A0A023ND10_ORYSJ Loading...

Glycosyltransferases

Involved in the synthesis of glucuronoxylan hemicellulose in secondary cell walls.

AlphaFold DB (Q8S626), UniProt , Accession A0A023ND10, Species ORYSJ (Oryza sativa subsp. japonica, Rice), Gene GT43G, Length 351 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.9	Very low	50.2	Low	249 Å²	249	151.1 Å²	151.1	100%	1.227	86%	0.862	S	S	*	*				0	110.7	0	-76.8	174.7	173.5	0	0	107.6
2	A	45	Very low	50.5	Low	105 Å²	105	149.5 Å²	149.5	87%	0.868	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-77.2	132.7	178.6	0	0	0	0	0	109.8
3	A	50.6	Low	51	Low	94 Å²	94	143.2 Å²	143.2	78%	0.777	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-72.2	143.7	179.7	0	0	0	0	0	111.3
4	P	51.5	Low	51.9	Low	116 Å²	116	138.8 Å²	138.8	75%	0.753	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-76.1	153	-173.9	30.7	-34.1	0	0	0	112.7
5	P	50.5	Low	52.8	Low	127 Å²	127	135.6 Å²	135.6	83%	0.825	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-75.9	138.3	-173.9	29.5	-32.7	0	0	0	112.9
6	C	54.3	Low	53.8	Low	125 Å²	125	131.5 Å²	131.5	85%	0.845	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-62.3	138.1	178.4	-72.8	0	0	0	0	112.9
7	P	47.3	Very low	55	Low	114 Å²	114	132.6 Å²	132.6	74%	0.74	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-76.6	153	177.2	31	-33.6	0	0	0	112.5
8	P	52.2	Low	56.4	Low	126 Å²	126	132 Å²	132	82%	0.818	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-73.6	135.7	-174.1	28.7	-33.2	0	0	0	112.5	R10	P8-R10 PolarHBondContact O-N 3.08Å
9	R	47.9	Very low	57.7	Low	247 Å²	247	131.1 Å²	131.1	93%	0.932	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-66	120.9	177.2	-71.6	-178.7	175.3	-166.2	-1.6	110.4
10	R	54.4	Low	59	Low	234 Å²	234	129 Å²	129	88%	0.883	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-67	138	170.1	-72.3	-176.5	178.2	-172.7	-0.8	110.1	P8 I12	P8-R10 PolarHBondContact O-N 3.08Å; R10-I12 PolarHBondContact O-N 3.24Å
11	P	53.1	Low	60.2	Low	125 Å²	125	129.8 Å²	129.8	81%	0.812	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-68.4	127.4	178.9	27.6	-32	0	0	0	110	S13	P11-S13 PolarHBondContact O-N 3.32Å
12	I	54.5	Low	62.1	Low	132 Å²	132	122.6 Å²	122.6	68%	0.677	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-63.6	116.8	174	-62.4	165.5	0	0	0	106.7	R10 A14 F17	R10-I12 PolarHBondContact O-N 3.24Å; I12-A14 PolarHBondContact O-N 3.23Å; I12-F17 HydrophobicContact CG2-CD2 4.39Å
13	S	57.3	Low	64	Low	68 Å²	68	122.9 Å²	122.9	48%	0.476	69%	0.691	S	S	.	*	P	Polyproline II helix	trans	-60.6	125.5	-179	68.3	0	0	0	0	110	P11 P15 C16	P11-S13 PolarHBondContact O-N 3.32Å; S13-P15 VanDerWaalsContact C-N 3.29Å; S13-P15 WeakPolarHBondContact O-CD 3.29Å; S13-P15 VanDerWaalsContact O-N 3.07Å; S13-C16 PolarHBondContact O-N 3.23Å; S13-C16 VanDerWaalsContact O-N 3.08Å
14	A	62.5	Low	65.5	Low	81 Å²	81	120.6 Å²	120.6	67%	0.669	68%	0.676	S	S	*	*	H	α-helix	trans	-41.7	-36.5	178.7	0	0	0	0	0	117	I12 C16 F17	I12-A14 PolarHBondContact O-N 3.23Å; A14-C16 VanDerWaalsContact C-N 3.26Å; A14-C16 PolarHBondContact O-N 3.32Å; A14-F17 PolarHBondContact O-N 2.81Å
15	P	66.1	Low	67.1	Low	91 Å²	91	120.9 Å²	120.9	59%	0.591	67%	0.666	S	S	*	*	H	α-helix	trans	-61.3	-30.4	179.3	20.4	-34.2	0	0	0	114.1	S13 F17 L19	S13-P15 VanDerWaalsContact C-N 3.29Å; S13-P15 WeakPolarHBondContact O-CD 3.29Å; S13-P15 VanDerWaalsContact O-N 3.07Å; P15-F17 VanDerWaalsContact C-N 3.34Å; P15-F17 PolarHBondContact O-N 3.32Å; P15-L19 PolarHBondContact O-N 2.69Å
16	C	69.1	Low	68.5	Low	70 Å²	70	118.9 Å²	118.9	47%	0.473	65%	0.651	S	S	.	*	H	α-helix	trans	-69.4	-32.7	179.7	-67.5	0	0	0	0	112.5	S13 A14 C20	S13-C16 PolarHBondContact O-N 3.23Å; S13-C16 VanDerWaalsContact O-N 3.08Å; A14-C16 VanDerWaalsContact C-N 3.26Å; A14-C16 PolarHBondContact O-N 3.32Å; C16-C20 PolarHBondContact O-N 3.06Å; C16-C20 PolarHBondContact O-SG 3.49Å
17	F	74.1	Confident	69.6	Low	150 Å²	150	116.2 Å²	116.2	66%	0.658	64%	0.638	S	S	*	*	H	α-helix	trans	-70.7	-40.5	-178.4	-129.1	-83.5	0	0	0	111.6	I12 A14 P15 F21	I12-F17 HydrophobicContact CG2-CD2 4.39Å; A14-F17 PolarHBondContact O-N 2.81Å; P15-F17 VanDerWaalsContact C-N 3.34Å; P15-F17 PolarHBondContact O-N 3.32Å; F17-F21 WeakPolarHBondContact O-CB 3.33Å; F17-F21 PolarHBondContact O-N 3.18Å
18	L	80.3	Confident	70.9	Confident	122 Å²	122	112.7 Å²	112.7	64%	0.639	62%	0.622	S	S	*	*	H	α-helix	trans	-68.4	-39.9	-179.5	-150.1	112.7	0	0	0	111.5	F21 L22	L18-F21 PolarHBondContact O-N 3.08Å; L18-L22 HydrophobicContact CD2-CD1 4.03Å; L18-L22 WeakPolarHBondContact O-CG 3.49Å; L18-L22 PolarHBondContact O-N 3.31Å
19	L	80	Confident	71.7	Confident	114 Å²	114	110.8 Å²	110.8	60%	0.597	61%	0.605	S	S	*	*	H	α-helix	trans	-66.3	-42	179.1	-152.9	122.2	0	0	0	111.7	P15 L22 L23	P15-L19 PolarHBondContact O-N 2.69Å; L19-L22 PolarHBondContact O-N 3.47Å; L19-L23 HydrophobicContact CD2-CD1 3.77Å; L19-L23 WeakPolarHBondContact O-CB 3.38Å; L19-L23 PolarHBondContact O-N 3.35Å
20	C	84.2	Confident	72.5	Confident	89 Å²	89	105.7 Å²	105.7	60%	0.601	59%	0.59	S	S	*	*	H	α-helix	trans	-64.7	-39.1	174.7	-70.7	0	0	0	0	112.7	C16 G24	C16-C20 PolarHBondContact O-N 3.06Å; C16-C20 PolarHBondContact O-SG 3.49Å; C20-G24 PolarHBondContact O-N 3.36Å
21	F	84.7	Confident	72.7	Confident	146 Å²	146	98.7 Å²	98.7	64%	0.64	57%	0.574	S	S	*	*	H	α-helix	trans	-65.4	-44.2	178	-173	-94.2	0	0	0	111.8	F17 L18 G24 F25	F17-F21 WeakPolarHBondContact O-CB 3.33Å; F17-F21 PolarHBondContact O-N 3.18Å; L18-F21 PolarHBondContact O-N 3.08Å; F21-G24 PolarHBondContact O-N 3.07Å; F21-F25 WeakPolarHBondContact O-CB 3.39Å; F21-F25 PolarHBondContact O-N 3.25Å
22	L	84.9	Confident	73.1	Confident	98 Å²	98	100.4 Å²	100.4	51%	0.513	57%	0.57	S	S	.	*	H	α-helix	trans	-66.3	-42.8	178.6	-69.8	171.7	0	0	0	112.3	L18 L19 G24 F25 V26	L18-L22 HydrophobicContact CD2-CD1 4.03Å; L18-L22 WeakPolarHBondContact O-CG 3.49Å; L18-L22 PolarHBondContact O-N 3.31Å; L19-L22 PolarHBondContact O-N 3.47Å; L22-G24 PolarHBondContact O-N 3.22Å; L22-F25 PolarHBondContact O-N 3.08Å; L22-V26 WeakPolarHBondContact O-CG2 3.37Å; L22-V26 PolarHBondContact O-N 3.22Å
23	L	83.6	Confident	73.1	Confident	112 Å²	112	98 Å²	98	59%	0.586	57%	0.569	S	S	*	*	H	α-helix	trans	-61.5	-43	174.5	-83.1	159.9	0	0	0	111.9	L19 A27	L19-L23 HydrophobicContact CD2-CD1 3.77Å; L19-L23 WeakPolarHBondContact O-CB 3.38Å; L19-L23 PolarHBondContact O-N 3.35Å; L23-A27 VanDerWaalsContact O-CB 3.32Å; L23-A27 WeakPolarHBondContact O-CB 3.36Å; L23-A27 PolarHBondContact O-N 2.6Å
24	G	83.4	Confident	72.8	Confident	46 Å²	46	101.4 Å²	101.4	47%	0.474	58%	0.577	S	S	.	*	H	α-helix	trans	-64.9	-38.2	176.1	0	0	0	0	0	113.1	C20 F21 L22 G28	C20-G24 PolarHBondContact O-N 3.36Å; F21-G24 PolarHBondContact O-N 3.07Å; L22-G24 PolarHBondContact O-N 3.22Å; G24-G28 PolarHBondContact O-N 3.48Å
25	F	85.6	Confident	72.1	Confident	122 Å²	122	108.4 Å²	108.4	54%	0.535	59%	0.586	S	S	.	*	H	α-helix	trans	-66.8	-44.9	177.9	-171.6	-100.4	0	0	0	112	F21 L22 G28 L29	F21-F25 WeakPolarHBondContact O-CB 3.39Å; F21-F25 PolarHBondContact O-N 3.25Å; L22-F25 PolarHBondContact O-N 3.08Å; F25-G28 PolarHBondContact O-N 3.24Å; F25-L29 HydrophobicContact CD1-CD1 3.83Å; F25-L29 HydrophobicContact CE1-CD1 3.37Å; F25-L29 HydrophobicContact CE1-CG 4.46Å; F25-L29 HydrophobicContact CE2-CD1 4.5Å; F25-L29 HydrophobicContact CZ-CD1 3.75Å; F25-L29 WeakPolarHBondContact O-CG 3.44Å; F25-L29 PolarHBondContact O-N 2.84Å
26	V	79.1	Confident	70.9	Confident	84 Å²	84	113 Å²	113	51%	0.509	60%	0.6	S	S	.	*	H	α-helix	trans	-67.3	-42.8	177.7	176.6	0	0	0	0	111.4	L22 G28 L29 F30	L22-V26 WeakPolarHBondContact O-CG2 3.37Å; L22-V26 PolarHBondContact O-N 3.22Å; V26-G28 VanDerWaalsContact C-N 3.29Å; V26-G28 PolarHBondContact O-N 3.4Å; V26-L29 PolarHBondContact O-N 3.48Å; V26-F30 HydrophobicContact CG1-CD2 4.48Å; V26-F30 PolarHBondContact O-N 2.74Å
27	A	77.3	Confident	69.4	Low	69 Å²	69	116 Å²	116	57%	0.57	61%	0.61	S	S	*	*	H	α-helix	trans	-64.1	-33.9	175.6	0	0	0	0	0	112.5	L23 L29 P31	L23-A27 VanDerWaalsContact O-CB 3.32Å; L23-A27 WeakPolarHBondContact O-CB 3.36Å; L23-A27 PolarHBondContact O-N 2.6Å; A27-L29 VanDerWaalsContact C-N 3.34Å; A27-P31 WeakPolarHBondContact O-CD 3.43Å
28	G	74.3	Confident	67.7	Low	40 Å²	40	116.1 Å²	116.1	41%	0.412	61%	0.612	S	S	.	*	H	α-helix	trans	-70.4	-25.4	176	0	0	0	0	0	114.4	G24 F25 V26 P31 F32	G24-G28 PolarHBondContact O-N 3.48Å; F25-G28 PolarHBondContact O-N 3.24Å; V26-G28 VanDerWaalsContact C-N 3.29Å; V26-G28 PolarHBondContact O-N 3.4Å; G28-P31 WeakPolarHBondContact O-CD 3.42Å; G28-F32 WeakPolarHBondContact O-CD2 3.32Å
