	95.9	Very high	94.4	Very high	31 Å²	31	46.5 Å²	46.5	32%	0.32	26%	0.26	S	S	.	.			trans	74.1	-105.5	-177.5	0	0	0	0	0	113	F90 N128	F90-G130 PolarHBondContact N-O 3.37Å; N128-G130 VanDerWaalsContact C-N 3.31Å; N128-G130 PolarHBondContact O-N 3.17Å; N128-G130 PolarHBondContact OD1-N 3.08Å
131	L	96.9	Very high	94.3	Very high	113 Å²	113	43.6 Å²	43.6	59%	0.592	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.1	-177.5	-70.8	172.5	0	0	0	111	Q87 L88 A89 P129	Q87-L131 HydrophobicContact CG-CD2 4.22Å; L88-L131 WeakPolarHBondContact O-CA 3.4Å; A89-L131 HydrophobicContact CB-CD2 3.76Å; P129-L131 PolarHBondContact O-N 3.19Å
132	V	97.4	Very high	94.2	Very high	11 Å²	11	41.6 Å²	41.6	7%	0.067	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	132.1	176.2	-175.2	0	0	0	0	108.3	Q87 L88 F90 I109 I120 F123 P129	Q87-V132 CarbonylContact C-O 3.39Å; Q87-V132 WeakPolarHBondContact CA-O 3.4Å; L88-V132 HydrophobicContact CB-CB 4.37Å; L88-V132 PolarHBondContact N-O 3.47Å; L88-V132 PolarHBondContact O-N 2.97Å; F90-V132 HydrophobicContact CD2-CG2 4.48Å; F90-V132 HydrophobicContact CE2-CG2 3.98Å; I109-V132 HydrophobicContact CD1-CG1 4.46Å; I109-V132 HydrophobicContact CG2-CG1 4.48Å; I120-V132 HydrophobicContact CG2-CG1 3.84Å; F123-V132 HydrophobicContact CE2-CG2 3.91Å; F123-V132 HydrophobicContact CZ-CG2 3.83Å; P129-V132 HydrophobicContact CB-CG2 4.17Å
133	T	95.9	Very high	94.1	Very high	55 Å²	55	37.7 Å²	37.7	34%	0.337	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	133.8	-176.5	-50.6	0	0	0	0	110.4	R85 I86 Q87 V161	R85-T133 HydrophobicContact CB-CG2 4.3Å; I86-T133 WeakPolarHBondContact O-CA 3.5Å; I86-T133 WeakPolarHBondContact O-CG2 3.38Å; Q87-T133 HydrophobicContact CB-CG2 4.31Å; Q87-T133 PolarHBondContact NE2-OG1 2.94Å; T133-V161 HydrophobicContact CG2-CG2 4.3Å
134	S	95.3	Very high	94	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.021	22%	0.22	C	C	.	.			trans	-69.9	164.4	175.2	55.8	0	0	0	0	112	R85 I86 D111 G136	R85-S134 VanDerWaalsContact CD-O 3.31Å; R85-S134 WeakPolarHBondContact CD-O 3.31Å; I86-S134 PolarHBondContact N-OG 2.85Å; I86-S134 PolarHBondContact O-N 2.87Å; I86-S134 PolarHBondContact O-OG 2.79Å; D111-S134 VanDerWaalsContact OD1-CB 3.23Å; D111-S134 WeakPolarHBondContact OD1-CB 3.32Å; S134-G136 WeakPolarHBondContact CB-O 3.23Å; S134-G136 PolarHBondContact OG-O 2.67Å
135	T	92	Very high	94	Very high	86 Å²	86	37 Å²	37	53%	0.528	22%	0.216	S	C	.	.	S	Bend	trans	-90.4	-21	167.4	72.2	0	0	0	0	112.6	R85 D111 K238	R85-T135 PolarHBondContact NE-O 2.9Å; D111-T135 VanDerWaalsContact CG-N 3.35Å; D111-T135 PolarHBondContact OD1-N 2.94Å; D111-T135 WeakPolarHBondContact OD2-CB 3.45Å; D111-T135 WeakPolarHBondContact OD2-CG2 3.42Å; D111-T135 PolarHBondContact OD2-N 2.98Å; D111-T135 PolarHBondContact OD2-OG1 2.79Å; T135-K238 PolarHBondContact O-NZ 3.12Å
136	G	89.3	Confident	93.9	Very high	19 Å²	19	39.2 Å²	39.2	20%	0.196	23%	0.227	C	C	.	.	S	Bend	trans	-120.2	-171.9	176.1	0	0	0	0	0	114.2	D111 S134 F138	D111-G136 PolarHBondContact OD1-N 2.03Å; S134-G136 WeakPolarHBondContact CB-O 3.23Å; S134-G136 PolarHBondContact OG-O 2.67Å; G136-F138 VanDerWaalsContact C-N 3.28Å; G136-F138 PolarHBondContact O-N 2.83Å
137	R	87.4	Confident	93.9	Very high	23 Å²	23	44.1 Å²	44.1	9%	0.087	24%	0.236	C	C	.	.	S	Bend	trans	-80.3	2.4	-178.2	82.4	174.4	-154.4	-164.1	2.8	115.4	E79 A80 Q84 I86	E79-R137 WeakPolarHBondContact CA-O 3.28Å; E79-R137 IonicContact OE1-CZ 3.05Å; E79-R137 IonicContact OE1-NE 3.1Å; E79-R137 IonicContact OE1-NH2 2.74Å; E79-R137 PolarHBondContact OE1-NH2 2.74Å; A80-R137 HydrophobicContact CB-CB 4.19Å; A80-R137 PolarHBondContact N-O 3.05Å; A80-R137 WeakPolarHBondContact O-CD 3.42Å; Q84-R137 WeakPolarHBondContact O-CA 3.23Å; Q84-R137 WeakPolarHBondContact O-CB 3.4Å; I86-R137 VanDerWaalsContact CD1-O 3.32Å; I86-R137 WeakPolarHBondContact CD1-O 3.28Å
138	F	89.4	Confident	93.7	Very high	14 Å²	14	41.9 Å²	41.9	6%	0.061	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	143.7	-175.7	-65.4	-64.7	0	0	0	110.5	L78 E79 G112 P113 G136 I251	L78-F138 WeakPolarHBondContact O-CA 3.46Å; E79-F138 HydrophobicContact CB-CD1 3.95Å; E79-F138 HydrophobicContact CB-CE1 3.8Å; E79-F138 HydrophobicContact CG-CD1 4.11Å; E79-F138 HydrophobicContact CG-CE1 3.6Å; E79-F138 HydrophobicContact CG-CZ 4.47Å; E79-F138 WeakPolarHBondContact OE1-CE1 3.41Å; G112-F138 PolarHBondContact N-O 2.94Å; P113-F138 HydrophobicContact CB-CB 4.17Å; P113-F138 HydrophobicContact CB-CD1 4.2Å; P113-F138 HydrophobicContact CB-CG 4.11Å; P113-F138 HydrophobicContact CG-CB 4.46Å; P113-F138 HydrophobicContact CG-CD2 4.35Å; P113-F138 HydrophobicContact CG-CG 4.32Å; G136-F138 VanDerWaalsContact C-N 3.28Å; G136-F138 PolarHBondContact O-N 2.83Å; F138-I251 HydrophobicContact CD1-CD1 3.86Å; F138-I251 HydrophobicContact CD1-CG1 4.07Å; F138-I251 HydrophobicContact CE1-CD1 3.3Å; F138-I251 HydrophobicContact CE1-CG1 3.88Å; F138-I251 HydrophobicContact CZ-CD1 3.73Å
139	M	92.3	Very high	93.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	131.2	173.1	-167.3	-174.8	-75.2	0	0	109.4	L78 I86 L88 I109 R110 G112 I120 I141	L78-M139 PolarHBondContact N-O 2.92Å; L78-M139 PolarHBondContact O-N 3.1Å; L78-M139 VanDerWaalsContact O-N 3.14Å; I86-M139 HydrophobicContact CB-CB 4.38Å; I86-M139 HydrophobicContact CB-CE 4.14Å; I86-M139 HydrophobicContact CD1-CB 3.7Å; I86-M139 HydrophobicContact CG2-CB 4.33Å; I86-M139 HydrophobicContact CG2-CE 4.03Å; I86-M139 HydrophobicContact CG2-SD 4.22Å; L88-M139 HydrophobicContact CD1-SD 3.5Å; L88-M139 WeakPolarHBondContact CD1-SD 3.16Å; L88-M139 HydrophobicContact CD2-SD 4.12Å; L88-M139 HydrophobicContact CG-CE 4.24Å; L88-M139 HydrophobicContact CG-SD 3.67Å; I109-M139 HydrophobicContact CG2-CE 4.46Å; I109-M139 HydrophobicContact CG2-CG 3.74Å; I109-M139 HydrophobicContact CG2-SD 3.5Å; I109-M139 VanDerWaalsContact CG2-SD 3.5Å; R110-M139 WeakPolarHBondContact O-CA 3.32Å; R110-M139 WeakPolarHBondContact O-CG 3.46Å; G112-M139 CarbonylContact O-C 3.58Å; G112-M139 VanDerWaalsContact O-C 3.25Å; G112-M139 WeakPolarHBondContact O-CA 3.3Å; I120-M139 HydrophobicContact CD1-CE 4.16Å; M139-I141 HydrophobicContact CG-CD1 4.27Å; M139-I141 HydrophobicContact CG-CG1 4.1Å; M139-I141 HydrophobicContact SD-CD1 4.04Å; M139-I141 HydrophobicContact SD-CG1 4.15Å
140	W	92.3	Very high	93.3	Very high	28 Å²	28	47.6 Å²	47.6	11%	0.106	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	129.2	177.4	180	100.8	0	0	0	107.9	V75 R110 G112 G115 K142	V75-W140 HydrophobicContact CG1-CZ2 4.15Å; V75-W140 HydrophobicContact CG2-CZ2 4.35Å; R110-W140 HydrophobicContact CB-CB 4.41Å; R110-W140 HydrophobicContact CB-CE3 4.19Å; R110-W140 HydrophobicContact CG-CE3 3.87Å; R110-W140 HydrophobicContact CG-CZ3 4.24Å; R110-W140 PolarHBondContact N-O 2.76Å; R110-W140 PolarHBondContact O-N 2.72Å; G112-W140 VanDerWaalsContact O-CB 3.28Å; G112-W140 WeakPolarHBondContact O-CB 3.36Å; G112-W140 PolarHBondContact O-N 2.85Å; G115-W140 VanDerWaalsContact CA-CE2 3.48Å; W140-K142 HydrophobicContact CE3-CB 4.35Å; W140-K142 HydrophobicContact CH2-CB 3.39Å; W140-K142 HydrophobicContact CH2-CD 3.77Å; W140-K142 HydrophobicContact CH2-CG 4.2Å; W140-K142 HydrophobicContact CZ2-CB 4.04Å; W140-K142 HydrophobicContact CZ2-CD 4.39Å; W140-K142 HydrophobicContact CZ3-CB 3.55Å
141	I	94.4	Very high	93.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	127.2	-171.1	-61	145.6	0	0	0	107.3	F59 V75 Y76 L78 L88 I107 E108 I109 M139	F59-I141 HydrophobicContact CE1-CD1 4.39Å; F59-I141 HydrophobicContact CE2-CG2 4.22Å; F59-I141 HydrophobicContact CZ-CD1 3.88Å; F59-I141 HydrophobicContact CZ-CG2 4.36Å; V75-I141 CarbonylContact C-O 3.56Å; V75-I141 WeakPolarHBondContact CA-O 3.42Å; Y76-I141 HydrophobicContact CD2-CG2 4.3Å; Y76-I141 PolarHBondContact N-O 2.93Å; Y76-I141 PolarHBondContact O-N 3.26Å; L78-I141 HydrophobicContact CD1-CD1 3.73Å; L78-I141 HydrophobicContact CG-CD1 4.21Å; L88-I141 HydrophobicContact CD1-CD1 4Å; L88-I141 HydrophobicContact CD1-CG1 4.36Å; L88-I141 HydrophobicContact CD2-CD1 4.28Å; I107-I141 HydrophobicContact CD1-CG2 3.75Å; I107-I141 HydrophobicContact CG1-CG2 3.87Å; E108-I141 WeakPolarHBondContact O-CA 3.41Å; I109-I141 HydrophobicContact CG2-CG1 4.09Å; M139-I141 HydrophobicContact CG-CD1 4.27Å; M139-I141 HydrophobicContact CG-CG1 4.1Å; M139-I141 HydrophobicContact SD-CD1 4.04Å; M139-I141 HydrophobicContact SD-CG1 4.15Å
142	K	94.3	Very high	93	Very high	40 Å²	40	43.7 Å²	43.7	17%	0.174	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.8	172.7	170.3	170.2	168.6	161.8	0	109.7	E73 C74 V75 I107 E108 W140 T144	E73-K142 HydrophobicContact CG-CD 4.33Å; E73-K142 VanDerWaalsContact OE1-CE 3.3Å; E73-K142 WeakPolarHBondContact OE1-CE 3.32Å; E73-K142 IonicContact OE1-NZ 2.71Å; E73-K142 PolarHBondContact OE1-NZ 2.82Å; E73-K142 WeakPolarHBondContact OE2-CE 3.09Å; E73-K142 IonicContact OE2-NZ 3.47Å; E73-K142 PolarHBondContact OE2-NZ 3.09Å; C74-K142 WeakPolarHBondContact O-CA 3.47Å; V75-K142 HydrophobicContact CG2-CB 4.32Å; V75-K142 HydrophobicContact CG2-CD 4.45Å; V75-K142 HydrophobicContact CG2-CG 4.32Å; I107-K142 CarbonylContact C-O 3.47Å; I107-K142 WeakPolarHBondContact CA-O 3.24Å; E108-K142 PolarHBondContact N-O 2.89Å; E108-K142 PolarHBondContact O-N 3.36Å; W140-K142 HydrophobicContact CE3-CB 4.35Å; W140-K142 HydrophobicContact CH2-CB 3.39Å; W140-K142 HydrophobicContact CH2-CD 3.77Å; W140-K142 HydrophobicContact CH2-CG 4.2Å; W140-K142 HydrophobicContact CZ2-CB 4.04Å; W140-K142 HydrophobicContact CZ2-CD 4.39Å; W140-K142 HydrophobicContact CZ3-CB 3.55Å; K142-T144 WeakPolarHBondContact CE-OG1 3.09Å
143	F	95.6	Very high	92.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	138.2	160	172.7	-113.8	0	0	0	109.1	Y68 E73 C74 I96 H106 I107 F154	Y68-F143 AromaticContact CD1-CZ 3.86Å; Y68-F143 HydrophobicContact CD1-CZ 3.86Å; Y68-F143 HydrophobicContact CD2-CE1 4.25Å; Y68-F143 AromaticContact CD2-CZ 3.77Å; Y68-F143 HydrophobicContact CD2-CZ 3.77Å; Y68-F143 HydrophobicContact CE1-CE2 4.43Å; Y68-F143 AromaticContact CE1-CZ 3.93Å; Y68-F143 HydrophobicContact CE1-CZ 3.93Å; Y68-F143 AromaticContact CE2-CZ 3.85Å; Y68-F143 HydrophobicContact CE2-CZ 3.85Å; Y68-F143 HydrophobicContact CG-CE1 4.14Å; Y68-F143 AromaticContact CG-CZ 3.77Å; Y68-F143 HydrophobicContact CG-CZ 3.77Å; Y68-F143 AromaticContact CZ-CZ 3.93Å; E73-F143 WeakPolarHBondContact CA-O 3.21Å; C74-F143 HydrophobicContact CB-CB 4.25Å; C74-F143 HydrophobicContact CB-CD1 4.48Å; C74-F143 PolarHBondContact N-O 2.81Å; C74-F143 PolarHBondContact O-N 2.81Å; I96-F143 HydrophobicContact CD1-CD2 4.22Å; I96-F143 HydrophobicContact CD1-CE2 4.02Å; I96-F143 HydrophobicContact CG1-CE2 4.4Å; I96-F143 HydrophobicContact CG2-CE2 4.43Å; H106-F143 WeakPolarHBondContact O-CA 3.49Å; H106-F143 VanDerWaalsContact O-CD2 3.28Å; H106-F143 WeakPolarHBondContact O-CD2 3.43Å; I107-F143 HydrophobicContact CB-CD2 4.48Å; F143-F154 HydrophobicContact CB-CE1 3.8Å; F143-F154 HydrophobicContact CB-CZ 3.9Å; F143-F154 HydrophobicContact CD1-CE1 4.07Å; F143-F154 HydrophobicContact CD2-CD1 4.34Å; F143-F154 AromaticContact CD2-CE1 3.61Å; F143-F154 HydrophobicContact CD2-CE1 3.61Å; F143-F154 HydrophobicContact CE2-CE1 4.18Å; F143-F154 AromaticContact CG-CE1 3.54Å; F143-F154 HydrophobicContact CG-CE1 3.54Å; F143-F154 HydrophobicContact CG-CZ 4.1Å
144	T	95.2	Very high	92.8	Very high	30 Å²	30	40.6 Å²	40.6	18%	0.184	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.1	173.8	-34.9	0	0	0	0	108.4	K72 D105 H106 K142	K72-T144 CarbonylContact O-C 3.35Å; K72-T144 VanDerWaalsContact O-CA 3.28Å; K72-T144 WeakPolarHBondContact O-CA 3.2Å; D105-T144 VanDerWaalsContact CA-O 3.28Å; D105-T144 WeakPolarHBondContact CA-O 3.11Å; H106-T144 PolarHBondContact CE1-OG1 2.84Å; H106-T144 PolarHBondContact N-O 3.17Å; H106-T144 PolarHBondContact NE2-OG1 2.89Å; H106-T144 PolarHBondContact O-N 2.89Å; K142-T144 WeakPolarHBondContact CE-OG1 3.09Å
145	S	95.6	Very high	92.8	Very high	7 Å²	7	44.3 Å²	44.3	5%	0.049	22%	0.222	C	C	.	.			trans	-122.9	148.4	161.3	57.8	0	0	0	0	112.1	P69 N71 K72 D105	P69-S145 PolarHBondContact O-OG 2.96Å; N71-S145 WeakPolarHBondContact CA-O 3.49Å; N71-S145 PolarHBondContact N-O 3.29Å; N71-S145 PolarHBondContact N-OG 3.06Å; K72-S145 WeakPolarHBondContact CB-OG 3.37Å; K72-S145 PolarHBondContact N-O 3.1Å; K72-S145 PolarHBondContact N-OG 2.84Å; K72-S145 PolarHBondContact O-N 2.87Å; D105-S145 WeakPolarHBondContact OD1-CA 3.31Å; D105-S145 WeakPolarHBondContact OD1-CB 3.34Å
146	D	94.6	Very high	92.9	Very high	53 Å²	53	40.2 Å²	40.2	28%	0.283	20%	0.196	S	C	.	.			trans	-98.1	-151	177.4	79.5	28.1	0	0	0	113.6	P70 N71 F104 D105 E148	P70-D146 CarbonylContact C-O 3.44Å; P70-D146 VanDerWaalsContact CA-O 3.24Å; P70-D146 WeakPolarHBondContact CA-O 3.49Å; P70-D146 WeakPolarHBondContact CB-O 3.39Å; N71-D146 PolarHBondContact N-O 3.29Å; F104-D146 WeakPolarHBondContact CA-OD2 3.2Å; F104-D146 WeakPolarHBondContact CB-OD2 3.39Å; F104-D146 VanDerWaalsContact CD1-OD2 3.22Å; F104-D146 WeakPolarHBondContact CD1-OD2 3.45Å; F104-D146 VanDerWaalsContact CG-OD2 3.3Å; F104-D146 WeakPolarHBondContact CG-OD2 3.26Å; D105-D146 PolarHBondContact OD1-N 2.86Å; D146-E148 PolarHBondContact OD1-N 2.87Å
147	E	94.3	Very high	93.1	Very high	150 Å²	150	43.9 Å²	43.9	70%	0.701	21%	0.209	S	C	*	.	S	Bend	trans	-84	-18.3	-171.1	-55.8	-163.3	169.3	0	0	114.4
148	E	90.4	Very high	93.4	Very high	135 Å²	135	43 Å²	43	63%	0.631	21%	0.205	S	C	*	.	S	Bend	trans	-138.7	169.4	-172.1	-59.7	-166.7	160.2	0	0	114.6	D146	D146-E148 PolarHBondContact OD1-N 2.87Å
149	L	88.1	Confident	93.6	Very high	120 Å²	120	44.7 Å²	44.7	63%	0.628	22%	0.217	S	C	*	.			trans	62.4	47.4	164.1	-58.9	179.7	0	0	0	117.4	E97	E97-L149 HydrophobicContact CG-CB 3.86Å
150	E	92.9	Very high	93.6	Very high	81 Å²	81	46.4 Å²	46.4	38%	0.379	22%	0.224	S	C	.	.			trans	-69	138.8	-172.8	-43.8	94.1	139.3	0	0	114.6	Y68 P70	Y68-E150 HydrophobicContact CD2-CB 3.95Å; Y68-E150 HydrophobicContact CD2-CG 4.35Å; Y68-E150 HydrophobicContact CE2-CB 3.79Å; Y68-E150 HydrophobicContact CE2-CG 4.3Å; Y68-E150 WeakPolarHBondContact O-CB 3.37Å; Y68-E150 WeakPolarHBondContact O-CG 3.37Å; P70-E150 HydrophobicContact CB-CG 4.31Å; P70-E150 VanDerWaalsContact CD-OE1 3.28Å; P70-E150 WeakPolarHBondContact CD-OE1 3.2Å; P70-E150 WeakPolarHBondContact CG-OE1 3.47Å
151	G	92	Very high	93.4	Very high	2 Å²	2	47.1 Å²	47.1	2%	0.021	23%	0.232	C	C	.	.			trans	-96	175.6	176.1	0	0	0	0	0	115.1	T67 Y68 Y95 G153	T67-G151 WeakPolarHBondContact CA-O 3.23Å; T67-G151 WeakPolarHBondContact CB-O 3.31Å; Y68-G151 WeakPolarHBondContact CD1-O 3.49Å; Y68-G151 WeakPolarHBondContact CE1-O 3.22Å; Y68-G151 PolarHBondContact N-O 3.05Å; Y68-G151 PolarHBondContact OH-N 2.85Å; Y68-G151 VanDerWaalsContact OH-N 3.08Å; Y95-G151 CarbonylContact O-C 3.48Å; Y95-G151 WeakPolarHBondContact O-CA 3.01Å; G151-G153 PolarHBondContact O-N 2.77Å
152	L	94.1	Very high	93.1	Very high	61 Å²	61	49.6 Å²	49.6	32%	0.319	25%	0.252	S	S	.	.			trans	-61.5	-19.1	171.1	-170	115.1	0	0	0	112.7	Y64 P65 N93 Y95	Y64-L152 WeakPolarHBondContact CD2-O 3.23Å; Y64-L152 HydrophobicContact CE2-CD2 3.92Å; P65-L152 VanDerWaalsContact O-CD1 3.31Å; P65-L152 WeakPolarHBondContact O-CD1 3.38Å; N93-L152 HydrophobicContact CB-CD2 3.9Å; Y95-L152 PolarHBondContact O-N 3.33Å; Y95-L152 VanDerWaalsContact O-N 3.14Å
153	G	94.9	Very high	92.7	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	75.4	-136.7	-178.7	0	0	0	0	0	112.7	S61 Y68 Y94 Y95 G151	S61-G153 WeakPolarHBondContact OG-CA 3.4Å; Y68-G153 VanDerWaalsContact CD1-CA 3.41Å; Y94-G153 WeakPolarHBondContact CA-O 3.34Å; Y95-G153 PolarHBondContact N-O 2.77Å; Y95-G153 WeakPolarHBondContact O-CA 3.37Å; Y95-G153 PolarHBondContact O-N 2.87Å; G151-G153 PolarHBondContact O-N 2.77Å
154	F	94.7	Very high	92.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.276	C	S	.	.			trans	-151.4	154.5	-170.4	63.1	-90	0	0	0	112.3	F59 M60 S61 Y64 Y94 I96 I107 F143 I156	F59-F154 AromaticContact CD2-CE2 3.92Å; F59-F154 HydrophobicContact CD2-CE2 3.92Å; F59-F154 AromaticContact CE2-CE2 3.88Å; F59-F154 HydrophobicContact CE2-CE2 3.88Å; M60-F154 CarbonylContact C-O 3.57Å; M60-F154 WeakPolarHBondContact CA-O 3.21Å; M60-F154 VanDerWaalsContact CB-O 3.27Å; M60-F154 WeakPolarHBondContact CB-O 3.16Å; S61-F154 PolarHBondContact N-O 2.71Å; S61-F154 PolarHBondContact OG-N 2.88Å; S61-F154 VanDerWaalsContact OG-N 3.12Å; S61-F154 PolarHBondContact OG-O 2.94Å; Y64-F154 WeakPolarHBondContact CD2-O 3.47Å; Y94-F154 HydrophobicContact CD2-CB 3.77Å; Y94-F154 HydrophobicContact CE2-CB 4.12Å; I96-F154 HydrophobicContact CD1-CD1 4.06Å; I107-F154 HydrophobicContact CD1-CD2 4.39Å; I107-F154 HydrophobicContact CD1-CE1 4.32Å; I107-F154 HydrophobicContact CD1-CE2 4.13Å; I107-F154 HydrophobicContact CD1-CZ 4.1Å; F143-F154 HydrophobicContact CB-CE1 3.8Å; F143-F154 HydrophobicContact CB-CZ 3.9Å; F143-F154 HydrophobicContact CD1-CE1 4.07Å; F143-F154 HydrophobicContact CD2-CD1 4.34Å; F143-F154 AromaticContact CD2-CE1 3.61Å; F143-F154 HydrophobicContact CD2-CE1 3.61Å; F143-F154 HydrophobicContact CE2-CE1 4.18Å; F143-F154 AromaticContact CG-CE1 3.54Å; F143-F154 HydrophobicContact CG-CE1 3.54Å; F143-F154 HydrophobicContact CG-CZ 4.1Å; F154-I156 HydrophobicContact CD2-CD1 3.49Å; F154-I156 VanDerWaalsContact CD2-CD1 3.49Å; F154-I156 HydrophobicContact CD2-CG1 3.82Å; F154-I156 HydrophobicContact CE2-CD1 3.87Å; F154-I156 HydrophobicContact CG-CD1 4.27Å
155	R	94.1	Very high	91.4	Very high	81 Å²	81	56.1 Å²	56.1	31%	0.306	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	130.8	160.8	174.7	174.1	174.8	-84.3	-8.3	108	V58 M60 Y64 D91	V58-R155 HydrophobicContact CG1-CG 3.81Å; M60-R155 HydrophobicContact CB-CB 4.2Å; M60-R155 HydrophobicContact CB-CG 4.47Å; Y64-R155 HydrophobicContact CD1-CB 4.04Å; Y64-R155 HydrophobicContact CD2-CB 4.45Å; Y64-R155 HydrophobicContact CE1-CB 3.54Å; Y64-R155 HydrophobicContact CE1-CG 4.21Å; Y64-R155 HydrophobicContact CE2-CB 3.99Å; Y64-R155 HydrophobicContact CG-CB 4.48Å; D91-R155 HydrophobicContact CB-CB 3.95Å; D91-R155 HydrophobicContact CB-CG 4.29Å; D91-R155 VanDerWaalsContact CB-O 3.29Å; D91-R155 WeakPolarHBondContact CB-O 3.29Å; D91-R155 PolarHBondContact N-O 3.34Å; D91-R155 WeakPolarHBondContact OD2-CD 3.47Å; D91-R155 IonicContact OD2-CZ 3.73Å; D91-R155 IonicContact OD2-NE 2.77Å; D91-R155 IonicContact OD2-NH1 2.73Å; D91-R155 PolarHBondContact OD2-NH1 3.15Å
156	I	94.3	Very high	90.5	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.9	-176.4	-66.1	162.4	0	0	0	108.5	V58 F59 L88 A89 F90 I107 F154	V58-I156 VanDerWaalsContact CA-O 3.31Å; V58-I156 WeakPolarHBondContact CA-O 3.41Å; F59-I156 HydrophobicContact CD1-CB 4.42Å; F59-I156 HydrophobicContact CD1-CG2 4.49Å; F59-I156 HydrophobicContact CE1-CB 3.9Å; F59-I156 HydrophobicContact CE1-CG2 3.64Å; F59-I156 HydrophobicContact CE2-CB 4.16Å; F59-I156 HydrophobicContact CE2-CD1 3.73Å; F59-I156 HydrophobicContact CZ-CB 3.74Å; F59-I156 HydrophobicContact CZ-CD1 3.71Å; F59-I156 HydrophobicContact CZ-CG1 4.34Å; F59-I156 HydrophobicContact CZ-CG2 3.66Å; F59-I156 PolarHBondContact N-O 2.77Å; F59-I156 PolarHBondContact O-N 2.93Å; L88-I156 HydrophobicContact CB-CG2 3.82Å; L88-I156 HydrophobicContact CD1-CG2 4.32Å; L88-I156 HydrophobicContact CD2-CG2 3.92Å; L88-I156 HydrophobicContact CG-CG2 4.23Å; A89-I156 WeakPolarHBondContact O-CA 3.47Å; F90-I156 HydrophobicContact CD1-CD1 4.04Å; F90-I156 HydrophobicContact CD1-CG1 3.76Å; F90-I156 HydrophobicContact CD2-CG1 4.27Å; F90-I156 HydrophobicContact CE1-CD1 3.49Å; F90-I156 VanDerWaalsContact CE1-CD1 3.49Å; F90-I156 HydrophobicContact CE1-CG1 3.77Å; F90-I156 HydrophobicContact CE2-CD1 4.09Å; F90-I156 HydrophobicContact CE2-CG1 4.26Å; F90-I156 HydrophobicContact CG-CG1 4.02Å; F90-I156 HydrophobicContact CZ-CD1 3.51Å; F90-I156 HydrophobicContact CZ-CG1 4.02Å; I107-I156 HydrophobicContact CD1-CD1 3.48Å; I107-I156 VanDerWaalsContact CD1-CD1 3.48Å; F154-I156 HydrophobicContact CD2-CD1 3.49Å; F154-I156 VanDerWaalsContact CD2-CD1 3.49Å; F154-I156 HydrophobicContact CD2-CG1 3.82Å; F154-I156 HydrophobicContact CE2-CD1 3.87Å; F154-I156 HydrophobicContact CG-CD1 4.27Å
157	Q	94	Very high	89.1	Confident	97 Å²	97	61.7 Å²	61.7	45%	0.453	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	129.1	165.6	-177.6	172.8	-6.9	0	0	108.6	G57 V58 A89	G57-Q157 CarbonylContact O-C 3.53Å; G57-Q157 WeakPolarHBondContact O-CA 3.32Å; V58-Q157 HydrophobicContact CG2-CB 4.09Å; V58-Q157 HydrophobicContact CG2-CG 4.09Å; A89-Q157 PolarHBondContact N-O 3.49Å; A89-Q157 PolarHBondContact O-N 2.82Å
158	Y	94.1	Very high	87.5	Confident	5 Å²	5	58.3 Å²	58.3	2%	0.02	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	139.7	171.9	71.1	-92.4	0	0	0	111	V51 G56 G57 F59 L78 Q87 F160	V51-Y158 PolarHBondContact O-OH 2.75Å; G56-Y158 CarbonylContact C-O 3.49Å; G56-Y158 VanDerWaalsContact CA-O 3.24Å; G56-Y158 WeakPolarHBondContact CA-O 3.25Å; G57-Y158 PolarHBondContact N-O 3.2Å; G57-Y158 WeakPolarHBondContact O-CD1 3.26Å; G57-Y158 PolarHBondContact O-N 2.72Å; F59-Y158 AromaticContact CD1-CD1 3.88Å; F59-Y158 HydrophobicContact CD1-CD1 3.88Å; F59-Y158 HydrophobicContact CD1-CE1 4.36Å; F59-Y158 HydrophobicContact CE1-CD1 4.1Å; L78-Y158 HydrophobicContact CD1-CD1 4.24Å; L78-Y158 HydrophobicContact CD1-CD2 4.18Å; L78-Y158 HydrophobicContact CD1-CG 3.86Å; L78-Y158 HydrophobicContact CD2-CD1 4.14Å; L78-Y158 HydrophobicContact CD2-CD2 4.16Å; L78-Y158 HydrophobicContact CD2-CE1 3.94Å; L78-Y158 HydrophobicContact CD2-CE2 4Å; L78-Y158 HydrophobicContact CD2-CG 4.23Å; Q87-Y158 CarbonylContact O-C 3.56Å; Q87-Y158 WeakPolarHBondContact O-CA 3.37Å; Y158-F160 HydrophobicContact CD2-CE1 4.11Å; Y158-F160 HydrophobicContact CD2-CZ 4.14Å; Y158-F160 HydrophobicContact CE2-CE1 4.29Å; Y158-F160 AromaticContact CE2-CZ 3.88Å; Y158-F160 HydrophobicContact CE2-CZ 3.88Å
159	T	93.6	Very high	85.9	Confident	49 Å²	49	56.4 Å²	56.4	30%	0.301	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	162.5	175.7	60.6	0	0	0	0	109.9	Q87	Q87-T159 PolarHBondContact N-O 3.24Å; Q87-T159 PolarHBondContact O-N 2.91Å