29	L	70.4	Confident	65.6	Low	86 Å²	86	117.9 Å²	117.9	45%	0.45	62%	0.622	S	S	.	*	H	α-helix	trans	-91.2	-21.5	179.3	-70.7	175.4	0	0	0	114.1	F25 V26 A27 P31 F32 A33	F25-L29 HydrophobicContact CD1-CD1 3.83Å; F25-L29 HydrophobicContact CE1-CD1 3.37Å; F25-L29 HydrophobicContact CE1-CG 4.46Å; F25-L29 HydrophobicContact CE2-CD1 4.5Å; F25-L29 HydrophobicContact CZ-CD1 3.75Å; F25-L29 WeakPolarHBondContact O-CG 3.44Å; F25-L29 PolarHBondContact O-N 2.84Å; V26-L29 PolarHBondContact O-N 3.48Å; A27-L29 VanDerWaalsContact C-N 3.34Å; L29-P31 VanDerWaalsContact C-CD 3.44Å; L29-F32 PolarHBondContact O-N 3.42Å; L29-A33 PolarHBondContact O-N 2.73Å
30	F	62.9	Low	63.5	Low	140 Å²	140	117.6 Å²	117.6	61%	0.614	62%	0.621	S	S	*	*	H	α-helix	trans	-53.1	-39.2	177.1	-120.7	-93	0	0	0	115.2	V26 F32 A33	V26-F30 HydrophobicContact CG1-CD2 4.48Å; V26-F30 PolarHBondContact O-N 2.74Å; F30-F32 PolarHBondContact O-N 3.36Å; F30-A33 PolarHBondContact O-N 2.95Å
31	P	58.7	Low	61.3	Low	87 Å²	87	119.7 Å²	119.7	57%	0.565	63%	0.626	S	S	*	*	H	α-helix	trans	-71.4	-8.7	176.2	21.9	-26.6	0	0	0	114.6	A27 G28 L29	A27-P31 WeakPolarHBondContact O-CD 3.43Å; G28-P31 WeakPolarHBondContact O-CD 3.42Å; L29-P31 VanDerWaalsContact C-CD 3.44Å
32	F	63.2	Low	58.9	Low	162 Å²	162	121.1 Å²	121.1	71%	0.711	63%	0.634	S	S	*	*	H	α-helix	trans	-98.9	-21.7	178	-63.4	-80.6	0	0	0	113.5	G28 L29 F30	G28-F32 WeakPolarHBondContact O-CD2 3.32Å; L29-F32 PolarHBondContact O-N 3.42Å; F30-F32 PolarHBondContact O-N 3.36Å
33	A	53.7	Low	56.8	Low	81 Å²	81	123.2 Å²	123.2	67%	0.669	65%	0.645	S	S	*	*	H	α-helix	trans	-76.8	-21.8	-179	0	0	0	0	0	114.1	L29 F30	L29-A33 PolarHBondContact O-N 2.73Å; F30-A33 PolarHBondContact O-N 2.95Å
34	H	50.9	Low	54.5	Low	140 Å²	140	123.8 Å²	123.8	65%	0.648	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	15.4	-173.4	-97.6	-38.4	0	0	0	116.5
35	R	46.8	Very low	52.4	Low	227 Å²	227	129.5 Å²	129.5	86%	0.857	67%	0.674	S	S	*	*			trans	-93	7.5	176.5	-91.2	-169.9	172.6	-179.4	-0.5	116.4
36	H	42.8	Very low	50	Low	189 Å²	189	128.8 Å²	128.8	88%	0.875	68%	0.681	S	S	*	*			trans	-107	64.2	166.9	-86.5	-79.3	0	0	0	111.5
37	L	37.7	Very low	47.9	Very low	131 Å²	131	130.6 Å²	130.6	69%	0.686	70%	0.695	S	S	*	*	S	Bend	trans	-138.4	105.5	161.8	-83.1	173.1	0	0	0	109.9
38	H	36.9	Very low	46	Very low	153 Å²	153	133.2 Å²	133.2	71%	0.708	71%	0.706	S	S	*	*			trans	25.3	107.7	149	-87.6	-103.4	0	0	0	117.6	D40	H38-D40 IonicContact CE1-OD2 3.44Å; H38-D40 PolarHBondContact CE1-OD2 3.24Å; H38-D40 IonicContact CG-OD2 3.84Å; H38-D40 IonicContact ND1-OD1 3.75Å; H38-D40 IonicContact ND1-OD2 2.7Å; H38-D40 PolarHBondContact ND1-OD2 3.41Å
39	L	37	Very low	44.3	Very low	160 Å²	160	136.2 Å²	136.2	84%	0.838	73%	0.727	S	S	*	*			trans	-111.7	75.2	154.8	-149.1	87.5	0	0	0	108.3	L41	L39-L41 PolarHBondContact O-N 3.03Å; L39-L41 VanDerWaalsContact O-N 3.12Å
40	D	35.2	Very low	42.4	Very low	108 Å²	108	138.7 Å²	138.7	58%	0.578	75%	0.746	S	S	*	*			trans	-74.1	91.8	167.3	-71.7	-38.5	0	0	0	108.6	H38 H42	H38-D40 IonicContact CE1-OD2 3.44Å; H38-D40 PolarHBondContact CE1-OD2 3.24Å; H38-D40 IonicContact CG-OD2 3.84Å; H38-D40 IonicContact ND1-OD1 3.75Å; H38-D40 IonicContact ND1-OD2 2.7Å; H38-D40 PolarHBondContact ND1-OD2 3.41Å; D40-H42 PolarHBondContact O-N 3.33Å; D40-H42 VanDerWaalsContact O-N 3.15Å
41	L	38.5	Very low	40.9	Very low	133 Å²	133	136.5 Å²	136.5	70%	0.696	75%	0.753	S	S	*	*			trans	-83.4	83.6	172.5	-149.9	87.2	0	0	0	108.9	L39 L43	L39-L41 PolarHBondContact O-N 3.03Å; L39-L41 VanDerWaalsContact O-N 3.12Å; L41-L43 HydrophobicContact CD2-CD1 4.15Å; L41-L43 PolarHBondContact O-N 3.17Å
42	H	34.9	Very low	39.7	Very low	176 Å²	176	139.8 Å²	139.8	82%	0.815	77%	0.765	S	S	*	*			trans	-68.3	92.3	170.2	-78.8	-70.3	0	0	0	110.5	D40	D40-H42 PolarHBondContact O-N 3.33Å; D40-H42 VanDerWaalsContact O-N 3.15Å
43	L	40.2	Very low	38.1	Very low	142 Å²	142	139.9 Å²	139.9	74%	0.743	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-84.2	124	162.6	-96.7	152.8	0	0	0	108.8	L41 L45	L41-L43 HydrophobicContact CD2-CD1 4.15Å; L41-L43 PolarHBondContact O-N 3.17Å; L43-L45 PolarHBondContact O-N 2.91Å
44	P	35.5	Very low	37.1	Very low	123 Å²	123	142.1 Å²	142.1	80%	0.799	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-78.3	120.4	-175.6	14.4	-4.3	0	0	0	111.1
45	L	38.3	Very low	36.1	Very low	166 Å²	166	145.6 Å²	145.6	87%	0.869	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-76.4	137.5	168.5	-83.9	154.4	0	0	0	110.3	L43	L43-L45 PolarHBondContact O-N 2.91Å
46	P	35.6	Very low	35.4	Very low	107 Å²	107	143.1 Å²	143.1	70%	0.695	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-72.5	156.8	175.8	29.7	-32.3	0	0	0	112.1
47	P	35.1	Very low	34.9	Very low	123 Å²	123	141.3 Å²	141.3	80%	0.799	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-71.2	140.9	-166.3	27.8	-34.2	0	0	0	112.6
48	P	37.9	Very low	35	Very low	124 Å²	124	140.7 Å²	140.7	81%	0.805	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-79.5	134.3	-178.3	30.1	-32.1	0	0	0	111.9	T50	P48-T50 PolarHBondContact O-N 3.47Å
49	A	37.8	Very low	35.1	Very low	102 Å²	102	138.7 Å²	138.7	84%	0.843	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-65.8	128.5	169.4	0	0	0	0	0	110.5
50	T	30.9	Very low	35	Very low	139 Å²	139	136.5 Å²	136.5	85%	0.853	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-60.7	154.8	176.2	14.6	0	0	0	0	114.6	P48	P48-T50 PolarHBondContact O-N 3.47Å
51	A	31	Very low	35.3	Very low	93 Å²	93	137.6 Å²	137.6	77%	0.769	79%	0.792	S	S	*	*			trans	93.7	124.8	167.6	0	0	0	0	0	113.2
52	I	34.1	Very low	35.5	Very low	156 Å²	156	137.4 Å²	137.4	80%	0.8	80%	0.796	S	S	*	*			cis	-148.1	139.8	26.9	-70.6	175.3	0	0	0	109.1	V54	I52-V54 PolarHBondContact O-N 2.99Å
53	L	29.5	Very low	36	Very low	165 Å²	165	134.7 Å²	134.7	86%	0.864	79%	0.792	S	S	*	*			trans	-68.9	119	173.3	-67.3	162.5	0	0	0	110.7
54	V	32.1	Very low	36.1	Very low	127 Å²	127	134.5 Å²	134.5	77%	0.77	79%	0.791	S	S	*	*			trans	-122.1	107.7	153.1	179.4	0	0	0	0	106.6	I52	I52-V54 PolarHBondContact O-N 2.99Å
55	R	29.6	Very low	36.7	Very low	214 Å²	214	134.7 Å²	134.7	81%	0.808	79%	0.79	S	S	*	*			trans	-74.8	114.8	171.5	-77.4	170.8	59.3	147.7	1.2	108.1
56	E	33.6	Very low	36.8	Very low	174 Å²	174	133.6 Å²	133.6	81%	0.813	79%	0.785	S	S	*	*			trans	-136.5	117.1	149.7	-79.4	-170.8	140.6	0	0	106.8	P58	E56-P58 WeakPolarHBondContact O-CD 3.39Å
57	D	31.1	Very low	37.2	Very low	152 Å²	152	134.6 Å²	134.6	81%	0.813	79%	0.789	S	S	*	*			trans	-78.6	124.8	173.2	-70.1	-53.8	0	0	0	109.1
58	P	39.5	Very low	37.3	Very low	117 Å²	117	134 Å²	134	76%	0.76	79%	0.785	S	S	*	*			trans	-114.7	158.5	161.7	27.7	-8.9	0	0	0	112	E56	E56-P58 WeakPolarHBondContact O-CD 3.39Å
59	P	40.1	Very low	37.3	Very low	112 Å²	112	136 Å²	136	73%	0.727	79%	0.788	S	S	*	*			trans	-88.8	158.4	-144.5	33.9	-34.9	0	0	0	114.1	V61	P59-V61 PolarHBondContact O-N 3.08Å; P59-V61 VanDerWaalsContact O-N 3.08Å
60	S	35.1	Very low	37.6	Very low	114 Å²	114	136.8 Å²	136.8	80%	0.797	79%	0.785	S	S	*	*			trans	-51.2	106.2	172	50.7	0	0	0	0	112.1
61	V	41.6	Very low	38.1	Very low	130 Å²	130	134.8 Å²	134.8	79%	0.788	78%	0.783	S	S	*	*			trans	-89	108.3	166.8	-177.5	0	0	0	0	107.4	P59 V63	P59-V61 PolarHBondContact O-N 3.08Å; P59-V61 VanDerWaalsContact O-N 3.08Å; V61-V63 PolarHBondContact O-N 3.36Å
62	V	42.5	Very low	38.8	Very low	130 Å²	130	134.9 Å²	134.9	79%	0.788	78%	0.783	S	S	*	*			trans	-68.8	116.3	171.8	-163.3	0	0	0	0	106.8	D64	V62-D64 PolarHBondContact O-N 3.06Å
63	V	45.9	Very low	39.5	Very low	119 Å²	119	131.9 Å²	131.9	72%	0.721	78%	0.781	S	S	*	*			trans	-76.6	106.5	177.2	178.5	0	0	0	0	107.5	V61 V65	V61-V63 PolarHBondContact O-N 3.36Å; V63-V65 PolarHBondContact O-N 3.31Å
64	D	40.7	Very low	40.8	Very low	138 Å²	138	132 Å²	132	74%	0.738	78%	0.778	S	S	*	*			trans	-68.2	111.1	172.8	-147.8	-5.8	0	0	0	108.5	V62 D66	V62-D64 PolarHBondContact O-N 3.06Å; D64-D66 PolarHBondContact O-N 2.91Å; D64-D66 VanDerWaalsContact O-N 3.08Å
65	V	48.7	Very low	42.8	Very low	126 Å²	126	135.3 Å²	135.3	76%	0.764	79%	0.785	S	S	*	*			trans	-85.7	69.5	179.2	-176.6	0	0	0	0	107.8	V63	V63-V65 PolarHBondContact O-N 3.31Å
66	D	41.5	Very low	45.6	Very low	143 Å²	143	132 Å²	132	77%	0.765	77%	0.772	S	S	*	*			trans	-145.4	57.3	166	-101.1	-20.8	0	0	0	108.8	D64 P68	D64-D66 PolarHBondContact O-N 2.91Å; D64-D66 VanDerWaalsContact O-N 3.08Å; D66-P68 VanDerWaalsContact O-CD 3.29Å; D66-P68 WeakPolarHBondContact O-CD 3.42Å
67	T	42.8	Very low	48.6	Very low	128 Å²	128	127.3 Å²	127.3	79%	0.785	75%	0.749	S	S	*	*			trans	-80.4	112.4	164.2	-50.2	0	0	0	0	107.5	L69	T67-L69 PolarHBondContact O-N 3.49Å
68	P	36.8	Very low	51.8	Low	111 Å²	111	122 Å²	122	72%	0.721	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-62.8	131.3	179.9	-16.1	30.1	0	0	0	109.3	D66	D66-P68 VanDerWaalsContact O-CD 3.29Å; D66-P68 WeakPolarHBondContact O-CD 3.42Å
69	L	38.4	Very low	54.6	Low	166 Å²	166	116.5 Å²	116.5	87%	0.869	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-46.5	128.9	170.5	-83.4	152.5	0	0	0	109.2	T67 A71	T67-L69 PolarHBondContact O-N 3.49Å; L69-A71 PolarHBondContact O-N 3.38Å
70	P	44.8	Very low	57.4	Low	119 Å²	119	111.1 Å²	111.1	77%	0.773	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-54.3	130.5	-173.5	17.8	-29	0	0	0	110.2
71	A	41.4	Very low	60.4	Low	97 Å²	97	105.7 Å²	105.7	80%	0.802	61%	0.612	S	S	*	*	S	Bend	trans	-41	137.1	-179.7	0	0	0	0	0	111.5	L69 A73	L69-A71 PolarHBondContact O-N 3.38Å; A71-A73 PolarHBondContact O-N 2.97Å
72	A	45.2	Very low	63.1	Low	94 Å²	94	99.5 Å²	99.5	78%	0.777	57%	0.574	S	S	*	*	S	Bend	trans	-8.6	111.2	176.3	0	0	0	0	0	113.6	E74	A72-E74 PolarHBondContact O-N 2.99Å
73	A	49.4	Very low	65.8	Low	93 Å²	93	93.3 Å²	93.3	77%	0.769	54%	0.537	S	S	*	.			trans	-40.6	103.7	176.9	0	0	0	0	0	110.2	A71 E75	A71-A73 PolarHBondContact O-N 2.97Å; A73-E75 PolarHBondContact O-N 2.73Å
74	E	56.2	Low	68.1	Low	168 Å²	168	87.9 Å²	87.9	79%	0.785	50%	0.504	S	S	*	.			trans	-49.6	129.8	170.9	-71	-162.1	158.7	0	0	107.2	A72 R76	A72-E74 PolarHBondContact O-N 2.99Å; E74-R76 WeakPolarHBondContact O-CG 3.47Å; E74-R76 PolarHBondContact O-N 3.44Å
75	E	74.3	Confident	70.6	Confident	196 Å²	196	81.4 Å²	81.4	92%	0.916	47%	0.47	S	S	*	.			trans	-64.1	86.6	-176.6	-170.2	179.8	177.4	0	0	109.2	A73 K77	A73-E75 PolarHBondContact O-N 2.73Å; E75-K77 PolarHBondContact O-N 3.28Å
76	R	88.9	Confident	72.4	Confident	144 Å²	144	80 Å²	80	54%	0.543	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-70.5	126.2	-175.7	-61.6	-170.7	172.3	106.5	0.5	109.1	E74 L78 P108 R202	E74-R76 WeakPolarHBondContact O-CG 3.47Å; E74-R76 PolarHBondContact O-N 3.44Å; R76-L78 PolarHBondContact O-N 3.22Å; R76-P108 WeakPolarHBondContact O-CD 3.43Å; R76-P108 VanDerWaalsContact O-CG 3.32Å; R76-P108 WeakPolarHBondContact O-CG 3.35Å; R76-R202 VanDerWaalsContact CB-NH1 3.26Å
77	K	95.5	Very high	74.4	Confident	77 Å²	77	76.3 Å²	76.3	34%	0.335	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-52.8	131.3	179.5	-60	178.9	-168.1	147.4	0	112.5	E75 L79 I183 R202 I204	E75-K77 PolarHBondContact O-N 3.28Å; K77-L79 PolarHBondContact O-N 3.01Å; K77-I183 HydrophobicContact CB-CG1 4.37Å; K77-I183 HydrophobicContact CD-CD1 4.23Å; K77-I183 HydrophobicContact CD-CG1 4.21Å; K77-R202 WeakPolarHBondContact CD-O 3.45Å; K77-R202 WeakPolarHBondContact CE-O 3.42Å; K77-R202 PolarHBondContact NZ-O 2.81Å; K77-R202 PolarHBondContact O-NH1 3.24Å; K77-I204 PolarHBondContact NZ-O 3.27Å
78	L	97.8	Very high	76.3	Confident	41 Å²	41	70.6 Å²	70.6	22%	0.215	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-58.3	130.5	175.2	175.7	63.1	0	0	0	111.5	R76 L80 P108 L110 G182 I183	R76-L78 PolarHBondContact O-N 3.22Å; L78-L80 HydrophobicContact CD2-CD2 3.62Å; L78-L80 HydrophobicContact CD2-CG 4.41Å; L78-L80 HydrophobicContact CG-CD2 3.92Å; L78-L80 HydrophobicContact CG-CG 4.37Å; L78-P108 HydrophobicContact CD1-CB 4.02Å; L78-L110 HydrophobicContact CD1-CB 4.1Å; L78-G182 CarbonylContact O-C 3.43Å; L78-G182 WeakPolarHBondContact O-CA 3.37Å; L78-I183 PolarHBondContact O-N 3.1Å
79	L	98.5	Very high	78.3	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	124	169.5	-59.1	-176.1	0	0	0	109.7	K77 V81 P108 L109 L110 I183 F198 L201 R202	K77-L79 PolarHBondContact O-N 3.01Å; L79-V81 HydrophobicContact CB-CG2 4.45Å; L79-P108 PolarHBondContact N-O 3.31Å; L79-L109 HydrophobicContact CB-CB 4.42Å; L79-L109 HydrophobicContact CB-CD1 4.26Å; L79-L109 HydrophobicContact CB-CG 4.12Å; L79-L109 HydrophobicContact CD1-CD1 4.27Å; L79-L110 PolarHBondContact O-N 3.41Å; L79-I183 HydrophobicContact CD2-CB 4.04Å; L79-F198 HydrophobicContact CD1-CB 4.18Å; L79-F198 HydrophobicContact CD1-CD1 4.18Å; L79-L201 HydrophobicContact CD1-CB 4.48Å; L79-L201 HydrophobicContact CD1-CD1 4.45Å; L79-L201 HydrophobicContact CD2-CB 3.78Å; L79-R202 HydrophobicContact CD1-CG 4.45Å; L79-R202 HydrophobicContact CD2-CG 3.97Å; L79-R202 HydrophobicContact CG-CG 4.38Å
80	L	98.8	Very high	80.6	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	89.4	176.9	-59.8	171.8	0	0	0	108.3	L78 L110 I175 L180 I183 V184 Y185	L78-L80 HydrophobicContact CD2-CD2 3.62Å; L78-L80 HydrophobicContact CD2-CG 4.41Å; L78-L80 HydrophobicContact CG-CD2 3.92Å; L78-L80 HydrophobicContact CG-CG 4.37Å; L80-L110 HydrophobicContact CD2-CB 4.13Å; L80-L110 HydrophobicContact CD2-CD2 3.97Å; L80-L110 HydrophobicContact CD2-CG 4.43Å; L80-I175 HydrophobicContact CD1-CD1 4.46Å; L80-I175 HydrophobicContact CD1-CG1 4.38Å; L80-I175 HydrophobicContact CD1-CG2 4Å; L80-L180 HydrophobicContact CD1-CB 4.04Å; L80-L180 VanDerWaalsContact CD1-O 3.26Å; L80-L180 WeakPolarHBondContact CD1-O 3.43Å; L80-L180 HydrophobicContact CD2-CB 4.03Å; L80-L180 HydrophobicContact CD2-CD1 4.31Å; L80-I183 PolarHBondContact N-O 2.99Å; L80-V184 HydrophobicContact CB-CG2 4.47Å; L80-V184 HydrophobicContact CD1-CG2 4.08Å; L80-Y185 PolarHBondContact O-N 3.02Å
81	V	98.7	Very high	82.7	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	113.9	-175.7	-178.2	0	0	0	0	109.1	L79 L102 L109 L110 W111 L112 Y185 A187 F198	L79-V81 HydrophobicContact CB-CG2 4.45Å; V81-L102 HydrophobicContact CG1-CD1 4.21Å; V81-L102 HydrophobicContact CG1-CD2 4.17Å; V81-L102 HydrophobicContact CG2-CD2 4.19Å; V81-L109 HydrophobicContact CG2-CD1 3.92Å; V81-L109 HydrophobicContact CG2-CD2 4.2Å; V81-L109 HydrophobicContact CG2-CG 4.03Å; V81-L110 PolarHBondContact N-O 3.48Å; V81-W111 CarbonylContact O-C 3.58Å; V81-L112 PolarHBondContact O-N 3.12Å; V81-Y185 CarbonylContact C-O 3.54Å; V81-Y185 WeakPolarHBondContact CA-O 3.37Å; V81-A187 HydrophobicContact CG1-CB 3.51Å; V81-F198 HydrophobicContact CG2-CE1 4.39Å
82	V	98.7	Very high	85	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119.4	-178.1	176.8	0	0	0	0	109.7	L112 R168 A171 I175 V184 Y185 F186 A187	V82-L112 HydrophobicContact CG2-CB 4.34Å; V82-L112 HydrophobicContact CG2-CD1 4.04Å; V82-R168 HydrophobicContact CG1-CG 4.46Å; V82-A171 HydrophobicContact CB-CB 4.3Å; V82-A171 HydrophobicContact CG1-CB 3.44Å; V82-A171 VanDerWaalsContact CG1-CB 3.44Å; V82-A171 HydrophobicContact CG2-CB 3.85Å; V82-I175 HydrophobicContact CG2-CD1 4.01Å; V82-V184 HydrophobicContact CG2-CG1 4.19Å; V82-Y185 PolarHBondContact N-O 2.87Å; V82-F186 HydrophobicContact CB-CD1 3.79Å; V82-F186 HydrophobicContact CB-CE1 4.21Å; V82-F186 HydrophobicContact CG1-CD1 3.85Å; V82-F186 HydrophobicContact CG1-CE1 4.1Å; V82-F186 HydrophobicContact CG2-CD1 4.45Å; V82-F186 HydrophobicContact CG2-CE1 4.45Å; V82-A187 PolarHBondContact O-N 3.4Å
83	T	98	Very high	87.2	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	107.9	-179	-62.1	0	0	0	0	111	L95 L98 W111 L112 V114 A187 E189	T83-L95 HydrophobicContact CG2-CD2 4.2Å; T83-L98 HydrophobicContact CG2-CD2 3.86Å; T83-L98 WeakPolarHBondContact OG1-CD2 3.05Å; T83-W111 PolarHBondContact OG1-NE1 3.35Å; T83-L112 PolarHBondContact N-O 3.09Å; T83-V114 PolarHBondContact O-N 2.8Å; T83-A187 VanDerWaalsContact CA-O 3.32Å; T83-A187 WeakPolarHBondContact CA-O 3.08Å; T83-A187 VanDerWaalsContact CB-O 3.27Å; T83-A187 WeakPolarHBondContact CB-O 3.36Å; T83-A187 WeakPolarHBondContact CG2-O 3.31Å; T83-A187 PolarHBondContact OG1-O 3.16Å; T83-E189 HydrophobicContact CG2-CB 3.8Å
84	P	95.6	Very high	89.3	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.032	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	131.2	169	30.2	-31.9	0	0	0	110.3	R164 Q167	P84-R164 HydrophobicContact CB-CB 4.46Å; P84-R164 HydrophobicContact CB-CG 4.47Å; P84-Q167 HydrophobicContact CB-CB 3.85Å; P84-Q167 HydrophobicContact CB-CG 4.49Å
85	T	92.8	Very high	91.2	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.012	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	158	178.1	-170.4	0	0	0	0	111.5	Q91 V113 V114 E115 S116 Q167 E189	T85-Q91 WeakPolarHBondContact OG1-CG 3.46Å; T85-Q91 PolarHBondContact OG1-NE2 3.38Å; T85-V113 HydrophobicContact CG2-CG1 3.64Å; T85-V114 PolarHBondContact N-O 3.2Å; T85-E115 HydrophobicContact CG2-CB 3.88Å; T85-E115 HydrophobicContact CG2-CG 4.19Å; T85-E115 WeakPolarHBondContact O-CA 3.43Å; T85-S116 PolarHBondContact O-N 2.92Å; T85-Q167 PolarHBondContact O-NE2 2.86Å; T85-E189 WeakPolarHBondContact CB-OE2 3.48Å; T85-E189 PolarHBondContact OG1-OE2 3.44Å