160	F	91.3	Very high	84.1	Confident	36 Å²	36	58.6 Å²	58.6	16%	0.158	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127	172.9	-51.5	-50.4	0	0	0	109.5	N53 I54 E79 A80 Q84 R85 I86 Y158	N53-F160 VanDerWaalsContact O-CE2 3.25Å; N53-F160 WeakPolarHBondContact O-CE2 3.4Å; I54-F160 WeakPolarHBondContact O-CD2 3.44Å; I54-F160 WeakPolarHBondContact O-CE2 3.25Å; E79-F160 WeakPolarHBondContact O-CZ 3.36Å; A80-F160 HydrophobicContact CB-CB 4.31Å; A80-F160 HydrophobicContact CB-CD1 3.39Å; A80-F160 HydrophobicContact CB-CE1 3.8Å; A80-F160 HydrophobicContact CB-CG 3.88Å; Q84-F160 HydrophobicContact CB-CB 4.35Å; R85-F160 WeakPolarHBondContact O-CA 3.31Å; I86-F160 HydrophobicContact CG1-CD1 3.98Å; I86-F160 HydrophobicContact CG1-CE1 3.97Å; Y158-F160 HydrophobicContact CD2-CE1 4.11Å; Y158-F160 HydrophobicContact CD2-CZ 4.14Å; Y158-F160 HydrophobicContact CE2-CE1 4.29Å; Y158-F160 AromaticContact CE2-CZ 3.88Å; Y158-F160 HydrophobicContact CE2-CZ 3.88Å
161	V	90	Very high	82.3	Confident	43 Å²	43	58.6 Å²	58.6	26%	0.261	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	148.1	-179.7	-62.8	0	0	0	0	109.8	Q84 R85 Q87 T133 D163	Q84-V161 CarbonylContact C-O 3.47Å; Q84-V161 WeakPolarHBondContact CA-O 3.31Å; Q84-V161 WeakPolarHBondContact CB-O 3.29Å; R85-V161 HydrophobicContact CB-CG2 4.02Å; R85-V161 PolarHBondContact N-O 2.87Å; R85-V161 PolarHBondContact O-N 2.64Å; Q87-V161 HydrophobicContact CB-CG1 4.06Å; Q87-V161 HydrophobicContact CB-CG2 4.4Å; T133-V161 HydrophobicContact CG2-CG2 4.3Å; V161-D163 PolarHBondContact O-N 3.46Å
162	A	87.2	Confident	80.7	Confident	52 Å²	52	60.9 Å²	60.9	43%	0.43	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	136.5	175.9	0	0	0	0	0	110.4	P164	A162-P164 WeakPolarHBondContact O-CD 3.48Å
163	D	86.7	Confident	78.9	Confident	6 Å²	6	64.6 Å²	64.6	3%	0.032	38%	0.376	C	S	.	.			trans	-82.9	116.5	-178.3	-171.3	-43.6	0	0	0	110.6	R83 R85 V161 D165 F166 K238	R83-D163 VanDerWaalsContact O-CB 3.26Å; R83-D163 WeakPolarHBondContact O-CB 3.47Å; R83-D163 PolarHBondContact O-N 3.35Å; R85-D163 HydrophobicContact CG-CB 4.03Å; R85-D163 WeakPolarHBondContact CG-OD2 3.03Å; R85-D163 IonicContact CZ-OD1 2.77Å; R85-D163 IonicContact CZ-OD2 3.41Å; R85-D163 IonicContact NE-OD1 3.76Å; R85-D163 PolarHBondContact NE-OD1 3.05Å; R85-D163 VanDerWaalsContact NE-OD1 3.1Å; R85-D163 IonicContact NE-OD2 3.21Å; R85-D163 PolarHBondContact NE-OD2 2.64Å; R85-D163 IonicContact NH2-OD1 2.71Å; R85-D163 PolarHBondContact NH2-OD1 2.94Å; R85-D163 IonicContact NH2-OD2 2.72Å; V161-D163 PolarHBondContact O-N 3.46Å; D163-D165 PolarHBondContact O-N 3.19Å; D163-D165 VanDerWaalsContact O-N 3.08Å; D163-D165 WeakPolarHBondContact OD1-CB 3.4Å; D163-D165 PolarHBondContact OD1-N 3.26Å; D163-F166 HydrophobicContact CB-CD2 3.82Å; D163-F166 HydrophobicContact CB-CE2 4.3Å; D163-F166 PolarHBondContact O-N 2.86Å; D163-F166 VanDerWaalsContact O-N 3.09Å; D163-K238 VanDerWaalsContact CG-CE 3.49Å; D163-K238 VanDerWaalsContact CG-NZ 3.3Å; D163-K238 WeakPolarHBondContact OD1-CE 3.46Å; D163-K238 IonicContact OD1-NZ 2.72Å; D163-K238 PolarHBondContact OD1-NZ 3.34Å; D163-K238 WeakPolarHBondContact OD2-CE 3.4Å; D163-K238 IonicContact OD2-NZ 3.98Å; D163-K238 PolarHBondContact OD2-NZ 3.5Å
164	P	82.9	Confident	77.4	Confident	99 Å²	99	66.8 Å²	66.8	64%	0.643	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-11.9	-173.9	27	-36.9	0	0	0	114.8	A162 F166	A162-P164 WeakPolarHBondContact O-CD 3.48Å; P164-F166 PolarHBondContact O-N 3.1Å
165	D	80.4	Confident	75.9	Confident	101 Å²	101	69.2 Å²	69.2	54%	0.54	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-11.3	176.8	-54.9	-2.9	0	0	0	111.6	R85 D163 K238	R85-D165 IonicContact NH2-OD1 3.24Å; R85-D165 PolarHBondContact NH2-OD1 2.82Å; R85-D165 IonicContact NH2-OD2 3.71Å; R85-D165 PolarHBondContact NH2-OD2 2.72Å; R85-D165 VanDerWaalsContact NH2-OD2 3.1Å; D163-D165 PolarHBondContact O-N 3.19Å; D163-D165 VanDerWaalsContact O-N 3.08Å; D163-D165 WeakPolarHBondContact OD1-CB 3.4Å; D163-D165 PolarHBondContact OD1-N 3.26Å; D165-K238 WeakPolarHBondContact OD2-CE 3.27Å; D165-K238 IonicContact OD2-NZ 3.71Å; D165-K238 PolarHBondContact OD2-NZ 3Å
166	F	76.7	Confident	74.6	Confident	26 Å²	26	71.1 Å²	71.1	11%	0.114	42%	0.423	C	S	.	.	S	Bend	trans	-110.6	124.8	176.1	-61.4	-89.5	0	0	0	110.6	R83 D163 P164 L168 K238 W278 D280	R83-F166 HydrophobicContact CB-CB 4.06Å; R83-F166 HydrophobicContact CB-CD1 4.36Å; R83-F166 HydrophobicContact CB-CD2 3.82Å; R83-F166 HydrophobicContact CB-CE2 4.26Å; R83-F166 HydrophobicContact CB-CG 3.83Å; R83-F166 HydrophobicContact CG-CB 4.07Å; R83-F166 HydrophobicContact CG-CD1 3.6Å; R83-F166 HydrophobicContact CG-CD2 3.91Å; R83-F166 HydrophobicContact CG-CE1 3.88Å; R83-F166 HydrophobicContact CG-CE2 4.15Å; R83-F166 HydrophobicContact CG-CG 3.59Å; R83-F166 HydrophobicContact CG-CZ 4.13Å; D163-F166 HydrophobicContact CB-CD2 3.82Å; D163-F166 HydrophobicContact CB-CE2 4.3Å; D163-F166 PolarHBondContact O-N 2.86Å; D163-F166 VanDerWaalsContact O-N 3.09Å; P164-F166 PolarHBondContact O-N 3.1Å; F166-L168 PolarHBondContact O-N 2.88Å; F166-K238 HydrophobicContact CE2-CD 4.48Å; F166-K238 HydrophobicContact CE2-CG 4Å; F166-K238 HydrophobicContact CZ-CG 3.98Å; F166-W278 HydrophobicContact CE1-CZ2 4.32Å; F166-D280 HydrophobicContact CE1-CB 4.18Å
167	H	64.8	Low	73.7	Confident	151 Å²	151	73.3 Å²	73.3	70%	0.699	43%	0.434	S	S	*	.			trans	-71.3	113.7	-177.1	-59.5	-63.6	0	0	0	111.9
168	L	61	Low	72.7	Confident	79 Å²	79	70.3 Å²	70.3	41%	0.414	42%	0.423	S	S	.	.			trans	-57.6	137.9	161	-65.8	164.2	0	0	0	109.3	F166 L174	F166-L168 PolarHBondContact O-N 2.88Å; L168-L174 HydrophobicContact CD2-CB 4.47Å; L168-L174 HydrophobicContact CD2-CD2 3.61Å; L168-L174 HydrophobicContact CD2-CG 3.62Å
169	H	55.2	Low	71.8	Confident	96 Å²	96	76.5 Å²	76.5	44%	0.444	46%	0.457	S	S	.	.			trans	-69	163.1	172.7	-83.6	25.4	0	0	0	111.1	G171 G172 N175	H169-G171 PolarHBondContact O-N 3.1Å; H169-G172 PolarHBondContact O-N 2.91Å; H169-N175 PolarHBondContact CD2-ND2 3.27Å; H169-N175 PolarHBondContact CD2-OD1 3.24Å; H169-N175 PolarHBondContact CE1-ND2 3.45Å; H169-N175 VanDerWaalsContact CE1-ND2 3.27Å; H169-N175 PolarHBondContact NE2-ND2 3.46Å
170	V	50.6	Low	71.4	Confident	166 Å²	166	74.2 Å²	74.2	100%	1.006	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	110.8	178.6	-178.3	0	0	0	0	109.5
171	G	56.2	Low	71.4	Confident	81 Å²	81	78.1 Å²	78.1	84%	0.835	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	124.5	-12.8	-168.8	0	0	0	0	0	114.3	H169	H169-G171 PolarHBondContact O-N 3.1Å
172	G	56.8	Low	71.5	Confident	49 Å²	49	76.9 Å²	76.9	51%	0.505	45%	0.453	S	S	.	.	S	Bend	trans	79.4	14.5	170.9	0	0	0	0	0	115.3	H169	H169-G172 PolarHBondContact O-N 2.91Å
173	L	58	Low	71.8	Confident	140 Å²	140	80.3 Å²	80.3	73%	0.733	46%	0.46	S	S	*	.			trans	-104.8	146.1	175.9	-152.7	72.5	0	0	0	110.5
174	L	61.9	Low	72.2	Confident	45 Å²	45	82.3 Å²	82.3	24%	0.236	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-77.9	133.3	167.8	-70.5	169.8	0	0	0	109.1	R83 L168	R83-L174 HydrophobicContact CB-CD2 4.27Å; L168-L174 HydrophobicContact CD2-CB 4.47Å; L168-L174 HydrophobicContact CD2-CD2 3.61Å; L168-L174 HydrophobicContact CD2-CG 3.62Å
175	N	63.1	Low	72.7	Confident	51 Å²	51	79.7 Å²	79.7	27%	0.273	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-56.2	130.5	169.7	-66.8	-18.1	0	0	0	109.3	R83 H169 I177	R83-N175 PolarHBondContact NH2-O 3.42Å; H169-N175 PolarHBondContact CD2-ND2 3.27Å; H169-N175 PolarHBondContact CD2-OD1 3.24Å; H169-N175 PolarHBondContact CE1-ND2 3.45Å; H169-N175 VanDerWaalsContact CE1-ND2 3.27Å; H169-N175 PolarHBondContact NE2-ND2 3.46Å; N175-I177 PolarHBondContact O-N 3.09Å
176	P	67.6	Low	73.4	Confident	122 Å²	122	76.3 Å²	76.3	79%	0.792	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-59.9	134	178	25.6	-33.8	0	0	0	110
177	I	74.8	Confident	74.2	Confident	45 Å²	45	79.1 Å²	79.1	23%	0.231	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-79.6	127.9	177.3	-57.2	164.7	0	0	0	107.1	P82 R83 N175 D179 D209 W278	P82-I177 HydrophobicContact CB-CD1 3.81Å; P82-I177 HydrophobicContact CG-CD1 3.84Å; R83-I177 VanDerWaalsContact NH2-CG1 3.33Å; N175-I177 PolarHBondContact O-N 3.09Å; I177-D179 PolarHBondContact O-N 3.34Å; I177-D209 HydrophobicContact CG2-CB 3.81Å; I177-W278 HydrophobicContact CD1-CH2 4.17Å; I177-W278 HydrophobicContact CD1-CZ3 3.76Å; I177-W278 HydrophobicContact CG1-CZ3 4.31Å; I177-W278 HydrophobicContact CG2-CZ3 4.41Å
178	P	73.9	Confident	75.6	Confident	34 Å²	34	74.9 Å²	74.9	22%	0.221	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-67.9	128.7	176.5	24.6	-31.9	0	0	0	111.8	C180 V202 A207	P178-C180 PolarHBondContact O-N 3.06Å; P178-V202 HydrophobicContact CB-CG2 4.26Å; P178-V202 HydrophobicContact CG-CB 4.17Å; P178-V202 HydrophobicContact CG-CG1 3.85Å; P178-V202 HydrophobicContact CG-CG2 3.76Å; P178-A207 WeakPolarHBondContact CD-O 3.32Å
179	D	74.3	Confident	77.3	Confident	135 Å²	135	71.7 Å²	71.7	72%	0.722	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	104.6	174.5	-82.4	-55	0	0	0	111.2	I177	I177-D179 PolarHBondContact O-N 3.34Å
180	C	86.4	Confident	79.1	Confident	1 Å²	1	70 Å²	70	1%	0.007	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	103.7	173.2	34.9	0	0	0	0	110.1	P178 F182 R201 V202 C210 I211	P178-C180 PolarHBondContact O-N 3.06Å; C180-F182 HydrophobicContact CB-CE2 4.16Å; C180-R201 HydrophobicContact CB-CB 4.11Å; C180-V202 HydrophobicContact CB-CG2 4.23Å; C180-C210 HydrophobicContact CB-CB 3.79Å; C180-C210 WeakPolarHBondContact CB-SG 3.36Å; C180-C210 CarbonylContact O-C 3.59Å; C180-C210 VanDerWaalsContact O-CA 3.24Å; C180-C210 WeakPolarHBondContact O-CA 3.2Å; C180-C210 WeakPolarHBondContact SG-CA 3.44Å; C180-C210 WeakPolarHBondContact SG-CB 3.22Å; C180-C210 CovalentContact SG-SG 2.03Å; C180-C210 PolarHBondContact SG-SG 2.78Å; C180-I211 PolarHBondContact O-N 3.1Å
181	Q	91	Very high	81.3	Confident	118 Å²	118	62.1 Å²	62.1	55%	0.551	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.4	136.2	-179.7	-58.4	-174.6	18.5	0	0	111	I211	Q181-I211 CarbonylContact C-O 3.55Å; Q181-I211 WeakPolarHBondContact CA-O 3.16Å; Q181-I211 HydrophobicContact CG-CB 4.47Å
182	F	92.1	Very high	83.1	Confident	18 Å²	18	62.6 Å²	62.6	8%	0.079	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143.5	-177.8	-52.1	-89.7	0	0	0	110	C180 V196 R201 C210 I211 W212 T213	C180-F182 HydrophobicContact CB-CE2 4.16Å; F182-V196 HydrophobicContact CE2-CG2 4.19Å; F182-V196 HydrophobicContact CZ-CG2 4.31Å; F182-R201 HydrophobicContact CE1-CG 4.4Å; F182-R201 HydrophobicContact CZ-CG 4.15Å; F182-C210 HydrophobicContact CE2-CB 4.44Å; F182-I211 PolarHBondContact N-O 2.86Å; F182-W212 HydrophobicContact CB-CG 4.18Å; F182-W212 AromaticContact CD2-CD1 3.68Å; F182-W212 HydrophobicContact CD2-CD2 4.07Å; F182-W212 AromaticContact CD2-CE2 3.68Å; F182-W212 HydrophobicContact CD2-CG 4.09Å; F182-W212 HydrophobicContact CD2-CZ2 4.27Å; F182-W212 AromaticContact CD2-NE1 3.4Å; F182-W212 AromaticContact CE2-CE2 3.95Å; F182-W212 HydrophobicContact CE2-CZ2 4.07Å; F182-W212 AromaticContact CE2-NE1 3.91Å; F182-W212 AromaticContact CG-CD1 3.78Å; F182-W212 HydrophobicContact CG-CG 4.49Å; F182-W212 AromaticContact CG-NE1 3.75Å; F182-W212 CarbonylContact O-C 3.54Å; F182-W212 WeakPolarHBondContact O-CA 3.29Å; F182-T213 PolarHBondContact O-N 2.84Å
183	E	93.4	Very high	84.7	Confident	123 Å²	123	60.4 Å²	60.4	58%	0.575	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	141.3	166.1	-58.8	-147.2	145.7	0	0	110.2	T213 R215	E183-T213 WeakPolarHBondContact CA-O 3.47Å; E183-R215 VanDerWaalsContact CD-NE 3.32Å; E183-R215 IonicContact OE1-CZ 2.82Å; E183-R215 IonicContact OE1-NE 3.52Å; E183-R215 PolarHBondContact OE1-NE 2.98Å; E183-R215 IonicContact OE1-NH2 3.39Å; E183-R215 PolarHBondContact OE1-NH2 3.43Å; E183-R215 IonicContact OE2-CZ 3.1Å; E183-R215 IonicContact OE2-NE 2.72Å; E183-R215 PolarHBondContact OE2-NE 3.25Å; E183-R215 IonicContact OE2-NH2 3.49Å; E183-R215 PolarHBondContact OE2-NH2 3.09Å
184	I	94.4	Very high	86.2	Confident	48 Å²	48	55.3 Å²	55.3	25%	0.246	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	152.5	176.8	-164	164.9	0	0	0	109.3	I191 T213 I214 R215 F292	I184-I191 HydrophobicContact CG2-CD1 4.18Å; I184-I191 HydrophobicContact CG2-CG1 4.34Å; I184-T213 PolarHBondContact N-O 2.85Å; I184-I214 HydrophobicContact CG2-CB 4.46Å; I184-I214 HydrophobicContact CG2-CG1 3.85Å; I184-I214 CarbonylContact O-C 3.47Å; I184-I214 VanDerWaalsContact O-CA 3.31Å; I184-I214 WeakPolarHBondContact O-CA 3.18Å; I184-R215 PolarHBondContact O-N 2.81Å; I184-F292 HydrophobicContact CB-CE1 4.38Å; I184-F292 HydrophobicContact CD1-CE1 3.87Å; I184-F292 HydrophobicContact CG1-CE1 3.81Å; I184-F292 HydrophobicContact CG1-CZ 4.23Å; I184-F292 HydrophobicContact CG2-CD1 4.39Å; I184-F292 HydrophobicContact CG2-CE1 3.73Å; I184-F292 HydrophobicContact CG2-CZ 4.36Å
185	G	94.4	Very high	87.4	Confident	45 Å²	45	54.9 Å²	54.9	46%	0.464	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	165.5	-178.4	0	0	0	0	0	112.9	R215	G185-R215 WeakPolarHBondContact CA-O 3.41Å
186	G	93.9	Very high	88.6	Confident	29 Å²	29	52.4 Å²	52.4	30%	0.299	29%	0.288	S	S	.	.	S	Bend	trans	129.1	-168.1	-170.6	0	0	0	0	0	112.4	D188 R215 P217 S294	G186-D188 VanDerWaalsContact C-N 3.35Å; G186-R215 PolarHBondContact N-O 2.92Å; G186-P217 VanDerWaalsContact O-CD 3.3Å; G186-P217 WeakPolarHBondContact O-CD 3.4Å; G186-S294 PolarHBondContact O-OG 3.06Å
187	W	93.7	Very high	89.3	Confident	86 Å²	86	49.8 Å²	49.8	33%	0.326	27%	0.265	S	S	.	.	S	Bend	trans	-77	-23	-179.7	-65.4	99	0	0	0	113.2	P217 S294 I296 N314 L317	W187-P217 HydrophobicContact CD2-CG 3.8Å; W187-P217 HydrophobicContact CE3-CG 3.95Å; W187-P217 HydrophobicContact CG-CG 4.39Å; W187-P217 HydrophobicContact CH2-CB 3.98Å; W187-P217 HydrophobicContact CH2-CG 4.08Å; W187-P217 HydrophobicContact CZ2-CB 4.02Å; W187-P217 HydrophobicContact CZ2-CG 3.92Å; W187-P217 HydrophobicContact CZ3-CB 4.3Å; W187-P217 HydrophobicContact CZ3-CG 4.09Å; W187-S294 PolarHBondContact O-N 3.34Å; W187-I296 HydrophobicContact CH2-CD1 4.35Å; W187-I296 HydrophobicContact CZ3-CD1 4.34Å; W187-N314 HydrophobicContact CB-CB 4.29Å; W187-N314 HydrophobicContact CD2-CB 3.86Å; W187-N314 HydrophobicContact CE3-CB 3.88Å; W187-N314 HydrophobicContact CG-CB 4.03Å; W187-N314 PolarHBondContact NE1-ND2 2.96Å; W187-L317 HydrophobicContact CB-CD1 4.3Å
188	D	95.7	Very high	89.7	Confident	61 Å²	61	52.8 Å²	52.8	33%	0.326	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	170	177	70.6	-59.1	0	0	0	110.5	G186 F292 L317	G186-D188 VanDerWaalsContact C-N 3.35Å; D188-F292 VanDerWaalsContact C-CZ 3.46Å; D188-F292 VanDerWaalsContact CA-O 3.3Å; D188-F292 WeakPolarHBondContact CA-O 3.25Å; D188-F292 WeakPolarHBondContact O-CZ 3.46Å; D188-L317 HydrophobicContact CB-CD1 4.15Å; D188-L317 HydrophobicContact CB-CD2 3.85Å; D188-L317 WeakPolarHBondContact OD1-CD2 3.48Å
189	G	95.2	Very high	90.2	Very high	12 Å²	12	55.5 Å²	55.5	12%	0.124	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.4	162.4	168.2	0	0	0	0	0	113.7	L291 F292	G189-L291 WeakPolarHBondContact O-CA 3.36Å; G189-F292 PolarHBondContact N-O 3.31Å; G189-F292 VanDerWaalsContact N-O 3.1Å; G189-F292 VanDerWaalsContact O-CD1 3.26Å; G189-F292 WeakPolarHBondContact O-CD1 3.24Å; G189-F292 PolarHBondContact O-N 2.9Å
190	I	94.8	Very high	90.4	Very high	61 Å²	61	57.5 Å²	57.5	31%	0.313	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	123.1	-176.3	-57.5	175.2	0	0	0	110.1	R192 M227 R289 M290 L291	I190-R192 HydrophobicContact CG2-CG 4.04Å; I190-M227 HydrophobicContact CD1-SD 4.42Å; I190-R289 HydrophobicContact CG2-CG 3.62Å; I190-M290 WeakPolarHBondContact CA-O 3.23Å; I190-L291 HydrophobicContact CG1-CD1 4.04Å
191	I	95.6	Very high	89.9	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	131.5	174.9	-63.1	171	0	0	0	108.4	I184 W212 I214 I275 F288 R289 M290 F292	I184-I191 HydrophobicContact CG2-CD1 4.18Å; I184-I191 HydrophobicContact CG2-CG1 4.34Å; I191-W212 HydrophobicContact CD1-CB 4.3Å; I191-W212 HydrophobicContact CG2-CB 4.42Å; I191-W212 HydrophobicContact CG2-CD2 3.95Å; I191-W212 HydrophobicContact CG2-CG 3.79Å; I191-I214 HydrophobicContact CD1-CD1 3.83Å; I191-I214 HydrophobicContact CD1-CG1 3.87Å; I191-I275 HydrophobicContact CD1-CD1 3.42Å; I191-I275 VanDerWaalsContact CD1-CD1 3.42Å; I191-F288 HydrophobicContact CG2-CE2 3.89Å; I191-F288 HydrophobicContact CG2-CZ 4.15Å; I191-R289 WeakPolarHBondContact O-CA 3.33Å; I191-M290 PolarHBondContact N-O 3.3Å; I191-M290 PolarHBondContact O-N 2.63Å; I191-F292 HydrophobicContact CD1-CD1 4.35Å
192	R	93.6	Very high	89.4	Confident	91 Å²	91	57.4 Å²	57.4	34%	0.343	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	133.2	-178.5	-40.9	-172.5	-68.2	-116.8	5	110.2	I190 S194 Q195 E198 R289	I190-R192 HydrophobicContact CG2-CG 4.04Å; R192-S194 WeakPolarHBondContact CB-OG 3.27Å; R192-S194 PolarHBondContact NE-OG 2.96Å; R192-S194 PolarHBondContact O-N 2.85Å; R192-S194 VanDerWaalsContact O-N 3.12Å; R192-Q195 HydrophobicContact CB-CG 4.21Å; R192-Q195 WeakPolarHBondContact O-CB 3.47Å; R192-Q195 PolarHBondContact O-N 2.75Å; R192-Q195 PolarHBondContact O-OE1 3.38Å; R192-E198 IonicContact CZ-OE1 3.43Å; R192-E198 IonicContact CZ-OE2 2.69Å; R192-E198 IonicContact NE-OE1 2.7Å; R192-E198 IonicContact NH2-OE1 3.6Å; R192-E198 PolarHBondContact NH2-OE1 3.19Å; R192-E198 IonicContact NH2-OE2 2.9Å; R192-E198 PolarHBondContact NH2-OE2 2.86Å; R192-R289 HydrophobicContact CG-CG 4.47Å
193	S	91.7	Very high	88.7	Confident	3 Å²	3	63.5 Å²	63.5	2%	0.021	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-16.5	171.8	68.7	0	0	0	0	113.4	Q195 V196 S286 R287 F288	S193-Q195 VanDerWaalsContact C-N 3.28Å; S193-Q195 PolarHBondContact O-N 3.05Å; S193-V196 WeakPolarHBondContact O-CB 3.04Å; S193-V196 WeakPolarHBondContact O-CG2 2.98Å; S193-V196 PolarHBondContact O-N 2.89Å; S193-S286 PolarHBondContact OG-O 2.83Å; S193-R287 WeakPolarHBondContact OG-CA 3.39Å; S193-F288 PolarHBondContact N-O 3.36Å; S193-F288 VanDerWaalsContact N-O 3.09Å; S193-F288 PolarHBondContact OG-N 2.95Å
194	S	88.2	Confident	87.9	Confident	33 Å²	33	64 Å²	64	23%	0.231	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-23.5	172.6	64.9	0	0	0	0	113.8	R192 V196 E197 E198	R192-S194 WeakPolarHBondContact CB-OG 3.27Å; R192-S194 PolarHBondContact NE-OG 2.96Å; R192-S194 PolarHBondContact O-N 2.85Å; R192-S194 VanDerWaalsContact O-N 3.12Å; S194-V196 PolarHBondContact O-N 2.91Å; S194-V196 VanDerWaalsContact O-N 3.16Å; S194-E197 PolarHBondContact O-N 2.77Å; S194-E198 WeakPolarHBondContact CB-OE1 3.37Å; S194-E198 VanDerWaalsContact O-CG 3.28Å; S194-E198 WeakPolarHBondContact O-CG 2.92Å; S194-E198 PolarHBondContact O-N 3.02Å; S194-E198 PolarHBondContact OG-OE1 2.76Å
195	Q	88.8	Confident	87.1	Confident	35 Å²	35	63.7 Å²	63.7	16%	0.164	34%	0.337	C	S	.	.	H	α-helix	trans	-59.3	-28.8	177.5	-69.9	171.5	-83.7	0	0	112.6	R192 S193 E197 E199	R192-Q195 HydrophobicContact CB-CG 4.21Å; R192-Q195 WeakPolarHBondContact O-CB 3.47Å; R192-Q195 PolarHBondContact O-N 2.75Å; R192-Q195 PolarHBondContact O-OE1 3.38Å; S193-Q195 VanDerWaalsContact C-N 3.28Å; S193-Q195 PolarHBondContact O-N 3.05Å; Q195-E197 VanDerWaalsContact C-N 3.26Å; Q195-E197 PolarHBondContact O-N 3.45Å; Q195-E199 WeakPolarHBondContact O-CB 3.31Å; Q195-E199 PolarHBondContact O-N 3.27Å
196	V	86.6	Confident	86.5	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-62.2	-34.1	175.8	-174.1	0	0	0	0	112.2	F182 S193 S194 R201 V202 C210 W212	F182-V196 HydrophobicContact CE2-CG2 4.19Å; F182-V196 HydrophobicContact CZ-CG2 4.31Å; S193-V196 WeakPolarHBondContact O-CB 3.04Å; S193-V196 WeakPolarHBondContact O-CG2 2.98Å; S193-V196 PolarHBondContact O-N 2.89Å; S194-V196 PolarHBondContact O-N 2.91Å; S194-V196 VanDerWaalsContact O-N 3.16Å; V196-R201 PolarHBondContact O-N 2.73Å; V196-V202 HydrophobicContact CG1-CB 3.82Å; V196-V202 HydrophobicContact CG1-CG2 3.39Å; V196-C210 WeakPolarHBondContact CG1-SG 3.19Å; V196-C210 HydrophobicContact CG2-CB 4.2Å; V196-C210 VanDerWaalsContact CG2-SG 3.6Å; V196-W212 HydrophobicContact CG2-CH2 3.85Å; V196-W212 HydrophobicContact CG2-CZ2 3.66Å
197	E	82.9	Confident	86.1	Confident	67 Å²	67	63.3 Å²	63.3	31%	0.313	32%	0.318	S	S	.	.	H	α-helix	trans	-93.9	-34.9	179.5	-73.2	155.9	-144	0	0	111.6	S194 Q195 E199 E200 R284 R287	S194-E197 PolarHBondContact O-N 2.77Å; Q195-E197 VanDerWaalsContact C-N 3.26Å; Q195-E197 PolarHBondContact O-N 3.45Å; E197-E199 VanDerWaalsContact C-N 3.29Å; E197-E199 PolarHBondContact O-N 2.68Å; E197-E200 PolarHBondContact O-N 2.04Å; E197-R284 IonicContact OE1-CZ 3.57Å; E197-R284 IonicContact OE1-NH1 3.22Å; E197-R284 PolarHBondContact OE1-NH1 2.77Å; E197-R284 IonicContact OE1-NH2 3.35Å; E197-R284 PolarHBondContact OE1-NH2 2.97Å; E197-R287 VanDerWaalsContact CD-NH1 3.3Å; E197-R287 IonicContact OE1-CZ 3.1Å; E197-R287 IonicContact OE1-NH1 2.79Å; E197-R287 PolarHBondContact OE1-NH1 2.02Å; E197-R287 IonicContact OE1-NH2 3.54Å; E197-R287 IonicContact OE2-CZ 2.88Å; E197-R287 IonicContact OE2-NH1 3.36Å; E197-R287 PolarHBondContact OE2-NH1 3.06Å; E197-R287 VanDerWaalsContact OE2-NH1 3.15Å; E197-R287 IonicContact OE2-NH2 2.68Å; E197-R287 PolarHBondContact OE2-NH2 2.88Å
198	E	83.8	Confident	85.9	Confident	108 Å²	108	59.3 Å²	59.3	51%	0.505	30%	0.303	S	S	.	.	H	α-helix	trans	-63.4	-30.8	175.2	-67.4	163.1	-150.4	0	0	113	R192 S194	R192-E198 IonicContact CZ-OE1 3.43Å; R192-E198 IonicContact CZ-OE2 2.69Å; R192-E198 IonicContact NE-OE1 2.7Å; R192-E198 IonicContact NH2-OE1 3.6Å; R192-E198 PolarHBondContact NH2-OE1 3.19Å; R192-E198 IonicContact NH2-OE2 2.9Å; R192-E198 PolarHBondContact NH2-OE2 2.86Å; S194-E198 WeakPolarHBondContact CB-OE1 3.37Å; S194-E198 VanDerWaalsContact O-CG 3.28Å; S194-E198 WeakPolarHBondContact O-CG 2.92Å; S194-E198 PolarHBondContact O-N 3.02Å; S194-E198 PolarHBondContact OG-OE1 2.76Å
199	E	83.9	Confident	85.5	Confident	91 Å²	91	57.4 Å²	57.4	43%	0.425	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	11.2	175.1	-70.9	-173.7	-143.2	0	0	113.9	Q195 E197 R201	Q195-E199 WeakPolarHBondContact O-CB 3.31Å; Q195-E199 PolarHBondContact O-N 3.27Å; E197-E199 VanDerWaalsContact C-N 3.29Å; E197-E199 PolarHBondContact O-N 2.68Å; E199-R201 HydrophobicContact CB-CG 3.82Å; E199-R201 PolarHBondContact O-N 3.27Å; E199-R201 IonicContact OE2-CZ 3.36Å; E199-R201 IonicContact OE2-NE 3.07Å; E199-R201 PolarHBondContact OE2-NE 3.19Å; E199-R201 IonicContact OE2-NH2 3.81Å; E199-R201 PolarHBondContact OE2-NH2 2.84Å
200	E	78.1	Confident	85.3	Confident	176 Å²	176	56.8 Å²	56.8	82%	0.822	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	21.3	180	-58.7	-167.7	156.6	0	0	115.6	E197 V202	E197-E200 PolarHBondContact O-N 2.04Å; E200-V202 PolarHBondContact O-N 2.9Å