86	R	87.5	Confident	92.3	Very high	97 Å²	97	38.4 Å²	38.4	37%	0.366	18%	0.178	S	C	.	.			trans	-146.7	154.8	176.2	62.5	-178.9	178.8	83.4	1.1	109.8	R88 Q91	R86-R88 PolarHBondContact O-N 2.7Å; R86-Q91 WeakPolarHBondContact O-CG 3.5Å; R86-Q91 PolarHBondContact O-NE2 3.49Å; R86-Q91 PolarHBondContact O-OE1 3.38Å
87	A	82.7	Confident	92.6	Very high	65 Å²	65	34.2 Å²	34.2	54%	0.537	16%	0.163	S	C	.	.	S	Bend	trans	-56	113.5	170.9	0	0	0	0	0	110.2
88	R	81.9	Confident	92.7	Very high	7 Å²	7	30.7 Å²	30.7	3%	0.026	15%	0.147	C	C	.	.			trans	-156.4	156.7	176.3	67.2	-170.8	-177.5	151.5	-17.4	110.5	R86 L90 Q91 Y94 E189 D190 D322	R86-R88 PolarHBondContact O-N 2.7Å; R88-L90 PolarHBondContact O-N 3.09Å; R88-L90 VanDerWaalsContact O-N 3.12Å; R88-Q91 HydrophobicContact CG-CB 3.88Å; R88-Q91 VanDerWaalsContact O-CB 3.23Å; R88-Q91 WeakPolarHBondContact O-CB 3.47Å; R88-Q91 PolarHBondContact O-N 3.18Å; R88-Y94 VanDerWaalsContact CZ-CD2 3.41Å; R88-Y94 VanDerWaalsContact NH2-CD2 3.26Å; R88-E189 IonicContact CZ-OE1 3.06Å; R88-E189 IonicContact NE-OE1 2.75Å; R88-E189 PolarHBondContact NE-OE1 2.94Å; R88-E189 VanDerWaalsContact NH2-CG 3.34Å; R88-E189 IonicContact NH2-OE1 2.75Å; R88-E189 PolarHBondContact NH2-OE1 3.35Å; R88-D190 IonicContact CZ-OD2 3.72Å; R88-D190 IonicContact NH1-OD2 2.73Å; R88-D190 PolarHBondContact NH1-OD2 2.87Å; R88-D190 IonicContact NH2-OD2 3.12Å; R88-D190 PolarHBondContact NH2-OD2 2.87Å; R88-D322 VanDerWaalsContact CD-OD2 3.31Å; R88-D322 WeakPolarHBondContact CD-OD2 3.15Å; R88-D322 IonicContact CZ-OD2 2.96Å; R88-D322 IonicContact NE-OD2 3.89Å; R88-D322 IonicContact NH1-OD2 3.79Å; R88-D322 PolarHBondContact NH1-OD2 2.98Å
89	P	80.2	Confident	92.7	Very high	28 Å²	28	28.8 Å²	28.8	18%	0.182	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.4	-43.2	-179.5	-35.6	40.8	0	0	0	115	I326	P89-I326 WeakPolarHBondContact CB-O 3.34Å; P89-I326 VanDerWaalsContact CG-O 3.24Å; P89-I326 WeakPolarHBondContact CG-O 3.4Å
90	L	84.9	Confident	92.7	Very high	57 Å²	57	33.7 Å²	33.7	30%	0.298	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	6.3	-175.3	-62.6	180	0	0	0	114.4	R88 A92 Y93 Y94 W331	R88-L90 PolarHBondContact O-N 3.09Å; R88-L90 VanDerWaalsContact O-N 3.12Å; L90-A92 VanDerWaalsContact C-N 3.33Å; L90-A92 PolarHBondContact O-N 3.49Å; L90-Y93 WeakPolarHBondContact O-CB 3.29Å; L90-Y93 PolarHBondContact O-N 3.39Å; L90-Y93 VanDerWaalsContact O-N 3.07Å; L90-Y94 HydrophobicContact CB-CD2 3.8Å; L90-Y94 HydrophobicContact CB-CE2 3.32Å; L90-Y94 HydrophobicContact CD1-CE2 4.2Å; L90-Y94 WeakPolarHBondContact CD1-OH 3.48Å; L90-Y94 HydrophobicContact CG-CE2 4.41Å; L90-Y94 WeakPolarHBondContact O-CD2 3.41Å; L90-Y94 PolarHBondContact O-N 3.13Å; L90-W331 HydrophobicContact CD2-CH2 3.61Å; L90-W331 HydrophobicContact CD2-CZ3 3.81Å
91	Q	89.3	Confident	92.6	Very high	10 Å²	10	35.1 Å²	35.1	5%	0.047	17%	0.169	C	C	.	.	H	α-helix	trans	-51.8	-51.9	-175.8	-172.3	-174.6	13	0	0	111.8	T85 R86 R88 Y93 Y94 L95 T123	T85-Q91 WeakPolarHBondContact OG1-CG 3.46Å; T85-Q91 PolarHBondContact OG1-NE2 3.38Å; R86-Q91 WeakPolarHBondContact O-CG 3.5Å; R86-Q91 PolarHBondContact O-NE2 3.49Å; R86-Q91 PolarHBondContact O-OE1 3.38Å; R88-Q91 HydrophobicContact CG-CB 3.88Å; R88-Q91 VanDerWaalsContact O-CB 3.23Å; R88-Q91 WeakPolarHBondContact O-CB 3.47Å; R88-Q91 PolarHBondContact O-N 3.18Å; Q91-Y93 VanDerWaalsContact C-N 3.29Å; Q91-Y93 PolarHBondContact O-N 2.67Å; Q91-Y94 PolarHBondContact O-N 3.12Å; Q91-L95 HydrophobicContact CG-CD1 4Å; Q91-L95 HydrophobicContact CG-CG 4.49Å; Q91-L95 WeakPolarHBondContact O-CB 3.43Å; Q91-L95 WeakPolarHBondContact O-CG 3.41Å; Q91-L95 PolarHBondContact O-N 3.37Å; Q91-T123 PolarHBondContact NE2-OG1 2.96Å
92	A	91.1	Very high	92.6	Very high	22 Å²	22	35.3 Å²	35.3	18%	0.182	17%	0.17	C	C	.	.	H	α-helix	trans	-66.9	-29	-176.5	0	0	0	0	0	113.3	L90 R96 L126 W331	L90-A92 VanDerWaalsContact C-N 3.33Å; L90-A92 PolarHBondContact O-N 3.49Å; A92-R96 VanDerWaalsContact O-CB 3.25Å; A92-R96 WeakPolarHBondContact O-CB 3.32Å; A92-R96 WeakPolarHBondContact O-CG 3.08Å; A92-R96 PolarHBondContact O-N 3.25Å; A92-R96 VanDerWaalsContact O-N 3.07Å; A92-L126 HydrophobicContact CB-CD1 3.22Å; A92-W331 HydrophobicContact CB-CZ2 3.77Å
93	Y	91.2	Very high	92.5	Very high	115 Å²	115	41.3 Å²	41.3	45%	0.451	19%	0.193	S	C	.	.	H	α-helix	trans	-71.7	-48.6	175.4	163	-97.6	0	0	0	110	L90 Q91 R96 R97 W331	L90-Y93 WeakPolarHBondContact O-CB 3.29Å; L90-Y93 PolarHBondContact O-N 3.39Å; L90-Y93 VanDerWaalsContact O-N 3.07Å; Q91-Y93 VanDerWaalsContact C-N 3.29Å; Q91-Y93 PolarHBondContact O-N 2.67Å; Y93-R96 PolarHBondContact O-N 2.81Å; Y93-R97 WeakPolarHBondContact O-CB 3.38Å; Y93-R97 PolarHBondContact O-N 2.95Å; Y93-W331 HydrophobicContact CG-CH2 4.38Å
94	Y	93.7	Very high	92.5	Very high	8 Å²	8	46.9 Å²	46.9	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-60.4	-48.5	178.8	-67.1	-45.8	0	0	0	111.8	R88 L90 Q91 R96 R97 L98 E189 D190 L320	R88-Y94 VanDerWaalsContact CZ-CD2 3.41Å; R88-Y94 VanDerWaalsContact NH2-CD2 3.26Å; L90-Y94 HydrophobicContact CB-CD2 3.8Å; L90-Y94 HydrophobicContact CB-CE2 3.32Å; L90-Y94 HydrophobicContact CD1-CE2 4.2Å; L90-Y94 WeakPolarHBondContact CD1-OH 3.48Å; L90-Y94 HydrophobicContact CG-CE2 4.41Å; L90-Y94 WeakPolarHBondContact O-CD2 3.41Å; L90-Y94 PolarHBondContact O-N 3.13Å; Q91-Y94 PolarHBondContact O-N 3.12Å; Y94-R96 PolarHBondContact O-N 3.06Å; Y94-R97 PolarHBondContact O-N 3.19Å; Y94-L98 WeakPolarHBondContact O-CB 3.32Å; Y94-L98 PolarHBondContact O-N 3.47Å; Y94-E189 WeakPolarHBondContact CB-O 3.47Å; Y94-E189 HydrophobicContact CG-CG 4.45Å; Y94-D190 HydrophobicContact CD1-CB 3.97Å; Y94-D190 HydrophobicContact CD2-CB 4.44Å; Y94-D190 HydrophobicContact CE1-CB 3.89Å; Y94-D190 HydrophobicContact CE2-CB 4.35Å; Y94-D190 HydrophobicContact CG-CB 4.27Å; Y94-L320 HydrophobicContact CE1-CD1 3.98Å; Y94-L320 WeakPolarHBondContact OH-CD1 3.34Å
95	L	96	Very high	92.5	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.7	-42	177.2	-69.5	178.2	0	0	0	112.5	T83 Q91 A99 W111 V113 T123 L126 E189	T83-L95 HydrophobicContact CG2-CD2 4.2Å; Q91-L95 HydrophobicContact CG-CD1 4Å; Q91-L95 HydrophobicContact CG-CG 4.49Å; Q91-L95 WeakPolarHBondContact O-CB 3.43Å; Q91-L95 WeakPolarHBondContact O-CG 3.41Å; Q91-L95 PolarHBondContact O-N 3.37Å; L95-A99 VanDerWaalsContact O-CB 3.27Å; L95-A99 WeakPolarHBondContact O-CB 3.21Å; L95-A99 PolarHBondContact O-N 3.02Å; L95-W111 HydrophobicContact CB-CH2 4.28Å; L95-W111 HydrophobicContact CD2-CH2 4.08Å; L95-W111 HydrophobicContact CD2-CZ2 3.81Å; L95-W111 WeakPolarHBondContact O-CH2 3.03Å; L95-V113 HydrophobicContact CD2-CG1 4.22Å; L95-T123 HydrophobicContact CD1-CG2 4.15Å; L95-L126 HydrophobicContact CB-CD2 3.63Å; L95-L126 HydrophobicContact CD1-CD2 4.01Å; L95-E189 HydrophobicContact CD2-CB 4.23Å
96	R	96.1	Very high	92.5	Very high	129 Å²	129	48 Å²	48	49%	0.487	23%	0.23	S	C	.	.	H	α-helix	trans	-64.8	-46.6	176.6	-79.5	176.3	178.5	-176.2	0.9	111.7	A92 Y93 Y94 L98 A99 H100 L126	A92-R96 VanDerWaalsContact O-CB 3.25Å; A92-R96 WeakPolarHBondContact O-CB 3.32Å; A92-R96 WeakPolarHBondContact O-CG 3.08Å; A92-R96 PolarHBondContact O-N 3.25Å; A92-R96 VanDerWaalsContact O-N 3.07Å; Y93-R96 PolarHBondContact O-N 2.81Å; Y94-R96 PolarHBondContact O-N 3.06Å; R96-L98 VanDerWaalsContact C-N 3.34Å; R96-L98 PolarHBondContact O-N 3.24Å; R96-A99 WeakPolarHBondContact O-CB 3.26Å; R96-A99 PolarHBondContact O-N 2.94Å; R96-H100 PolarHBondContact O-CD2 2.86Å; R96-H100 PolarHBondContact O-N 2.81Å; R96-L126 HydrophobicContact CG-CD1 4.16Å; R96-L126 HydrophobicContact CG-CG 4.3Å
97	R	96.4	Very high	92.8	Very high	56 Å²	56	47.9 Å²	47.9	21%	0.211	24%	0.244	C	C	.	.	H	α-helix	trans	-58	-48.1	178.5	-174.7	-172.2	64.4	158.1	-1.6	110.7	Y93 Y94 A99 H100 T101 E189 D190 N191	Y93-R97 WeakPolarHBondContact O-CB 3.38Å; Y93-R97 PolarHBondContact O-N 2.95Å; Y94-R97 PolarHBondContact O-N 3.19Å; R97-A99 PolarHBondContact O-N 2.8Å; R97-H100 PolarHBondContact O-N 3.08Å; R97-T101 PolarHBondContact O-N 2.82Å; R97-T101 PolarHBondContact O-OG1 3.17Å; R97-E189 PolarHBondContact NH2-O 3.21Å; R97-D190 PolarHBondContact NH2-O 2.74Å; R97-N191 PolarHBondContact NH2-O 2.74Å
98	L	97.8	Very high	93.5	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-61.7	-44.9	176.1	-179.1	56.9	0	0	0	111.2	T83 Y94 R96 H100 T101 L102 W111 A187 Y193	T83-L98 HydrophobicContact CG2-CD2 3.86Å; T83-L98 WeakPolarHBondContact OG1-CD2 3.05Å; Y94-L98 WeakPolarHBondContact O-CB 3.32Å; Y94-L98 PolarHBondContact O-N 3.47Å; R96-L98 VanDerWaalsContact C-N 3.34Å; R96-L98 PolarHBondContact O-N 3.24Å; L98-H100 VanDerWaalsContact C-N 3.29Å; L98-H100 PolarHBondContact O-N 2.86Å; L98-T101 WeakPolarHBondContact O-CB 3.32Å; L98-T101 PolarHBondContact O-N 3.37Å; L98-T101 VanDerWaalsContact O-N 3.08Å; L98-L102 HydrophobicContact CD1-CD1 4.32Å; L98-L102 HydrophobicContact CD1-CD2 4.27Å; L98-L102 HydrophobicContact CD1-CG 4.02Å; L98-L102 HydrophobicContact CG-CD1 3.99Å; L98-L102 HydrophobicContact CG-CG 4.15Å; L98-L102 WeakPolarHBondContact O-CG 3.44Å; L98-L102 PolarHBondContact O-N 2.56Å; L98-W111 HydrophobicContact CD2-CZ2 4Å; L98-W111 HydrophobicContact CG-CZ2 4.28Å; L98-A187 HydrophobicContact CD2-CB 4.41Å; L98-Y193 HydrophobicContact CD1-CD2 3.7Å; L98-Y193 HydrophobicContact CD1-CE2 3.78Å
99	A	98	Very high	94.2	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-58.7	-38	176.8	0	0	0	0	0	113.4	L95 R96 R97 L102 R103 W111 C130 V132	L95-A99 VanDerWaalsContact O-CB 3.27Å; L95-A99 WeakPolarHBondContact O-CB 3.21Å; L95-A99 PolarHBondContact O-N 3.02Å; R96-A99 WeakPolarHBondContact O-CB 3.26Å; R96-A99 PolarHBondContact O-N 2.94Å; R97-A99 PolarHBondContact O-N 2.8Å; A99-L102 PolarHBondContact O-N 2.8Å; A99-R103 WeakPolarHBondContact O-CB 3.39Å; A99-R103 PolarHBondContact O-N 2.82Å; A99-W111 HydrophobicContact CB-CH2 4.02Å; A99-W111 HydrophobicContact CB-CZ3 3.77Å; A99-C130 HydrophobicContact CB-CB 3.6Å; A99-C130 WeakPolarHBondContact CB-SG 3.21Å; A99-V132 HydrophobicContact CB-CG2 4.34Å; A99-V132 WeakPolarHBondContact O-CG2 3.12Å
100	H	97.5	Very high	95.1	Very high	102 Å²	102	46.7 Å²	46.7	47%	0.472	23%	0.23	S	C	.	.	H	α-helix	trans	-62.1	-44.4	173.9	-71.4	-63.4	0	0	0	111.5	R96 R97 L98 R103 L104	R96-H100 PolarHBondContact O-CD2 2.86Å; R96-H100 PolarHBondContact O-N 2.81Å; R97-H100 PolarHBondContact O-N 3.08Å; L98-H100 VanDerWaalsContact C-N 3.29Å; L98-H100 PolarHBondContact O-N 2.86Å; H100-R103 PolarHBondContact O-N 3.48Å; H100-L104 PolarHBondContact O-N 2.98Å
101	T	97.9	Very high	95.8	Very high	30 Å²	30	44 Å²	44	18%	0.184	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-47.3	173.9	-55.9	0	0	0	0	111.7	R97 L98 R103 L104 A105 L195 F198	R97-T101 PolarHBondContact O-N 2.82Å; R97-T101 PolarHBondContact O-OG1 3.17Å; L98-T101 WeakPolarHBondContact O-CB 3.32Å; L98-T101 PolarHBondContact O-N 3.37Å; L98-T101 VanDerWaalsContact O-N 3.08Å; T101-R103 VanDerWaalsContact C-N 3.27Å; T101-R103 PolarHBondContact O-N 2.96Å; T101-L104 PolarHBondContact O-N 3.23Å; T101-L104 VanDerWaalsContact O-N 3.14Å; T101-A105 PolarHBondContact O-N 2.97Å; T101-L195 HydrophobicContact CG2-CD2 4Å; T101-F198 HydrophobicContact CG2-CE2 3.79Å; T101-F198 HydrophobicContact CG2-CZ 4.38Å
102	L	98.1	Very high	96.2	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.021	21%	0.214	C	C	.	.	H	α-helix	trans	-65.9	-28.2	-178.9	-64.4	-178.5	0	0	0	113.1	V81 L98 A99 L104 A105 L109 W111 V132 F198	V81-L102 HydrophobicContact CG1-CD1 4.21Å; V81-L102 HydrophobicContact CG1-CD2 4.17Å; V81-L102 HydrophobicContact CG2-CD2 4.19Å; L98-L102 HydrophobicContact CD1-CD1 4.32Å; L98-L102 HydrophobicContact CD1-CD2 4.27Å; L98-L102 HydrophobicContact CD1-CG 4.02Å; L98-L102 HydrophobicContact CG-CD1 3.99Å; L98-L102 HydrophobicContact CG-CG 4.15Å; L98-L102 WeakPolarHBondContact O-CG 3.44Å; L98-L102 PolarHBondContact O-N 2.56Å; A99-L102 PolarHBondContact O-N 2.8Å; L102-L104 VanDerWaalsContact C-N 3.3Å; L102-A105 WeakPolarHBondContact O-CB 3.23Å; L102-A105 PolarHBondContact O-N 3.08Å; L102-L109 HydrophobicContact CB-CD2 4.44Å; L102-L109 HydrophobicContact CD1-CD2 4.44Å; L102-L109 HydrophobicContact CD2-CD1 4.03Å; L102-W111 HydrophobicContact CD1-CB 4.19Å; L102-W111 HydrophobicContact CD1-CD2 3.69Å; L102-W111 HydrophobicContact CD1-CE3 4.31Å; L102-W111 HydrophobicContact CD1-CG 3.63Å; L102-V132 HydrophobicContact CB-CG1 4.18Å; L102-V132 HydrophobicContact CB-CG2 4.1Å; L102-F198 HydrophobicContact CD2-CD1 4.34Å; L102-F198 HydrophobicContact CD2-CE1 3.42Å; L102-F198 VanDerWaalsContact CD2-CE1 3.42Å; L102-F198 HydrophobicContact CD2-CZ 3.53Å
103	R	96.8	Very high	96.5	Very high	127 Å²	127	42.5 Å²	42.5	48%	0.479	21%	0.205	S	C	.	.	H	α-helix	trans	-69.2	-30.1	175.3	-165.3	-173.9	-55.2	174.4	5.5	112.6	A99 H100 T101 A105 C130 V132	A99-R103 WeakPolarHBondContact O-CB 3.39Å; A99-R103 PolarHBondContact O-N 2.82Å; H100-R103 PolarHBondContact O-N 3.48Å; T101-R103 VanDerWaalsContact C-N 3.27Å; T101-R103 PolarHBondContact O-N 2.96Å; R103-A105 VanDerWaalsContact C-N 3.35Å; R103-C130 VanDerWaalsContact CZ-O 3.31Å; R103-C130 PolarHBondContact NE-O 3.38Å; R103-C130 PolarHBondContact NH2-O 3.24Å; R103-V132 HydrophobicContact CB-CG2 4.18Å
104	L	97	Very high	96.8	Very high	117 Å²	117	37 Å²	37	61%	0.613	18%	0.184	S	C	*	.	H	α-helix	trans	-83.4	-15.8	175.9	-62.9	174	0	0	0	112.1	H100 T101 L102 L195	H100-L104 PolarHBondContact O-N 2.98Å; T101-L104 PolarHBondContact O-N 3.23Å; T101-L104 VanDerWaalsContact O-N 3.14Å; L102-L104 VanDerWaalsContact C-N 3.3Å; L104-L195 HydrophobicContact CB-CD1 3.91Å; L104-L195 HydrophobicContact CB-CD2 3.71Å; L104-L195 HydrophobicContact CB-CG 4.49Å; L104-L195 HydrophobicContact CD1-CD1 4.29Å
105	A	96.2	Very high	96.9	Very high	8 Å²	8	36.7 Å²	36.7	7%	0.066	18%	0.182	C	C	.	.	S	Bend	trans	-69.1	143.6	174.1	0	0	0	0	0	110.6	T101 L102 R103 L109 F198	T101-A105 PolarHBondContact O-N 2.97Å; L102-A105 WeakPolarHBondContact O-CB 3.23Å; L102-A105 PolarHBondContact O-N 3.08Å; R103-A105 VanDerWaalsContact C-N 3.35Å; A105-L109 HydrophobicContact CB-CD1 4.03Å; A105-F198 HydrophobicContact CB-CB 3.8Å; A105-F198 HydrophobicContact CB-CD1 4.15Å; A105-F198 HydrophobicContact CB-CD2 4.1Å; A105-F198 HydrophobicContact CB-CG 3.74Å
106	P	91.8	Very high	96.6	Very high	23 Å²	23	37.9 Å²	37.9	15%	0.149	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-59.2	144	177.5	-22.6	31.9	0	0	0	112	Y199 R202	P106-Y199 HydrophobicContact CG-CD1 3.61Å; P106-Y199 HydrophobicContact CG-CE1 3.15Å; P106-R202 PolarHBondContact O-NH2 3.18Å
107	S	94.3	Very high	96.2	Very high	94 Å²	94	32.7 Å²	32.7	66%	0.657	18%	0.177	S	C	*	.	S	Bend	trans	-76.7	156.1	169.1	-71.4	0	0	0	0	111.8	R202	S107-R202 VanDerWaalsContact C-NH2 3.3Å; S107-R202 PolarHBondContact O-NH2 3.11Å
108	P	96.8	Very high	95.5	Very high	56 Å²	56	33.8 Å²	33.8	36%	0.364	20%	0.199	S	C	.	.	P	Polyproline II helix	cis	-84.9	141.3	-0.1	31.7	-34.3	0	0	0	113.6	R76 L78 L79 R202	R76-P108 WeakPolarHBondContact O-CD 3.43Å; R76-P108 VanDerWaalsContact O-CG 3.32Å; R76-P108 WeakPolarHBondContact O-CG 3.35Å; L78-P108 HydrophobicContact CD1-CB 4.02Å; L79-P108 PolarHBondContact N-O 3.31Å; P108-R202 PolarHBondContact O-NH2 3.11Å
109	L	97.8	Very high	94.9	Very high	15 Å²	15	36.2 Å²	36.2	8%	0.079	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	134.5	178.7	-174.7	150.1	0	0	0	109.9	L79 V81 L102 A105 W111 V132 F198	L79-L109 HydrophobicContact CB-CB 4.42Å; L79-L109 HydrophobicContact CB-CD1 4.26Å; L79-L109 HydrophobicContact CB-CG 4.12Å; L79-L109 HydrophobicContact CD1-CD1 4.27Å; V81-L109 HydrophobicContact CG2-CD1 3.92Å; V81-L109 HydrophobicContact CG2-CD2 4.2Å; V81-L109 HydrophobicContact CG2-CG 4.03Å; L102-L109 HydrophobicContact CB-CD2 4.44Å; L102-L109 HydrophobicContact CD1-CD2 4.44Å; L102-L109 HydrophobicContact CD2-CD1 4.03Å; A105-L109 HydrophobicContact CB-CD1 4.03Å; L109-W111 HydrophobicContact CD2-CB 4.26Å; L109-V132 HydrophobicContact CD2-CG1 3.85Å; L109-F198 HydrophobicContact CD1-CD1 4.4Å
110	L	98.5	Very high	94.4	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.021	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	121.4	172.1	172.2	58.8	0	0	0	109.6	L78 L79 L80 V81 L112 M133 R135 L180	L78-L110 HydrophobicContact CD1-CB 4.1Å; L79-L110 PolarHBondContact O-N 3.41Å; L80-L110 HydrophobicContact CD2-CB 4.13Å; L80-L110 HydrophobicContact CD2-CD2 3.97Å; L80-L110 HydrophobicContact CD2-CG 4.43Å; V81-L110 PolarHBondContact N-O 3.48Å; L110-L112 HydrophobicContact CD1-CD2 4.45Å; L110-L112 HydrophobicContact CD2-CD2 4Å; L110-L112 HydrophobicContact CG-CD2 4.04Å; L110-L112 HydrophobicContact CG-CG 4.4Å; L110-M133 HydrophobicContact CB-CE 3.69Å; L110-M133 HydrophobicContact CD1-CE 3.67Å; L110-M133 HydrophobicContact CD1-CG 4.27Å; L110-M133 HydrophobicContact CD2-CE 4.41Å; L110-M133 HydrophobicContact CG-CE 4.09Å; L110-R135 HydrophobicContact CD1-CG 4.02Å; L110-L180 HydrophobicContact CD2-CD1 3.87Å