201	R	76.9	Confident	85.2	Confident	112 Å²	112	55.4 Å²	55.4	42%	0.423	28%	0.28	S	S	.	.			trans	-65.7	-24.6	-175.5	-55.6	-58.3	-164.6	109.6	10.1	113.4	C180 F182 V196 E199	C180-R201 HydrophobicContact CB-CB 4.11Å; F182-R201 HydrophobicContact CE1-CG 4.4Å; F182-R201 HydrophobicContact CZ-CG 4.15Å; V196-R201 PolarHBondContact O-N 2.73Å; E199-R201 HydrophobicContact CB-CG 3.82Å; E199-R201 PolarHBondContact O-N 3.27Å; E199-R201 IonicContact OE2-CZ 3.36Å; E199-R201 IonicContact OE2-NE 3.07Å; E199-R201 PolarHBondContact OE2-NE 3.19Å; E199-R201 IonicContact OE2-NH2 3.81Å; E199-R201 PolarHBondContact OE2-NH2 2.84Å
202	V	79.7	Confident	85.2	Confident	6 Å²	6	55.6 Å²	55.6	4%	0.036	28%	0.28	C	S	.	.	S	Bend	trans	-135.6	131.8	-176.8	-179	0	0	0	0	108.2	P178 C180 V196 E200 D206 L208	P178-V202 HydrophobicContact CB-CG2 4.26Å; P178-V202 HydrophobicContact CG-CB 4.17Å; P178-V202 HydrophobicContact CG-CG1 3.85Å; P178-V202 HydrophobicContact CG-CG2 3.76Å; C180-V202 HydrophobicContact CB-CG2 4.23Å; V196-V202 HydrophobicContact CG1-CB 3.82Å; V196-V202 HydrophobicContact CG1-CG2 3.39Å; E200-V202 PolarHBondContact O-N 2.9Å; V202-D206 HydrophobicContact CG1-CB 4.1Å; V202-D206 WeakPolarHBondContact CG1-O 3.07Å; V202-L208 HydrophobicContact CG1-CB 4.3Å; V202-L208 HydrophobicContact CG2-CB 4.29Å
203	K	78.3	Confident	85.3	Confident	146 Å²	146	52.5 Å²	52.5	64%	0.635	27%	0.271	S	S	*	.			trans	-67.2	152.6	179.6	-55.5	178.7	-163.2	158.1	0	111.1	G205 D206	K203-G205 PolarHBondContact O-N 2.7Å; K203-G205 VanDerWaalsContact O-N 3.12Å; K203-D206 HydrophobicContact CB-CB 4.42Å; K203-D206 WeakPolarHBondContact CB-OD2 3.35Å; K203-D206 WeakPolarHBondContact CD-OD2 3.49Å; K203-D206 PolarHBondContact O-N 2.91Å
204	P	75.9	Confident	85.5	Confident	133 Å²	133	52.3 Å²	52.3	86%	0.864	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	116.9	171.7	-24.4	35.3	0	0	0	111.5
205	G	76.9	Confident	85.9	Confident	42 Å²	42	56.6 Å²	56.6	43%	0.433	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.3	-24.3	179.6	0	0	0	0	0	115.6	K203 E281	K203-G205 PolarHBondContact O-N 2.7Å; K203-G205 VanDerWaalsContact O-N 3.12Å; G205-E281 WeakPolarHBondContact O-CA 3.43Å
206	D	83.1	Confident	86.2	Confident	59 Å²	59	55.9 Å²	55.9	32%	0.316	28%	0.281	S	S	.	.	S	Bend	trans	-69.1	139.8	177	-75	-11.5	0	0	0	110.6	V202 K203 R284	V202-D206 HydrophobicContact CG1-CB 4.1Å; V202-D206 WeakPolarHBondContact CG1-O 3.07Å; K203-D206 HydrophobicContact CB-CB 4.42Å; K203-D206 WeakPolarHBondContact CB-OD2 3.35Å; K203-D206 WeakPolarHBondContact CD-OD2 3.49Å; K203-D206 PolarHBondContact O-N 2.91Å; D206-R284 WeakPolarHBondContact O-CD 3.35Å; D206-R284 PolarHBondContact O-NE 2.95Å
207	A	85.9	Confident	86.6	Confident	6 Å²	6	57 Å²	57	5%	0.05	29%	0.288	C	S	.	.			trans	-59.1	149.2	173	0	0	0	0	0	112.3	P178 W278 A279 E281	P178-A207 WeakPolarHBondContact CD-O 3.32Å; A207-W278 HydrophobicContact CB-CH2 4Å; A207-W278 HydrophobicContact CB-CZ3 4.27Å; A207-A279 WeakPolarHBondContact CA-O 3.31Å; A207-E281 HydrophobicContact CB-CG 4.26Å
208	L	88.4	Confident	87	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	142.3	-177.2	76.3	89.5	0	0	0	112.1	V202 C210 M277 W278 A279	V202-L208 HydrophobicContact CG1-CB 4.3Å; V202-L208 HydrophobicContact CG2-CB 4.29Å; L208-C210 HydrophobicContact CD1-CB 4.05Å; L208-M277 HydrophobicContact CD1-CB 3.96Å; L208-M277 HydrophobicContact CD1-CG 3.84Å; L208-M277 VanDerWaalsContact CD1-O 3.23Å; L208-M277 WeakPolarHBondContact CD1-O 3.43Å; L208-M277 HydrophobicContact CD1-SD 3.96Å; L208-M277 HydrophobicContact CD2-CE 4.31Å; L208-M277 HydrophobicContact CD2-SD 4.32Å; L208-W278 WeakPolarHBondContact O-CA 3.26Å; L208-A279 HydrophobicContact CD2-CB 4.24Å; L208-A279 HydrophobicContact CG-CB 4.12Å; L208-A279 PolarHBondContact N-O 3.27Å; L208-A279 PolarHBondContact O-N 2.77Å
209	D	88.5	Confident	87.3	Confident	21 Å²	21	63.3 Å²	63.3	11%	0.112	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	74.3	165.7	-166.8	18.3	0	0	0	108.9	P82 I177 R276 M277 W278	P82-D209 HydrophobicContact CG-CB 4.09Å; P82-D209 WeakPolarHBondContact CG-OD2 3.48Å; I177-D209 HydrophobicContact CG2-CB 3.81Å; D209-R276 WeakPolarHBondContact OD1-CG 3.41Å; D209-R276 IonicContact OD1-CZ 3.73Å; D209-R276 IonicContact OD1-NE 3.7Å; D209-R276 PolarHBondContact OD1-NE 2.71Å; D209-R276 IonicContact OD1-NH2 3.36Å; D209-R276 IonicContact OD2-CZ 2.76Å; D209-R276 IonicContact OD2-NE 2.72Å; D209-R276 PolarHBondContact OD2-NE 2.89Å; D209-R276 IonicContact OD2-NH2 2.87Å; D209-R276 PolarHBondContact OD2-NH2 3.48Å; D209-M277 CarbonylContact C-O 3.53Å; D209-M277 WeakPolarHBondContact CA-O 3.33Å; D209-W278 HydrophobicContact CB-CE3 3.83Å; D209-W278 HydrophobicContact CB-CZ3 4.28Å
210	C	90.9	Very high	87.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	142.5	-170.2	-57.7	0	0	0	0	112.8	C180 F182 V196 L208 W212 R276 M277	C180-C210 HydrophobicContact CB-CB 3.79Å; C180-C210 WeakPolarHBondContact CB-SG 3.36Å; C180-C210 CarbonylContact O-C 3.59Å; C180-C210 VanDerWaalsContact O-CA 3.24Å; C180-C210 WeakPolarHBondContact O-CA 3.2Å; C180-C210 WeakPolarHBondContact SG-CA 3.44Å; C180-C210 WeakPolarHBondContact SG-CB 3.22Å; C180-C210 CovalentContact SG-SG 2.03Å; C180-C210 PolarHBondContact SG-SG 2.78Å; F182-C210 HydrophobicContact CE2-CB 4.44Å; V196-C210 WeakPolarHBondContact CG1-SG 3.19Å; V196-C210 HydrophobicContact CG2-CB 4.2Å; V196-C210 VanDerWaalsContact CG2-SG 3.6Å; L208-C210 HydrophobicContact CD1-CB 4.05Å; C210-W212 HydrophobicContact CB-CE3 4.47Å; C210-W212 HydrophobicContact CB-CH2 3.66Å; C210-W212 HydrophobicContact CB-CZ2 4.38Å; C210-W212 HydrophobicContact CB-CZ3 3.71Å; C210-W212 WeakPolarHBondContact O-CZ3 3.42Å; C210-R276 CarbonylContact O-C 3.54Å; C210-R276 VanDerWaalsContact O-CA 3.26Å; C210-R276 WeakPolarHBondContact O-CA 3.28Å; C210-M277 PolarHBondContact N-O 3.43Å; C210-M277 PolarHBondContact O-N 3.37Å
211	I	92.3	Very high	88.5	Confident	32 Å²	32	52.9 Å²	52.9	16%	0.164	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.4	-176.5	-57.5	178.3	0	0	0	110.3	C180 Q181 F182 V274 I275 R276	C180-I211 PolarHBondContact O-N 3.1Å; Q181-I211 CarbonylContact C-O 3.55Å; Q181-I211 WeakPolarHBondContact CA-O 3.16Å; Q181-I211 HydrophobicContact CG-CB 4.47Å; F182-I211 PolarHBondContact N-O 2.86Å; I211-V274 HydrophobicContact CG2-CG1 3.45Å; I211-V274 VanDerWaalsContact CG2-CG1 3.45Å; I211-I275 CarbonylContact C-O 3.53Å; I211-I275 WeakPolarHBondContact CA-O 3.37Å; I211-R276 HydrophobicContact CG1-CB 4.45Å; I211-R276 HydrophobicContact CG1-CG 4.02Å
212	W	94.8	Very high	89.4	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.015	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	122.3	169.5	-62.8	-101.5	0	0	0	109.5	F182 I191 V196 C210 V274 I275 M277 F288	F182-W212 HydrophobicContact CB-CG 4.18Å; F182-W212 AromaticContact CD2-CD1 3.68Å; F182-W212 HydrophobicContact CD2-CD2 4.07Å; F182-W212 AromaticContact CD2-CE2 3.68Å; F182-W212 HydrophobicContact CD2-CG 4.09Å; F182-W212 HydrophobicContact CD2-CZ2 4.27Å; F182-W212 AromaticContact CD2-NE1 3.4Å; F182-W212 AromaticContact CE2-CE2 3.95Å; F182-W212 HydrophobicContact CE2-CZ2 4.07Å; F182-W212 AromaticContact CE2-NE1 3.91Å; F182-W212 AromaticContact CG-CD1 3.78Å; F182-W212 HydrophobicContact CG-CG 4.49Å; F182-W212 AromaticContact CG-NE1 3.75Å; F182-W212 CarbonylContact O-C 3.54Å; F182-W212 WeakPolarHBondContact O-CA 3.29Å; I191-W212 HydrophobicContact CD1-CB 4.3Å; I191-W212 HydrophobicContact CG2-CB 4.42Å; I191-W212 HydrophobicContact CG2-CD2 3.95Å; I191-W212 HydrophobicContact CG2-CG 3.79Å; V196-W212 HydrophobicContact CG2-CH2 3.85Å; V196-W212 HydrophobicContact CG2-CZ2 3.66Å; C210-W212 HydrophobicContact CB-CE3 4.47Å; C210-W212 HydrophobicContact CB-CH2 3.66Å; C210-W212 HydrophobicContact CB-CZ2 4.38Å; C210-W212 HydrophobicContact CB-CZ3 3.71Å; C210-W212 WeakPolarHBondContact O-CZ3 3.42Å; W212-V274 WeakPolarHBondContact O-CA 3.48Å; W212-I275 HydrophobicContact CB-CB 4.41Å; W212-I275 HydrophobicContact CE3-CG2 4.37Å; W212-I275 PolarHBondContact N-O 3.1Å; W212-I275 PolarHBondContact O-N 3.13Å; W212-M277 HydrophobicContact CH2-CB 4.06Å; W212-M277 HydrophobicContact CZ3-CB 3.66Å; W212-F288 HydrophobicContact CH2-CE1 4.29Å; W212-F288 HydrophobicContact CH2-CZ 4.19Å; W212-F288 HydrophobicContact CZ3-CE1 4.41Å; W212-F288 HydrophobicContact CZ3-CZ 4.14Å
213	T	95.7	Very high	90.2	Very high	26 Å²	26	47.6 Å²	47.6	16%	0.16	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	115.9	174.5	-57.5	0	0	0	0	109.5	F182 E183 I184 R215 V272 V274	F182-T213 PolarHBondContact O-N 2.84Å; E183-T213 WeakPolarHBondContact CA-O 3.47Å; I184-T213 PolarHBondContact N-O 2.85Å; T213-R215 HydrophobicContact CG2-CG 4.3Å; T213-V272 HydrophobicContact CG2-CG1 4.18Å; T213-V274 HydrophobicContact CG2-CG2 4.42Å
214	I	96.6	Very high	91.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	129.8	170.8	-59.4	167.8	0	0	0	108.9	I184 I191 I222 L224 V272 G273 I275 F292	I184-I214 HydrophobicContact CG2-CB 4.46Å; I184-I214 HydrophobicContact CG2-CG1 3.85Å; I184-I214 CarbonylContact O-C 3.47Å; I184-I214 VanDerWaalsContact O-CA 3.31Å; I184-I214 WeakPolarHBondContact O-CA 3.18Å; I191-I214 HydrophobicContact CD1-CD1 3.83Å; I191-I214 HydrophobicContact CD1-CG1 3.87Å; I214-I222 HydrophobicContact CB-CD1 4.04Å; I214-I222 HydrophobicContact CD1-CG2 4.27Å; I214-I222 HydrophobicContact CG2-CD1 3.65Å; I214-I222 HydrophobicContact CG2-CG1 4.23Å; I214-I222 HydrophobicContact CG2-CG2 4.46Å; I214-L224 HydrophobicContact CD1-CD2 3.62Å; I214-V272 WeakPolarHBondContact O-CA 3.41Å; I214-V272 WeakPolarHBondContact O-CG1 3.48Å; I214-G273 PolarHBondContact N-O 3.18Å; I214-G273 PolarHBondContact O-N 2.91Å; I214-G273 VanDerWaalsContact O-N 3.1Å; I214-I275 HydrophobicContact CD1-CD1 3.49Å; I214-I275 VanDerWaalsContact CD1-CD1 3.49Å; I214-I275 HydrophobicContact CG1-CD1 4.13Å; I214-F292 HydrophobicContact CD1-CB 3.74Å; I214-F292 HydrophobicContact CD1-CD1 4.07Å; I214-F292 HydrophobicContact CD1-CG 3.9Å; I214-F292 HydrophobicContact CG1-CD1 4.21Å; I214-F292 HydrophobicContact CG1-CG 4.35Å; I214-F292 HydrophobicContact CG2-CD1 4.4Å; I214-F292 HydrophobicContact CG2-CD2 3.73Å; I214-F292 HydrophobicContact CG2-CE1 4.45Å; I214-F292 HydrophobicContact CG2-CE2 3.8Å; I214-F292 HydrophobicContact CG2-CG 4.06Å; I214-F292 HydrophobicContact CG2-CZ 4.17Å
215	R	95.8	Very high	92	Very high	122 Å²	122	37.4 Å²	37.4	46%	0.46	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	102.3	172	-60.8	-175.6	-179.7	-74.7	-3.6	109.5	E183 I184 G185 G186 T213	E183-R215 VanDerWaalsContact CD-NE 3.32Å; E183-R215 IonicContact OE1-CZ 2.82Å; E183-R215 IonicContact OE1-NE 3.52Å; E183-R215 PolarHBondContact OE1-NE 2.98Å; E183-R215 IonicContact OE1-NH2 3.39Å; E183-R215 PolarHBondContact OE1-NH2 3.43Å; E183-R215 IonicContact OE2-CZ 3.1Å; E183-R215 IonicContact OE2-NE 2.72Å; E183-R215 PolarHBondContact OE2-NE 3.25Å; E183-R215 IonicContact OE2-NH2 3.49Å; E183-R215 PolarHBondContact OE2-NH2 3.09Å; I184-R215 PolarHBondContact O-N 2.81Å; G185-R215 WeakPolarHBondContact CA-O 3.41Å; G186-R215 PolarHBondContact N-O 2.92Å; T213-R215 HydrophobicContact CG2-CG 4.3Å
216	A	95.3	Very high	92.9	Very high	20 Å²	20	36.5 Å²	36.5	17%	0.165	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-78.9	160.8	177.3	0	0	0	0	0	111.5	S220 I222 G271 S294	A216-S220 VanDerWaalsContact CB-OG 3.28Å; A216-S220 WeakPolarHBondContact CB-OG 3.22Å; A216-I222 HydrophobicContact CB-CD1 4.25Å; A216-I222 HydrophobicContact CB-CG1 3.82Å; A216-G271 VanDerWaalsContact CB-O 3.22Å; A216-G271 WeakPolarHBondContact CB-O 3.4Å; A216-G271 PolarHBondContact N-O 3.04Å; A216-S294 WeakPolarHBondContact CB-OG 3.41Å
217	P	94.1	Very high	93.4	Very high	23 Å²	23	38.1 Å²	38.1	15%	0.149	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-53.4	155.1	169.2	-27.8	35.7	0	0	0	113.3	G186 W187 S220	G186-P217 VanDerWaalsContact O-CD 3.3Å; G186-P217 WeakPolarHBondContact O-CD 3.4Å; W187-P217 HydrophobicContact CD2-CG 3.8Å; W187-P217 HydrophobicContact CE3-CG 3.95Å; W187-P217 HydrophobicContact CG-CG 4.39Å; W187-P217 HydrophobicContact CH2-CB 3.98Å; W187-P217 HydrophobicContact CH2-CG 4.08Å; W187-P217 HydrophobicContact CZ2-CB 4.02Å; W187-P217 HydrophobicContact CZ2-CG 3.92Å; W187-P217 HydrophobicContact CZ3-CB 4.3Å; W187-P217 HydrophobicContact CZ3-CG 4.09Å; P217-S220 WeakPolarHBondContact CD-OG 3.28Å; P217-S220 WeakPolarHBondContact O-CB 3.43Å; P217-S220 PolarHBondContact O-N 3.08Å; P217-S220 PolarHBondContact O-OG 3.5Å
218	P	91.9	Very high	93.7	Very high	119 Å²	119	40.9 Å²	40.9	77%	0.773	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	143.7	176.2	25.9	-35.2	0	0	0	111.4	S220	P218-S220 PolarHBondContact O-N 3.05Å
219	Q	89.5	Confident	94	Very high	189 Å²	189	42.1 Å²	42.1	88%	0.883	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	18.9	-176.5	-54.1	-178.2	-48.9	0	0	115.2
220	S	93.5	Very high	94.2	Very high	6 Å²	6	47.9 Å²	47.9	4%	0.042	24%	0.235	C	C	.	.			trans	-111.4	156.1	172.2	72.3	0	0	0	0	112.9	A216 P217 P218 G271 Y295	A216-S220 VanDerWaalsContact CB-OG 3.28Å; A216-S220 WeakPolarHBondContact CB-OG 3.22Å; P217-S220 WeakPolarHBondContact CD-OG 3.28Å; P217-S220 WeakPolarHBondContact O-CB 3.43Å; P217-S220 PolarHBondContact O-N 3.08Å; P217-S220 PolarHBondContact O-OG 3.5Å; P218-S220 PolarHBondContact O-N 3.05Å; S220-G271 WeakPolarHBondContact O-CA 3.48Å; S220-G271 PolarHBondContact O-N 2.96Å; S220-Y295 CarbonylContact C-O 3.57Å; S220-Y295 WeakPolarHBondContact CA-O 3.37Å; S220-Y295 WeakPolarHBondContact CB-O 3.37Å
221	K	94.8	Very high	94.3	Very high	43 Å²	43	48.5 Å²	48.5	19%	0.187	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	168.4	174.6	-75.1	-175.7	174.9	177.4	0	110	L268 D269 S294 Y295 D297	K221-L268 WeakPolarHBondContact CB-O 3.35Å; K221-D269 WeakPolarHBondContact CE-O 3.49Å; K221-D269 IonicContact NZ-OD1 3.9Å; K221-D269 PolarHBondContact NZ-OD1 3.31Å; K221-S294 CarbonylContact O-C 3.55Å; K221-S294 VanDerWaalsContact O-CA 3.29Å; K221-S294 WeakPolarHBondContact O-CA 3.04Å; K221-Y295 HydrophobicContact CB-CD1 4.07Å; K221-Y295 HydrophobicContact CB-CD2 4.3Å; K221-Y295 HydrophobicContact CB-CE1 3.56Å; K221-Y295 HydrophobicContact CB-CE2 3.82Å; K221-Y295 HydrophobicContact CB-CG 4.42Å; K221-Y295 VanDerWaalsContact CB-CZ 3.42Å; K221-Y295 HydrophobicContact CD-CE2 4.08Å; K221-Y295 WeakPolarHBondContact CD-OH 3.31Å; K221-Y295 PolarHBondContact N-O 3.32Å; K221-Y295 WeakPolarHBondContact O-CD1 3.49Å; K221-Y295 PolarHBondContact O-N 3.08Å; K221-D297 VanDerWaalsContact CE-OD2 3.23Å; K221-D297 WeakPolarHBondContact CE-OD2 3.26Å; K221-D297 IonicContact NZ-OD1 3.6Å; K221-D297 IonicContact NZ-OD2 2.71Å; K221-D297 PolarHBondContact NZ-OD2 3.12Å
222	I	96.5	Very high	94.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	119.5	-175.8	-56.1	161.1	0	0	0	110.5	I214 A216 L224 L268 F292	I214-I222 HydrophobicContact CB-CD1 4.04Å; I214-I222 HydrophobicContact CD1-CG2 4.27Å; I214-I222 HydrophobicContact CG2-CD1 3.65Å; I214-I222 HydrophobicContact CG2-CG1 4.23Å; I214-I222 HydrophobicContact CG2-CG2 4.46Å; A216-I222 HydrophobicContact CB-CD1 4.25Å; A216-I222 HydrophobicContact CB-CG1 3.82Å; I222-L224 HydrophobicContact CG2-CD2 3.74Å; I222-L224 HydrophobicContact CG2-CG 4.01Å; I222-L268 HydrophobicContact CB-CB 4.18Å; I222-L268 HydrophobicContact CB-CD1 4.2Å; I222-L268 HydrophobicContact CB-CG 4.38Å; I222-L268 HydrophobicContact CD1-CD1 4.35Å; I222-L268 HydrophobicContact CG2-CD1 4.42Å; I222-L268 PolarHBondContact N-O 3.48Å; I222-L268 PolarHBondContact O-N 3.24Å; I222-F292 HydrophobicContact CG2-CB 4.02Å
223	Y	96.4	Very high	93.8	Very high	7 Å²	7	54 Å²	54	3%	0.027	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	131.1	163.4	173.8	-133.2	0	0	0	108.9	R225 D265 L266 M267 F292 T293 M311 N324 V326	Y223-R225 HydrophobicContact CE1-CB 4.28Å; Y223-D265 HydrophobicContact CE2-CB 3.9Å; Y223-D265 PolarHBondContact OH-OD2 3.05Å; Y223-L266 WeakPolarHBondContact CD2-O 3.22Å; Y223-M267 HydrophobicContact CD2-CG 4.5Å; Y223-M267 HydrophobicContact CD2-SD 3.46Å; Y223-M267 WeakPolarHBondContact CD2-SD 3.36Å; Y223-M267 HydrophobicContact CE2-SD 4.42Å; Y223-M267 HydrophobicContact CG-SD 3.86Å; Y223-F292 CarbonylContact O-C 3.56Å; Y223-F292 WeakPolarHBondContact O-CA 3.05Å; Y223-T293 PolarHBondContact N-O 3.46Å; Y223-T293 PolarHBondContact O-N 2.7Å; Y223-M311 HydrophobicContact CD1-CE 4.03Å; Y223-M311 HydrophobicContact CG-SD 4.5Å; Y223-N324 VanDerWaalsContact CD1-O 3.29Å; Y223-N324 WeakPolarHBondContact CD1-O 3.45Å; Y223-N324 WeakPolarHBondContact CE1-O 3.26Å; Y223-V326 HydrophobicContact CE1-CG2 4.32Å; Y223-V326 HydrophobicContact CE2-CG2 4.18Å
224	L	96.9	Very high	93.4	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131.8	179.3	-66.1	177.3	0	0	0	110.4	I214 I222 V244 D265 L266 L268 I275 M290 F292	I214-L224 HydrophobicContact CD1-CD2 3.62Å; I222-L224 HydrophobicContact CG2-CD2 3.74Å; I222-L224 HydrophobicContact CG2-CG 4.01Å; L224-V244 HydrophobicContact CD1-CG1 3.44Å; L224-V244 VanDerWaalsContact CD1-CG1 3.44Å; L224-V244 HydrophobicContact CD1-CG2 4.49Å; L224-D265 CarbonylContact O-C 3.5Å; L224-D265 VanDerWaalsContact O-CA 3.31Å; L224-D265 WeakPolarHBondContact O-CA 3.47Å; L224-D265 WeakPolarHBondContact O-CB 3.26Å; L224-L266 HydrophobicContact CB-CB 4.31Å; L224-L266 PolarHBondContact N-O 2.83Å; L224-L266 PolarHBondContact O-N 2.79Å; L224-L268 HydrophobicContact CD1-CD1 3.86Å; L224-L268 HydrophobicContact CD1-CD2 4.35Å; L224-L268 HydrophobicContact CD1-CG 4.11Å; L224-L268 HydrophobicContact CG-CD1 4.47Å; L224-I275 HydrophobicContact CD2-CD1 4.43Å; L224-M290 HydrophobicContact CB-SD 4.03Å; L224-M290 HydrophobicContact CD1-CE 4.43Å; L224-M290 HydrophobicContact CD1-SD 4.47Å; L224-M290 HydrophobicContact CD2-CE 4.36Å; L224-M290 HydrophobicContact CD2-SD 4.41Å; L224-F292 HydrophobicContact CD2-CB 3.52Å
225	R	95.1	Very high	92.9	Very high	63 Å²	63	60.1 Å²	60.1	24%	0.238	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	126.2	-174.5	175.9	164.2	-160.3	-143.6	4.9	113.2	Y223 M227 D265 M290 L291 Q323	Y223-R225 HydrophobicContact CE1-CB 4.28Å; R225-M227 PolarHBondContact O-N 3.02Å; R225-D265 VanDerWaalsContact CA-OD1 3.27Å; R225-D265 WeakPolarHBondContact CA-OD1 3.1Å; R225-D265 WeakPolarHBondContact CG-OD2 3.3Å; R225-D265 IonicContact NE-OD2 3.63Å; R225-M290 CarbonylContact O-C 3.51Å; R225-M290 WeakPolarHBondContact O-CA 3.42Å; R225-M290 WeakPolarHBondContact O-CG 3.41Å; R225-L291 HydrophobicContact CB-CB 4.46Å; R225-L291 PolarHBondContact N-O 2.93Å; R225-L291 PolarHBondContact O-N 2.76Å; R225-Q323 VanDerWaalsContact CZ-OE1 3.29Å; R225-Q323 VanDerWaalsContact NH1-CB 3.31Å; R225-Q323 VanDerWaalsContact NH1-CG 3.3Å; R225-Q323 PolarHBondContact NH1-O 3.15Å; R225-Q323 VanDerWaalsContact NH1-O 3.13Å
226	F	95.1	Very high	92.4	Very high	24 Å²	24	58.1 Å²	58.1	11%	0.105	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	118.6	176.4	-72.4	-87	0	0	0	110.6	Y229 F258 A263 D265 F288 M290	F226-Y229 AromaticContact CD1-CD2 3.83Å; F226-Y229 HydrophobicContact CD1-CD2 3.83Å; F226-Y229 HydrophobicContact CD1-CG 4.31Å; F226-Y229 AromaticContact CE1-CD2 3.8Å; F226-Y229 HydrophobicContact CE1-CD2 3.8Å; F226-Y229 HydrophobicContact CE1-CE2 4.21Å; F226-F258 HydrophobicContact CE2-CD2 4.03Å; F226-F258 AromaticContact CE2-CE2 3.6Å; F226-F258 HydrophobicContact CE2-CE2 3.6Å; F226-F258 AromaticContact CE2-CZ 3.97Å; F226-F258 HydrophobicContact CE2-CZ 3.97Å; F226-F258 AromaticContact CZ-CD2 3.75Å; F226-F258 HydrophobicContact CZ-CD2 3.75Å; F226-F258 AromaticContact CZ-CE2 3.73Å; F226-F258 HydrophobicContact CZ-CE2 3.73Å; F226-A263 HydrophobicContact CD1-CB 4.04Å; F226-A263 HydrophobicContact CD2-CB 3.61Å; F226-A263 HydrophobicContact CE1-CB 4.05Å; F226-A263 HydrophobicContact CE2-CB 3.63Å; F226-A263 HydrophobicContact CG-CB 3.82Å; F226-A263 HydrophobicContact CZ-CB 3.85Å; F226-D265 PolarHBondContact N-OD1 3.22Å; F226-F288 HydrophobicContact CE1-CD2 4.44Å; F226-M290 HydrophobicContact CD1-SD 4.33Å; F226-M290 HydrophobicContact CD2-SD 4.31Å; F226-M290 HydrophobicContact CE1-SD 3.85Å; F226-M290 HydrophobicContact CE2-SD 3.82Å; F226-M290 HydrophobicContact CZ-SD 3.57Å; F226-M290 VanDerWaalsContact CZ-SD 3.57Å
227	M	93.3	Very high	91.9	Very high	93 Å²	93	59.1 Å²	59.1	46%	0.458	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-41.5	172.4	-57.4	-176.6	76.6	0	0	110.9	I190 R225 R289 L291	I190-M227 HydrophobicContact CD1-SD 4.42Å; R225-M227 PolarHBondContact O-N 3.02Å; M227-R289 HydrophobicContact CB-CB 4.31Å; M227-R289 HydrophobicContact CB-CG 4.14Å; M227-R289 PolarHBondContact N-O 3.19Å; M227-R289 HydrophobicContact SD-CG 4.15Å; M227-L291 HydrophobicContact CG-CB 4.21Å; M227-L291 HydrophobicContact SD-CB 4.11Å
228	D	93.1	Very high	91.4	Very high	63 Å²	63	61 Å²	61	34%	0.337	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	137.6	176.1	-52	-103	0	0	0	108.7	F288 R289	D228-F288 CarbonylContact O-C 3.6Å; D228-F288 VanDerWaalsContact O-CA 3.26Å; D228-F288 WeakPolarHBondContact O-CA 3.5Å; D228-R289 HydrophobicContact CB-CB 3.91Å; D228-R289 PolarHBondContact N-O 2.78Å; D228-R289 VanDerWaalsContact N-O 3.17Å; D228-R289 PolarHBondContact O-N 2.8Å; D228-R289 IonicContact OD1-NH1 3.55Å; D228-R289 VanDerWaalsContact OD2-CB 3.3Å; D228-R289 WeakPolarHBondContact OD2-CB 3.26Å; D228-R289 VanDerWaalsContact OD2-CD 3.23Å; D228-R289 WeakPolarHBondContact OD2-CD 3.45Å; D228-R289 IonicContact OD2-CZ 2.77Å; D228-R289 IonicContact OD2-NE 3.45Å; D228-R289 PolarHBondContact OD2-NE 3.41Å; D228-R289 IonicContact OD2-NH1 3.72Å; D228-R289 PolarHBondContact OD2-NH1 2.83Å
229	Y	94.4	Very high	91.2	Very high	29 Å²	29	57.7 Å²	57.7	11%	0.114	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	115.8	177.3	-174.6	-105.3	0	0	0	110.3	F226 M231 V242 F258 C259 S260 A263 F288	F226-Y229 AromaticContact CD1-CD2 3.83Å; F226-Y229 HydrophobicContact CD1-CD2 3.83Å; F226-Y229 HydrophobicContact CD1-CG 4.31Å; F226-Y229 AromaticContact CE1-CD2 3.8Å; F226-Y229 HydrophobicContact CE1-CD2 3.8Å; F226-Y229 HydrophobicContact CE1-CE2 4.21Å; Y229-M231 HydrophobicContact CD2-CE 3.98Å; Y229-M231 HydrophobicContact CD2-CG 4.49Å; Y229-M231 HydrophobicContact CE1-CG 3.77Å; Y229-M231 HydrophobicContact CE2-CE 3.71Å; Y229-M231 HydrophobicContact CE2-CG 3.73Å; Y229-M231 HydrophobicContact CE2-SD 3.95Å; Y229-M231 VanDerWaalsContact OH-CG 3.23Å; Y229-M231 WeakPolarHBondContact OH-CG 3.25Å; Y229-V242 HydrophobicContact CE2-CG2 4.29Å; Y229-F258 HydrophobicContact CE2-CB 4.24Å; Y229-F258 WeakPolarHBondContact OH-CB 3.43Å; Y229-F258 PolarHBondContact OH-O 2.86Å; Y229-C259 PolarHBondContact OH-N 2.85Å; Y229-S260 VanDerWaalsContact CE1-O 3.28Å; Y229-S260 WeakPolarHBondContact CE1-O 3.39Å; Y229-A263 HydrophobicContact CD1-CB 3.77Å; Y229-A263 HydrophobicContact CD2-CB 3.91Å; Y229-A263 HydrophobicContact CE1-CB 3.8Å; Y229-A263 HydrophobicContact CE2-CB 3.96Å; Y229-A263 HydrophobicContact CG-CB 3.82Å; Y229-F288 HydrophobicContact CD2-CB 4.01Å