111	W	98.7	Very high	94	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	112.5	178.7	-171.7	27.3	0	0	0	111.5	V81 T83 L95 L98 A99 L102 L109 V113 L127 C130 V132 M133 Y134 R135	V81-W111 CarbonylContact O-C 3.58Å; T83-W111 PolarHBondContact OG1-NE1 3.35Å; L95-W111 HydrophobicContact CB-CH2 4.28Å; L95-W111 HydrophobicContact CD2-CH2 4.08Å; L95-W111 HydrophobicContact CD2-CZ2 3.81Å; L95-W111 WeakPolarHBondContact O-CH2 3.03Å; L98-W111 HydrophobicContact CD2-CZ2 4Å; L98-W111 HydrophobicContact CG-CZ2 4.28Å; A99-W111 HydrophobicContact CB-CH2 4.02Å; A99-W111 HydrophobicContact CB-CZ3 3.77Å; L102-W111 HydrophobicContact CD1-CB 4.19Å; L102-W111 HydrophobicContact CD1-CD2 3.69Å; L102-W111 HydrophobicContact CD1-CE3 4.31Å; L102-W111 HydrophobicContact CD1-CG 3.63Å; L109-W111 HydrophobicContact CD2-CB 4.26Å; W111-V113 HydrophobicContact CD2-CG2 3.47Å; W111-V113 VanDerWaalsContact CD2-CG2 3.47Å; W111-V113 HydrophobicContact CE3-CG2 3.94Å; W111-V113 HydrophobicContact CG-CG2 3.9Å; W111-V113 HydrophobicContact CH2-CG2 4.08Å; W111-V113 HydrophobicContact CZ2-CG2 3.63Å; W111-V113 HydrophobicContact CZ3-CG2 4.22Å; W111-L127 HydrophobicContact CE3-CD2 4.17Å; W111-L127 HydrophobicContact CH2-CD2 3.64Å; W111-L127 HydrophobicContact CZ2-CD2 4.48Å; W111-L127 HydrophobicContact CZ3-CD2 3.45Å; W111-L127 VanDerWaalsContact CZ3-CD2 3.45Å; W111-C130 HydrophobicContact CZ3-CB 4.26Å; W111-V132 HydrophobicContact CB-CG1 3.93Å; W111-V132 HydrophobicContact CE3-CB 4.25Å; W111-V132 HydrophobicContact CE3-CG1 4.26Å; W111-M133 PolarHBondContact N-O 2.95Å; W111-Y134 CarbonylContact O-C 3.59Å; W111-Y134 WeakPolarHBondContact O-CA 3.37Å; W111-Y134 WeakPolarHBondContact O-CB 3.27Å; W111-R135 PolarHBondContact O-N 3.25Å
112	L	98.6	Very high	93.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	99.4	177.4	-60	174.6	0	0	0	109	V81 V82 T83 L110 R135 I175	V81-L112 PolarHBondContact O-N 3.12Å; V82-L112 HydrophobicContact CG2-CB 4.34Å; V82-L112 HydrophobicContact CG2-CD1 4.04Å; T83-L112 PolarHBondContact N-O 3.09Å; L110-L112 HydrophobicContact CD1-CD2 4.45Å; L110-L112 HydrophobicContact CD2-CD2 4Å; L110-L112 HydrophobicContact CG-CD2 4.04Å; L110-L112 HydrophobicContact CG-CG 4.4Å; L112-R135 HydrophobicContact CD2-CB 3.79Å; L112-R135 HydrophobicContact CD2-CG 4.23Å; L112-I175 HydrophobicContact CD1-CD1 3.57Å; L112-I175 HydrophobicContact CD1-CG1 3.44Å; L112-I175 VanDerWaalsContact CD1-CG1 3.44Å
113	V	98.2	Very high	93.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	114.5	179.6	-176.8	0	0	0	0	108.8	T85 L95 W111 L127 R135 H136 L137	T85-V113 HydrophobicContact CG2-CG1 3.64Å; L95-V113 HydrophobicContact CD2-CG1 4.22Å; W111-V113 HydrophobicContact CD2-CG2 3.47Å; W111-V113 VanDerWaalsContact CD2-CG2 3.47Å; W111-V113 HydrophobicContact CE3-CG2 3.94Å; W111-V113 HydrophobicContact CG-CG2 3.9Å; W111-V113 HydrophobicContact CH2-CG2 4.08Å; W111-V113 HydrophobicContact CZ2-CG2 3.63Å; W111-V113 HydrophobicContact CZ3-CG2 4.22Å; V113-L127 HydrophobicContact CB-CD1 3.91Å; V113-L127 HydrophobicContact CB-CD2 4.43Å; V113-L127 HydrophobicContact CG1-CD1 4Å; V113-L127 HydrophobicContact CG1-CD2 4.38Å; V113-L127 HydrophobicContact CG2-CD1 4.11Å; V113-L127 HydrophobicContact CG2-CD2 3.82Å; V113-R135 PolarHBondContact N-O 2.72Å; V113-H136 WeakPolarHBondContact O-CA 3.2Å; V113-L137 PolarHBondContact O-N 2.69Å
114	V	97.4	Very high	93.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	106.5	-177.5	-167.2	0	0	0	0	109.7	T83 T85 L137 Q167 T170 A171	T83-V114 PolarHBondContact O-N 2.8Å; T85-V114 PolarHBondContact N-O 3.2Å; V114-L137 CarbonylContact C-O 3.57Å; V114-L137 WeakPolarHBondContact CA-O 3.38Å; V114-L137 HydrophobicContact CG1-CB 4.28Å; V114-L137 HydrophobicContact CG2-CB 4.24Å; V114-L137 HydrophobicContact CG2-CD1 4.25Å; V114-Q167 HydrophobicContact CB-CB 4.04Å; V114-Q167 HydrophobicContact CG1-CB 3.75Å; V114-Q167 HydrophobicContact CG1-CG 4Å; V114-Q167 PolarHBondContact O-NE2 3.31Å; V114-T170 HydrophobicContact CG1-CG2 4.24Å; V114-A171 HydrophobicContact CG2-CB 3.81Å
115	E	94.2	Very high	93.1	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	131.3	178.5	-169.8	166.8	-156.4	0	0	110.9	T85 A119 T120 T123 H136 L137 S138 S139	T85-E115 HydrophobicContact CG2-CB 3.88Å; T85-E115 HydrophobicContact CG2-CG 4.19Å; T85-E115 WeakPolarHBondContact O-CA 3.43Å; E115-A119 WeakPolarHBondContact OE2-CA 3.18Å; E115-T120 WeakPolarHBondContact OE1-CG2 3.4Å; E115-T120 PolarHBondContact OE1-OG1 3.36Å; E115-T120 PolarHBondContact OE2-N 3.41Å; E115-T120 PolarHBondContact OE2-OG1 3.18Å; E115-T123 WeakPolarHBondContact OE1-CB 3.41Å; E115-T123 PolarHBondContact OE1-OG1 3.09Å; E115-T123 WeakPolarHBondContact OE2-CB 3.29Å; E115-H136 IonicContact OE2-CE1 2.67Å; E115-H136 PolarHBondContact OE2-CE1 2.66Å; E115-H136 IonicContact OE2-NE2 2.65Å; E115-H136 PolarHBondContact OE2-NE2 3.23Å; E115-L137 PolarHBondContact N-O 3.35Å; E115-S138 WeakPolarHBondContact O-CA 3.3Å; E115-S139 PolarHBondContact O-N 3.22Å
116	S	90.4	Very high	93	Very high	26 Å²	26	39.7 Å²	39.7	18%	0.182	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	128.3	172.6	-172.5	0	0	0	0	110.1	T85 S163	T85-S116 PolarHBondContact O-N 2.92Å; S116-S163 PolarHBondContact OG-OG 3.49Å; S116-S163 VanDerWaalsContact OG-OG 3.12Å
117	G	86.9	Confident	93.2	Very high	19 Å²	19	38.6 Å²	38.6	20%	0.196	24%	0.236	C	C	.	.	S	Bend	trans	84.2	-148.4	-170.1	0	0	0	0	0	113.3	S138 S139	G117-S138 VanDerWaalsContact O-CB 3.29Å; G117-S138 WeakPolarHBondContact O-CB 3.43Å; G117-S139 WeakPolarHBondContact CA-O 3.44Å; G117-S139 PolarHBondContact N-O 3.42Å
118	A	83.3	Confident	93.3	Very high	80 Å²	80	41.9 Å²	41.9	66%	0.661	23%	0.234	S	C	*	.	S	Bend	trans	-79.2	142.3	178.7	0	0	0	0	0	110.5	T120	A118-T120 PolarHBondContact O-N 2.88Å; A118-T120 VanDerWaalsContact O-N 3.15Å
119	A	84.5	Confident	93.2	Very high	53 Å²	53	42.2 Å²	42.2	44%	0.438	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-58.3	117.8	171.2	0	0	0	0	0	109.9	E115	E115-A119 WeakPolarHBondContact OE2-CA 3.18Å
120	T	87.7	Confident	93.1	Very high	51 Å²	51	41.8 Å²	41.8	31%	0.313	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-87.1	149.8	-176.8	64.1	0	0	0	0	111.3	E115 A118 D122 T123 A124	E115-T120 WeakPolarHBondContact OE1-CG2 3.4Å; E115-T120 PolarHBondContact OE1-OG1 3.36Å; E115-T120 PolarHBondContact OE2-N 3.41Å; E115-T120 PolarHBondContact OE2-OG1 3.18Å; A118-T120 PolarHBondContact O-N 2.88Å; A118-T120 VanDerWaalsContact O-N 3.15Å; T120-D122 PolarHBondContact O-N 3.5Å; T120-T123 VanDerWaalsContact OG1-CB 3.26Å; T120-T123 WeakPolarHBondContact OG1-CB 3.34Å; T120-T123 PolarHBondContact OG1-N 3.24Å; T120-T123 PolarHBondContact OG1-OG1 3.44Å; T120-A124 WeakPolarHBondContact O-CB 3.23Å; T120-A124 PolarHBondContact O-N 2.95Å
121	R	90	Very high	93	Very high	222 Å²	222	44.5 Å²	44.5	84%	0.838	28%	0.275	S	S	*	.	H	α-helix	trans	-62.8	-33.8	176.5	-72.3	-175	174.7	-169.9	-1.1	111.9	A124 A125	R121-A124 PolarHBondContact O-N 2.85Å; R121-A125 WeakPolarHBondContact O-CB 3.48Å; R121-A125 PolarHBondContact O-N 3.48Å
122	D	90	Very high	92.9	Very high	100 Å²	100	45.2 Å²	45.2	54%	0.535	28%	0.279	S	S	.	.	H	α-helix	trans	-70.5	-46.8	-178.6	-60	-26.1	0	0	0	111.2	T120 A124 A125 L126	T120-D122 PolarHBondContact O-N 3.5Å; D122-A124 VanDerWaalsContact C-N 3.34Å; D122-A124 PolarHBondContact O-N 2.88Å; D122-A125 PolarHBondContact O-N 3.47Å; D122-L126 WeakPolarHBondContact O-CB 3.13Å; D122-L126 PolarHBondContact O-N 3.12Å
123	T	92.3	Very high	92.9	Very high	5 Å²	5	51 Å²	51	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-44.6	172.5	-61.1	0	0	0	0	110.6	Q91 L95 E115 T120 A125 L126 L127	Q91-T123 PolarHBondContact NE2-OG1 2.96Å; L95-T123 HydrophobicContact CD1-CG2 4.15Å; E115-T123 WeakPolarHBondContact OE1-CB 3.41Å; E115-T123 PolarHBondContact OE1-OG1 3.09Å; E115-T123 WeakPolarHBondContact OE2-CB 3.29Å; T120-T123 VanDerWaalsContact OG1-CB 3.26Å; T120-T123 WeakPolarHBondContact OG1-CB 3.34Å; T120-T123 PolarHBondContact OG1-N 3.24Å; T120-T123 PolarHBondContact OG1-OG1 3.44Å; T123-A125 VanDerWaalsContact C-N 3.35Å; T123-A125 PolarHBondContact O-N 3.5Å; T123-L126 WeakPolarHBondContact O-CB 3.42Å; T123-L126 PolarHBondContact O-N 2.82Å; T123-L127 HydrophobicContact CG2-CD1 4.07Å; T123-L127 HydrophobicContact CG2-CG 4.35Å; T123-L127 VanDerWaalsContact O-CG 3.29Å; T123-L127 WeakPolarHBondContact O-CG 3.36Å; T123-L127 PolarHBondContact O-N 3.45Å
124	A	93.9	Very high	92.9	Very high	17 Å²	17	54 Å²	54	14%	0.14	32%	0.32	C	S	.	.	H	α-helix	trans	-62.4	-39.7	177.6	0	0	0	0	0	112.8	T120 R121 D122 R128	T120-A124 WeakPolarHBondContact O-CB 3.23Å; T120-A124 PolarHBondContact O-N 2.95Å; R121-A124 PolarHBondContact O-N 2.85Å; D122-A124 VanDerWaalsContact C-N 3.34Å; D122-A124 PolarHBondContact O-N 2.88Å; A124-R128 WeakPolarHBondContact O-CG 3.41Å; A124-R128 PolarHBondContact O-N 2.98Å; A124-R128 VanDerWaalsContact O-N 3.11Å; A124-R128 PolarHBondContact O-NH1 3.22Å
125	A	93.5	Very high	92.9	Very high	48 Å²	48	58.1 Å²	58.1	40%	0.397	34%	0.335	S	S	.	.	H	α-helix	trans	-66.1	-39.9	175.6	0	0	0	0	0	112.1	R121 D122 T123 R128 G129	R121-A125 WeakPolarHBondContact O-CB 3.48Å; R121-A125 PolarHBondContact O-N 3.48Å; D122-A125 PolarHBondContact O-N 3.47Å; T123-A125 VanDerWaalsContact C-N 3.35Å; T123-A125 PolarHBondContact O-N 3.5Å; A125-R128 VanDerWaalsContact CA-NH2 3.32Å; A125-G129 PolarHBondContact O-N 3.48Å
126	L	94.3	Very high	93.1	Very high	20 Å²	20	60.1 Å²	60.1	11%	0.105	34%	0.344	C	S	.	.	H	α-helix	trans	-60.2	-50.1	174.3	179.6	145	0	0	0	111.4	A92 L95 R96 D122 T123 R128 G129 C130	A92-L126 HydrophobicContact CB-CD1 3.22Å; L95-L126 HydrophobicContact CB-CD2 3.63Å; L95-L126 HydrophobicContact CD1-CD2 4.01Å; R96-L126 HydrophobicContact CG-CD1 4.16Å; R96-L126 HydrophobicContact CG-CG 4.3Å; D122-L126 WeakPolarHBondContact O-CB 3.13Å; D122-L126 PolarHBondContact O-N 3.12Å; T123-L126 WeakPolarHBondContact O-CB 3.42Å; T123-L126 PolarHBondContact O-N 2.82Å; L126-R128 VanDerWaalsContact C-N 3.34Å; L126-R128 PolarHBondContact O-N 3.14Å; L126-G129 WeakPolarHBondContact O-CA 3.07Å; L126-G129 PolarHBondContact O-N 3.11Å; L126-C130 PolarHBondContact O-N 3.35Å; L126-C130 PolarHBondContact O-SG 3.42Å
127	L	96.8	Very high	93.4	Very high	0 Å²	0	60 Å²	60	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-63.8	-37.5	-178.2	-65.3	175.5	0	0	0	112.3	W111 V113 T123 G129 C130 Y134 H136	W111-L127 HydrophobicContact CE3-CD2 4.17Å; W111-L127 HydrophobicContact CH2-CD2 3.64Å; W111-L127 HydrophobicContact CZ2-CD2 4.48Å; W111-L127 HydrophobicContact CZ3-CD2 3.45Å; W111-L127 VanDerWaalsContact CZ3-CD2 3.45Å; V113-L127 HydrophobicContact CB-CD1 3.91Å; V113-L127 HydrophobicContact CB-CD2 4.43Å; V113-L127 HydrophobicContact CG1-CD1 4Å; V113-L127 HydrophobicContact CG1-CD2 4.38Å; V113-L127 HydrophobicContact CG2-CD1 4.11Å; V113-L127 HydrophobicContact CG2-CD2 3.82Å; T123-L127 HydrophobicContact CG2-CD1 4.07Å; T123-L127 HydrophobicContact CG2-CG 4.35Å; T123-L127 VanDerWaalsContact O-CG 3.29Å; T123-L127 WeakPolarHBondContact O-CG 3.36Å; T123-L127 PolarHBondContact O-N 3.45Å; L127-G129 PolarHBondContact O-N 3.26Å; L127-C130 VanDerWaalsContact O-CB 3.32Å; L127-C130 WeakPolarHBondContact O-CB 3.26Å; L127-C130 PolarHBondContact O-N 3.29Å; L127-Y134 VanDerWaalsContact C-CE1 3.48Å; L127-Y134 HydrophobicContact CB-CD1 4.13Å; L127-Y134 HydrophobicContact CB-CD2 3.84Å; L127-Y134 HydrophobicContact CB-CE1 3.84Å; L127-Y134 HydrophobicContact CB-CE2 3.53Å; L127-Y134 HydrophobicContact CB-CG 4.14Å; L127-Y134 HydrophobicContact CD1-CD2 3.79Å; L127-Y134 HydrophobicContact CD1-CE2 3.84Å; L127-Y134 HydrophobicContact CG-CD2 4.36Å; L127-Y134 HydrophobicContact CG-CE2 4.33Å; L127-Y134 WeakPolarHBondContact O-CE1 3.28Å; L127-H136 HydrophobicContact CD1-CB 3.97Å
128	R	96.2	Very high	93.7	Very high	162 Å²	162	62.1 Å²	62.1	61%	0.611	35%	0.354	S	S	*	.	H	α-helix	trans	-57.9	-35.2	172.2	-75.6	-169.4	-63.7	-84.9	2.7	112.6	A124 A125 L126 C130 Y134	A124-R128 WeakPolarHBondContact O-CG 3.41Å; A124-R128 PolarHBondContact O-N 2.98Å; A124-R128 VanDerWaalsContact O-N 3.11Å; A124-R128 PolarHBondContact O-NH1 3.22Å; A125-R128 VanDerWaalsContact CA-NH2 3.32Å; L126-R128 VanDerWaalsContact C-N 3.34Å; L126-R128 PolarHBondContact O-N 3.14Å; R128-C130 VanDerWaalsContact C-N 3.33Å; R128-Y134 WeakPolarHBondContact CG-OH 3.28Å; R128-Y134 PolarHBondContact N-OH 3.38Å
129	G	94.6	Very high	94.1	Very high	64 Å²	64	58.4 Å²	58.4	66%	0.66	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-8.6	177.5	0	0	0	0	0	114.9	A125 L126 L127	A125-G129 PolarHBondContact O-N 3.48Å; L126-G129 WeakPolarHBondContact O-CA 3.07Å; L126-G129 PolarHBondContact O-N 3.11Å; L127-G129 PolarHBondContact O-N 3.26Å
130	C	95.7	Very high	94.1	Very high	5 Å²	5	60.5 Å²	60.5	3%	0.034	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-18.2	-174.2	-77.6	0	0	0	0	114.3	A99 R103 W111 L126 L127 R128 V132	A99-C130 HydrophobicContact CB-CB 3.6Å; A99-C130 WeakPolarHBondContact CB-SG 3.21Å; R103-C130 VanDerWaalsContact CZ-O 3.31Å; R103-C130 PolarHBondContact NE-O 3.38Å; R103-C130 PolarHBondContact NH2-O 3.24Å; W111-C130 HydrophobicContact CZ3-CB 4.26Å; L126-C130 PolarHBondContact O-N 3.35Å; L126-C130 PolarHBondContact O-SG 3.42Å; L127-C130 VanDerWaalsContact O-CB 3.32Å; L127-C130 WeakPolarHBondContact O-CB 3.26Å; L127-C130 PolarHBondContact O-N 3.29Å; R128-C130 VanDerWaalsContact C-N 3.33Å; C130-V132 PolarHBondContact O-N 3.37Å
131	G	95.2	Very high	93.5	Very high	62 Å²	62	61 Å²	61	64%	0.639	33%	0.334	S	S	*	.			trans	63.1	22.5	178.2	0	0	0	0	0	114.7
132	V	97.7	Very high	92.2	Very high	14 Å²	14	52.3 Å²	52.3	9%	0.085	31%	0.307	C	S	.	.	S	Bend	trans	-114.3	137.3	174.3	178.9	0	0	0	0	107.2	A99 L102 R103 L109 W111 C130 Y134	A99-V132 HydrophobicContact CB-CG2 4.34Å; A99-V132 WeakPolarHBondContact O-CG2 3.12Å; L102-V132 HydrophobicContact CB-CG1 4.18Å; L102-V132 HydrophobicContact CB-CG2 4.1Å; R103-V132 HydrophobicContact CB-CG2 4.18Å; L109-V132 HydrophobicContact CD2-CG1 3.85Å; W111-V132 HydrophobicContact CB-CG1 3.93Å; W111-V132 HydrophobicContact CE3-CB 4.25Å; W111-V132 HydrophobicContact CE3-CG1 4.26Å; C130-V132 PolarHBondContact O-N 3.37Å; V132-Y134 WeakPolarHBondContact O-CD1 3.29Å; V132-Y134 PolarHBondContact O-N 3.49Å
133	M	97.8	Very high	90.6	Very high	121 Å²	121	53.3 Å²	53.3	60%	0.596	31%	0.313	S	S	*	.			trans	-63.2	121.8	175	-170.6	177.3	92.5	0	0	109.2	L110 W111	L110-M133 HydrophobicContact CB-CE 3.69Å; L110-M133 HydrophobicContact CD1-CE 3.67Å; L110-M133 HydrophobicContact CD1-CG 4.27Å; L110-M133 HydrophobicContact CD2-CE 4.41Å; L110-M133 HydrophobicContact CG-CE 4.09Å; W111-M133 PolarHBondContact N-O 2.95Å
134	Y	98.2	Very high	88.7	Confident	64 Å²	64	54.9 Å²	54.9	25%	0.251	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	158	-173.4	75.9	-86.9	0	0	0	113.1	W111 L127 R128 V132 H136	W111-Y134 CarbonylContact O-C 3.59Å; W111-Y134 WeakPolarHBondContact O-CA 3.37Å; W111-Y134 WeakPolarHBondContact O-CB 3.27Å; L127-Y134 VanDerWaalsContact C-CE1 3.48Å; L127-Y134 HydrophobicContact CB-CD1 4.13Å; L127-Y134 HydrophobicContact CB-CD2 3.84Å; L127-Y134 HydrophobicContact CB-CE1 3.84Å; L127-Y134 HydrophobicContact CB-CE2 3.53Å; L127-Y134 HydrophobicContact CB-CG 4.14Å; L127-Y134 HydrophobicContact CD1-CD2 3.79Å; L127-Y134 HydrophobicContact CD1-CE2 3.84Å; L127-Y134 HydrophobicContact CG-CD2 4.36Å; L127-Y134 HydrophobicContact CG-CE2 4.33Å; L127-Y134 WeakPolarHBondContact O-CE1 3.28Å; R128-Y134 WeakPolarHBondContact CG-OH 3.28Å; R128-Y134 PolarHBondContact N-OH 3.38Å; V132-Y134 WeakPolarHBondContact O-CD1 3.29Å; V132-Y134 PolarHBondContact O-N 3.49Å; Y134-H136 HydrophobicContact CD2-CB 4.21Å; Y134-H136 HydrophobicContact CE2-CB 4.01Å
135	R	97.9	Very high	86.4	Confident	86 Å²	86	59.5 Å²	59.5	33%	0.325	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	130.7	159.5	-64.8	176.4	-175.9	-165.7	-2.4	108.3	L110 W111 L112 V113 H174	L110-R135 HydrophobicContact CD1-CG 4.02Å; W111-R135 PolarHBondContact O-N 3.25Å; L112-R135 HydrophobicContact CD2-CB 3.79Å; L112-R135 HydrophobicContact CD2-CG 4.23Å; V113-R135 PolarHBondContact N-O 2.72Å; R135-H174 WeakPolarHBondContact CD-NE2 3.37Å; R135-H174 PolarHBondContact NH1-CE1 3.09Å; R135-H174 PolarHBondContact NH1-NE2 2.89Å
136	H	97.4	Very high	84.3	Confident	43 Å²	43	66.2 Å²	66.2	20%	0.199	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	113.1	178	-176.4	-168.2	0	0	0	108.6	V113 E115 L127 Y134	V113-H136 WeakPolarHBondContact O-CA 3.2Å; E115-H136 IonicContact OE2-CE1 2.67Å; E115-H136 PolarHBondContact OE2-CE1 2.66Å; E115-H136 IonicContact OE2-NE2 2.65Å; E115-H136 PolarHBondContact OE2-NE2 3.23Å; L127-H136 HydrophobicContact CD1-CB 3.97Å; Y134-H136 HydrophobicContact CD2-CB 4.21Å; Y134-H136 HydrophobicContact CE2-CB 4.01Å
137	L	96.9	Very high	82	Confident	25 Å²	25	71.4 Å²	71.4	13%	0.131	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	153.2	-178.7	-53.2	-179.9	0	0	0	109.6	V113 V114 E115 T170 H174	V113-L137 PolarHBondContact O-N 2.69Å; V114-L137 CarbonylContact C-O 3.57Å; V114-L137 WeakPolarHBondContact CA-O 3.38Å; V114-L137 HydrophobicContact CG1-CB 4.28Å; V114-L137 HydrophobicContact CG2-CB 4.24Å; V114-L137 HydrophobicContact CG2-CD1 4.25Å; E115-L137 PolarHBondContact N-O 3.35Å; L137-T170 HydrophobicContact CB-CG2 4.49Å; L137-H174 HydrophobicContact CD1-CB 3.76Å