230	Q	92.8	Very high	91.2	Very high	141 Å²	141	48.8 Å²	48.8	66%	0.659	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-145.2	103.4	-177.8	-64.1	-177.9	10.7	0	0	109.5	S286 R287	Q230-S286 CarbonylContact O-C 3.55Å; Q230-S286 WeakPolarHBondContact O-CA 3.47Å; Q230-R287 PolarHBondContact N-O 2.87Å; Q230-R287 PolarHBondContact O-N 2.97Å
231	M	91.8	Very high	91.2	Very high	13 Å²	13	48.7 Å²	48.7	6%	0.064	24%	0.236	C	C	.	.			trans	-105.1	122.8	-176.1	-66.2	-65.4	106.5	0	0	112.2	Y229 S234 V242 F288	Y229-M231 HydrophobicContact CD2-CE 3.98Å; Y229-M231 HydrophobicContact CD2-CG 4.49Å; Y229-M231 HydrophobicContact CE1-CG 3.77Å; Y229-M231 HydrophobicContact CE2-CE 3.71Å; Y229-M231 HydrophobicContact CE2-CG 3.73Å; Y229-M231 HydrophobicContact CE2-SD 3.95Å; Y229-M231 VanDerWaalsContact OH-CG 3.23Å; Y229-M231 WeakPolarHBondContact OH-CG 3.25Å; M231-S234 PolarHBondContact O-OG 3.46Å; M231-V242 HydrophobicContact CE-CG2 4.29Å; M231-V242 HydrophobicContact SD-CG2 4.27Å; M231-F288 HydrophobicContact CE-CB 4.19Å
232	E	90.9	Very high	91.1	Very high	88 Å²	88	46.7 Å²	46.7	41%	0.411	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	152.7	164.4	-74.5	-62.6	169.1	0	0	111.1	S234 N240 L285 S286	E232-S234 PolarHBondContact O-N 2.7Å; E232-N240 PolarHBondContact N-ND2 2.88Å; E232-N240 PolarHBondContact O-ND2 2.79Å; E232-L285 HydrophobicContact CG-CB 4.06Å; E232-S286 PolarHBondContact N-OG 3.36Å
233	H	86.9	Confident	90.9	Very high	64 Å²	64	46.7 Å²	46.7	30%	0.296	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	43.1	-175.6	-73.6	-76.2	0	0	0	112.8	N235 E236 K239	H233-N235 PolarHBondContact O-N 2.94Å; H233-E236 HydrophobicContact CB-CB 4.14Å; H233-E236 HydrophobicContact CB-CG 4.29Å; H233-E236 IonicContact CE1-OE1 3.15Å; H233-E236 IonicContact CG-OE1 3.37Å; H233-E236 IonicContact ND1-OE1 2.82Å; H233-E236 PolarHBondContact ND1-OE1 3.47Å; H233-E236 WeakPolarHBondContact O-CA 3.49Å; H233-E236 VanDerWaalsContact O-CB 3.22Å; H233-E236 WeakPolarHBondContact O-CB 3.46Å; H233-E236 PolarHBondContact O-N 3.4Å; H233-K239 HydrophobicContact CB-CD 4.2Å
234	S	86.4	Confident	90.9	Very high	38 Å²	38	46.4 Å²	46.4	27%	0.266	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	136.6	179.5	-80.4	0	0	0	0	112.8	M231 E232 E236 C259	M231-S234 PolarHBondContact O-OG 3.46Å; E232-S234 PolarHBondContact O-N 2.7Å; S234-E236 PolarHBondContact O-N 2.81Å; S234-C259 CarbonylContact C-O 3.56Å; S234-C259 WeakPolarHBondContact CA-O 3.36Å
235	N	85.4	Confident	90.7	Very high	116 Å²	116	46.4 Å²	46.4	62%	0.62	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	72	-12.4	-169.3	-47.9	-53.7	0	0	0	115.7	H233 C237 C259 S260	H233-N235 PolarHBondContact O-N 2.94Å; N235-C237 PolarHBondContact O-N 3.33Å; N235-C259 PolarHBondContact N-O 3.17Å; N235-S260 WeakPolarHBondContact OD1-CB 2.96Å
236	E	86.5	Confident	90.7	Very high	81 Å²	81	43.9 Å²	43.9	38%	0.379	22%	0.218	S	C	.	.			trans	-80.9	65	173.4	-54.4	-162.2	-110.5	0	0	111.7	H233 S234 K238 K239 N240	H233-E236 HydrophobicContact CB-CB 4.14Å; H233-E236 HydrophobicContact CB-CG 4.29Å; H233-E236 IonicContact CE1-OE1 3.15Å; H233-E236 IonicContact CG-OE1 3.37Å; H233-E236 IonicContact ND1-OE1 2.82Å; H233-E236 PolarHBondContact ND1-OE1 3.47Å; H233-E236 WeakPolarHBondContact O-CA 3.49Å; H233-E236 VanDerWaalsContact O-CB 3.22Å; H233-E236 WeakPolarHBondContact O-CB 3.46Å; H233-E236 PolarHBondContact O-N 3.4Å; S234-E236 PolarHBondContact O-N 2.81Å; E236-K238 PolarHBondContact O-N 2.77Å; E236-K239 HydrophobicContact CB-CB 4.46Å; E236-K239 HydrophobicContact CB-CD 4.25Å; E236-K239 HydrophobicContact CB-CG 4.46Å; E236-K239 PolarHBondContact O-N 2.91Å; E236-K239 IonicContact OE1-NZ 3.77Å; E236-K239 PolarHBondContact OE1-NZ 3.14Å; E236-K239 WeakPolarHBondContact OE2-CE 3.11Å; E236-K239 IonicContact OE2-NZ 2.71Å; E236-K239 PolarHBondContact OE2-NZ 2.68Å; E236-N240 PolarHBondContact O-N 2.86Å
237	C	85.3	Confident	90.4	Very high	41 Å²	41	43.5 Å²	43.5	28%	0.277	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	0.1	-177.8	-121	0	0	0	0	117	N235 N240 F241 K257 C259	N235-C237 PolarHBondContact O-N 3.33Å; C237-N240 WeakPolarHBondContact CA-O 3.31Å; C237-F241 WeakPolarHBondContact O-CD1 3.09Å; C237-K257 WeakPolarHBondContact O-CE 3.46Å; C237-K257 PolarHBondContact O-NZ 2.78Å; C237-C259 WeakPolarHBondContact CA-SG 3.45Å; C237-C259 HydrophobicContact CB-CB 3.82Å; C237-C259 WeakPolarHBondContact CB-SG 3.22Å; C237-C259 WeakPolarHBondContact SG-CB 3.12Å; C237-C259 CovalentContact SG-SG 2.03Å; C237-C259 PolarHBondContact SG-SG 3.31Å
238	K	83.1	Confident	89.9	Confident	61 Å²	61	41.4 Å²	41.4	27%	0.265	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-37.8	178.1	-178.1	169.2	179.2	168.2	0	112	T135 D163 D165 F166 E236 W278	T135-K238 PolarHBondContact O-NZ 3.12Å; D163-K238 VanDerWaalsContact CG-CE 3.49Å; D163-K238 VanDerWaalsContact CG-NZ 3.3Å; D163-K238 WeakPolarHBondContact OD1-CE 3.46Å; D163-K238 IonicContact OD1-NZ 2.72Å; D163-K238 PolarHBondContact OD1-NZ 3.34Å; D163-K238 WeakPolarHBondContact OD2-CE 3.4Å; D163-K238 IonicContact OD2-NZ 3.98Å; D163-K238 PolarHBondContact OD2-NZ 3.5Å; D165-K238 WeakPolarHBondContact OD2-CE 3.27Å; D165-K238 IonicContact OD2-NZ 3.71Å; D165-K238 PolarHBondContact OD2-NZ 3Å; F166-K238 HydrophobicContact CE2-CD 4.48Å; F166-K238 HydrophobicContact CE2-CG 4Å; F166-K238 HydrophobicContact CZ-CG 3.98Å; E236-K238 PolarHBondContact O-N 2.77Å; K238-W278 PolarHBondContact O-NE1 3.01Å
239	K	86.6	Confident	89.1	Confident	50 Å²	50	41.4 Å²	41.4	22%	0.217	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-37.3	175.7	-66	178.9	-178.4	161.4	0	112.3	H233 E236 W278 A279 D280	H233-K239 HydrophobicContact CB-CD 4.2Å; E236-K239 HydrophobicContact CB-CB 4.46Å; E236-K239 HydrophobicContact CB-CD 4.25Å; E236-K239 HydrophobicContact CB-CG 4.46Å; E236-K239 PolarHBondContact O-N 2.91Å; E236-K239 IonicContact OE1-NZ 3.77Å; E236-K239 PolarHBondContact OE1-NZ 3.14Å; E236-K239 WeakPolarHBondContact OE2-CE 3.11Å; E236-K239 IonicContact OE2-NZ 2.71Å; E236-K239 PolarHBondContact OE2-NZ 2.68Å; K239-W278 PolarHBondContact O-NE1 3.21Å; K239-A279 WeakPolarHBondContact O-CA 3.21Å; K239-D280 WeakPolarHBondContact CG-OD2 3.46Å; K239-D280 PolarHBondContact O-N 3.45Å
240	N	90.6	Very high	87.9	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.011	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	135.5	-172.2	-169.2	15.9	0	0	0	111.1	E232 E236 C237 C259 W278 S286	E232-N240 PolarHBondContact N-ND2 2.88Å; E232-N240 PolarHBondContact O-ND2 2.79Å; E236-N240 PolarHBondContact O-N 2.86Å; C237-N240 WeakPolarHBondContact CA-O 3.31Å; N240-C259 VanDerWaalsContact O-CB 3.31Å; N240-C259 WeakPolarHBondContact O-CB 3.44Å; N240-W278 CarbonylContact C-O 3.6Å; N240-W278 VanDerWaalsContact CA-O 3.31Å; N240-W278 WeakPolarHBondContact CA-O 3.37Å; N240-W278 PolarHBondContact OD1-O 3.04Å; N240-S286 PolarHBondContact ND2-OG 3.45Å
241	F	92.3	Very high	86.8	Confident	5 Å²	5	33.8 Å²	33.8	2%	0.022	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165	159.9	165.5	64.3	-96.9	0	0	0	112.9	C237 A243 K257 F258 C259 M277 W278	C237-F241 WeakPolarHBondContact O-CD1 3.09Å; F241-A243 HydrophobicContact CD2-CB 3.77Å; F241-A243 HydrophobicContact CE2-CB 3.69Å; F241-K257 HydrophobicContact CB-CD 4.46Å; F241-K257 VanDerWaalsContact CB-CE 3.48Å; F241-K257 HydrophobicContact CB-CG 4.08Å; F241-K257 HydrophobicContact CD2-CD 4.44Å; F241-K257 HydrophobicContact CD2-CG 4.16Å; F241-K257 HydrophobicContact CG-CD 4.31Å; F241-K257 HydrophobicContact CG-CG 4.22Å; F241-F258 CarbonylContact C-O 3.58Å; F241-F258 VanDerWaalsContact CA-O 3.26Å; F241-F258 WeakPolarHBondContact CA-O 3.47Å; F241-F258 WeakPolarHBondContact CB-O 3.09Å; F241-C259 HydrophobicContact CB-CB 4.12Å; F241-M277 WeakPolarHBondContact O-CA 3.15Å; F241-W278 HydrophobicContact CD1-CB 3.91Å; F241-W278 AromaticContact CD1-CD1 3.76Å; F241-W278 HydrophobicContact CD1-CG 4.22Å; F241-W278 HydrophobicContact CD2-CB 4.43Å; F241-W278 HydrophobicContact CE1-CB 3.47Å; F241-W278 VanDerWaalsContact CE1-CB 3.47Å; F241-W278 AromaticContact CE1-CD1 3.54Å; F241-W278 AromaticContact CE1-CG 3.75Å; F241-W278 HydrophobicContact CE1-CG 3.75Å; F241-W278 HydrophobicContact CE2-CB 4.03Å; F241-W278 HydrophobicContact CG-CB 4.37Å; F241-W278 HydrophobicContact CZ-CB 3.53Å; F241-W278 HydrophobicContact CZ-CG 4.22Å; F241-W278 PolarHBondContact N-O 3.01Å; F241-W278 PolarHBondContact O-N 3.35Å
242	V	93.9	Very high	85.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	120.5	159	-179.5	0	0	0	0	107.9	Y229 M231 F258 I275 M277 F288	Y229-V242 HydrophobicContact CE2-CG2 4.29Å; M231-V242 HydrophobicContact CE-CG2 4.29Å; M231-V242 HydrophobicContact SD-CG2 4.27Å; V242-F258 PolarHBondContact N-O 3.42Å; V242-F258 PolarHBondContact O-N 3.13Å; V242-I275 HydrophobicContact CG1-CG2 3.92Å; V242-M277 HydrophobicContact CG2-CG 4.18Å; V242-F288 HydrophobicContact CG1-CZ 4.5Å; V242-F288 HydrophobicContact CG2-CD1 3.64Å; V242-F288 HydrophobicContact CG2-CE1 3.84Å; V242-F288 HydrophobicContact CG2-CG 4.24Å
243	A	92.3	Very high	85.5	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.008	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	144.6	176.1	0	0	0	0	0	110.1	F241 Y245 L254 A256 K257 I275 R276	F241-A243 HydrophobicContact CD2-CB 3.77Å; F241-A243 HydrophobicContact CE2-CB 3.69Å; A243-Y245 HydrophobicContact CB-CE2 3.75Å; A243-L254 HydrophobicContact CB-CD1 3.85Å; A243-A256 WeakPolarHBondContact CA-O 3.41Å; A243-K257 HydrophobicContact CB-CG 4.46Å; A243-I275 CarbonylContact O-C 3.46Å; A243-I275 WeakPolarHBondContact O-CA 3.48Å; A243-R276 PolarHBondContact N-O 2.88Å; A243-R276 PolarHBondContact O-N 3.02Å
244	V	95.3	Very high	85.5	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.6	-179.4	-179.7	0	0	0	0	109.1	L224 K255 A256 F258 L266 L268 I275	L224-V244 HydrophobicContact CD1-CG1 3.44Å; L224-V244 VanDerWaalsContact CD1-CG1 3.44Å; L224-V244 HydrophobicContact CD1-CG2 4.49Å; V244-K255 PolarHBondContact O-N 3.25Å; V244-A256 PolarHBondContact N-O 3.27Å; V244-A256 PolarHBondContact O-N 2.93Å; V244-A256 VanDerWaalsContact O-N 3.17Å; V244-F258 HydrophobicContact CG2-CE2 4.06Å; V244-L266 HydrophobicContact CB-CD1 3.76Å; V244-L266 HydrophobicContact CG1-CD1 3.74Å; V244-L266 HydrophobicContact CG2-CD1 3.9Å; V244-L268 HydrophobicContact CG1-CD1 4.41Å; V244-L268 HydrophobicContact CG1-CD2 3.94Å; V244-I275 HydrophobicContact CG2-CG1 4.33Å
245	Y	94.2	Very high	85.8	Confident	2 Å²	2	36.3 Å²	36.3	1%	0.008	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	140.7	-177.3	-52	-108.2	0	0	0	110.5	A243 S248 A250 I251 N253 L254 G273 V274 R276	A243-Y245 HydrophobicContact CB-CE2 3.75Å; Y245-S248 WeakPolarHBondContact CB-O 3.31Å; Y245-A250 VanDerWaalsContact CD1-O 3.29Å; Y245-A250 WeakPolarHBondContact CD1-O 3.48Å; Y245-I251 HydrophobicContact CE1-CD1 4.46Å; Y245-N253 CarbonylContact C-O 3.25Å; Y245-N253 WeakPolarHBondContact CA-O 3.29Å; Y245-L254 HydrophobicContact CD1-CB 3.86Å; Y245-L254 HydrophobicContact CD1-CD1 4.08Å; Y245-L254 HydrophobicContact CD2-CD1 4.46Å; Y245-L254 HydrophobicContact CE1-CB 3.89Å; Y245-L254 HydrophobicContact CE1-CD1 3.81Å; Y245-L254 HydrophobicContact CE1-CG 4.38Å; Y245-L254 HydrophobicContact CE2-CD1 4.19Å; Y245-L254 HydrophobicContact CG-CD1 4.41Å; Y245-G273 WeakPolarHBondContact O-CA 3.23Å; Y245-V274 WeakPolarHBondContact CD2-O 3.16Å; Y245-V274 PolarHBondContact N-O 3.27Å; Y245-V274 PolarHBondContact O-N 3.38Å; Y245-R276 HydrophobicContact CE2-CB 3.92Å
246	D	94	Very high	86	Confident	10 Å²	10	31.6 Å²	31.6	5%	0.053	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	104.9	-175.4	-168.1	-16	0	0	0	109.6	N253 K255 L268 D269 N270	D246-N253 PolarHBondContact N-O 3.28Å; D246-N253 WeakPolarHBondContact O-CB 3.45Å; D246-N253 PolarHBondContact O-OD1 3.17Å; D246-K255 HydrophobicContact CB-CB 4.28Å; D246-K255 HydrophobicContact CB-CD 4.01Å; D246-K255 WeakPolarHBondContact OD2-CE 3.37Å; D246-K255 IonicContact OD2-NZ 3.08Å; D246-K255 PolarHBondContact OD2-NZ 2.94Å; D246-L268 HydrophobicContact CB-CB 4.43Å; D246-L268 HydrophobicContact CB-CD2 4.01Å; D246-L268 WeakPolarHBondContact OD2-CA 3.31Å; D246-D269 PolarHBondContact OD1-N 2.92Å; D246-D269 VanDerWaalsContact OD1-N 3.15Å; D246-D269 PolarHBondContact OD2-N 3.47Å; D246-N270 WeakPolarHBondContact OD1-CB 3.26Å; D246-N270 PolarHBondContact OD1-N 2.84Å; D246-N270 PolarHBondContact OD1-ND2 3.17Å
247	G	89.8	Confident	86.1	Confident	15 Å²	15	31.4 Å²	31.4	16%	0.155	17%	0.169	C	C	.	.	S	Bend	trans	100.1	-101.8	-167.1	0	0	0	0	0	112.2	V272	G247-V272 VanDerWaalsContact CA-O 3.25Å; G247-V272 WeakPolarHBondContact CA-O 3.23Å; G247-V272 PolarHBondContact N-O 3.16Å; G247-V272 VanDerWaalsContact O-CG1 3.26Å; G247-V272 WeakPolarHBondContact O-CG1 3.41Å
248	S	82.6	Confident	86.5	Confident	50 Å²	50	30.5 Å²	30.5	35%	0.35	16%	0.161	S	C	.	.	S	Bend	trans	-107.3	174.9	-174	85.9	0	0	0	0	113.6	Y245 A250 N253	Y245-S248 WeakPolarHBondContact CB-O 3.31Å; S248-A250 PolarHBondContact O-N 3.24Å; S248-A250 VanDerWaalsContact OG-CB 3.26Å; S248-A250 WeakPolarHBondContact OG-CB 3.45Å; S248-A250 PolarHBondContact OG-N 2.93Å; S248-A250 VanDerWaalsContact OG-N 3.12Å; S248-N253 PolarHBondContact N-ND2 2.78Å; S248-N253 PolarHBondContact OG-ND2 2.85Å
249	S	75.6	Confident	86.9	Confident	62 Å²	62	28.4 Å²	28.4	43%	0.434	15%	0.153	S	C	.	.	S	Bend	trans	-74.6	4.5	172.2	55.7	0	0	0	0	114.7
250	A	69.6	Low	87	Confident	7 Å²	7	27.7 Å²	27.7	6%	0.058	16%	0.155	C	C	.	.	S	Bend	trans	-70.4	149.7	176.3	0	0	0	0	0	112.1	W50 Y245 S248 E252 N253	W50-A250 HydrophobicContact CH2-CB 3.67Å; W50-A250 HydrophobicContact CZ2-CB 4.1Å; W50-A250 HydrophobicContact CZ3-CB 4.16Å; Y245-A250 VanDerWaalsContact CD1-O 3.29Å; Y245-A250 WeakPolarHBondContact CD1-O 3.48Å; S248-A250 PolarHBondContact O-N 3.24Å; S248-A250 VanDerWaalsContact OG-CB 3.26Å; S248-A250 WeakPolarHBondContact OG-CB 3.45Å; S248-A250 PolarHBondContact OG-N 2.93Å; S248-A250 VanDerWaalsContact OG-N 3.12Å; A250-E252 VanDerWaalsContact C-N 3.31Å; A250-E252 HydrophobicContact CB-CG 3.93Å; A250-E252 WeakPolarHBondContact CB-OE1 3.4Å; A250-E252 PolarHBondContact O-N 3.41Å; A250-N253 WeakPolarHBondContact O-CB 3.41Å; A250-N253 PolarHBondContact O-N 2.8Å; A250-N253 VanDerWaalsContact O-N 3.09Å
251	I	70.7	Confident	87	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.015	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-68.2	-28.6	-171.3	-169.1	52.7	0	0	0	113.8	W50 I77 P113 F138 Y245 N253 L254	W50-I251 HydrophobicContact CZ2-CG2 4.12Å; I77-I251 HydrophobicContact CB-CG2 3.86Å; I77-I251 HydrophobicContact CG2-CB 4.43Å; I77-I251 HydrophobicContact CG2-CG1 3.92Å; I77-I251 HydrophobicContact CG2-CG2 3.6Å; P113-I251 HydrophobicContact CB-CD1 3.62Å; P113-I251 HydrophobicContact CB-CG1 3.59Å; P113-I251 HydrophobicContact CG-CD1 4.3Å; F138-I251 HydrophobicContact CD1-CD1 3.86Å; F138-I251 HydrophobicContact CD1-CG1 4.07Å; F138-I251 HydrophobicContact CE1-CD1 3.3Å; F138-I251 HydrophobicContact CE1-CG1 3.88Å; F138-I251 HydrophobicContact CZ-CD1 3.73Å; Y245-I251 HydrophobicContact CE1-CD1 4.46Å; I251-N253 PolarHBondContact O-N 3.23Å; I251-L254 HydrophobicContact CD1-CB 4.05Å; I251-L254 HydrophobicContact CD1-CD2 3.66Å; I251-L254 HydrophobicContact CD1-CG 4.44Å; I251-L254 VanDerWaalsContact O-CB 3.26Å; I251-L254 WeakPolarHBondContact O-CB 3.32Å; I251-L254 PolarHBondContact O-N 2.73Å
252	E	70.8	Confident	86.9	Confident	115 Å²	115	36.5 Å²	36.5	54%	0.537	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-55.4	-31.2	170.8	65.7	-146.4	-170.7	0	0	113.5	A250	A250-E252 VanDerWaalsContact C-N 3.31Å; A250-E252 HydrophobicContact CB-CG 3.93Å; A250-E252 WeakPolarHBondContact CB-OE1 3.4Å; A250-E252 PolarHBondContact O-N 3.41Å
253	N	83.5	Confident	86.9	Confident	44 Å²	44	37.2 Å²	37.2	24%	0.235	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-88.6	0.4	-176.9	-69.7	-35.7	0	0	0	112.9	Y245 D246 S248 A250 I251 K255	Y245-N253 CarbonylContact C-O 3.25Å; Y245-N253 WeakPolarHBondContact CA-O 3.29Å; D246-N253 PolarHBondContact N-O 3.28Å; D246-N253 WeakPolarHBondContact O-CB 3.45Å; D246-N253 PolarHBondContact O-OD1 3.17Å; S248-N253 PolarHBondContact N-ND2 2.78Å; S248-N253 PolarHBondContact OG-ND2 2.85Å; A250-N253 WeakPolarHBondContact O-CB 3.41Å; A250-N253 PolarHBondContact O-N 2.8Å; A250-N253 VanDerWaalsContact O-N 3.09Å; I251-N253 PolarHBondContact O-N 3.23Å; N253-K255 PolarHBondContact O-N 2.81Å
254	L	88	Confident	86.9	Confident	11 Å²	11	42.4 Å²	42.4	6%	0.058	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	94.8	-177.3	179.9	65.5	0	0	0	111.6	P113 F114 A243 Y245 I251 A256	P113-L254 HydrophobicContact CG-CD2 3.94Å; F114-L254 HydrophobicContact CE1-CB 4.44Å; F114-L254 HydrophobicContact CE1-CD2 4.38Å; F114-L254 HydrophobicContact CE2-CD2 4.3Å; F114-L254 HydrophobicContact CZ-CB 4.31Å; F114-L254 HydrophobicContact CZ-CD2 3.69Å; F114-L254 HydrophobicContact CZ-CG 3.94Å; A243-L254 HydrophobicContact CB-CD1 3.85Å; Y245-L254 HydrophobicContact CD1-CB 3.86Å; Y245-L254 HydrophobicContact CD1-CD1 4.08Å; Y245-L254 HydrophobicContact CD2-CD1 4.46Å; Y245-L254 HydrophobicContact CE1-CB 3.89Å; Y245-L254 HydrophobicContact CE1-CD1 3.81Å; Y245-L254 HydrophobicContact CE1-CG 4.38Å; Y245-L254 HydrophobicContact CE2-CD1 4.19Å; Y245-L254 HydrophobicContact CG-CD1 4.41Å; I251-L254 HydrophobicContact CD1-CB 4.05Å; I251-L254 HydrophobicContact CD1-CD2 3.66Å; I251-L254 HydrophobicContact CD1-CG 4.44Å; I251-L254 VanDerWaalsContact O-CB 3.26Å; I251-L254 WeakPolarHBondContact O-CB 3.32Å; I251-L254 PolarHBondContact O-N 2.73Å; L254-A256 WeakPolarHBondContact CD1-O 3.26Å
255	K	90.8	Very high	86.9	Confident	87 Å²	87	45.5 Å²	45.5	38%	0.378	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	-39.6	179.6	-158.3	79	162.6	-156.7	0	111.9	V244 D246 N253 M267 L268 D269	V244-K255 PolarHBondContact O-N 3.25Å; D246-K255 HydrophobicContact CB-CB 4.28Å; D246-K255 HydrophobicContact CB-CD 4.01Å; D246-K255 WeakPolarHBondContact OD2-CE 3.37Å; D246-K255 IonicContact OD2-NZ 3.08Å; D246-K255 PolarHBondContact OD2-NZ 2.94Å; N253-K255 PolarHBondContact O-N 2.81Å; K255-M267 WeakPolarHBondContact CE-O 3.06Å; K255-L268 HydrophobicContact CB-CD2 4.19Å; K255-L268 HydrophobicContact CG-CD2 4.01Å; K255-D269 IonicContact NZ-OD2 3.52Å; K255-D269 PolarHBondContact NZ-OD2 2.86Å
256	A	90.4	Very high	86.9	Confident	17 Å²	17	46.8 Å²	46.8	14%	0.14	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	157.7	-177.8	0	0	0	0	0	113.4	A243 V244 L254 F258 L266	A243-A256 WeakPolarHBondContact CA-O 3.41Å; V244-A256 PolarHBondContact N-O 3.27Å; V244-A256 PolarHBondContact O-N 2.93Å; V244-A256 VanDerWaalsContact O-N 3.17Å; L254-A256 WeakPolarHBondContact CD1-O 3.26Å; A256-F258 HydrophobicContact CB-CE1 4.38Å; A256-F258 HydrophobicContact CB-CE2 3.93Å; A256-F258 HydrophobicContact CB-CZ 3.79Å; A256-L266 HydrophobicContact CB-CD1 3.74Å; A256-L266 HydrophobicContact CB-CD2 3.99Å
257	K	88.7	Confident	87	Confident	76 Å²	76	49.2 Å²	49.2	33%	0.33	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	121.2	170.5	-174.4	-176.1	178.4	-171.6	0	110.3	C237 F241 A243	C237-K257 WeakPolarHBondContact O-CE 3.46Å; C237-K257 PolarHBondContact O-NZ 2.78Å; F241-K257 HydrophobicContact CB-CD 4.46Å; F241-K257 VanDerWaalsContact CB-CE 3.48Å; F241-K257 HydrophobicContact CB-CG 4.08Å; F241-K257 HydrophobicContact CD2-CD 4.44Å; F241-K257 HydrophobicContact CD2-CG 4.16Å; F241-K257 HydrophobicContact CG-CD 4.31Å; F241-K257 HydrophobicContact CG-CG 4.22Å; A243-K257 HydrophobicContact CB-CG 4.46Å
258	F	92.9	Very high	87.2	Confident	22 Å²	22	48.5 Å²	48.5	10%	0.096	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.8	-178.3	-50.4	-76.4	0	0	0	111	F226 Y229 F241 V242 V244 A256 A263 N264 L266	F226-F258 HydrophobicContact CE2-CD2 4.03Å; F226-F258 AromaticContact CE2-CE2 3.6Å; F226-F258 HydrophobicContact CE2-CE2 3.6Å; F226-F258 AromaticContact CE2-CZ 3.97Å; F226-F258 HydrophobicContact CE2-CZ 3.97Å; F226-F258 AromaticContact CZ-CD2 3.75Å; F226-F258 HydrophobicContact CZ-CD2 3.75Å; F226-F258 AromaticContact CZ-CE2 3.73Å; F226-F258 HydrophobicContact CZ-CE2 3.73Å; Y229-F258 HydrophobicContact CE2-CB 4.24Å; Y229-F258 WeakPolarHBondContact OH-CB 3.43Å; Y229-F258 PolarHBondContact OH-O 2.86Å; F241-F258 CarbonylContact C-O 3.58Å; F241-F258 VanDerWaalsContact CA-O 3.26Å; F241-F258 WeakPolarHBondContact CA-O 3.47Å; F241-F258 WeakPolarHBondContact CB-O 3.09Å; V242-F258 PolarHBondContact N-O 3.42Å; V242-F258 PolarHBondContact O-N 3.13Å; V244-F258 HydrophobicContact CG2-CE2 4.06Å; A256-F258 HydrophobicContact CB-CE1 4.38Å; A256-F258 HydrophobicContact CB-CE2 3.93Å; A256-F258 HydrophobicContact CB-CZ 3.79Å; F258-A263 HydrophobicContact CB-CB 4.13Å; F258-A263 HydrophobicContact CD1-CB 3.73Å; F258-A263 HydrophobicContact CD2-CB 4.32Å; F258-A263 HydrophobicContact CE1-CB 4.14Å; F258-A263 HydrophobicContact CG-CB 3.81Å; F258-N264 HydrophobicContact CE1-CB 4.4Å; F258-N264 VanDerWaalsContact CZ-O 3.27Å; F258-N264 WeakPolarHBondContact CZ-O 3.48Å; F258-L266 HydrophobicContact CE2-CD1 3.77Å; F258-L266 HydrophobicContact CE2-CG 4.44Å; F258-L266 HydrophobicContact CZ-CD1 3.76Å; F258-L266 HydrophobicContact CZ-CD2 4.11Å; F258-L266 HydrophobicContact CZ-CG 3.97Å
259	C	91.5	Very high	87.7	Confident	17 Å²	17	50.3 Å²	50.3	12%	0.115	28%	0.276	C	S	.	.			trans	-146.8	7.9	173.6	57.4	0	0	0	0	112.5	Y229 S234 N235 C237 N240 F241	Y229-C259 PolarHBondContact OH-N 2.85Å; S234-C259 CarbonylContact C-O 3.56Å; S234-C259 WeakPolarHBondContact CA-O 3.36Å; N235-C259 PolarHBondContact N-O 3.17Å; C237-C259 WeakPolarHBondContact CA-SG 3.45Å; C237-C259 HydrophobicContact CB-CB 3.82Å; C237-C259 WeakPolarHBondContact CB-SG 3.22Å; C237-C259 WeakPolarHBondContact SG-CB 3.12Å; C237-C259 CovalentContact SG-SG 2.03Å; C237-C259 PolarHBondContact SG-SG 3.31Å; N240-C259 VanDerWaalsContact O-CB 3.31Å; N240-C259 WeakPolarHBondContact O-CB 3.44Å; F241-C259 HydrophobicContact CB-CB 4.12Å
260	S	90.3	Very high	88.5	Confident	36 Å²	36	51.1 Å²	51.1	25%	0.252	28%	0.276	S	S	.	.	S	Bend	trans	-88.5	-167.9	-177.1	91.4	0	0	0	0	110.9	Y229 N235 V262	Y229-S260 VanDerWaalsContact CE1-O 3.28Å; Y229-S260 WeakPolarHBondContact CE1-O 3.39Å; N235-S260 WeakPolarHBondContact OD1-CB 2.96Å; S260-V262 VanDerWaalsContact C-N 3.26Å; S260-V262 PolarHBondContact OG-N 2.85Å; S260-V262 PolarHBondContact OG-O 2.61Å
261	T	89.6	Confident	89.6	Confident	104 Å²	104	51.9 Å²	51.9	64%	0.638	28%	0.284	S	S	*	.	S	Bend	trans	-76.4	-11.8	168.4	50.9	0	0	0	0	113.5
262	V	89.9	Confident	90.8	Very high	87 Å²	87	54.2 Å²	54.2	53%	0.527	30%	0.298	S	S	.	.			trans	-128.1	144.8	-178.5	-176	0	0	0	0	110.3	S260	S260-V262 VanDerWaalsContact C-N 3.26Å; S260-V262 PolarHBondContact OG-N 2.85Å; S260-V262 PolarHBondContact OG-O 2.61Å
263	A	93.4	Very high	92	Very high	15 Å²	15	48.7 Å²	48.7	12%	0.124	27%	0.273	C	S	.	.			trans	-126	146.8	165.8	0	0	0	0	0	109.1	F226 Y229 F258	F226-A263 HydrophobicContact CD1-CB 4.04Å; F226-A263 HydrophobicContact CD2-CB 3.61Å; F226-A263 HydrophobicContact CE1-CB 4.05Å; F226-A263 HydrophobicContact CE2-CB 3.63Å; F226-A263 HydrophobicContact CG-CB 3.82Å; F226-A263 HydrophobicContact CZ-CB 3.85Å; Y229-A263 HydrophobicContact CD1-CB 3.77Å; Y229-A263 HydrophobicContact CD2-CB 3.91Å; Y229-A263 HydrophobicContact CE1-CB 3.8Å; Y229-A263 HydrophobicContact CE2-CB 3.96Å; Y229-A263 HydrophobicContact CG-CB 3.82Å; F258-A263 HydrophobicContact CB-CB 4.13Å; F258-A263 HydrophobicContact CD1-CB 3.73Å; F258-A263 HydrophobicContact CD2-CB 4.32Å; F258-A263 HydrophobicContact CE1-CB 4.14Å; F258-A263 HydrophobicContact CG-CB 3.81Å
264	N	93.8	Very high	92.5	Very high	111 Å²	111	46.9 Å²	46.9	59%	0.594	26%	0.263	S	S	*	.			trans	-103.6	149.5	179.5	-66.7	-20.2	0	0	0	109.7	F258	F258-N264 HydrophobicContact CE1-CB 4.4Å; F258-N264 VanDerWaalsContact CZ-O 3.27Å; F258-N264 WeakPolarHBondContact CZ-O 3.48Å
265	D	94.5	Very high	92.9	Very high	64 Å²	64	46.4 Å²	46.4	34%	0.342	26%	0.26	S	S	.	.			trans	-65.1	153	171.7	-64.3	-9.2	0	0	0	111.1	Y223 L224 R225 F226	Y223-D265 HydrophobicContact CE2-CB 3.9Å; Y223-D265 PolarHBondContact OH-OD2 3.05Å; L224-D265 CarbonylContact O-C 3.5Å; L224-D265 VanDerWaalsContact O-CA 3.31Å; L224-D265 WeakPolarHBondContact O-CA 3.47Å; L224-D265 WeakPolarHBondContact O-CB 3.26Å; R225-D265 VanDerWaalsContact CA-OD1 3.27Å; R225-D265 WeakPolarHBondContact CA-OD1 3.1Å; R225-D265 WeakPolarHBondContact CG-OD2 3.3Å; R225-D265 IonicContact NE-OD2 3.63Å; F226-D265 PolarHBondContact N-OD1 3.22Å
266	L	95.4	Very high	92.9	Very high	29 Å²	29	42.7 Å²	42.7	15%	0.152	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	147.2	-173.1	-61.8	172.2	0	0	0	112.2	Y223 L224 V244 A256 F258	Y223-L266 WeakPolarHBondContact CD2-O 3.22Å; L224-L266 HydrophobicContact CB-CB 4.31Å; L224-L266 PolarHBondContact N-O 2.83Å; L224-L266 PolarHBondContact O-N 2.79Å; V244-L266 HydrophobicContact CB-CD1 3.76Å; V244-L266 HydrophobicContact CG1-CD1 3.74Å; V244-L266 HydrophobicContact CG2-CD1 3.9Å; A256-L266 HydrophobicContact CB-CD1 3.74Å; A256-L266 HydrophobicContact CB-CD2 3.99Å; F258-L266 HydrophobicContact CE2-CD1 3.77Å; F258-L266 HydrophobicContact CE2-CG 4.44Å; F258-L266 HydrophobicContact CZ-CD1 3.76Å; F258-L266 HydrophobicContact CZ-CD2 4.11Å; F258-L266 HydrophobicContact CZ-CG 3.97Å
267	M	94.3	Very high	93	Very high	62 Å²	62	42 Å²	42	31%	0.305	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.8	163	-62.6	-67.6	-115.2	0	0	108.7	Y223 K255 Y295 M311 V326	Y223-M267 HydrophobicContact CD2-CG 4.5Å; Y223-M267 HydrophobicContact CD2-SD 3.46Å; Y223-M267 WeakPolarHBondContact CD2-SD 3.36Å; Y223-M267 HydrophobicContact CE2-SD 4.42Å; Y223-M267 HydrophobicContact CG-SD 3.86Å; K255-M267 WeakPolarHBondContact CE-O 3.06Å; M267-Y295 HydrophobicContact CE-CE1 3.73Å; M267-Y295 HydrophobicContact CE-CE2 4.11Å; M267-Y295 VanDerWaalsContact CE-CZ 3.47Å; M267-Y295 WeakPolarHBondContact CE-OH 3.03Å; M267-Y295 HydrophobicContact SD-CE1 3.7Å; M267-M311 HydrophobicContact CE-SD 3.85Å; M267-V326 HydrophobicContact CE-CG2 4.44Å
268	L	95.4	Very high	93.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136.2	170.1	-52.1	-173.1	0	0	0	109.1	K221 I222 L224 V244 D246 K255	K221-L268 WeakPolarHBondContact CB-O 3.35Å; I222-L268 HydrophobicContact CB-CB 4.18Å; I222-L268 HydrophobicContact CB-CD1 4.2Å; I222-L268 HydrophobicContact CB-CG 4.38Å; I222-L268 HydrophobicContact CD1-CD1 4.35Å; I222-L268 HydrophobicContact CG2-CD1 4.42Å; I222-L268 PolarHBondContact N-O 3.48Å; I222-L268 PolarHBondContact O-N 3.24Å; L224-L268 HydrophobicContact CD1-CD1 3.86Å; L224-L268 HydrophobicContact CD1-CD2 4.35Å; L224-L268 HydrophobicContact CD1-CG 4.11Å; L224-L268 HydrophobicContact CG-CD1 4.47Å; V244-L268 HydrophobicContact CG1-CD1 4.41Å; V244-L268 HydrophobicContact CG1-CD2 3.94Å; D246-L268 HydrophobicContact CB-CB 4.43Å; D246-L268 HydrophobicContact CB-CD2 4.01Å; D246-L268 WeakPolarHBondContact OD2-CA 3.31Å; K255-L268 HydrophobicContact CB-CD2 4.19Å; K255-L268 HydrophobicContact CG-CD2 4.01Å
269	D	93.1	Very high	93	Very high	88 Å²	88	37.4 Å²	37.4	47%	0.471	22%	0.218	S	C	.	.	S	Bend	trans	-85.6	-12.6	-176.2	-71.5	-73.2	0	0	0	113	K221 D246 K255	K221-D269 WeakPolarHBondContact CE-O 3.49Å; K221-D269 IonicContact NZ-OD1 3.9Å; K221-D269 PolarHBondContact NZ-OD1 3.31Å; D246-D269 PolarHBondContact OD1-N 2.92Å; D246-D269 VanDerWaalsContact OD1-N 3.15Å; D246-D269 PolarHBondContact OD2-N 3.47Å; K255-D269 IonicContact NZ-OD2 3.52Å; K255-D269 PolarHBondContact NZ-OD2 2.86Å
270	N	92.8	Very high	92.8	Very high	79 Å²	79	37.3 Å²	37.3	42%	0.422	22%	0.216	S	C	.	.	S	Bend	trans	-100.6	155.4	172.9	-64.5	-83.5	0	0	0	113.2	D246 V272	D246-N270 WeakPolarHBondContact OD1-CB 3.26Å; D246-N270 PolarHBondContact OD1-N 2.84Å; D246-N270 PolarHBondContact OD1-ND2 3.17Å; N270-V272 PolarHBondContact O-N 2.89Å
271	G	92.6	Very high	92.6	Very high	22 Å²	22	39.5 Å²	39.5	23%	0.227	22%	0.222	C	C	.	.	S	Bend	trans	-79.4	8.5	169.7	0	0	0	0	0	114.8	A216 S220	A216-G271 VanDerWaalsContact CB-O 3.22Å; A216-G271 WeakPolarHBondContact CB-O 3.4Å; A216-G271 PolarHBondContact N-O 3.04Å; S220-G271 WeakPolarHBondContact O-CA 3.48Å; S220-G271 PolarHBondContact O-N 2.96Å
272	V	94.8	Very high	92.5	Very high	52 Å²	52	40.8 Å²	40.8	32%	0.315	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	137.2	168.7	-170.6	0	0	0	0	106.9	T213 I214 G247 N270	T213-V272 HydrophobicContact CG2-CG1 4.18Å; I214-V272 WeakPolarHBondContact O-CA 3.41Å; I214-V272 WeakPolarHBondContact O-CG1 3.48Å; G247-V272 VanDerWaalsContact CA-O 3.25Å; G247-V272 WeakPolarHBondContact CA-O 3.23Å; G247-V272 PolarHBondContact N-O 3.16Å; G247-V272 VanDerWaalsContact O-CG1 3.26Å; G247-V272 WeakPolarHBondContact O-CG1 3.41Å; N270-V272 PolarHBondContact O-N 2.89Å
273	G	95.5	Very high	92.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	140.7	177.3	0	0	0	0	0	109.7	I214 Y245	I214-G273 PolarHBondContact N-O 3.18Å; I214-G273 PolarHBondContact O-N 2.91Å; I214-G273 VanDerWaalsContact O-N 3.1Å; Y245-G273 WeakPolarHBondContact O-CA 3.23Å
274	V	95.6	Very high	92.1	Very high	6 Å²	6	36.7 Å²	36.7	4%	0.036	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	135.1	178.5	-177.1	0	0	0	0	109.8	I211 W212 T213 Y245	I211-V274 HydrophobicContact CG2-CG1 3.45Å; I211-V274 VanDerWaalsContact CG2-CG1 3.45Å; W212-V274 WeakPolarHBondContact O-CA 3.48Å; T213-V274 HydrophobicContact CG2-CG2 4.42Å; Y245-V274 WeakPolarHBondContact CD2-O 3.16Å; Y245-V274 PolarHBondContact N-O 3.27Å; Y245-V274 PolarHBondContact O-N 3.38Å
275	I	95.2	Very high	91.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	131.3	178.3	-62.4	141.4	0	0	0	107.5	I191 I211 W212 I214 L224 V242 A243 V244 F288 M290	I191-I275 HydrophobicContact CD1-CD1 3.42Å; I191-I275 VanDerWaalsContact CD1-CD1 3.42Å; I211-I275 CarbonylContact C-O 3.53Å; I211-I275 WeakPolarHBondContact CA-O 3.37Å; W212-I275 HydrophobicContact CB-CB 4.41Å; W212-I275 HydrophobicContact CE3-CG2 4.37Å; W212-I275 PolarHBondContact N-O 3.1Å; W212-I275 PolarHBondContact O-N 3.13Å; I214-I275 HydrophobicContact CD1-CD1 3.49Å; I214-I275 VanDerWaalsContact CD1-CD1 3.49Å; I214-I275 HydrophobicContact CG1-CD1 4.13Å; L224-I275 HydrophobicContact CD2-CD1 4.43Å; V242-I275 HydrophobicContact CG1-CG2 3.92Å; A243-I275 CarbonylContact O-C 3.46Å; A243-I275 WeakPolarHBondContact O-CA 3.48Å; V244-I275 HydrophobicContact CG2-CG1 4.33Å; I275-F288 HydrophobicContact CG2-CZ 4.38Å; I275-M290 HydrophobicContact CB-CE 4.38Å; I275-M290 HydrophobicContact CD1-CE 3.34Å; I275-M290 HydrophobicContact CG1-CE 3.61Å; I275-M290 HydrophobicContact CG2-CE 3.9Å
276	R	92.3	Very high	91.7	Very high	10 Å²	10	34.1 Å²	34.1	4%	0.038	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	118.1	-178.5	-173.9	168.6	172.6	-167.4	0.6	110.5	E79 D209 C210 I211 A243 Y245	E79-R276 IonicContact OE1-CZ 2.63Å; E79-R276 IonicContact OE1-NH1 2.69Å; E79-R276 PolarHBondContact OE1-NH1 2.88Å; E79-R276 IonicContact OE1-NH2 2.97Å; E79-R276 IonicContact OE2-NH1 2.67Å; E79-R276 PolarHBondContact OE2-NH1 3.19Å; D209-R276 WeakPolarHBondContact OD1-CG 3.41Å; D209-R276 IonicContact OD1-CZ 3.73Å; D209-R276 IonicContact OD1-NE 3.7Å; D209-R276 PolarHBondContact OD1-NE 2.71Å; D209-R276 IonicContact OD1-NH2 3.36Å; D209-R276 IonicContact OD2-CZ 2.76Å; D209-R276 IonicContact OD2-NE 2.72Å; D209-R276 PolarHBondContact OD2-NE 2.89Å; D209-R276 IonicContact OD2-NH2 2.87Å; D209-R276 PolarHBondContact OD2-NH2 3.48Å; C210-R276 CarbonylContact O-C 3.54Å; C210-R276 VanDerWaalsContact O-CA 3.26Å; C210-R276 WeakPolarHBondContact O-CA 3.28Å; I211-R276 HydrophobicContact CG1-CB 4.45Å; I211-R276 HydrophobicContact CG1-CG 4.02Å; A243-R276 PolarHBondContact N-O 2.88Å; A243-R276 PolarHBondContact O-N 3.02Å; Y245-R276 HydrophobicContact CE2-CB 3.92Å
277	M	91.8	Very high	91.5	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	128.8	172	-172.3	-172.5	174	0	0	108.8	L208 D209 C210 W212 F241 V242 A279 F288	L208-M277 HydrophobicContact CD1-CB 3.96Å; L208-M277 HydrophobicContact CD1-CG 3.84Å; L208-M277 VanDerWaalsContact CD1-O 3.23Å; L208-M277 WeakPolarHBondContact CD1-O 3.43Å; L208-M277 HydrophobicContact CD1-SD 3.96Å; L208-M277 HydrophobicContact CD2-CE 4.31Å; L208-M277 HydrophobicContact CD2-SD 4.32Å; D209-M277 CarbonylContact C-O 3.53Å; D209-M277 WeakPolarHBondContact CA-O 3.33Å; C210-M277 PolarHBondContact N-O 3.43Å; C210-M277 PolarHBondContact O-N 3.37Å; W212-M277 HydrophobicContact CH2-CB 4.06Å; W212-M277 HydrophobicContact CZ3-CB 3.66Å; F241-M277 WeakPolarHBondContact O-CA 3.15Å; V242-M277 HydrophobicContact CG2-CG 4.18Å; M277-A279 HydrophobicContact CE-CB 4.04Å; M277-F288 HydrophobicContact CB-CE1 4.09Å; M277-F288 HydrophobicContact CG-CE1 4.14Å; M277-F288 HydrophobicContact SD-CD1 4.05Å; M277-F288 HydrophobicContact SD-CE1 3.71Å
278	W	90.8	Very high	91.5	Very high	3 Å²	3	34.2 Å²	34.2	1%	0.011	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	129.3	166.5	164.8	-107.1	0	0	0	108.4	P82 R83 F166 I177 A207 L208 D209 K238 K239 N240 F241 D280	P82-W278 HydrophobicContact CB-CD2 3.69Å; P82-W278 HydrophobicContact CB-CE3 3.42Å; P82-W278 VanDerWaalsContact CB-CE3 3.42Å; P82-W278 HydrophobicContact CB-CH2 3.51Å; P82-W278 HydrophobicContact CB-CZ2 3.73Å; P82-W278 HydrophobicContact CB-CZ3 3.35Å; P82-W278 HydrophobicContact CG-CD2 4.16Å; P82-W278 HydrophobicContact CG-CE3 3.64Å; P82-W278 HydrophobicContact CG-CH2 4.47Å; P82-W278 HydrophobicContact CG-CZ3 3.84Å; R83-W278 HydrophobicContact CG-CH2 3.84Å; R83-W278 HydrophobicContact CG-CZ2 3.7Å; F166-W278 HydrophobicContact CE1-CZ2 4.32Å; I177-W278 HydrophobicContact CD1-CH2 4.17Å; I177-W278 HydrophobicContact CD1-CZ3 3.76Å; I177-W278 HydrophobicContact CG1-CZ3 4.31Å; I177-W278 HydrophobicContact CG2-CZ3 4.41Å; A207-W278 HydrophobicContact CB-CH2 4Å; A207-W278 HydrophobicContact CB-CZ3 4.27Å; L208-W278 WeakPolarHBondContact O-CA 3.26Å; D209-W278 HydrophobicContact CB-CE3 3.83Å; D209-W278 HydrophobicContact CB-CZ3 4.28Å; K238-W278 PolarHBondContact O-NE1 3.01Å; K239-W278 PolarHBondContact O-NE1 3.21Å; N240-W278 CarbonylContact C-O 3.6Å; N240-W278 VanDerWaalsContact CA-O 3.31Å; N240-W278 WeakPolarHBondContact CA-O 3.37Å; N240-W278 PolarHBondContact OD1-O 3.04Å; F241-W278 HydrophobicContact CD1-CB 3.91Å; F241-W278 AromaticContact CD1-CD1 3.76Å; F241-W278 HydrophobicContact CD1-CG 4.22Å; F241-W278 HydrophobicContact CD2-CB 4.43Å; F241-W278 HydrophobicContact CE1-CB 3.47Å; F241-W278 VanDerWaalsContact CE1-CB 3.47Å; F241-W278 AromaticContact CE1-CD1 3.54Å; F241-W278 AromaticContact CE1-CG 3.75Å; F241-W278 HydrophobicContact CE1-CG 3.75Å; F241-W278 HydrophobicContact CE2-CB 4.03Å; F241-W278 HydrophobicContact CG-CB 4.37Å; F241-W278 HydrophobicContact CZ-CB 3.53Å; F241-W278 HydrophobicContact CZ-CG 4.22Å; F241-W278 PolarHBondContact N-O 3.01Å; F241-W278 PolarHBondContact O-N 3.35Å; W278-D280 HydrophobicContact CZ2-CB 4.38Å
279	A	90.7	Very high	91.5	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	126.7	169.9	0	0	0	0	0	110.6	A207 L208 K239 M277	A207-A279 WeakPolarHBondContact CA-O 3.31Å; L208-A279 HydrophobicContact CD2-CB 4.24Å; L208-A279 HydrophobicContact CG-CB 4.12Å; L208-A279 PolarHBondContact N-O 3.27Å; L208-A279 PolarHBondContact O-N 2.77Å; K239-A279 WeakPolarHBondContact O-CA 3.21Å; M277-A279 HydrophobicContact CE-CB 4.04Å
280	D	88.1	Confident	91.7	Very high	14 Å²	14	34.9 Å²	34.9	8%	0.075	17%	0.168	C	C	.	.			trans	-67.1	169.5	171.2	80.7	-8.4	0	0	0	112.4	F166 K239 W278 K282 S283 R284	F166-D280 HydrophobicContact CE1-CB 4.18Å; K239-D280 WeakPolarHBondContact CG-OD2 3.46Å; K239-D280 PolarHBondContact O-N 3.45Å; W278-D280 HydrophobicContact CZ2-CB 4.38Å; D280-K282 PolarHBondContact O-N 3.43Å; D280-K282 PolarHBondContact OD1-N 3Å; D280-S283 PolarHBondContact O-N 2.93Å; D280-S283 WeakPolarHBondContact OD1-CB 3.5Å; D280-S283 PolarHBondContact OD1-N 3.48Å; D280-S283 PolarHBondContact OD1-OG 2.97Å; D280-R284 WeakPolarHBondContact O-CG 3.5Å; D280-R284 PolarHBondContact O-N 3.43Å
281	E	85.8	Confident	91.8	Very high	83 Å²	83	31.2 Å²	31.2	39%	0.388	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-31.2	-178.5	-68.3	145	-153.2	0	0	113.3	R83 G205 A207	R83-E281 IonicContact NH1-OE1 3.98Å; G205-E281 WeakPolarHBondContact O-CA 3.43Å; A207-E281 HydrophobicContact CB-CG 4.26Å
282	K	86.8	Confident	92	Very high	131 Å²	131	30.1 Å²	30.1	57%	0.57	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-33.8	-179.9	-64.7	171.3	-176.7	170.3	0	112.1	D280 R284	D280-K282 PolarHBondContact O-N 3.43Å; D280-K282 PolarHBondContact OD1-N 3Å; K282-R284 VanDerWaalsContact C-N 3.28Å; K282-R284 PolarHBondContact O-N 3.29Å
283	S	89.8	Confident	92.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	2.9	-175.9	-50.1	0	0	0	0	113.7	D280 L285 S286	D280-S283 PolarHBondContact O-N 2.93Å; D280-S283 WeakPolarHBondContact OD1-CB 3.5Å; D280-S283 PolarHBondContact OD1-N 3.48Å; D280-S283 PolarHBondContact OD1-OG 2.97Å; S283-L285 PolarHBondContact O-N 3.5Å; S283-L285 VanDerWaalsContact O-N 3.08Å; S283-S286 VanDerWaalsContact O-CB 3.3Å; S283-S286 WeakPolarHBondContact O-CB 3.37Å; S283-S286 PolarHBondContact O-N 2.93Å; S283-S286 PolarHBondContact O-OG 3.49Å
284	R	86.4	Confident	92.1	Very high	15 Å²	15	27.7 Å²	27.7	6%	0.057	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.5	-170.9	-79.4	-62.1	-81.6	94.8	-6.1	116.4	E197 D206 D280 K282 S286	E197-R284 IonicContact OE1-CZ 3.57Å; E197-R284 IonicContact OE1-NH1 3.22Å; E197-R284 PolarHBondContact OE1-NH1 2.77Å; E197-R284 IonicContact OE1-NH2 3.35Å; E197-R284 PolarHBondContact OE1-NH2 2.97Å; D206-R284 WeakPolarHBondContact O-CD 3.35Å; D206-R284 PolarHBondContact O-NE 2.95Å; D280-R284 WeakPolarHBondContact O-CG 3.5Å; D280-R284 PolarHBondContact O-N 3.43Å; K282-R284 VanDerWaalsContact C-N 3.28Å; K282-R284 PolarHBondContact O-N 3.29Å; R284-S286 PolarHBondContact O-N 3.1Å
285	L	87.3	Confident	92.1	Very high	120 Å²	120	27.7 Å²	27.7	63%	0.628	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-6.8	177.1	-59.9	179.8	0	0	0	113.6	E232 S283 R287	E232-L285 HydrophobicContact CG-CB 4.06Å; S283-L285 PolarHBondContact O-N 3.5Å; S283-L285 VanDerWaalsContact O-N 3.08Å; L285-R287 WeakPolarHBondContact O-CG 3.3Å; L285-R287 PolarHBondContact O-N 2.67Å
286	S	91.7	Very high	92.1	Very high	1 Å²	1	30 Å²	30	1%	0.007	13%	0.133	C	C	.	.			trans	-57.6	123	-178.9	-61.4	0	0	0	0	113.2	S193 Q230 E232 N240 S283 R284	S193-S286 PolarHBondContact OG-O 2.83Å; Q230-S286 CarbonylContact O-C 3.55Å; Q230-S286 WeakPolarHBondContact O-CA 3.47Å; E232-S286 PolarHBondContact N-OG 3.36Å; N240-S286 PolarHBondContact ND2-OG 3.45Å; S283-S286 VanDerWaalsContact O-CB 3.3Å; S283-S286 WeakPolarHBondContact O-CB 3.37Å; S283-S286 PolarHBondContact O-N 2.93Å; S283-S286 PolarHBondContact O-OG 3.49Å; R284-S286 PolarHBondContact O-N 3.1Å
287	R	91.6	Very high	92.1	Very high	87 Å²	87	33 Å²	33	33%	0.328	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	133.9	-178.7	-58.9	-46.3	-175.6	-170.3	5.6	111.4	S193 E197 Q230 L285	S193-R287 WeakPolarHBondContact OG-CA 3.39Å; E197-R287 VanDerWaalsContact CD-NH1 3.3Å; E197-R287 IonicContact OE1-CZ 3.1Å; E197-R287 IonicContact OE1-NH1 2.79Å; E197-R287 PolarHBondContact OE1-NH1 2.02Å; E197-R287 IonicContact OE1-NH2 3.54Å; E197-R287 IonicContact OE2-CZ 2.88Å; E197-R287 IonicContact OE2-NH1 3.36Å; E197-R287 PolarHBondContact OE2-NH1 3.06Å; E197-R287 VanDerWaalsContact OE2-NH1 3.15Å; E197-R287 IonicContact OE2-NH2 2.68Å; E197-R287 PolarHBondContact OE2-NH2 2.88Å; Q230-R287 PolarHBondContact N-O 2.87Å; Q230-R287 PolarHBondContact O-N 2.97Å; L285-R287 WeakPolarHBondContact O-CG 3.3Å; L285-R287 PolarHBondContact O-N 2.67Å
288	F	94.6	Very high	92	Very high	6 Å²	6	35.8 Å²	35.8	3%	0.026	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	150.6	162	78.7	-90.2	0	0	0	110.9	I191 S193 W212 F226 D228 Y229 M231 V242 I275 M277 M290	I191-F288 HydrophobicContact CG2-CE2 3.89Å; I191-F288 HydrophobicContact CG2-CZ 4.15Å; S193-F288 PolarHBondContact N-O 3.36Å; S193-F288 VanDerWaalsContact N-O 3.09Å; S193-F288 PolarHBondContact OG-N 2.95Å; W212-F288 HydrophobicContact CH2-CE1 4.29Å; W212-F288 HydrophobicContact CH2-CZ 4.19Å; W212-F288 HydrophobicContact CZ3-CE1 4.41Å; W212-F288 HydrophobicContact CZ3-CZ 4.14Å; F226-F288 HydrophobicContact CE1-CD2 4.44Å; D228-F288 CarbonylContact O-C 3.6Å; D228-F288 VanDerWaalsContact O-CA 3.26Å; D228-F288 WeakPolarHBondContact O-CA 3.5Å; Y229-F288 HydrophobicContact CD2-CB 4.01Å; M231-F288 HydrophobicContact CE-CB 4.19Å; V242-F288 HydrophobicContact CG1-CZ 4.5Å; V242-F288 HydrophobicContact CG2-CD1 3.64Å; V242-F288 HydrophobicContact CG2-CE1 3.84Å; V242-F288 HydrophobicContact CG2-CG 4.24Å; I275-F288 HydrophobicContact CG2-CZ 4.38Å; M277-F288 HydrophobicContact CB-CE1 4.09Å; M277-F288 HydrophobicContact CG-CE1 4.14Å; M277-F288 HydrophobicContact SD-CD1 4.05Å; M277-F288 HydrophobicContact SD-CE1 3.71Å; F288-M290 HydrophobicContact CD2-CB 4.13Å; F288-M290 HydrophobicContact CE2-CB 4.27Å; F288-M290 HydrophobicContact CE2-CE 4.46Å
289	R	95.1	Very high	92.1	Very high	101 Å²	101	41.3 Å²	41.3	38%	0.381	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	121.3	169.4	-176	-176.8	-62.6	141.7	-3.5	107.4	I190 I191 R192 M227 D228	I190-R289 HydrophobicContact CG2-CG 3.62Å; I191-R289 WeakPolarHBondContact O-CA 3.33Å; R192-R289 HydrophobicContact CG-CG 4.47Å; M227-R289 HydrophobicContact CB-CB 4.31Å; M227-R289 HydrophobicContact CB-CG 4.14Å; M227-R289 PolarHBondContact N-O 3.19Å; M227-R289 HydrophobicContact SD-CG 4.15Å; D228-R289 HydrophobicContact CB-CB 3.91Å; D228-R289 PolarHBondContact N-O 2.78Å; D228-R289 VanDerWaalsContact N-O 3.17Å; D228-R289 PolarHBondContact O-N 2.8Å; D228-R289 IonicContact OD1-NH1 3.55Å; D228-R289 VanDerWaalsContact OD2-CB 3.3Å; D228-R289 WeakPolarHBondContact OD2-CB 3.26Å; D228-R289 VanDerWaalsContact OD2-CD 3.23Å; D228-R289 WeakPolarHBondContact OD2-CD 3.45Å; D228-R289 IonicContact OD2-CZ 2.77Å; D228-R289 IonicContact OD2-NE 3.45Å; D228-R289 PolarHBondContact OD2-NE 3.41Å; D228-R289 IonicContact OD2-NH1 3.72Å; D228-R289 PolarHBondContact OD2-NH1 2.83Å
290	M	95.7	Very high	92	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	128.3	-177.7	-175.6	158	64.5	0	0	109.7	I190 I191 L224 R225 F226 I275 F288	I190-M290 WeakPolarHBondContact CA-O 3.23Å; I191-M290 PolarHBondContact N-O 3.3Å; I191-M290 PolarHBondContact O-N 2.63Å; L224-M290 HydrophobicContact CB-SD 4.03Å; L224-M290 HydrophobicContact CD1-CE 4.43Å; L224-M290 HydrophobicContact CD1-SD 4.47Å; L224-M290 HydrophobicContact CD2-CE 4.36Å; L224-M290 HydrophobicContact CD2-SD 4.41Å; R225-M290 CarbonylContact O-C 3.51Å; R225-M290 WeakPolarHBondContact O-CA 3.42Å; R225-M290 WeakPolarHBondContact O-CG 3.41Å; F226-M290 HydrophobicContact CD1-SD 4.33Å; F226-M290 HydrophobicContact CD2-SD 4.31Å; F226-M290 HydrophobicContact CE1-SD 3.85Å; F226-M290 HydrophobicContact CE2-SD 3.82Å; F226-M290 HydrophobicContact CZ-SD 3.57Å; F226-M290 VanDerWaalsContact CZ-SD 3.57Å; I275-M290 HydrophobicContact CB-CE 4.38Å; I275-M290 HydrophobicContact CD1-CE 3.34Å; I275-M290 HydrophobicContact CG1-CE 3.61Å; I275-M290 HydrophobicContact CG2-CE 3.9Å; F288-M290 HydrophobicContact CD2-CB 4.13Å; F288-M290 HydrophobicContact CE2-CB 4.27Å; F288-M290 HydrophobicContact CE2-CE 4.46Å
291	L	96.5	Very high	92.1	Very high	2 Å²	2	47 Å²	47	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	134.4	167.8	177.9	70.7	0	0	0	108	G189 I190 R225 M227 I322	G189-L291 WeakPolarHBondContact O-CA 3.36Å; I190-L291 HydrophobicContact CG1-CD1 4.04Å; R225-L291 HydrophobicContact CB-CB 4.46Å; R225-L291 PolarHBondContact N-O 2.93Å; R225-L291 PolarHBondContact O-N 2.76Å; M227-L291 HydrophobicContact CG-CB 4.21Å; M227-L291 HydrophobicContact SD-CB 4.11Å; L291-I322 HydrophobicContact CD1-CG2 4.08Å; L291-I322 HydrophobicContact CD2-CG2 3.5Å; L291-I322 HydrophobicContact CG-CG2 4.45Å
292	F	97.1	Very high	91.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	147.5	158.6	81.1	-93.7	0	0	0	110.1	I184 D188 G189 I191 I214 I222 Y223 L224	I184-F292 HydrophobicContact CB-CE1 4.38Å; I184-F292 HydrophobicContact CD1-CE1 3.87Å; I184-F292 HydrophobicContact CG1-CE1 3.81Å; I184-F292 HydrophobicContact CG1-CZ 4.23Å; I184-F292 HydrophobicContact CG2-CD1 4.39Å; I184-F292 HydrophobicContact CG2-CE1 3.73Å; I184-F292 HydrophobicContact CG2-CZ 4.36Å; D188-F292 VanDerWaalsContact C-CZ 3.46Å; D188-F292 VanDerWaalsContact CA-O 3.3Å; D188-F292 WeakPolarHBondContact CA-O 3.25Å; D188-F292 WeakPolarHBondContact O-CZ 3.46Å; G189-F292 PolarHBondContact N-O 3.31Å; G189-F292 VanDerWaalsContact N-O 3.1Å; G189-F292 VanDerWaalsContact O-CD1 3.26Å; G189-F292 WeakPolarHBondContact O-CD1 3.24Å; G189-F292 PolarHBondContact O-N 2.9Å; I191-F292 HydrophobicContact CD1-CD1 4.35Å; I214-F292 HydrophobicContact CD1-CB 3.74Å; I214-F292 HydrophobicContact CD1-CD1 4.07Å; I214-F292 HydrophobicContact CD1-CG 3.9Å; I214-F292 HydrophobicContact CG1-CD1 4.21Å; I214-F292 HydrophobicContact CG1-CG 4.35Å; I214-F292 HydrophobicContact CG2-CD1 4.4Å; I214-F292 HydrophobicContact CG2-CD2 3.73Å; I214-F292 HydrophobicContact CG2-CE1 4.45Å; I214-F292 HydrophobicContact CG2-CE2 3.8Å; I214-F292 HydrophobicContact CG2-CG 4.06Å; I214-F292 HydrophobicContact CG2-CZ 4.17Å; I222-F292 HydrophobicContact CG2-CB 4.02Å; Y223-F292 CarbonylContact O-C 3.56Å; Y223-F292 WeakPolarHBondContact O-CA 3.05Å; L224-F292 HydrophobicContact CD2-CB 3.52Å
293	T	96.4	Very high	92	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	123.3	175	-57	0	0	0	0	108.1	Y223 I313 L317 N324	Y223-T293 PolarHBondContact N-O 3.46Å; Y223-T293 PolarHBondContact O-N 2.7Å; T293-I313 HydrophobicContact CG2-CG2 3.81Å; T293-L317 HydrophobicContact CG2-CD1 4.08Å; T293-N324 HydrophobicContact CG2-CB 3.88Å; T293-N324 PolarHBondContact OG1-ND2 3.17Å
294	S	95.9	Very high	92.1	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.7	175.1	-54	0	0	0	0	109.9	G186 W187 A216 K221	G186-S294 PolarHBondContact O-OG 3.06Å; W187-S294 PolarHBondContact O-N 3.34Å; A216-S294 WeakPolarHBondContact CB-OG 3.41Å; K221-S294 CarbonylContact O-C 3.55Å; K221-S294 VanDerWaalsContact O-CA 3.29Å; K221-S294 WeakPolarHBondContact O-CA 3.04Å
295	Y	95	Very high	92.4	Very high	7 Å²	7	50 Å²	50	3%	0.027	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	162.4	-172.8	76.5	-93.3	0	0	0	112.5	S220 K221 M267 D297 M311 C312	S220-Y295 CarbonylContact C-O 3.57Å; S220-Y295 WeakPolarHBondContact CA-O 3.37Å; S220-Y295 WeakPolarHBondContact CB-O 3.37Å; K221-Y295 HydrophobicContact CB-CD1 4.07Å; K221-Y295 HydrophobicContact CB-CD2 4.3Å; K221-Y295 HydrophobicContact CB-CE1 3.56Å; K221-Y295 HydrophobicContact CB-CE2 3.82Å; K221-Y295 HydrophobicContact CB-CG 4.42Å; K221-Y295 VanDerWaalsContact CB-CZ 3.42Å; K221-Y295 HydrophobicContact CD-CE2 4.08Å; K221-Y295 WeakPolarHBondContact CD-OH 3.31Å; K221-Y295 PolarHBondContact N-O 3.32Å; K221-Y295 WeakPolarHBondContact O-CD1 3.49Å; K221-Y295 PolarHBondContact O-N 3.08Å; M267-Y295 HydrophobicContact CE-CE1 3.73Å; M267-Y295 HydrophobicContact CE-CE2 4.11Å; M267-Y295 VanDerWaalsContact CE-CZ 3.47Å; M267-Y295 WeakPolarHBondContact CE-OH 3.03Å; M267-Y295 HydrophobicContact SD-CE1 3.7Å; Y295-D297 WeakPolarHBondContact CE2-OD1 3.28Å; Y295-M311 VanDerWaalsContact CB-CG 3.49Å; Y295-M311 HydrophobicContact CD1-CG 4.25Å; Y295-M311 HydrophobicContact CD1-SD 3.65Å; Y295-M311 HydrophobicContact CD2-CB 4.2Å; Y295-M311 HydrophobicContact CD2-CG 3.54Å; Y295-M311 HydrophobicContact CD2-SD 4Å; Y295-M311 HydrophobicContact CE1-SD 4.18Å; Y295-M311 HydrophobicContact CE2-CG 4.29Å; Y295-M311 HydrophobicContact CE2-SD 4.49Å; Y295-M311 HydrophobicContact CG-CG 3.51Å; Y295-M311 HydrophobicContact CG-SD 3.54Å; Y295-M311 VanDerWaalsContact CG-SD 3.54Å; Y295-C312 CarbonylContact C-O 3.56Å; Y295-C312 WeakPolarHBondContact CA-O 3.37Å
296	I	94.1	Very high	92.6	Very high	48 Å²	48	47.8 Å²	47.8	25%	0.246	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-117.6	142	177.8	-52.2	176.1	0	0	0	108.6	W187 C312	W187-I296 HydrophobicContact CH2-CD1 4.35Å; W187-I296 HydrophobicContact CZ3-CD1 4.34Å; I296-C312 HydrophobicContact CB-CB 4.4Å; I296-C312 PolarHBondContact N-O 3.36Å; I296-C312 VanDerWaalsContact O-CB 3.22Å; I296-C312 WeakPolarHBondContact O-CB 2.96Å; I296-C312 PolarHBondContact O-N 3.39Å
297	D	92.5	Very high	92.5	Very high	73 Å²	73	47.7 Å²	47.7	39%	0.39	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-68	148.1	172.5	-69.2	-29	0	0	0	110.1	K221 Y295	K221-D297 VanDerWaalsContact CE-OD2 3.23Å; K221-D297 WeakPolarHBondContact CE-OD2 3.26Å; K221-D297 IonicContact NZ-OD1 3.6Å; K221-D297 IonicContact NZ-OD2 2.71Å; K221-D297 PolarHBondContact NZ-OD2 3.12Å; Y295-D297 WeakPolarHBondContact CE2-OD1 3.28Å
298	P	90.8	Very high	92.1	Very high	59 Å²	59	49.7 Å²	49.7	38%	0.383	28%	0.276	S	S	.	.	S	Bend	trans	-59.1	148.6	178.9	-25	34.5	0	0	0	113.3	F306 N310	P298-F306 HydrophobicContact CG-CE2 3.94Å; P298-N310 WeakPolarHBondContact CD-O 3.3Å; P298-N310 HydrophobicContact CG-CB 4.39Å
299	P	92.2	Very high	91.6	Very high	119 Å²	119	51 Å²	51	77%	0.773	29%	0.286	S	S	*	.	S	Bend	cis	-84	136.9	13.9	32.1	-35.7	0	0	0	114.7
300	C	89.6	Confident	91.2	Very high	45 Å²	45	51.8 Å²	51.8	30%	0.304	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-68.2	144.3	175.7	-50.1	0	0	0	0	111.9	C312	C300-C312 WeakPolarHBondContact CA-SG 3.44Å; C300-C312 HydrophobicContact CB-CB 3.8Å; C300-C312 WeakPolarHBondContact CB-SG 3.08Å; C300-C312 PolarHBondContact N-SG 3Å; C300-C312 VanDerWaalsContact N-SG 3.43Å; C300-C312 WeakPolarHBondContact SG-CB 3.01Å; C300-C312 CovalentContact SG-SG 2.04Å; C300-C312 PolarHBondContact SG-SG 2.9Å
301	T	88.9	Confident	91.1	Very high	89 Å²	89	51.8 Å²	51.8	55%	0.546	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-89.5	169	172.8	72.7	0	0	0	0	111.5	N303 T304	T301-N303 PolarHBondContact O-N 2.98Å; T301-T304 PolarHBondContact N-OG1 3.41Å; T301-T304 PolarHBondContact O-N 3.04Å; T301-T304 VanDerWaalsContact O-O 3.13Å; T301-T304 PolarHBondContact O-OG1 3.09Å; T301-T304 PolarHBondContact OG1-OG1 3.12Å
302	A	82.9	Confident	91	Very high	95 Å²	95	51.7 Å²	51.7	79%	0.785	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-22	-180	0	0	0	0	0	114.9	N315	A302-N315 PolarHBondContact O-ND2 3.48Å; A302-N315 VanDerWaalsContact O-ND2 3.12Å
303	N	88.4	Confident	90.8	Very high	121 Å²	121	51.7 Å²	51.7	65%	0.647	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	5.7	178	-70	-3.5	0	0	0	113.5	T301 N315	T301-N303 PolarHBondContact O-N 2.98Å; N303-N315 VanDerWaalsContact C-ND2 3.28Å; N303-N315 WeakPolarHBondContact CA-ND2 3.48Å; N303-N315 WeakPolarHBondContact O-CB 3.4Å; N303-N315 VanDerWaalsContact O-CG 3.22Å; N303-N315 PolarHBondContact O-N 3.3Å; N303-N315 PolarHBondContact O-ND2 3.34Å
304	T	91.8	Very high	90.7	Very high	18 Å²	18	52.9 Å²	52.9	11%	0.11	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	141.3	-176.4	51.3	0	0	0	0	112.8	T301 I313 N315	T301-T304 PolarHBondContact N-OG1 3.41Å; T301-T304 PolarHBondContact O-N 3.04Å; T301-T304 VanDerWaalsContact O-O 3.13Å; T301-T304 PolarHBondContact O-OG1 3.09Å; T301-T304 PolarHBondContact OG1-OG1 3.12Å; T304-I313 CarbonylContact C-O 3.56Å; T304-I313 WeakPolarHBondContact CA-O 3.46Å; T304-I313 VanDerWaalsContact CB-O 3.22Å; T304-I313 WeakPolarHBondContact CB-O 3.23Å; T304-N315 WeakPolarHBondContact CA-OD1 3.41Å; T304-N315 PolarHBondContact N-OD1 3.05Å
305	F	91.7	Very high	90.4	Very high	59 Å²	59	56.4 Å²	56.4	26%	0.259	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	139.1	-178.9	174.8	-97.3	0	0	0	111.3	C312 I313 N315 V318 W329 D330	F305-C312 CarbonylContact O-C 3.59Å; F305-C312 VanDerWaalsContact O-CA 3.31Å; F305-C312 WeakPolarHBondContact O-CA 3.42Å; F305-I313 HydrophobicContact CB-CG1 4.21Å; F305-I313 HydrophobicContact CD1-CD1 4.23Å; F305-I313 HydrophobicContact CD1-CG1 4.13Å; F305-I313 PolarHBondContact N-O 2.78Å; F305-I313 PolarHBondContact O-N 3.46Å; F305-N315 PolarHBondContact N-OD1 3.3Å; F305-N315 VanDerWaalsContact N-OD1 3.1Å; F305-V318 HydrophobicContact CB-CG2 3.49Å; F305-V318 VanDerWaalsContact CB-CG2 3.49Å; F305-V318 HydrophobicContact CD1-CG2 3.82Å; F305-V318 HydrophobicContact CD2-CG2 4.19Å; F305-V318 HydrophobicContact CG-CG2 3.57Å; F305-W329 HydrophobicContact CE1-CB 4.47Å; F305-D330 HydrophobicContact CE1-CB 4.39Å
306	F	93.2	Very high	90.3	Very high	72 Å²	72	60.7 Å²	60.7	32%	0.316	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	110.4	-177	-177.4	-126.4	0	0	0	111.7	P298 H308	P298-F306 HydrophobicContact CG-CE2 3.94Å; F306-H308 HydrophobicContact CE1-CB 4.41Å; F306-H308 AromaticContact CE1-ND1 3.88Å; F306-H308 PolarHBondContact O-CD2 3.07Å; F306-H308 PolarHBondContact O-N 3.42Å
307	C	89.4	Confident	90.2	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	34%	0.339	C	S	.	.			trans	-70.1	14.5	177.8	-67.8	0	0	0	0	114.7	S309 M311 C325	C307-S309 PolarHBondContact O-N 2.03Å; C307-S309 PolarHBondContact O-OG 3.27Å; C307-M311 HydrophobicContact CB-CB 4.13Å; C307-M311 HydrophobicContact CB-CE 4.28Å; C307-M311 HydrophobicContact CB-CG 4.49Å; C307-M311 WeakPolarHBondContact CB-O 3.3Å; C307-M311 PolarHBondContact N-O 3.16Å; C307-C325 VanDerWaalsContact CA-SG 3.59Å; C307-C325 HydrophobicContact CB-CB 3.65Å; C307-C325 WeakPolarHBondContact CB-SG 3.41Å; C307-C325 VanDerWaalsContact SG-CA 3.58Å; C307-C325 WeakPolarHBondContact SG-CB 3.5Å; C307-C325 CovalentContact SG-SG 2.04Å; C307-C325 PolarHBondContact SG-SG 2.66Å
308	H	82.9	Confident	90.2	Very high	128 Å²	128	56.9 Å²	56.9	59%	0.593	33%	0.332	S	S	*	.	S	Bend	trans	53.2	3.3	-173	-74.2	-90.1	0	0	0	116.9	F306	F306-H308 HydrophobicContact CE1-CB 4.41Å; F306-H308 AromaticContact CE1-ND1 3.88Å; F306-H308 PolarHBondContact O-CD2 3.07Å; F306-H308 PolarHBondContact O-N 3.42Å
309	S	83.1	Confident	90.2	Very high	34 Å²	34	57.4 Å²	57.4	24%	0.238	34%	0.336	C	S	.	.	S	Bend	trans	-119.3	38.8	-170.9	-46.7	0	0	0	0	110.7	C307 M311 Y327	C307-S309 PolarHBondContact O-N 2.03Å; C307-S309 PolarHBondContact O-OG 3.27Å; S309-M311 PolarHBondContact O-N 2.99Å; S309-Y327 WeakPolarHBondContact OG-CD2 3.47Å
310	N	87.8	Confident	90	Very high	118 Å²	118	54.7 Å²	54.7	63%	0.631	32%	0.315	S	S	*	.	S	Bend	trans	51.5	38.9	-171.1	-62.8	-17.4	0	0	0	114	P298	P298-N310 WeakPolarHBondContact CD-O 3.3Å; P298-N310 HydrophobicContact CG-CB 4.39Å
311	M	92.5	Very high	90	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	33%	0.331	C	S	.	.			trans	-138.1	125.9	-175.2	179	160.7	92.9	0	0	110.9	Y223 M267 Y295 C307 S309 I313 N324 C325 V326	Y223-M311 HydrophobicContact CD1-CE 4.03Å; Y223-M311 HydrophobicContact CG-SD 4.5Å; M267-M311 HydrophobicContact CE-SD 3.85Å; Y295-M311 VanDerWaalsContact CB-CG 3.49Å; Y295-M311 HydrophobicContact CD1-CG 4.25Å; Y295-M311 HydrophobicContact CD1-SD 3.65Å; Y295-M311 HydrophobicContact CD2-CB 4.2Å; Y295-M311 HydrophobicContact CD2-CG 3.54Å; Y295-M311 HydrophobicContact CD2-SD 4Å; Y295-M311 HydrophobicContact CE1-SD 4.18Å; Y295-M311 HydrophobicContact CE2-CG 4.29Å; Y295-M311 HydrophobicContact CE2-SD 4.49Å; Y295-M311 HydrophobicContact CG-CG 3.51Å; Y295-M311 HydrophobicContact CG-SD 3.54Å; Y295-M311 VanDerWaalsContact CG-SD 3.54Å; C307-M311 HydrophobicContact CB-CB 4.13Å; C307-M311 HydrophobicContact CB-CE 4.28Å; C307-M311 HydrophobicContact CB-CG 4.49Å; C307-M311 WeakPolarHBondContact CB-O 3.3Å; C307-M311 PolarHBondContact N-O 3.16Å; S309-M311 PolarHBondContact O-N 2.99Å; M311-I313 HydrophobicContact CE-CG2 4Å; M311-I313 HydrophobicContact CG-CG2 4.19Å; M311-N324 WeakPolarHBondContact CE-O 3.36Å; M311-C325 HydrophobicContact CE-CB 4.48Å; M311-V326 HydrophobicContact CE-CG2 4.14Å
312	C	94.4	Very high	90.1	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.007	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	111.8	175.2	-52.7	0	0	0	0	110.1	Y295 I296 C300 F305	Y295-C312 CarbonylContact C-O 3.56Å; Y295-C312 WeakPolarHBondContact CA-O 3.37Å; I296-C312 HydrophobicContact CB-CB 4.4Å; I296-C312 PolarHBondContact N-O 3.36Å; I296-C312 VanDerWaalsContact O-CB 3.22Å; I296-C312 WeakPolarHBondContact O-CB 2.96Å; I296-C312 PolarHBondContact O-N 3.39Å; C300-C312 WeakPolarHBondContact CA-SG 3.44Å; C300-C312 HydrophobicContact CB-CB 3.8Å; C300-C312 WeakPolarHBondContact CB-SG 3.08Å; C300-C312 PolarHBondContact N-SG 3Å; C300-C312 VanDerWaalsContact N-SG 3.43Å; C300-C312 WeakPolarHBondContact SG-CB 3.01Å; C300-C312 CovalentContact SG-SG 2.04Å; C300-C312 PolarHBondContact SG-SG 2.9Å; F305-C312 CarbonylContact O-C 3.59Å; F305-C312 VanDerWaalsContact O-CA 3.31Å; F305-C312 WeakPolarHBondContact O-CA 3.42Å
313	I	94.1	Very high	90.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	162.3	176.2	61.4	170.7	0	0	0	111.1	T293 T304 F305 M311 L317 V318 N324 D330	T293-I313 HydrophobicContact CG2-CG2 3.81Å; T304-I313 CarbonylContact C-O 3.56Å; T304-I313 WeakPolarHBondContact CA-O 3.46Å; T304-I313 VanDerWaalsContact CB-O 3.22Å; T304-I313 WeakPolarHBondContact CB-O 3.23Å; F305-I313 HydrophobicContact CB-CG1 4.21Å; F305-I313 HydrophobicContact CD1-CD1 4.23Å; F305-I313 HydrophobicContact CD1-CG1 4.13Å; F305-I313 PolarHBondContact N-O 2.78Å; F305-I313 PolarHBondContact O-N 3.46Å; M311-I313 HydrophobicContact CE-CG2 4Å; M311-I313 HydrophobicContact CG-CG2 4.19Å; I313-L317 HydrophobicContact CB-CD1 4.46Å; I313-L317 HydrophobicContact CD1-CB 4.17Å; I313-V318 HydrophobicContact CD1-CG2 4.32Å; I313-N324 HydrophobicContact CD1-CB 4.22Å; I313-D330 HydrophobicContact CD1-CB 4.19Å
314	N	93.4	Very high	90.8	Very high	25 Å²	25	45.3 Å²	45.3	13%	0.134	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	137.6	175	-172.3	-23.9	0	0	0	110.9	W187 T316 L317	W187-N314 HydrophobicContact CB-CB 4.29Å; W187-N314 HydrophobicContact CD2-CB 3.86Å; W187-N314 HydrophobicContact CE3-CB 3.88Å; W187-N314 HydrophobicContact CG-CB 4.03Å; W187-N314 PolarHBondContact NE1-ND2 2.96Å; N314-T316 VanDerWaalsContact CG-OG1 3.25Å; N314-T316 PolarHBondContact O-N 3.28Å; N314-T316 PolarHBondContact OD1-N 2.95Å; N314-T316 VanDerWaalsContact OD1-N 3.13Å; N314-T316 PolarHBondContact OD1-OG1 3.39Å; N314-L317 HydrophobicContact CB-CG 4.39Å; N314-L317 WeakPolarHBondContact O-CB 3.41Å; N314-L317 PolarHBondContact O-N 3.35Å
315	N	91.2	Very high	90.9	Very high	73 Å²	73	44.5 Å²	44.5	39%	0.39	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-55.2	-21.1	176.3	-74.3	-11.2	0	0	0	113.9	A302 N303 T304 F305 L317 V318	A302-N315 PolarHBondContact O-ND2 3.48Å; A302-N315 VanDerWaalsContact O-ND2 3.12Å; N303-N315 VanDerWaalsContact C-ND2 3.28Å; N303-N315 WeakPolarHBondContact CA-ND2 3.48Å; N303-N315 WeakPolarHBondContact O-CB 3.4Å; N303-N315 VanDerWaalsContact O-CG 3.22Å; N303-N315 PolarHBondContact O-N 3.3Å; N303-N315 PolarHBondContact O-ND2 3.34Å; T304-N315 WeakPolarHBondContact CA-OD1 3.41Å; T304-N315 PolarHBondContact N-OD1 3.05Å; F305-N315 PolarHBondContact N-OD1 3.3Å; F305-N315 VanDerWaalsContact N-OD1 3.1Å; N315-L317 PolarHBondContact O-N 2.97Å; N315-V318 PolarHBondContact O-N 3.03Å
316	T	91.7	Very high	90.9	Very high	97 Å²	97	44 Å²	44	60%	0.595	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-69.3	-16	174	57.1	0	0	0	0	114.2	N314	N314-T316 VanDerWaalsContact CG-OG1 3.25Å; N314-T316 PolarHBondContact O-N 3.28Å; N314-T316 PolarHBondContact OD1-N 2.95Å; N314-T316 VanDerWaalsContact OD1-N 3.13Å; N314-T316 PolarHBondContact OD1-OG1 3.39Å
317	L	92	Very high	90.8	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.021	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-95	1.6	-179.5	-54.6	-177.2	0	0	0	113.1	W187 D188 T293 I313 N314 N315 N320 N324	W187-L317 HydrophobicContact CB-CD1 4.3Å; D188-L317 HydrophobicContact CB-CD1 4.15Å; D188-L317 HydrophobicContact CB-CD2 3.85Å; D188-L317 WeakPolarHBondContact OD1-CD2 3.48Å; T293-L317 HydrophobicContact CG2-CD1 4.08Å; I313-L317 HydrophobicContact CB-CD1 4.46Å; I313-L317 HydrophobicContact CD1-CB 4.17Å; N314-L317 HydrophobicContact CB-CG 4.39Å; N314-L317 WeakPolarHBondContact O-CB 3.41Å; N314-L317 PolarHBondContact O-N 3.35Å; N315-L317 PolarHBondContact O-N 2.97Å; L317-N320 PolarHBondContact O-ND2 2.97Å; L317-N320 PolarHBondContact O-OD1 2.76Å; L317-N324 HydrophobicContact CB-CB 4.42Å
318	V	92.3	Very high	90.8	Very high	38 Å²	38	49.8 Å²	49.8	23%	0.23	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	130	-179.4	-174.3	0	0	0	0	109.3	F305 I313 N315 N320 D330	F305-V318 HydrophobicContact CB-CG2 3.49Å; F305-V318 VanDerWaalsContact CB-CG2 3.49Å; F305-V318 HydrophobicContact CD1-CG2 3.82Å; F305-V318 HydrophobicContact CD2-CG2 4.19Å; F305-V318 HydrophobicContact CG-CG2 3.57Å; I313-V318 HydrophobicContact CD1-CG2 4.32Å; N315-V318 PolarHBondContact O-N 3.03Å; V318-N320 VanDerWaalsContact C-N 3.34Å; V318-D330 WeakPolarHBondContact CG1-O 3.32Å
319	C	90.3	Very high	91.1	Very high	70 Å²	70	48.1 Å²	48.1	47%	0.473	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	36.2	-174.6	-52	0	0	0	0	114	E331 C334	C319-E331 VanDerWaalsContact C-OE1 3.29Å; C319-E331 WeakPolarHBondContact CA-OE1 3.14Å; C319-E331 PolarHBondContact N-OE1 3.06Å; C319-C334 WeakPolarHBondContact CA-SG 3.42Å; C319-C334 HydrophobicContact CB-CB 3.83Å; C319-C334 WeakPolarHBondContact CB-SG 3.47Å; C319-C334 VanDerWaalsContact SG-CA 3.5Å; C319-C334 WeakPolarHBondContact SG-CB 3.42Å; C319-C334 CovalentContact SG-SG 2.02Å; C319-C334 PolarHBondContact SG-SG 2.94Å
320	N	89.3	Confident	91.5	Very high	61 Å²	61	46.6 Å²	46.6	33%	0.326	26%	0.259	S	S	.	.	S	Bend	trans	-94.2	-9.2	176	69	2.3	0	0	0	112.8	L317 V318 I322 N324 E331	L317-N320 PolarHBondContact O-ND2 2.97Å; L317-N320 PolarHBondContact O-OD1 2.76Å; V318-N320 VanDerWaalsContact C-N 3.34Å; N320-I322 WeakPolarHBondContact OD1-CA 3.05Å; N320-I322 WeakPolarHBondContact OD1-CB 3.49Å; N320-I322 PolarHBondContact OD1-N 2.54Å; N320-I322 PolarHBondContact OD1-O 3.48Å; N320-N324 PolarHBondContact ND2-OD1 2.77Å; N320-E331 PolarHBondContact N-OE1 2.94Å; N320-E331 PolarHBondContact OD1-OE1 3.25Å
321	G	88.4	Confident	91.7	Very high	63 Å²	63	43.3 Å²	43.3	65%	0.649	24%	0.24	S	C	*	.	S	Bend	trans	85	9	-175.3	0	0	0	0	0	114.7	E331	G321-E331 VanDerWaalsContact CA-OE2 3.26Å; G321-E331 WeakPolarHBondContact CA-OE2 3.28Å; G321-E331 VanDerWaalsContact N-CD 3.32Å; G321-E331 PolarHBondContact N-OE1 3.22Å; G321-E331 PolarHBondContact N-OE2 2.99Å
322	I	91.4	Very high	91.4	Very high	48 Å²	48	48.4 Å²	48.4	25%	0.246	27%	0.267	C	S	.	.	S	Bend	trans	-123.4	118.9	178.5	-56.1	176.8	0	0	0	107.1	L291 N320 N324	L291-I322 HydrophobicContact CD1-CG2 4.08Å; L291-I322 HydrophobicContact CD2-CG2 3.5Å; L291-I322 HydrophobicContact CG-CG2 4.45Å; N320-I322 WeakPolarHBondContact OD1-CA 3.05Å; N320-I322 WeakPolarHBondContact OD1-CB 3.49Å; N320-I322 PolarHBondContact OD1-N 2.54Å; N320-I322 PolarHBondContact OD1-O 3.48Å; I322-N324 PolarHBondContact O-N 3.37Å; I322-N324 PolarHBondContact O-OD1 2.71Å
323	Q	92.6	Very high	90.6	Very high	43 Å²	43	55.2 Å²	55.2	20%	0.201	30%	0.298	C	S	.	.			trans	-71.5	100.1	171.9	171.6	-165.4	-1.1	0	0	109	R225 C325 V326 P328	R225-Q323 VanDerWaalsContact CZ-OE1 3.29Å; R225-Q323 VanDerWaalsContact NH1-CB 3.31Å; R225-Q323 VanDerWaalsContact NH1-CG 3.3Å; R225-Q323 PolarHBondContact NH1-O 3.15Å; R225-Q323 VanDerWaalsContact NH1-O 3.13Å; Q323-C325 WeakPolarHBondContact CG-O 3.32Å; Q323-C325 PolarHBondContact NE2-O 2.82Å; Q323-V326 PolarHBondContact NE2-O 3.35Å; Q323-P328 HydrophobicContact CB-CB 4.49Å; Q323-P328 HydrophobicContact CG-CB 4.05Å
324	N	94.3	Very high	90	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.31	C	S	.	.			trans	-87.7	-25.7	172.7	-76.8	108.8	0	0	0	111.5	Y223 T293 M311 I313 L317 N320 I322 D330	Y223-N324 VanDerWaalsContact CD1-O 3.29Å; Y223-N324 WeakPolarHBondContact CD1-O 3.45Å; Y223-N324 WeakPolarHBondContact CE1-O 3.26Å; T293-N324 HydrophobicContact CG2-CB 3.88Å; T293-N324 PolarHBondContact OG1-ND2 3.17Å; M311-N324 WeakPolarHBondContact CE-O 3.36Å; I313-N324 HydrophobicContact CD1-CB 4.22Å; L317-N324 HydrophobicContact CB-CB 4.42Å; N320-N324 PolarHBondContact ND2-OD1 2.77Å; I322-N324 PolarHBondContact O-N 3.37Å; I322-N324 PolarHBondContact O-OD1 2.71Å; N324-D330 PolarHBondContact N-OD2 2.69Å
325	C	93	Very high	89	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.344	C	S	.	.	S	Bend	trans	-79.6	148.6	173.8	-70.2	0	0	0	0	112.8	C307 M311 Q323 Y327 D330	C307-C325 VanDerWaalsContact CA-SG 3.59Å; C307-C325 HydrophobicContact CB-CB 3.65Å; C307-C325 WeakPolarHBondContact CB-SG 3.41Å; C307-C325 VanDerWaalsContact SG-CA 3.58Å; C307-C325 WeakPolarHBondContact SG-CB 3.5Å; C307-C325 CovalentContact SG-SG 2.04Å; C307-C325 PolarHBondContact SG-SG 2.66Å; M311-C325 HydrophobicContact CE-CB 4.48Å; Q323-C325 WeakPolarHBondContact CG-O 3.32Å; Q323-C325 PolarHBondContact NE2-O 2.82Å; C325-Y327 CarbonylContact C-O 3.57Å; C325-Y327 WeakPolarHBondContact CB-O 3.24Å; C325-Y327 PolarHBondContact O-N 2.88Å; C325-D330 HydrophobicContact CB-CB 4.36Å; C325-D330 WeakPolarHBondContact CB-OD2 3.48Å; C325-D330 PolarHBondContact N-OD2 3.12Å
326	V	92.4	Very high	87.4	Confident	49 Å²	49	68.3 Å²	68.3	30%	0.297	36%	0.357	S	S	.	.	S	Bend	trans	-53.4	-39.3	177.4	179.4	0	0	0	0	112.7	Y223 M267 M311 Q323	Y223-V326 HydrophobicContact CE1-CG2 4.32Å; Y223-V326 HydrophobicContact CE2-CG2 4.18Å; M267-V326 HydrophobicContact CE-CG2 4.44Å; M311-V326 HydrophobicContact CE-CG2 4.14Å; Q323-V326 PolarHBondContact NE2-O 3.35Å
327	Y	90.9	Very high	85.5	Confident	148 Å²	148	73.6 Å²	73.6	58%	0.58	37%	0.372	S	S	*	.	S	Bend	trans	-116.5	153.2	164.1	-54.4	-75.8	0	0	0	108.6	S309 C325 W329	S309-Y327 WeakPolarHBondContact OG-CD2 3.47Å; C325-Y327 CarbonylContact C-O 3.57Å; C325-Y327 WeakPolarHBondContact CB-O 3.24Å; C325-Y327 PolarHBondContact O-N 2.88Å; Y327-W329 PolarHBondContact O-N 3.38Å
328	P	89.6	Confident	83.5	Confident	45 Å²	45	82 Å²	82	29%	0.292	40%	0.403	S	S	.	.	S	Bend	trans	-74.1	45.9	-169.9	30.8	-37	0	0	0	115.6	Q323 D330 E331 N332	Q323-P328 HydrophobicContact CB-CB 4.49Å; Q323-P328 HydrophobicContact CG-CB 4.05Å; P328-D330 VanDerWaalsContact C-N 3.31Å; P328-D330 VanDerWaalsContact CA-OD1 3.25Å; P328-D330 WeakPolarHBondContact CA-OD1 3.46Å; P328-E331 PolarHBondContact O-N 2.99Å; P328-N332 WeakPolarHBondContact O-CB 3.47Å; P328-N332 PolarHBondContact O-N 3.01Å; P328-N332 PolarHBondContact O-ND2 3.3Å; P328-N332 VanDerWaalsContact O-ND2 3.16Å
329	W	89.5	Confident	81.4	Confident	94 Å²	94	85.3 Å²	85.3	36%	0.356	43%	0.428	S	S	.	.	H	α-helix	trans	-69.2	-28.4	177.9	-65.4	115.8	0	0	0	113.6	F305 Y327	F305-W329 HydrophobicContact CE1-CB 4.47Å; Y327-W329 PolarHBondContact O-N 3.38Å
330	D	91.1	Very high	79.4	Confident	1 Å²	1	91.5 Å²	91.5	1%	0.005	45%	0.447	C	S	.	.	H	α-helix	trans	-60.5	-45.6	170.3	43.6	3.8	0	0	0	112.5	F305 I313 V318 N324 C325 P328 C334	F305-D330 HydrophobicContact CE1-CB 4.39Å; I313-D330 HydrophobicContact CD1-CB 4.19Å; V318-D330 WeakPolarHBondContact CG1-O 3.32Å; N324-D330 PolarHBondContact N-OD2 2.69Å; C325-D330 HydrophobicContact CB-CB 4.36Å; C325-D330 WeakPolarHBondContact CB-OD2 3.48Å; C325-D330 PolarHBondContact N-OD2 3.12Å; P328-D330 VanDerWaalsContact C-N 3.31Å; P328-D330 VanDerWaalsContact CA-OD1 3.25Å; P328-D330 WeakPolarHBondContact CA-OD1 3.46Å; D330-C334 PolarHBondContact O-SG 3.22Å
331	E	91.7	Very high	77.2	Confident	50 Å²	50	90.1 Å²	90.1	23%	0.234	45%	0.447	C	S	.	.	H	α-helix	trans	-94.3	-28.7	-174.9	-66.8	-62.3	122.8	0	0	113.8	C319 N320 G321 P328 H333 C334	C319-E331 VanDerWaalsContact C-OE1 3.29Å; C319-E331 WeakPolarHBondContact CA-OE1 3.14Å; C319-E331 PolarHBondContact N-OE1 3.06Å; N320-E331 PolarHBondContact N-OE1 2.94Å; N320-E331 PolarHBondContact OD1-OE1 3.25Å; G321-E331 VanDerWaalsContact CA-OE2 3.26Å; G321-E331 WeakPolarHBondContact CA-OE2 3.28Å; G321-E331 VanDerWaalsContact N-CD 3.32Å; G321-E331 PolarHBondContact N-OE1 3.22Å; G321-E331 PolarHBondContact N-OE2 2.99Å; P328-E331 PolarHBondContact O-N 2.99Å; E331-H333 VanDerWaalsContact C-N 3.29Å; E331-H333 PolarHBondContact O-N 3.44Å; E331-H333 VanDerWaalsContact O-N 3.17Å; E331-C334 WeakPolarHBondContact O-CB 3.38Å; E331-C334 PolarHBondContact O-N 2.97Å; E331-C334 PolarHBondContact O-SG 2.9Å
332	N	84.9	Confident	75.5	Confident	106 Å²	106	93.2 Å²	93.2	57%	0.567	45%	0.448	S	S	*	.	H	α-helix	trans	-62.7	-26	-172.8	-84	-18.1	0	0	0	115.3	P328	P328-N332 WeakPolarHBondContact O-CB 3.47Å; P328-N332 PolarHBondContact O-N 3.01Å; P328-N332 PolarHBondContact O-ND2 3.3Å; P328-N332 VanDerWaalsContact O-ND2 3.16Å
333	H	78.3	Confident	73.6	Confident	144 Å²	144	98.6 Å²	98.6	67%	0.667	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	9.5	-176	-65.6	104.4	0	0	0	113.8	E331 K335	E331-H333 VanDerWaalsContact C-N 3.29Å; E331-H333 PolarHBondContact O-N 3.44Å; E331-H333 VanDerWaalsContact O-N 3.17Å; H333-K335 PolarHBondContact O-N 3.36Å; H333-K335 VanDerWaalsContact O-N 3.17Å
334	C	82.1	Confident	71.4	Confident	36 Å²	36	103.7 Å²	103.7	24%	0.243	49%	0.493	C	S	.	.			trans	-72.3	108.1	-179.4	-60.7	0	0	0	0	111.4	C319 D330 E331 E336	C319-C334 WeakPolarHBondContact CA-SG 3.42Å; C319-C334 HydrophobicContact CB-CB 3.83Å; C319-C334 WeakPolarHBondContact CB-SG 3.47Å; C319-C334 VanDerWaalsContact SG-CA 3.5Å; C319-C334 WeakPolarHBondContact SG-CB 3.42Å; C319-C334 CovalentContact SG-SG 2.02Å; C319-C334 PolarHBondContact SG-SG 2.94Å; D330-C334 PolarHBondContact O-SG 3.22Å; E331-C334 WeakPolarHBondContact O-CB 3.38Å; E331-C334 PolarHBondContact O-N 2.97Å; E331-C334 PolarHBondContact O-SG 2.9Å; C334-E336 PolarHBondContact O-N 3.21Å; C334-E336 VanDerWaalsContact O-N 3.1Å
335	K	71.6	Confident	69.2	Low	197 Å²	197	111.8 Å²	111.8	86%	0.857	53%	0.531	S	S	*	.			trans	-53.4	119.5	163.6	-68.2	178.3	-179.4	175.2	0	107.6	H333 K337	H333-K335 PolarHBondContact O-N 3.36Å; H333-K335 VanDerWaalsContact O-N 3.17Å; K335-K337 VanDerWaalsContact C-N 3.32Å; K335-K337 PolarHBondContact O-N 3.42Å
336	E	58.5	Low	67.4	Low	141 Å²	141	115.1 Å²	115.1	66%	0.659	55%	0.548	S	S	*	.			trans	-51.3	89.6	-172.9	-81.5	-160.9	147.6	0	0	112.7	C334 R338	C334-E336 PolarHBondContact O-N 3.21Å; C334-E336 VanDerWaalsContact O-N 3.1Å; E336-R338 HydrophobicContact CB-CG 4.28Å; E336-R338 HydrophobicContact CG-CG 4.36Å; E336-R338 PolarHBondContact O-N 3.19Å; E336-R338 IonicContact OE1-CZ 3.55Å; E336-R338 IonicContact OE1-NE 3.87Å; E336-R338 PolarHBondContact OE1-NE 3.07Å; E336-R338 IonicContact OE1-NH2 3.39Å; E336-R338 PolarHBondContact OE1-NH2 3.41Å; E336-R338 WeakPolarHBondContact OE2-CD 3.44Å; E336-R338 IonicContact OE2-CZ 3.56Å; E336-R338 IonicContact OE2-NE 2.66Å; E336-R338 PolarHBondContact OE2-NE 3.03Å
337	K	51.8	Low	65.8	Low	208 Å²	208	116.8 Å²	116.8	90%	0.904	56%	0.559	S	S	*	*			trans	-75.7	60.2	144.3	-77.4	-172.8	179.4	175.2	0	107.8	K335 S339	K335-K337 VanDerWaalsContact C-N 3.32Å; K335-K337 PolarHBondContact O-N 3.42Å; K337-S339 VanDerWaalsContact C-N 3.33Å; K337-S339 PolarHBondContact O-N 2.71Å
338	R	49.1	Very low	64.3	Low	180 Å²	180	118.5 Å²	118.5	68%	0.679	57%	0.569	S	S	*	*			trans	-49.4	113.1	144.4	-80.7	-174.8	-172.9	-148.2	-0.7	105	E336 K340	E336-R338 HydrophobicContact CB-CG 4.28Å; E336-R338 HydrophobicContact CG-CG 4.36Å; E336-R338 PolarHBondContact O-N 3.19Å; E336-R338 IonicContact OE1-CZ 3.55Å; E336-R338 IonicContact OE1-NE 3.87Å; E336-R338 PolarHBondContact OE1-NE 3.07Å; E336-R338 IonicContact OE1-NH2 3.39Å; E336-R338 PolarHBondContact OE1-NH2 3.41Å; E336-R338 WeakPolarHBondContact OE2-CD 3.44Å; E336-R338 IonicContact OE2-CZ 3.56Å; E336-R338 IonicContact OE2-NE 2.66Å; E336-R338 PolarHBondContact OE2-NE 3.03Å; R338-K340 PolarHBondContact O-N 2.9Å
339	S	49	Very low	62.9	Low	107 Å²	107	120.2 Å²	120.2	75%	0.748	58%	0.579	S	S	*	*			trans	-52.1	120.9	158.9	54.7	0	0	0	0	104.9	K337 G341	K337-S339 VanDerWaalsContact C-N 3.33Å; K337-S339 PolarHBondContact O-N 2.71Å; S339-G341 PolarHBondContact O-N 3.06Å
340	K	47.2	Very low	61.6	Low	200 Å²	200	120.8 Å²	120.8	87%	0.87	59%	0.586	S	S	*	*			trans	-69.7	84	173.8	-75.9	-174.9	178.5	178.8	0	105.3	R338 L342	R338-K340 PolarHBondContact O-N 2.9Å; K340-L342 PolarHBondContact O-N 3.44Å
341	G	44.4	Very low	60.4	Low	32 Å²	32	122.8 Å²	122.8	33%	0.33	61%	0.606	S	S	.	*			trans	-52.5	139	-167	0	0	0	0	0	109.7	S339 F343 H344	S339-G341 PolarHBondContact O-N 3.06Å; G341-F343 PolarHBondContact O-N 2.85Å; G341-H344 PolarHBondContact O-N 2.82Å
342	L	51.9	Low	59.4	Low	128 Å²	128	124.7 Å²	124.7	67%	0.67	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-43	-35.6	-174.4	-165.7	68.7	0	0	0	112.7	K340 H344 Q345 I346	K340-L342 PolarHBondContact O-N 3.44Å; L342-H344 PolarHBondContact O-N 2.91Å; L342-Q345 PolarHBondContact O-N 3Å; L342-I346 HydrophobicContact CG-CD1 4.33Å
343	F	51.2	Low	58.9	Low	161 Å²	161	124.3 Å²	124.3	71%	0.706	62%	0.622	S	S	*	*	H	α-helix	trans	-48.2	-41.4	171.6	-63.2	-75.6	0	0	0	116.2	G341 Q345 I346 T347	G341-F343 PolarHBondContact O-N 2.85Å; F343-Q345 PolarHBondContact O-N 3.05Å; F343-I346 WeakPolarHBondContact O-CB 3.45Å; F343-I346 PolarHBondContact O-N 3.3Å; F343-T347 WeakPolarHBondContact O-CG2 3.48Å; F343-T347 PolarHBondContact O-N 3.31Å; F343-T347 PolarHBondContact O-OG1 3.32Å
344	H	46.7	Very low	58.9	Low	151 Å²	151	122.6 Å²	122.6	70%	0.699	62%	0.617	S	S	*	*	H	α-helix	trans	-67.5	-25.7	-176.3	-164.1	74.4	0	0	0	112.7	G341 L342 T347	G341-H344 PolarHBondContact O-N 2.82Å; L342-H344 PolarHBondContact O-N 2.91Å; H344-T347 WeakPolarHBondContact CA-OG1 3.49Å; H344-T347 PolarHBondContact O-OG1 3.15Å; H344-T347 VanDerWaalsContact O-OG1 3.05Å
345	Q	49.3	Very low	58.6	Low	169 Å²	169	122.9 Å²	122.9	79%	0.79	63%	0.626	S	S	*	*	H	α-helix	trans	-78.4	-23.8	173.7	-160	167	-2	0	0	112.2	L342 F343	L342-Q345 PolarHBondContact O-N 3Å; F343-Q345 PolarHBondContact O-N 3.05Å
346	I	55.1	Low	59.2	Low	70 Å²	70	117.9 Å²	117.9	36%	0.359	61%	0.612	S	S	.	*	H	α-helix	trans	-85.4	-34.6	178.7	-63.8	170.8	0	0	0	111.5	L342 F343 K348 H350	L342-I346 HydrophobicContact CG-CD1 4.33Å; F343-I346 WeakPolarHBondContact O-CB 3.45Å; F343-I346 PolarHBondContact O-N 3.3Å; I346-K348 VanDerWaalsContact C-N 3.34Å; I346-K348 PolarHBondContact O-N 3.37Å; I346-K348 VanDerWaalsContact O-N 3.15Å; I346-H350 HydrophobicContact CG2-CB 3.9Å; I346-H350 WeakPolarHBondContact O-CB 3.46Å; I346-H350 PolarHBondContact O-CD2 3.23Å; I346-H350 PolarHBondContact O-N 3.26Å; I346-H350 VanDerWaalsContact O-N 3.15Å
347	T	58.4	Low	60.3	Low	85 Å²	85	114.1 Å²	114.1	52%	0.521	60%	0.601	S	S	.	*	H	α-helix	trans	-59.6	-31.6	-167.2	34.7	0	0	0	0	116.1	F343 H344 G351	F343-T347 WeakPolarHBondContact O-CG2 3.48Å; F343-T347 PolarHBondContact O-N 3.31Å; F343-T347 PolarHBondContact O-OG1 3.32Å; H344-T347 WeakPolarHBondContact CA-OG1 3.49Å; H344-T347 PolarHBondContact O-OG1 3.15Å; H344-T347 VanDerWaalsContact O-OG1 3.05Å; T347-G351 PolarHBondContact O-N 3.15Å
348	K	59.2	Low	61.9	Low	184 Å²	184	107.3 Å²	107.3	80%	0.8	58%	0.58	S	S	*	*	H	α-helix	trans	-84.9	-27	-170.2	-158.1	170.5	-174.5	178.1	0	114.4	I346 T352	I346-K348 VanDerWaalsContact C-N 3.34Å; I346-K348 PolarHBondContact O-N 3.37Å; I346-K348 VanDerWaalsContact O-N 3.15Å; K348-T352 PolarHBondContact O-OG1 2.9Å
349	T	61	Low	63.7	Low	81 Å²	81	100.3 Å²	100.3	50%	0.497	56%	0.563	S	S	.	*	H	α-helix	trans	-99.8	-43.4	178.4	46.4	0	0	0	0	112	T352 V353	T349-T352 PolarHBondContact O-OG1 3.38Å; T349-V353 WeakPolarHBondContact O-CG2 3.37Å; T349-V353 PolarHBondContact O-N 3.01Å
350	H	62.2	Low	65.7	Low	106 Å²	106	99.9 Å²	99.9	49%	0.491	55%	0.552	S	S	.	*	H	α-helix	trans	-75.5	-32.7	-179.3	-64.4	-97.1	0	0	0	111.7	I346 T352 V353 I354	I346-H350 HydrophobicContact CG2-CB 3.9Å; I346-H350 WeakPolarHBondContact O-CB 3.46Å; I346-H350 PolarHBondContact O-CD2 3.23Å; I346-H350 PolarHBondContact O-N 3.26Å; I346-H350 VanDerWaalsContact O-N 3.15Å; H350-T352 PolarHBondContact O-N 3.25Å; H350-V353 PolarHBondContact O-N 3.32Å; H350-I354 WeakPolarHBondContact O-CB 3.46Å; H350-I354 WeakPolarHBondContact O-CD1 3.37Å; H350-I354 WeakPolarHBondContact O-CG1 3.22Å; H350-I354 PolarHBondContact O-N 3.47Å
351	G	64.5	Low	67.8	Low	42 Å²	42	94.4 Å²	94.4	43%	0.433	54%	0.535	S	S	.	.	H	α-helix	trans	-62.1	-40.2	175.7	0	0	0	0	0	113.4	T347 G355	T347-G351 PolarHBondContact O-N 3.15Å; G351-G355 PolarHBondContact O-N 2.97Å
352	T	70.3	Confident	70	Confident	91 Å²	91	97.8 Å²	97.8	56%	0.558	55%	0.545	S	S	*	.	H	α-helix	trans	-72.6	-39.8	176.1	46.9	0	0	0	0	112.2	K348 T349 H350 G355 V356	K348-T352 PolarHBondContact O-OG1 2.9Å; T349-T352 PolarHBondContact O-OG1 3.38Å; H350-T352 PolarHBondContact O-N 3.25Å; T352-G355 PolarHBondContact O-N 3.38Å; T352-V356 WeakPolarHBondContact O-CB 3.49Å; T352-V356 WeakPolarHBondContact O-CG2 3.33Å; T352-V356 PolarHBondContact O-N 3.39Å
353	V	75.8	Confident	71.9	Confident	97 Å²	97	95.6 Å²	95.6	59%	0.588	54%	0.537	S	S	*	.	H	α-helix	trans	-62.6	-41.6	174.5	170.5	0	0	0	0	112	T349 H350 S357	T349-V353 WeakPolarHBondContact O-CG2 3.37Å; T349-V353 PolarHBondContact O-N 3.01Å; H350-V353 PolarHBondContact O-N 3.32Å; V353-S357 WeakPolarHBondContact O-CB 3.34Å; V353-S357 PolarHBondContact O-N 2.67Å; V353-S357 PolarHBondContact O-OG 3.17Å; V353-S357 VanDerWaalsContact O-OG 3.09Å
354	I	76.9	Confident	73.6	Confident	108 Å²	108	92.7 Å²	92.7	55%	0.554	53%	0.528	S	S	*	.	H	α-helix	trans	-69.7	-40.3	177.2	-68	165.4	0	0	0	111.2	H350 S357 S358	H350-I354 WeakPolarHBondContact O-CB 3.46Å; H350-I354 WeakPolarHBondContact O-CD1 3.37Å; H350-I354 WeakPolarHBondContact O-CG1 3.22Å; H350-I354 PolarHBondContact O-N 3.47Å; I354-S357 PolarHBondContact O-OG 3.08Å; I354-S358 WeakPolarHBondContact O-CB 3.4Å; I354-S358 PolarHBondContact O-N 3.03Å; I354-S358 PolarHBondContact O-OG 3.02Å
355	G	77.6	Confident	75.7	Confident	42 Å²	42	90.4 Å²	90.4	43%	0.433	52%	0.52	S	S	.	.	H	α-helix	trans	-61.9	-43	174.3	0	0	0	0	0	113.4	G351 T352 S358 G359	G351-G355 PolarHBondContact O-N 2.97Å; T352-G355 PolarHBondContact O-N 3.38Å; G355-S358 PolarHBondContact O-OG 3Å; G355-G359 PolarHBondContact O-N 2.94Å; G355-G359 VanDerWaalsContact O-N 3.08Å
356	V	82.8	Confident	77.6	Confident	93 Å²	93	86.6 Å²	86.6	56%	0.564	50%	0.504	S	S	*	.	H	α-helix	trans	-70.3	-43.8	178	171.7	0	0	0	0	111.8	T352 G359 I360	T352-V356 WeakPolarHBondContact O-CB 3.49Å; T352-V356 WeakPolarHBondContact O-CG2 3.33Å; T352-V356 PolarHBondContact O-N 3.39Å; V356-G359 PolarHBondContact O-N 3.33Å; V356-I360 HydrophobicContact CG1-CD1 3.82Å; V356-I360 WeakPolarHBondContact O-CG1 3.4Å; V356-I360 PolarHBondContact O-N 3.01Å
357	S	82.7	Confident	79.1	Confident	62 Å²	62	87.4 Å²	87.4	43%	0.434	51%	0.508	S	S	.	.	H	α-helix	trans	-67.2	-43.7	-178.9	65.4	0	0	0	0	112.3	V353 I354 I360 V361	V353-S357 WeakPolarHBondContact O-CB 3.34Å; V353-S357 PolarHBondContact O-N 2.67Å; V353-S357 PolarHBondContact O-OG 3.17Å; V353-S357 VanDerWaalsContact O-OG 3.09Å; I354-S357 PolarHBondContact O-OG 3.08Å; S357-I360 PolarHBondContact O-N 3.33Å; S357-V361 WeakPolarHBondContact O-CG2 3.4Å; S357-V361 PolarHBondContact O-N 3.37Å
358	S	84.9	Confident	80.4	Confident	65 Å²	65	86.1 Å²	86.1	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-62.7	-40.8	174	55.6	0	0	0	0	112.3	I354 G355 V361 L362	I354-S358 WeakPolarHBondContact O-CB 3.4Å; I354-S358 PolarHBondContact O-N 3.03Å; I354-S358 PolarHBondContact O-OG 3.02Å; G355-S358 PolarHBondContact O-OG 3Å; S358-V361 PolarHBondContact O-N 3.23Å; S358-L362 WeakPolarHBondContact O-CB 3.41Å; S358-L362 PolarHBondContact O-N 3.09Å
359	G	86.9	Confident	81.6	Confident	32 Å²	32	82 Å²	82	33%	0.33	49%	0.489	S	S	.	.	H	α-helix	trans	-59.4	-45.1	174.2	0	0	0	0	0	113.2	G355 V356 L362 V363	G355-G359 PolarHBondContact O-N 2.94Å; G355-G359 VanDerWaalsContact O-N 3.08Å; V356-G359 PolarHBondContact O-N 3.33Å; G359-L362 PolarHBondContact O-N 3.35Å; G359-V363 WeakPolarHBondContact O-CG2 3.4Å; G359-V363 PolarHBondContact O-N 3.29Å
360	I	91.2	Very high	82.5	Confident	98 Å²	98	83.1 Å²	83.1	50%	0.503	49%	0.491	S	S	.	.	H	α-helix	trans	-62.9	-45.4	177.1	-69.1	165.2	0	0	0	111.1	V356 S357 L362 V363 L364	V356-I360 HydrophobicContact CG1-CD1 3.82Å; V356-I360 WeakPolarHBondContact O-CG1 3.4Å; V356-I360 PolarHBondContact O-N 3.01Å; S357-I360 PolarHBondContact O-N 3.33Å; I360-L362 VanDerWaalsContact C-N 3.32Å; I360-L362 PolarHBondContact O-N 3.42Å; I360-V363 PolarHBondContact O-N 3.06Å; I360-L364 HydrophobicContact CG2-CD1 4.01Å; I360-L364 HydrophobicContact CG2-CG 4.49Å; I360-L364 WeakPolarHBondContact O-CG 3.42Å; I360-L364 PolarHBondContact O-N 2.93Å
361	V	91.1	Very high	83.3	Confident	85 Å²	85	82.1 Å²	82.1	52%	0.515	49%	0.492	S	S	.	.	H	α-helix	trans	-60.3	-42.1	177	170.8	0	0	0	0	111.3	S357 S358 L364 L365	S357-V361 WeakPolarHBondContact O-CG2 3.4Å; S357-V361 PolarHBondContact O-N 3.37Å; S358-V361 PolarHBondContact O-N 3.23Å; V361-L364 PolarHBondContact O-N 2.98Å; V361-L365 HydrophobicContact CG1-CD1 4.15Å; V361-L365 WeakPolarHBondContact O-CG 3.37Å; V361-L365 PolarHBondContact O-N 3.38Å
362	L	89.6	Confident	83.5	Confident	104 Å²	104	87 Å²	87	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-66.6	-39.7	-179.9	-155.7	157.4	0	0	0	111.6	S358 G359 I360 L365 I366	S358-L362 WeakPolarHBondContact O-CB 3.41Å; S358-L362 PolarHBondContact O-N 3.09Å; G359-L362 PolarHBondContact O-N 3.35Å; I360-L362 VanDerWaalsContact C-N 3.32Å; I360-L362 PolarHBondContact O-N 3.42Å; L362-L365 PolarHBondContact O-N 2.96Å; L362-I366 HydrophobicContact CD2-CD1 3.62Å; L362-I366 HydrophobicContact CD2-CG1 4.25Å; L362-I366 WeakPolarHBondContact O-CG1 3.41Å; L362-I366 PolarHBondContact O-N 3.02Å
363	V	91.8	Very high	83.3	Confident	82 Å²	82	90 Å²	90	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-62.8	-43.9	172.1	170.4	0	0	0	0	111.8	G359 I360 L365 I366 I367	G359-V363 WeakPolarHBondContact O-CG2 3.4Å; G359-V363 PolarHBondContact O-N 3.29Å; I360-V363 PolarHBondContact O-N 3.06Å; V363-L365 VanDerWaalsContact C-N 3.32Å; V363-L365 PolarHBondContact O-N 3.48Å; V363-I366 PolarHBondContact O-N 3.24Å; V363-I367 HydrophobicContact CG1-CD1 3.83Å; V363-I367 HydrophobicContact CG1-CG1 4.48Å; V363-I367 WeakPolarHBondContact O-CG1 3.43Å; V363-I367 PolarHBondContact O-N 3.43Å
364	L	88.6	Confident	82.7	Confident	99 Å²	99	94.2 Å²	94.2	52%	0.518	52%	0.524	S	S	.	.	H	α-helix	trans	-64.4	-35	177.5	-70.8	171.3	0	0	0	112.7	I360 V361 S368	I360-L364 HydrophobicContact CG2-CD1 4.01Å; I360-L364 HydrophobicContact CG2-CG 4.49Å; I360-L364 WeakPolarHBondContact O-CG 3.42Å; I360-L364 PolarHBondContact O-N 2.93Å; V361-L364 PolarHBondContact O-N 2.98Å; L364-S368 WeakPolarHBondContact O-CB 3.32Å; L364-S368 PolarHBondContact O-N 2.87Å; L364-S368 PolarHBondContact O-OG 3.41Å
365	L	90	Very high	81.7	Confident	103 Å²	103	95.7 Å²	95.7	54%	0.539	53%	0.528	S	S	.	.	H	α-helix	trans	-66.3	-44.2	172.2	-73.4	169.8	0	0	0	111.8	V361 L362 V363 I367 S368 I369	V361-L365 HydrophobicContact CG1-CD1 4.15Å; V361-L365 WeakPolarHBondContact O-CG 3.37Å; V361-L365 PolarHBondContact O-N 3.38Å; L362-L365 PolarHBondContact O-N 2.96Å; V363-L365 VanDerWaalsContact C-N 3.32Å; V363-L365 PolarHBondContact O-N 3.48Å; L365-I367 PolarHBondContact O-N 2.76Å; L365-S368 WeakPolarHBondContact O-CB 3.49Å; L365-S368 PolarHBondContact O-N 2.94Å; L365-I369 WeakPolarHBondContact O-CG1 3.34Å; L365-I369 PolarHBondContact O-N 3.27Å
366	I	88.7	Confident	80.4	Confident	89 Å²	89	99.4 Å²	99.4	46%	0.456	55%	0.545	S	S	.	.	H	α-helix	trans	-60	-46.3	175.2	-70.3	169.4	0	0	0	110.8	L362 V363 S368 I369 L370	L362-I366 HydrophobicContact CD2-CD1 3.62Å; L362-I366 HydrophobicContact CD2-CG1 4.25Å; L362-I366 WeakPolarHBondContact O-CG1 3.41Å; L362-I366 PolarHBondContact O-N 3.02Å; V363-I366 PolarHBondContact O-N 3.24Å; I366-S368 VanDerWaalsContact C-N 3.32Å; I366-S368 PolarHBondContact O-N 3.22Å; I366-I369 PolarHBondContact O-N 2.95Å; I366-L370 HydrophobicContact CG2-CD1 3.9Å; I366-L370 HydrophobicContact CG2-CG 4.4Å; I366-L370 WeakPolarHBondContact O-CG 3.35Å; I366-L370 PolarHBondContact O-N 2.98Å
367	I	87.4	Confident	79	Confident	87 Å²	87	106.7 Å²	106.7	45%	0.446	56%	0.562	S	S	.	*	H	α-helix	trans	-59.1	-43.9	176.1	-68.6	166.4	0	0	0	110.8	V363 L365 I369 L370 V371	V363-I367 HydrophobicContact CG1-CD1 3.83Å; V363-I367 HydrophobicContact CG1-CG1 4.48Å; V363-I367 WeakPolarHBondContact O-CG1 3.43Å; V363-I367 PolarHBondContact O-N 3.43Å; L365-I367 PolarHBondContact O-N 2.76Å; I367-I369 PolarHBondContact O-N 3.44Å; I367-L370 PolarHBondContact O-N 3.49Å; I367-V371 HydrophobicContact CG2-CG2 4.48Å; I367-V371 WeakPolarHBondContact O-CG2 3.34Å; I367-V371 PolarHBondContact O-N 2.92Å
368	S	84.3	Confident	77.4	Confident	59 Å²	59	113.1 Å²	113.1	41%	0.413	58%	0.583	S	S	.	*	H	α-helix	trans	-61.9	-41.8	178.3	-59.2	0	0	0	0	112.4	L364 L365 I366 V371 Q372	L364-S368 WeakPolarHBondContact O-CB 3.32Å; L364-S368 PolarHBondContact O-N 2.87Å; L364-S368 PolarHBondContact O-OG 3.41Å; L365-S368 WeakPolarHBondContact O-CB 3.49Å; L365-S368 PolarHBondContact O-N 2.94Å; I366-S368 VanDerWaalsContact C-N 3.32Å; I366-S368 PolarHBondContact O-N 3.22Å; S368-V371 PolarHBondContact O-N 3.44Å; S368-Q372 WeakPolarHBondContact O-CG 3.36Å; S368-Q372 PolarHBondContact O-N 2.96Å
369	I	85.3	Confident	75.9	Confident	96 Å²	96	119.8 Å²	119.8	49%	0.492	60%	0.603	S	S	.	*	H	α-helix	trans	-64.4	-44.7	175.6	-68.5	163.6	0	0	0	110.6	L365 I366 I367 V371 Q372 M373	L365-I369 WeakPolarHBondContact O-CG1 3.34Å; L365-I369 PolarHBondContact O-N 3.27Å; I366-I369 PolarHBondContact O-N 2.95Å; I367-I369 PolarHBondContact O-N 3.44Å; I369-V371 VanDerWaalsContact C-N 3.34Å; I369-V371 PolarHBondContact O-N 3.43Å; I369-Q372 PolarHBondContact O-N 3.27Å; I369-M373 HydrophobicContact CG2-CG 4.5Å; I369-M373 HydrophobicContact CG2-SD 4.47Å; I369-M373 WeakPolarHBondContact O-CG 3.35Å; I369-M373 PolarHBondContact O-N 3.46Å
370	L	79.5	Confident	73.9	Confident	106 Å²	106	124.8 Å²	124.8	56%	0.555	63%	0.627	S	S	*	*	H	α-helix	trans	-63.5	-37.8	177.8	-70.3	171.6	0	0	0	112.4	I366 I367 M373 K374	I366-L370 HydrophobicContact CG2-CD1 3.9Å; I366-L370 HydrophobicContact CG2-CG 4.4Å; I366-L370 WeakPolarHBondContact O-CG 3.35Å; I366-L370 PolarHBondContact O-N 2.98Å; I367-L370 PolarHBondContact O-N 3.49Å; L370-M373 PolarHBondContact O-N 3.23Å; L370-K374 WeakPolarHBondContact O-CB 3.4Å; L370-K374 PolarHBondContact O-N 3.07Å; L370-K374 VanDerWaalsContact O-N 3.07Å
371	V	78.6	Confident	71.6	Confident	85 Å²	85	126.5 Å²	126.5	52%	0.515	64%	0.642	S	S	.	*	H	α-helix	trans	-64.6	-44.1	173.2	169.5	0	0	0	0	111.2	I367 S368 I369 M373 K374	I367-V371 HydrophobicContact CG2-CG2 4.48Å; I367-V371 WeakPolarHBondContact O-CG2 3.34Å; I367-V371 PolarHBondContact O-N 2.92Å; S368-V371 PolarHBondContact O-N 3.44Å; I369-V371 VanDerWaalsContact C-N 3.34Å; I369-V371 PolarHBondContact O-N 3.43Å; V371-M373 PolarHBondContact O-N 3.01Å; V371-K374 PolarHBondContact O-N 3.24Å
372	Q	69.3	Low	69.6	Low	144 Å²	144	127 Å²	127	67%	0.673	66%	0.655	S	S	*	*	H	α-helix	trans	-64	-38.3	175.9	-71.7	176.4	15.8	0	0	112.4	S368 I369 K374	S368-Q372 WeakPolarHBondContact O-CG 3.36Å; S368-Q372 PolarHBondContact O-N 2.96Å; I369-Q372 PolarHBondContact O-N 3.27Å; Q372-K374 VanDerWaalsContact C-N 3.31Å; Q372-K374 PolarHBondContact O-N 3.46Å
373	M	67.1	Low	66.9	Low	155 Å²	155	133.9 Å²	133.9	76%	0.764	67%	0.674	S	S	*	*	H	α-helix	trans	-69.4	-25.7	175.6	-73.4	-165.7	70.4	0	0	113.6	I369 L370 V371	I369-M373 HydrophobicContact CG2-CG 4.5Å; I369-M373 HydrophobicContact CG2-SD 4.47Å; I369-M373 WeakPolarHBondContact O-CG 3.35Å; I369-M373 PolarHBondContact O-N 3.46Å; L370-M373 PolarHBondContact O-N 3.23Å; V371-M373 PolarHBondContact O-N 3.01Å
374	K	61.7	Low	64.4	Low	184 Å²	184	141.1 Å²	141.1	80%	0.8	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-5.8	-178.2	-157.6	169.1	-176.5	178.7	0	113.9	L370 V371 Q372 P376	L370-K374 WeakPolarHBondContact O-CB 3.4Å; L370-K374 PolarHBondContact O-N 3.07Å; L370-K374 VanDerWaalsContact O-N 3.07Å; V371-K374 PolarHBondContact O-N 3.24Å; Q372-K374 VanDerWaalsContact C-N 3.31Å; Q372-K374 PolarHBondContact O-N 3.46Å; K374-P376 WeakPolarHBondContact O-CD 3.46Å
375	Q	57.3	Low	63	Low	139 Å²	139	142.5 Å²	142.5	65%	0.65	71%	0.707	S	S	*	*	S	Bend	trans	-79.1	119.5	171.3	-66.7	-167.1	5.8	0	0	111	R377	Q375-R377 PolarHBondContact O-N 2.94Å; Q375-R377 VanDerWaalsContact O-N 3.12Å
376	P	48.8	Very low	60.3	Low	120 Å²	120	140.7 Å²	140.7	78%	0.779	71%	0.713	S	S	*	*			trans	-69.5	112.7	179.7	27.5	-33.4	0	0	0	110.5	K374 K378	K374-P376 WeakPolarHBondContact O-CD 3.46Å; P376-K378 PolarHBondContact O-N 3.12Å
377	R	54.3	Low	57.8	Low	246 Å²	246	142.8 Å²	142.8	93%	0.928	73%	0.73	S	S	*	*			trans	-56.9	104	176.8	-66.9	-178.2	179.3	-178.6	-0.4	110.4	Q375 K379	Q375-R377 PolarHBondContact O-N 2.94Å; Q375-R377 VanDerWaalsContact O-N 3.12Å; R377-K379 PolarHBondContact O-N 3.41Å
378	K	48.9	Very low	55.2	Low	198 Å²	198	147.6 Å²	147.6	86%	0.861	75%	0.748	S	S	*	*			trans	-61.3	108.1	170.9	-74.7	-173.6	176.7	-179.1	0	109	P376 V380	P376-K378 PolarHBondContact O-N 3.12Å; K378-V380 PolarHBondContact O-N 3.03Å
379	K	52.6	Low	52.7	Low	205 Å²	205	151.7 Å²	151.7	89%	0.891	77%	0.765	S	S	*	*			trans	-66.2	124.2	171.5	-65.4	178.5	179.7	178.3	0	108.5	R377	R377-K379 PolarHBondContact O-N 3.41Å
380	V	44.8	Very low	50.5	Low	136 Å²	136	156.6 Å²	156.6	82%	0.824	78%	0.783	S	S	*	*			trans	-112.4	134.6	169.2	-178.8	0	0	0	0	108.4	K378	K378-V380 PolarHBondContact O-N 3.03Å
381	V	44.9	Very low	48.3	Very low	135 Å²	135	156.3 Å²	156.3	82%	0.818	80%	0.796	S	S	*	*			trans	-85.8	145	-171.6	177.2	0	0	0	0	110.7
382	A	47.9	Very low	45.9	Very low	96 Å²	96	155.8 Å²	155.8	79%	0.793	81%	0.807	S	S	*	*			trans	-88.9	132.1	176.4	0	0	0	0	0	112.3
383	R	32.2	Very low	44	Very low	248 Å²	248	158.5 Å²	158.5	94%	0.936	82%	0.817	S	S	*	*			trans	-153	143.9	158.8	-141.3	177.4	-176.8	179.8	0.5	111.6
384	R	41.2	Very low	42.2	Very low	234 Å²	234	158.4 Å²	158.4	88%	0.883	82%	0.815	S	S	*	*			trans	-109.3	-178.1	168.6	-76.1	-179.9	166.9	-176.4	-3.8	108.3
385	P	57.6	Low	40.9	Very low	128 Å²	128	156.4 Å²	156.4	83%	0.831	81%	0.809	S	S	*	*				-131.4	-174.1	-56.4	39.6	-23.9	0	0	0	111.9
386	G	33.3	Very low	39.7	Very low	64 Å²	64	154.7 Å²	154.7	66%	0.66	81%	0.807	S	S	*	*			trans	120	118.3	170.8	0	0	0	0	0	112.4
387	V	37.8	Very low	38.7	Very low	134 Å²	134	158.4 Å²	158.4	81%	0.812	81%	0.811	S	S	*	*				83.7	148.4	67.7	171.7	0	0	0	0	112
388	F	32	Very low	37.6	Very low	188 Å²	188	153.3 Å²	153.3	83%	0.825	80%	0.803	S	S	*	*			trans	82.8	134.3	-165.1	-70.5	-93.9	0	0	0	115
389	N	31.5	Very low	37.9	Very low	145 Å²	145	148.2 Å²	148.2	78%	0.775	79%	0.79	S	S	*	*			cis	-154.2	175.2	-12.3	-151.4	4.5	0	0	0	113.3
390	K	39.3	Very low	38.1	Very low	198 Å²	198	144.2 Å²	144.2	86%	0.861	79%	0.785	S	S	*	*			trans	-125.9	119.6	177.7	171.7	-173.4	175.6	-177.7	0	111.6
391	A	33.1	Very low	37.5	Very low	100 Å²	100	145 Å²	145	83%	0.826	78%	0.78	S	S	*	*			trans	-168.4	154	167.6	0	0	0	0	0	112.4
392	G	29.1	Very low	36.9	Very low	74 Å²	74	147 Å²	147	76%	0.763	77%	0.774	S	S	*	*			trans	78.3	113.9	176.6	0	0	0	0	0	113.8
393	F	27.9	Very low	36.6	Very low	202 Å²	202	149 Å²	149	89%	0.886	77%	0.766	S	S	*	*			cis	76.5	87.9	19.3	-108.5	-73.6	0	0	0	116.2
394	Q	29	Very low	37.1	Very low	152 Å²	152	144.1 Å²	144.1	71%	0.71	76%	0.758	S	S	*	*			trans	178.6	166.3	133.1	-148.4	61.9	26.1	0	0	108
395	E	34.7	Very low	36.4	Very low	143 Å²	143	142.6 Å²	142.6	67%	0.668	76%	0.758	S	S	*	*				-164.7	170.1	-67.8	-165.5	-176.1	-124.9	0	0	107.1
396	V	32.6	Very low	35.5	Very low	103 Å²	103	141.2 Å²	141.2	62%	0.624	75%	0.752	S	S	*	*			trans	63.4	101.3	165.7	-165	0	0	0	0	118.2
397	F	28.1	Very low	35.8	Very low	197 Å²	197	145.3 Å²	145.3	86%	0.864	76%	0.758	S	S	*	*				-165.5	141	103.5	-112	-72.5	0	0	0	111.5
398	D	31.3	Very low	35.8	Very low	139 Å²	139	148.6 Å²	148.6	74%	0.743	76%	0.756	S	S	*	*			trans	-164.8	170.3	-176.2	-138.9	11.9	0	0	0	106.5
399	P	56.1	Low	35.9	Very low	91 Å²	91	145.5 Å²	145.5	59%	0.591	75%	0.747	S	S	*	*			cis	-126.6	-150	-1.6	44.1	-24.2	0	0	0	110.7
400	P	55.9	Low	35.8	Very low	122 Å²	122	147.4 Å²	147.4	79%	0.792	75%	0.749	S	S	*	*			cis	-127.2	164.4	44.6	28.2	-6	0	0	0	116.9
401	H	32.4	Very low	35.3	Very low	153 Å²	153	146 Å²	146	71%	0.708	75%	0.746	S	S	*	*			trans	-76.4	-177.2	168.6	-59.2	-116.8	0	0	0	110.8
402	Y	33	Very low	35.3	Very low	177 Å²	177	150.2 Å²	150.2	69%	0.694	75%	0.75	S	S	*	*			cis	-162.2	-174.7	15.9	-146.2	17	0	0	0	108.2
403	E	39.9	Very low	35.4	Very low	136 Å²	136	151.9 Å²	151.9	64%	0.636	75%	0.75	S	S	*	*			cis	-144.6	-135.8	6.1	-169.5	152.8	-166.9	0	0	110.1
404	L	43.5	Very low	35.5	Very low	146 Å²	146	146.6 Å²	146.6	76%	0.764	74%	0.738	S	S	*	*			trans	-146.6	165.6	-176.4	-77.4	155.9	0	0	0	109.2
405	F	26.6	Very low	35.6	Very low	202 Å²	202	146 Å²	146	89%	0.886	74%	0.74	S	S	*	*			trans	-155.9	151.2	136.2	-118.2	-75.4	0	0	0	111.5
406	S	39.4	Very low	35.6	Very low	99 Å²	99	147 Å²	147	69%	0.692	75%	0.749	S	S	*	*			trans	-145.4	160.5	177.6	64.4	0	0	0	0	111.3
407	L	38.8	Very low	35.5	Very low	151 Å²	151	145.2 Å²	145.2	79%	0.791	75%	0.752	S	S	*	*			trans	133.3	113.9	172.3	-76.8	167	0	0	0	108.3
408	R	38.5	Very low	35.7	Very low	203 Å²	203	143.1 Å²	143.1	77%	0.766	75%	0.749	S	S	*	*				101.8	140.9	73.5	-173.3	164	-172.7	139.7	15.6	109
409	D	33.4	Very low	35.6	Very low	122 Å²	122	143.8 Å²	143.8	65%	0.652	75%	0.752	S	S	*	*			cis	-153.9	-178.2	30.1	-133.9	-24.8	0	0	0	113.2
410	K	28.7	Very low	34.5	Very low	186 Å²	186	144.9 Å²	144.9	81%	0.809	76%	0.762	S	S	*	*			trans	98.5	162.1	151.4	-133.5	160.9	-173.2	172.9	0	121
411	E	29.4	Very low	33.6	Very low	169 Å²	169	148.2 Å²	148.2	79%	0.79	77%	0.767	S	S	*	*			trans	-124.7	-178.5	-144.4	-54.8	158.9	109.3	0	0	114.8
412	M	32.2	Very low	33.6	Very low	188 Å²	188	150 Å²	150	93%	0.926	78%	0.775	S	S	*	*			trans	86.2	130.3	162.8	-160.3	174.3	-63.3	0	0	115.9
413	S	32.4	Very low	33.6	Very low	109 Å²	109	148.9 Å²	148.9	76%	0.762	78%	0.781	S	S	*	*			cis	-136.9	175.3	-0.6	64.3	0	0	0	0	113
414	S	29.4	Very low	33.2	Very low	90 Å²	90	150.2 Å²	150.2	63%	0.629	79%	0.793	S	S	*	*			trans	-74.4	166.7	166	55.2	0	0	0	0	113
415	D	31	Very low	32.5	Very low	139 Å²	139	147.8 Å²	147.8	74%	0.743	79%	0.787	S	S	*	*				-164.4	155	102.2	-97.4	4.7	0	0	0	114.1
416	L	34.1	Very low	32.8	Very low	165 Å²	165	146.8 Å²	146.8	86%	0.864	78%	0.783	S	S	*	*			trans	26.9	113.3	175.4	-92.1	64.5	0	0	0	119
417	G	32.1	Very low	32.5	Very low	66 Å²	66	151.5 Å²	151.5	68%	0.68	79%	0.794	S	S	*	*			trans	-101.4	159.1	133	0	0	0	0	0	109.1
418	D	30.6	Very low	32.1	Very low	153 Å²	153	154 Å²	154	82%	0.818	80%	0.798	S	S	*	*			trans	-156.5	144.6	131.3	-117.7	-20.1	0	0	0	113.3
419	L	29.6	Very low	31.8	Very low	152 Å²	152	150.8 Å²	150.8	80%	0.796	80%	0.801	S	S	*	*			trans	26	110.3	160.3	-57.7	175	0	0	0	120.3
420	S	34.3	Very low	31.7	Very low	115 Å²	115	154.9 Å²	154.9	80%	0.804	81%	0.807	S	S	*	*			trans	-69.2	122.6	145.6	55.5	0	0	0	0	111.4
421	E	36.5	Very low	31.9	Very low	192 Å²	192	155.9 Å²	155.9	90%	0.897	81%	0.806	S	S	*	*			trans	-158.8	157.7	144.7	-120.9	168.3	-158.6	0	0	111.5
422	E	32.9	Very low	32	Very low	189 Å²	189	153.5 Å²	153.5	88%	0.883	81%	0.808	S	S	*	*	S	Bend	trans	72.7	149.4	177.8	-156.7	155.9	-130.8	0	0	119
423	L	32.1	Very low	32	Very low	155 Å²	155	149.8 Å²	149.8	81%	0.812	80%	0.801	S	S	*	*			trans	68.6	58.3	168.6	-146.5	78.4	0	0	0	120.9
424	D	30.8	Very low	32	Very low	164 Å²	164	150.8 Å²	150.8	88%	0.877	80%	0.802	S	S	*	*			trans	-137.8	98	146.5	-159.7	-5.7	0	0	0	111.8
425	S	29.7	Very low	32.1	Very low	94 Å²	94	154.9 Å²	154.9	66%	0.657	81%	0.813	S	S	*	*			trans	-133.4	20.7	-165.1	60.6	0	0	0	0	115.3
426	F	32.8	Very low	32.3	Very low	182 Å²	182	152.8 Å²	152.8	80%	0.798	81%	0.81	S	S	*	*			trans	-125.6	61.6	-175.4	-92.7	-73.9	0	0	0	116.1
427	H	34.1	Very low	32.4	Very low	197 Å²	197	156.2 Å²	156.2	91%	0.912	81%	0.811	S	S	*	*			trans	-152.8	73.2	157.7	-93.3	-31.6	0	0	0	116.4
428	K	30.2	Very low	32.5	Very low	204 Å²	204	159.2 Å²	159.2	89%	0.887	82%	0.821	S	S	*	*			trans	-154.8	136.4	163.4	-99.2	-173.1	-177.3	169.3	0	108.4
429	V	31.6	Very low	32.6	Very low	136 Å²	136	157.8 Å²	157.8	82%	0.824	82%	0.817	S	S	*	*			cis	-134.5	157.5	-0.2	172.6	0	0	0	0	110.8
430	R	31.3	Very low	32.7	Very low	208 Å²	208	158.6 Å²	158.6	79%	0.785	82%	0.817	S	S	*	*			trans	-73.7	153.7	-176.7	-154.7	-175.4	-168.4	157.9	2.1	114.5
431	R	33.1	Very low	32.8	Very low	207 Å²	207	160.4 Å²	160.4	78%	0.781	81%	0.812	S	S	*	*			trans	94.7	96.2	156.8	-59	-172.9	169.6	147	-2.9	120.5
432	S	31.2	Very low	32.8	Very low	118 Å²	118	158.6 Å²	158.6	83%	0.825	80%	0.804	S	S	*	*				41.5	118.4	109	-47	0	0	0	0	121.5
433	S	31.8	Very low	33	Very low	111 Å²	111	158 Å²	158	78%	0.776	80%	0.8	S	S	*	*				-159	129.8	124.5	33	0	0	0	0	113.8
434	T	32.6	Very low	32.8	Very low	130 Å²	130	157.6 Å²	157.6	80%	0.798	81%	0.809	S	S	*	*			trans	38.1	123.6	147.5	55.4	0	0	0	0	122.8
435	M	32.3	Very low	32.8	Very low	175 Å²	175	152.5 Å²	152.5	86%	0.862	80%	0.795	S	S	*	*				80.6	110.1	125.9	-170.6	162.8	167.9	0	0	120.2
436	S	35.2	Very low	33.1	Very low	96 Å²	96	153.4 Å²	153.4	67%	0.671	80%	0.801	S	S	*	*			trans	39.8	116.7	150.8	63.7	0	0	0	0	120.4
437	R	34.8	Very low	33.2	Very low	236 Å²	236	153.6 Å²	153.6	89%	0.891	80%	0.804	S	S	*	*			trans	-117.8	109.9	151.1	-84.4	-175.4	172.1	137.6	-1.9	110.4	V439	R437-V439 HydrophobicContact CB-CG2 4.39Å
438	C	35.2	Very low	33.1	Very low	130 Å²	130	147.7 Å²	147.7	88%	0.878	80%	0.797	S	S	*	*			trans	-91.1	139.9	144.7	-61.4	0	0	0	0	106.6
439	V	32.9	Very low	33.2	Very low	123 Å²	123	143.2 Å²	143.2	75%	0.745	79%	0.792	S	S	*	*			trans	-137.4	112.5	173.9	179.7	0	0	0	0	108.4	R437	R437-V439 HydrophobicContact CB-CG2 4.39Å
440	H	32.5	Very low	33.1	Very low	169 Å²	169	143.3 Å²	143.3	78%	0.782	79%	0.792	S	S	*	*			trans	-150.4	140.9	164.2	-162.1	57.6	0	0	0	107.8
441	E	35.7	Very low	33.2	Very low	153 Å²	153	137 Å²	137	72%	0.715	79%	0.785	S	S	*	*			trans	59.1	150.6	-178.2	-63.9	-58.2	94.9	0	0	118.3
442	H	35.8	Very low	33.1	Very low	154 Å²	154	134 Å²	134	71%	0.713	79%	0.789	S	S	*	*			trans	-150.8	140.2	-178.7	-136	-101.4	0	0	0	110.7
443	H	37.1	Very low	33.1	Very low	177 Å²	177	132 Å²	132	82%	0.819	79%	0.788	S	S	*	*			trans	77.6	108.7	177.6	-53.8	-74.8	0	0	0	118.2
444	C	28.4	Very low	33.1	Very low	146 Å²	146	130.9 Å²	130.9	99%	0.986	79%	0.794	S	S	*	*			trans	-139.4	143.6	155.5	-158.3	0	0	0	0	109.5
445	G	30.9	Very low	33.1	Very low	57 Å²	57	128.6 Å²	128.6	59%	0.588	80%	0.796	S	S	*	*			trans	170.4	103.7	179.8	0	0	0	0	0	108.9
446	S	35.4	Very low	33.1	Very low	112 Å²	112	124.4 Å²	124.4	78%	0.783	80%	0.797	S	S	*	*				80	125.1	87.2	71.4	0	0	0	0	112.3
447	Q	34.8	Very low	32.9	Very low	186 Å²	186	123.8 Å²	123.8	87%	0.869	81%	0.806	S	S	*	*			cis	-132.2	159.9	5.7	-57.7	179.3	4.3	0	0	109
448	G	31.3	Very low	32.8	Very low	73 Å²	73	116.6 Å²	116.6	75%	0.753	81%	0.806	S	S	*	*				82.1	137.3	89.9	0	0	0	0	0	112.9
449	S	33.7	Very low	32.6	Very low	111 Å²	111	114.4 Å²	114.4	78%	0.776	81%	0.805	S	S	*	*			cis	-172.9	172.5	-2	54.8	0	0	0	0	111.3
450	V	30	Very low	32.4	Very low	137 Å²	137	112.8 Å²	112.8	83%	0.83	81%	0.813	S	S	*	*			trans	88	130.7	159	178.8	0	0	0	0	120.4
451	A	32	Very low	32.3	Very low	77 Å²	77	108.8 Å²	108.8	64%	0.636	82%	0.817	S	S	*	*			trans	79.8	111.3	150.5	0	0	0	0	0	123.9
452	T	31.3	Very low	32.1	Very low	142 Å²	142	106.8 Å²	106.8	87%	0.871	82%	0.821	S	S	*	*				52.1	121	129.6	62.6	0	0	0	0	122.9
453	G	31.5	Very low	32	Very low	77 Å²	77	106.3 Å²	106.3	79%	0.794	82%	0.82	S	S	*	*				106.3	88.4	101.4	0	0	0	0	0	120
454	G	32.3	Very low	31.7	Very low	88 Å²	88	105.8 Å²	105.8	91%	0.907	82%	0.816	S	S	*	*			trans	62.9	136.9	134.6	0	0	0	0	0	122
455	G	31.9	Very low	31.7	Very low	81 Å²	81	107 Å²	107	84%	0.835	81%	0.806	S	S	*	*			trans	129.2	101.6	150.3	0	0	0	0	0	117.8
456	G	32.4	Very low	31.7	Very low	87 Å²	87	108.7 Å²	108.7	90%	0.897	81%	0.809	S	S	*	*			trans	42	127.5	133.2	0	0	0	0	0	123.5
457	G	31.8	Very low	31.6	Very low	84 Å²	84	114.4 Å²	114.4	87%	0.866	81%	0.814	S	S	*	*				107.2	92.2	116.9	0	0	0	0	0	120.2
458	G	31.5	Very low	31.6	Very low	85 Å²	85	110.5 Å²	110.5	88%	0.876	80%	0.803	S	S	*	*				71.2	166.6	127.8	0	0	0	0	0	121.4
459	G	30.9	Very low	31.5	Very low	84 Å²	84	112.9 Å²	112.9	87%	0.866	80%	0.803	S	S	*	*			trans	103.9	105.5	164.8	0	0	0	0	0	115.5
460	G	28.9	Very low	31.4	Very low	88 Å²	88	115.4 Å²	115.4	91%	0.907	81%	0.807	S	S	*	*			trans	-83.8	167.4	171.4	0	0	0	0	0	113.4
461	G	29.7	Very low	31.4	Very low	85 Å²	85	113.9 Å²	113.9	88%	0.876	80%	0.802	S	S	*	*			trans	-165.8	142.6	174.8	0	0	0	0	0	111.3
462	S	32.1	Very low	31.4	Very low	112 Å²	112	114.3 Å²	114.3	78%	0.783	80%	0.801	S	S	*	*			trans	-128.2	152.6	-176	179.8	0	0	0	0	111
463	M	33.2	Very low	31.4	Very low	144 Å²	144	115.3 Å²	115.3	71%	0.709	80%	0.797	S	S	*	*			trans	129.6	123	144.8	-69.3	-150.8	-178.1	0	0	118
464	K	31	Very low	31.3	Very low	165 Å²	165	119.1 Å²	119.1	72%	0.717	80%	0.795	S	S	*	*				75.7	112.6	127.2	-68.9	177.8	179.1	163.4	0	122.4
465	H	29.5	Very low	31.2	Very low	171 Å²	171	122 Å²	122	79%	0.792	79%	0.789	S	S	*	*				86.6	132.5	119.4	-94.6	-70.9	0	0	0	124.2
466	S	31.3	Very low	30.9	Very low	93 Å²	93	122.6 Å²	122.6	65%	0.65	78%	0.779	S	S	*	*			trans	85.4	125.1	141.1	-64.4	0	0	0	0	118.8
467	R	32.7	Very low	30.6	Very low	232 Å²	232	128.8 Å²	128.8	88%	0.875	78%	0.777	S	S	*	*				74.8	130.4	73.4	-122.5	-171.3	-174.5	177.9	1.2	110.3
468	T	33.9	Very low	30.7	Very low	105 Å²	105	132 Å²	132	64%	0.644	77%	0.77	S	S	*	*			cis	-163.2	145.4	41.8	38.9	0	0	0	0	115.7
469	T	30.5	Very low	30.7	Very low	123 Å²	123	133.8 Å²	133.8	76%	0.755	76%	0.759	S	S	*	*			trans	51.8	135	134.9	65.8	0	0	0	0	125.8
470	L	30.7	Very low	30.8	Very low	164 Å²	164	135.3 Å²	135.3	86%	0.859	75%	0.747	S	S	*	*				-153.1	128.3	121.5	-121.2	74.9	0	0	0	106.2
471	S	31.1	Very low	30.8	Very low	104 Å²	104	140 Å²	140	73%	0.727	74%	0.743	S	S	*	*				69.2	132.2	78.1	-143.2	0	0	0	0	113.9
472	S	31.7	Very low	30.9	Very low	87 Å²	87	140.8 Å²	140.8	61%	0.608	74%	0.735	S	S	*	*			cis	-175.5	154.2	0.2	26.5	0	0	0	0	113
473	M	31.2	Very low	31	Very low	162 Å²	162	145 Å²	145	80%	0.798	74%	0.739	S	S	*	*			trans	60.6	153.2	151.5	-81.2	121.9	161.7	0	0	120
474	E	29.9	Very low	31.7	Very low	158 Å²	158	143.6 Å²	143.6	74%	0.738	74%	0.741	S	S	*	*			cis	-154.4	-177.9	-0.6	-132.4	167	163.8	0	0	115.7
475	L	28.5	Very low	32.5	Very low	149 Å²	149	141.2 Å²	141.2	78%	0.78	74%	0.742	S	S	*	*			trans	-47.1	173	176.4	-73.7	159	0	0	0	118
476	S	26.1	Very low	34	Very low	92 Å²	92	138.7 Å²	138.7	64%	0.643	74%	0.741	S	S	*	*			cis	-178.2	158.8	-7.8	46.3	0	0	0	0	112
477	Y	27.3	Very low	33.9	Very low	217 Å²	217	141.6 Å²	141.6	85%	0.851	75%	0.746	S	S	*	*			trans	-170.2	112.1	144.5	-107.7	-84.1	0	0	0	107.8
478	H	33.2	Very low	33.8	Very low	152 Å²	152	138.1 Å²	138.1	70%	0.704	74%	0.738	S	S	*	*				59.9	139.8	89	-90.3	-20.7	0	0	0	116.1
479	N	32	Very low	33.6	Very low	123 Å²	123	137.7 Å²	137.7	66%	0.658	74%	0.735	S	S	*	*			cis	-174.6	167.4	-16.6	-123.8	40.6	0	0	0	107.8
480	D	31.7	Very low	33.4	Very low	115 Å²	115	140.3 Å²	140.3	62%	0.615	74%	0.736	S	S	*	*			cis	-162.9	173.9	-13	-151.9	-49.1	0	0	0	107.9
481	F	29.5	Very low	33.4	Very low	186 Å²	186	138.5 Å²	138.5	82%	0.816	73%	0.727	S	S	*	*				165.8	101.5	124.4	-102.7	-76.3	0	0	0	115.2
482	S	32.7	Very low	33.4	Very low	102 Å²	102	137.9 Å²	137.9	71%	0.713	72%	0.723	S	S	*	*			trans	70.6	142.5	140.2	68.1	0	0	0	0	124.2
483	K	32.9	Very low	33.2	Very low	200 Å²	200	139.3 Å²	139.3	87%	0.87	73%	0.729	S	S	*	*			trans	-154.1	177	170.2	-102.5	-177.4	178.1	175.7	0	106.8
484	P	49	Very low	33	Very low	115 Å²	115	136.9 Å²	136.9	75%	0.747	73%	0.728	S	S	*	*			cis	-109.8	-113.3	-11.8	36.5	-15.8	0	0	0	108.1
485	P	47.8	Very low	33	Very low	115 Å²	115	135.1 Å²	135.1	75%	0.747	73%	0.727	S	S	*	*			cis	-117.2	178.3	-21.7	37.5	-19.8	0	0	0	114.8
486	P	61.4	Low	33	Very low	118 Å²	118	139.2 Å²	139.2	77%	0.766	73%	0.734	S	S	*	*			trans	-121.5	178.6	-178.2	42.6	-31.1	0	0	0	114.9
487	M	27.6	Very low	33.1	Very low	154 Å²	154	144 Å²	144	76%	0.759	74%	0.744	S	S	*	*			trans	165.6	154.1	156.2	-87.8	-142.9	-53.3	0	0	109.1
488	K	31.4	Very low	33.2	Very low	160 Å²	160	143.5 Å²	143.5	70%	0.696	75%	0.746	S	S	*	*			cis	-170.8	149.5	-10.6	-119.9	-171.2	-168.7	155	0	112.3
489	T	29	Very low	32.7	Very low	96 Å²	96	141.2 Å²	141.2	59%	0.589	75%	0.747	S	S	*	*			trans	57.7	161	146.6	53.5	0	0	0	0	120.3
490	F	27.7	Very low	32.3	Very low	177 Å²	177	141 Å²	141	78%	0.776	75%	0.753	S	S	*	*			cis	-121.9	153.1	12.2	-81.1	-104.9	0	0	0	111.6
491	N	28.9	Very low	32.2	Very low	126 Å²	126	146.3 Å²	146.3	67%	0.674	77%	0.766	S	S	*	*				66.8	136.6	56.3	-95.5	12.4	0	0	0	113.8
492	S	31.8	Very low	32.1	Very low	92 Å²	92	140.9 Å²	140.9	64%	0.643	76%	0.763	S	S	*	*			cis	-151.2	136.4	7.8	-81.3	0	0	0	0	114.5
493	T	27.4	Very low	31.8	Very low	117 Å²	117	146.8 Å²	146.8	72%	0.718	77%	0.772	S	S	*	*				34.5	128.8	115.7	-35.3	0	0	0	0	121.4
494	S	28.2	Very low	31.7	Very low	111 Å²	111	146.1 Å²	146.1	78%	0.776	77%	0.769	S	S	*	*			trans	-145	150.9	130.7	86.5	0	0	0	0	111.2
495	T	29.8	Very low	30.7	Very low	120 Å²	120	149.3 Å²	149.3	74%	0.736	77%	0.774	S	S	*	*			trans	-141.8	138.5	175.3	42.9	0	0	0	0	109.6
496	Y	27.3	Very low	29.8	Very low	236 Å²	236	152 Å²	152	93%	0.925	78%	0.776	S	S	*	*			trans	-140	156	171.5	-98.6	-81.6	0	0	0	112.1
497	K	29.5	Very low	28.2	Very low	193 Å²	193	150.3 Å²	150.3	84%	0.839	77%	0.767	S	S	*	*			trans	-112.4	153.7	-172.4	-71.3	173.4	175.5	171.7	0	111.3
498	K	27.8	Very low	28.3	Very low	205 Å²	205	152.6 Å²	152.6	89%	0.891	78%	0.776	S	S	*	*			trans	45.1	123.9	150.3	-69.5	-174.3	172.8	-168.7	0	118.8
499	S	23.7	Very low	28.1	Very low	105 Å²	105	150.8 Å²	150.8	73%	0.734	78%	0.778	S	S	*	*				-159.8	164.6	114.4	-159.5	0	0	0	0	111.4
500	C	24	Very low	28.1	Very low	117 Å²	117	155.8 Å²	155.8	79%	0.791	79%	0.794	S	S	*	*			trans	-120	137.6	173.2	-60.1	0	0	0	0	110.1
501	Y	29.4	Very low	28	Very low	227 Å²	227	154.1 Å²	154.1	89%	0.89	79%	0.793	S	S	*	*			trans	-146.3	144.7	153.3	-76.2	-80.6	0	0	0	106.9
502	G	26.4	Very low	27.8	Very low	73 Å²	73	152.8 Å²	152.8	75%	0.753	79%	0.793	S	S	*	*			cis	123.2	77	-1.7	0	0	0	0	0	112.3
503	Y	27.4	Very low	27.6	Very low	226 Å²	226	155.7 Å²	155.7	89%	0.886	80%	0.801	S	S	*	*			trans	-123.4	147	171.3	-150.3	-92.8	0	0	0	110
504	K	29.8	Very low	27.6	Very low	185 Å²	185	157.5 Å²	157.5	80%	0.804	80%	0.802	S	S	*	*			trans	-124.8	144.2	-177	-77.3	-177.9	172.3	-176.8	0	110.4
505	Q	29	Very low	27.6	Very low	183 Å²	183	161.7 Å²	161.7	86%	0.855	81%	0.809	S	S	*	*			trans	-150.3	-179.8	136.1	-123.3	170.9	-3.9	0	0	111.9
506	H	29.3	Very low	27.5	Very low	171 Å²	171	160.7 Å²	160.7	79%	0.792	80%	0.802	S	S	*	*			trans	-76	137.9	-140.5	-100.5	-78.1	0	0	0	118.2
507	S	27.7	Very low	27.7	Very low	82 Å²	82	156.2 Å²	156.2	57%	0.573	79%	0.793	S	S	*	*			trans	-34.4	142.6	148.5	54.9	0	0	0	0	117.1
508	Q	29.8	Very low	27.8	Very low	203 Å²	203	155.2 Å²	155.2	95%	0.949	79%	0.791	S	S	*	*				-128.7	157	120.3	-100.9	-174.3	0.6	0	0	109.4
509	T	26.4	Very low	27.7	Very low	121 Å²	121	151.8 Å²	151.8	74%	0.742	78%	0.783	S	S	*	*			trans	-115.8	134.2	-165.8	47.8	0	0	0	0	112.1
510	H	29.2	Very low	28.1	Very low	201 Å²	201	157 Å²	157	93%	0.931	79%	0.787	S	S	*	*			trans	-147.5	160.5	137.7	-116	-81.2	0	0	0	109.3
511	D	25.5	Very low	28.2	Very low	142 Å²	142	157.1 Å²	157.1	76%	0.759	78%	0.783	S	S	*	*			trans	-129.9	153.8	-153.6	-164.4	15.7	0	0	0	112.6
512	C	25	Very low	28.3	Very low	99 Å²	99	152.6 Å²	152.6	67%	0.669	78%	0.779	S	S	*	*			trans	58.8	151.4	178.3	-76	0	0	0	0	117.7
513	D	27.3	Very low	28.5	Very low	152 Å²	152	157 Å²	157	81%	0.813	78%	0.781	S	S	*	*			cis	-143.3	168.9	-3	-139.1	-33.2	0	0	0	112.5
514	Q	26.5	Very low	28.4	Very low	155 Å²	155	155.5 Å²	155.5	72%	0.724	78%	0.782	S	S	*	*			trans	-103	131.7	-164.7	-178.9	166.8	-10.7	0	0	114.1	V516	Q514-V516 HydrophobicContact CG-CG2 3.78Å; Q514-V516 VanDerWaalsContact NE2-CG2 3.26Å
515	Q	29.8	Very low	28.6	Very low	199 Å²	199	153.5 Å²	153.5	93%	0.93	78%	0.778	S	S	*	*			trans	-143	150.2	146.2	-116.6	171.7	29.4	0	0	111.4
516	V	27.3	Very low	28.6	Very low	99 Å²	99	150.5 Å²	150.5	60%	0.6	78%	0.775	S	S	*	*			trans	-135.7	142.1	-165.3	-168.8	0	0	0	0	108.2	Q514	Q514-V516 HydrophobicContact CG-CG2 3.78Å; Q514-V516 VanDerWaalsContact NE2-CG2 3.26Å
517	I	31.8	Very low	28.5	Very low	143 Å²	143	148.3 Å²	148.3	73%	0.733	78%	0.777	S	S	*	*				167.8	129.8	127.2	-87.7	162.7	0	0	0	110.7
518	E	29.9	Very low	28.5	Very low	171 Å²	171	152.7 Å²	152.7	80%	0.799	79%	0.788	S	S	*	*			trans	37.3	122.2	150.8	-62.2	167.6	161.8	0	0	119.5
519	D	26.8	Very low	28.5	Very low	133 Å²	133	149.7 Å²	149.7	71%	0.711	78%	0.777	S	S	*	*				85.6	141.9	56.3	-172.6	37.7	0	0	0	113.4
520	R	31.1	Very low	28.6	Very low	216 Å²	216	155.6 Å²	155.6	82%	0.815	79%	0.788	S	S	*	*			trans	71	155.4	178.7	-65.7	-179.1	-178.7	164.3	0.9	119
521	V	27.3	Very low	28.6	Very low	119 Å²	119	149 Å²	149	72%	0.721	77%	0.774	S	S	*	*			cis	-168.6	164.6	-39.1	103.6	0	0	0	0	109.4
522	T	31.2	Very low	28.9	Very low	131 Å²	131	154.6 Å²	154.6	80%	0.804	78%	0.784	S	S	*	*			trans	70.4	147.2	169.6	29.9	0	0	0	0	119.4
523	E	30.2	Very low	29	Very low	167 Å²	167	153.7 Å²	153.7	78%	0.78	79%	0.792	S	S	*	*			trans	-100.4	155.9	179.1	-56.5	148.7	112.8	0	0	110.9
524	E	26.7	Very low	29.1	Very low	194 Å²	194	151.2 Å²	151.2	91%	0.907	79%	0.793	S	S	*	*			trans	-131.7	127.4	149.5	-73	-168.5	162.6	0	0	108.4
525	I	32.7	Very low	29.4	Very low	143 Å²	143	151.1 Å²	151.1	73%	0.733	80%	0.802	S	S	*	*			trans	-135	118.4	173	-58	179.4	0	0	0	108.4
526	P	29.6	Very low	29.4	Very low	120 Å²	120	145.2 Å²	145.2	78%	0.779	80%	0.795	S	S	*	*			trans	-85.7	145	171.4	33.8	-32.6	0	0	0	111.5
527	C	26.1	Very low	29.6	Very low	125 Å²	125	148.2 Å²	148.2	85%	0.845	81%	0.807	S	S	*	*			trans	-85.4	140.3	167.2	-58.7	0	0	0	0	110.5
528	E	29.1	Very low	29.6	Very low	174 Å²	174	148.2 Å²	148.2	81%	0.813	81%	0.808	S	S	*	*			trans	-161	150.3	144.2	-119.9	-172.5	-165.9	0	0	114.9
529	I	30.3	Very low	30.6	Very low	139 Å²	139	144.7 Å²	144.7	71%	0.713	80%	0.8	S	S	*	*			trans	58.7	115.8	157.3	-57.7	159.9	0	0	0	118.8
530	Y	28.4	Very low	30.7	Very low	245 Å²	245	146.6 Å²	146.6	96%	0.961	81%	0.805	S	S	*	*			trans	-115.4	141.2	150.9	-117.7	-84.5	0	0	0	110.2
531	G	28.8	Very low	30.6	Very low	62 Å²	62	143.2 Å²	143.2	64%	0.639	80%	0.798	S	S	*	*			trans	-125.5	115.3	-172.9	0	0	0	0	0	114.9
532	R	30.3	Very low	30.7	Very low	260 Å²	260	147.6 Å²	147.6	98%	0.981	80%	0.802	S	S	*	*			trans	50.4	106.7	140.7	-157.9	-172.8	-146.6	-173.8	7.8	118.8
533	G	27.4	Very low	30.6	Very low	80 Å²	80	146.4 Å²	146.4	83%	0.825	80%	0.799	S	S	*	*			trans	-163.3	135.5	160.6	0	0	0	0	0	111.7
534	A	31.1	Very low	30.6	Very low	101 Å²	101	146.7 Å²	146.7	84%	0.835	80%	0.804	S	S	*	*			trans	-146.8	150.6	178.3	0	0	0	0	0	110.8
535	V	32.6	Very low	30.6	Very low	153 Å²	153	143.2 Å²	143.2	93%	0.927	80%	0.801	S	S	*	*			trans	146.7	138.7	156.9	158.1	0	0	0	0	110
536	G	28.5	Very low	30.5	Very low	75 Å²	75	143.5 Å²	143.5	77%	0.773	80%	0.801	S	S	*	*			trans	116.1	133.1	159.9	0	0	0	0	0	115.5
537	L	31.1	Very low	30.5	Very low	162 Å²	162	144 Å²	144	85%	0.848	80%	0.797	S	S	*	*			trans	-131.4	143.7	174.6	-93.7	163.6	0	0	0	109.5
538	D	33.6	Very low	31	Very low	143 Å²	143	151.3 Å²	151.3	77%	0.765	82%	0.815	S	S	*	*			trans	64.2	156.8	153.1	-86.8	17.2	0	0	0	120.8
539	P	49	Very low	31.1	Very low	97 Å²	97	150.2 Å²	150.2	63%	0.63	82%	0.815	S	S	*	*			cis	-143	172.3	-47	38	-20.4	0	0	0	114.6
540	Q	29.9	Very low	31.2	Very low	172 Å²	172	150.8 Å²	150.8	80%	0.804	82%	0.821	S	S	*	*			trans	50.3	123.9	155.1	-67.1	-176.7	18	0	0	121
541	Q	29.5	Very low	31.3	Very low	145 Å²	145	145.6 Å²	145.6	68%	0.678	81%	0.813	S	S	*	*				152.1	127	96.4	-164.6	163.3	98.3	0	0	115.9
542	R	28.6	Very low	31.5	Very low	212 Å²	212	150.5 Å²	150.5	80%	0.8	82%	0.823	S	S	*	*			trans	73.6	154.5	154.5	-83.2	172	178.4	173.6	-1.4	122.6
543	S	28.7	Very low	31.5	Very low	105 Å²	105	143.6 Å²	143.6	73%	0.734	81%	0.813	S	S	*	*			trans	62.2	114.5	171.5	24.1	0	0	0	0	115.8
544	I	30.3	Very low	31.8	Very low	174 Å²	174	147.9 Å²	147.9	89%	0.892	81%	0.812	S	S	*	*				67.3	95.9	56	-54.8	170.4	0	0	0	112.7
545	S	28.2	Very low	31.9	Very low	120 Å²	120	151.2 Å²	151.2	84%	0.839	81%	0.811	S	S	*	*			trans	-160.6	159.2	135.3	-169.1	0	0	0	0	108.7
546	M	30.3	Very low	31.8	Very low	149 Å²	149	151.1 Å²	151.1	73%	0.734	80%	0.802	S	S	*	*			trans	-98.8	174.3	178.3	-67.1	161.4	45.2	0	0	112.3
547	D	29	Very low	32.1	Very low	132 Å²	132	157.4 Å²	157.4	71%	0.706	80%	0.804	S	S	*	*			trans	68.8	137.2	162.5	-44.1	-40.2	0	0	0	116.4
548	F	37	Very low	32.2	Very low	278 Å²	278	157 Å²	157	100%	1.219	80%	0.8	S	S	*	*			cis	-116.8	0	9.1	-87.4	-106.9	0	0	0	113

Retrieved 548 of 548 residues in 226.2 ms (Link to these results)

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