138	S	94.4	Very high	79.4	Confident	63 Å²	63	80.5 Å²	80.5	44%	0.441	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.8	176	54.1	0	0	0	0	110.1	E115 G117	E115-S138 WeakPolarHBondContact O-CA 3.3Å; G117-S138 VanDerWaalsContact O-CB 3.29Å; G117-S138 WeakPolarHBondContact O-CB 3.43Å
139	S	91.6	Very high	76.9	Confident	2 Å²	2	77 Å²	77	1%	0.014	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	131	175.9	-166	0	0	0	0	110.2	E115 G117 V141 T170	E115-S139 PolarHBondContact O-N 3.22Å; G117-S139 WeakPolarHBondContact CA-O 3.44Å; G117-S139 PolarHBondContact N-O 3.42Å; S139-V141 PolarHBondContact O-N 2.93Å; S139-T170 PolarHBondContact OG-OG1 2.67Å
140	P	83.2	Confident	74.4	Confident	96 Å²	96	86 Å²	86	62%	0.623	45%	0.452	S	S	*	.			trans	-57.1	138.3	-179.7	-23.7	33.1	0	0	0	113.3
141	V	75.1	Confident	71.9	Confident	61 Å²	61	96.6 Å²	96.6	37%	0.37	49%	0.491	S	S	.	.			trans	-72	136.4	172.8	179.3	0	0	0	0	109.1	S139 D143 A144	S139-V141 PolarHBondContact O-N 2.93Å; V141-D143 PolarHBondContact O-N 3.33Å; V141-D143 VanDerWaalsContact O-N 3.07Å; V141-A144 PolarHBondContact O-N 3.3Å
142	P	63	Low	69.4	Low	40 Å²	40	105.9 Å²	105.9	26%	0.26	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-29.2	-178.9	-24.6	32.1	0	0	0	114.9	V161	P142-V161 HydrophobicContact CB-CB 4.21Å; P142-V161 HydrophobicContact CB-CG1 3.9Å; P142-V161 HydrophobicContact CG-CB 4.18Å; P142-V161 HydrophobicContact CG-CG1 3.56Å
143	D	56.9	Low	66.7	Low	122 Å²	122	107.9 Å²	107.9	65%	0.652	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	20.5	-174.6	-65.6	-47.7	0	0	0	113.7	V141	V141-D143 PolarHBondContact O-N 3.33Å; V141-D143 VanDerWaalsContact O-N 3.07Å
144	A	51.7	Low	64.1	Low	37 Å²	37	112.4 Å²	112.4	31%	0.306	54%	0.541	S	S	.	.			trans	-54.5	133.7	172.1	0	0	0	0	0	109.6	V141 Q146 D147	V141-A144 PolarHBondContact O-N 3.3Å; A144-Q146 PolarHBondContact O-N 3.21Å; A144-D147 PolarHBondContact O-N 2.82Å
145	P	47.4	Very low	61.6	Low	115 Å²	115	121.9 Å²	121.9	75%	0.747	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-55.5	-18	-172.7	-27.4	33.6	0	0	0	115.8	R148	P145-R148 PolarHBondContact O-N 2.99Å
146	Q	49.2	Very low	58.8	Low	189 Å²	189	123.9 Å²	123.9	88%	0.883	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-69.6	-28.1	-177.6	-124.3	160.1	8.5	0	0	113.5	A144	A144-Q146 PolarHBondContact O-N 3.21Å
147	D	45.3	Very low	56.2	Low	128 Å²	128	128.9 Å²	128.9	68%	0.684	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-96.9	21.8	179.2	-75.5	-25.5	0	0	0	113.4	A144 P149	A144-D147 PolarHBondContact O-N 2.82Å; D147-P149 WeakPolarHBondContact O-CD 3.41Å
148	R	42.3	Very low	53.6	Low	191 Å²	191	137.3 Å²	137.3	72%	0.721	65%	0.647	S	S	*	*			trans	-87.9	95.4	168.9	-68	-118.7	-164.2	-180	5.1	110	P145 R150	P145-R148 PolarHBondContact O-N 2.99Å; R148-R150 PolarHBondContact O-N 2.81Å
149	P	44.3	Very low	51.4	Low	90 Å²	90	138.5 Å²	138.5	58%	0.584	65%	0.654	S	S	*	*			trans	-59.2	126.6	148.9	26	-27.8	0	0	0	105.7	D147 R151	D147-P149 WeakPolarHBondContact O-CD 3.41Å; P149-R151 PolarHBondContact O-N 3.2Å
150	R	41.8	Very low	49.4	Very low	251 Å²	251	143.1 Å²	143.1	95%	0.947	69%	0.692	S	S	*	*			trans	-61.9	69.7	178	-67.8	179	175	155.4	-2	110.6	R148	R148-R150 PolarHBondContact O-N 2.81Å
151	R	42.7	Very low	48.3	Very low	228 Å²	228	141 Å²	141	86%	0.86	68%	0.677	S	S	*	*			trans	-101.1	87.6	168	-69.8	-158.5	175.1	-135	1.2	107.5	P149 G153	P149-R151 PolarHBondContact O-N 3.2Å; R151-G153 PolarHBondContact O-N 2.84Å
152	R	43	Very low	48.1	Very low	258 Å²	258	139.6 Å²	139.6	97%	0.974	67%	0.668	S	S	*	*			trans	-64.2	87.9	158.9	-78	-178.6	173.5	-106.3	2.3	106.9
153	G	41.7	Very low	49	Very low	55 Å²	55	139.1 Å²	139.1	57%	0.567	67%	0.665	S	S	*	*	S	Bend	trans	177.3	106.6	179	0	0	0	0	0	111.4	R151	R151-G153 PolarHBondContact O-N 2.84Å
154	R	42.2	Very low	50.5	Low	217 Å²	217	137.3 Å²	137.3	82%	0.819	65%	0.649	S	S	*	*			trans	64.6	104.1	168.5	-53.1	-172.8	-174	-123.1	-0.1	115	Q156	R154-Q156 HydrophobicContact CB-CB 4.05Å; R154-Q156 PolarHBondContact O-N 2.91Å
155	R	46	Very low	52.4	Low	263 Å²	263	135.5 Å²	135.5	99%	0.992	63%	0.634	S	S	*	*			trans	-68.2	52.8	159.3	-66.2	-177.1	174.7	-169.6	-1.4	110	D157	R155-D157 PolarHBondContact O-N 2.9Å
156	Q	39	Very low	54.5	Low	128 Å²	128	133.5 Å²	133.5	60%	0.598	61%	0.612	S	S	*	*			trans	-90.3	103.6	-176.4	-166.2	145.2	25.7	0	0	107.8	R154 R158	R154-Q156 HydrophobicContact CB-CB 4.05Å; R154-Q156 PolarHBondContact O-N 2.91Å; Q156-R158 VanDerWaalsContact C-N 3.33Å; Q156-R158 PolarHBondContact O-N 2.86Å
157	D	42.4	Very low	56.6	Low	148 Å²	148	124.7 Å²	124.7	79%	0.791	57%	0.571	S	S	*	*			trans	30.5	57.8	155.2	-57.3	-32.2	0	0	0	115.7	R155 P159	R155-D157 PolarHBondContact O-N 2.9Å; D157-P159 WeakPolarHBondContact O-CD 3.12Å
158	R	43.4	Very low	59	Low	201 Å²	201	119 Å²	119	76%	0.758	54%	0.54	S	S	*	.			trans	-63.4	122.1	155.2	-81.3	-173.6	176.2	-178.2	-3.9	105.2	Q156 A160	Q156-R158 VanDerWaalsContact C-N 3.33Å; Q156-R158 PolarHBondContact O-N 2.86Å; R158-A160 PolarHBondContact O-N 3.03Å
159	P	46.5	Very low	61.6	Low	88 Å²	88	111 Å²	111	57%	0.571	51%	0.512	S	S	*	.			trans	-52.2	137.1	174.5	20.6	-29.9	0	0	0	107.8	D157 V161	D157-P159 WeakPolarHBondContact O-CD 3.12Å; P159-V161 PolarHBondContact O-N 3.26Å
160	A	51.1	Low	64.1	Low	100 Å²	100	108.3 Å²	108.3	83%	0.826	49%	0.493	S	S	*	.			trans	-51	107.7	177.7	0	0	0	0	0	108.1	R158 D162	R158-A160 PolarHBondContact O-N 3.03Å; A160-D162 PolarHBondContact O-N 3.49Å
161	V	58.5	Low	66.7	Low	50 Å²	50	96.4 Å²	96.4	30%	0.303	45%	0.448	S	S	.	.			trans	-61.3	122	175.9	164.1	0	0	0	0	107.1	P142 P159 S163 R166	P142-V161 HydrophobicContact CB-CB 4.21Å; P142-V161 HydrophobicContact CB-CG1 3.9Å; P142-V161 HydrophobicContact CG-CB 4.18Å; P142-V161 HydrophobicContact CG-CG1 3.56Å; P159-V161 PolarHBondContact O-N 3.26Å; V161-S163 PolarHBondContact O-N 2.74Å; V161-R166 VanDerWaalsContact CG1-CZ 3.41Å
162	D	71.2	Confident	69.4	Low	33 Å²	33	85.5 Å²	85.5	18%	0.176	41%	0.407	C	S	.	.			trans	-71.1	103	172.8	-178.6	19.3	0	0	0	109.6	A160 R164 A165 R168 Q288	A160-D162 PolarHBondContact O-N 3.49Å; D162-R164 PolarHBondContact O-N 2.85Å; D162-R164 WeakPolarHBondContact OD1-CB 3.36Å; D162-R164 PolarHBondContact OD1-N 2.93Å; D162-A165 HydrophobicContact CB-CB 4.09Å; D162-A165 PolarHBondContact O-N 3.26Å; D162-A165 PolarHBondContact OD2-N 3.22Å; D162-A165 VanDerWaalsContact OD2-N 3.11Å; D162-R168 IonicContact OD2-NH2 3.66Å; D162-R168 PolarHBondContact OD2-NH2 3.1Å; D162-Q288 PolarHBondContact OD2-OE1 2.87Å; D162-Q288 VanDerWaalsContact OD2-OE1 3.09Å
163	S	82	Confident	72	Confident	29 Å²	29	76.2 Å²	76.2	20%	0.203	38%	0.377	C	S	.	.	H	α-helix	trans	-54.3	-33.5	172.4	178.7	0	0	0	0	111.3	S116 V161 R166 Q167	S116-S163 PolarHBondContact OG-OG 3.49Å; S116-S163 VanDerWaalsContact OG-OG 3.12Å; V161-S163 PolarHBondContact O-N 2.74Å; S163-R166 PolarHBondContact O-N 2.84Å; S163-Q167 VanDerWaalsContact O-CG 3.31Å; S163-Q167 WeakPolarHBondContact O-CG 3.08Å; S163-Q167 PolarHBondContact O-N 3.09Å; S163-Q167 VanDerWaalsContact O-N 3.12Å; S163-Q167 PolarHBondContact O-OE1 3.2Å; S163-Q167 PolarHBondContact OG-OE1 3.08Å
164	R	89.6	Confident	74.7	Confident	84 Å²	84	75.1 Å²	75.1	32%	0.317	36%	0.357	S	S	.	.	H	α-helix	trans	-71	-36	-177.1	-60.3	-174.4	167.2	106.6	-14.4	112.1	P84 D162 R166 Q167 R168 D190	P84-R164 HydrophobicContact CB-CB 4.46Å; P84-R164 HydrophobicContact CB-CG 4.47Å; D162-R164 PolarHBondContact O-N 2.85Å; D162-R164 WeakPolarHBondContact OD1-CB 3.36Å; D162-R164 PolarHBondContact OD1-N 2.93Å; R164-R166 VanDerWaalsContact C-N 3.33Å; R164-R166 PolarHBondContact O-N 2.95Å; R164-Q167 PolarHBondContact O-N 3.15Å; R164-R168 VanDerWaalsContact CB-NH1 3.27Å; R164-R168 WeakPolarHBondContact O-CG 3.35Å; R164-R168 PolarHBondContact O-N 3.4Å; R164-D190 IonicContact NH2-OD2 3.03Å
165	A	90.6	Very high	77.3	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.2	-43.8	173.5	0	0	0	0	0	111.5	D162 Q167 R168 N169 Q279	D162-A165 HydrophobicContact CB-CB 4.09Å; D162-A165 PolarHBondContact O-N 3.26Å; D162-A165 PolarHBondContact OD2-N 3.22Å; D162-A165 VanDerWaalsContact OD2-N 3.11Å; A165-Q167 PolarHBondContact O-N 2.87Å; A165-R168 PolarHBondContact O-N 2.8Å; A165-N169 WeakPolarHBondContact O-CB 3.47Å; A165-N169 VanDerWaalsContact O-CG 3.27Å; A165-N169 PolarHBondContact O-N 2.9Å; A165-Q279 HydrophobicContact CB-CB 4.13Å
166	R	91.1	Very high	79.7	Confident	73 Å²	73	54.4 Å²	54.4	28%	0.275	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-44.1	174.4	-62.7	-169.2	-165.8	-62.9	-10.6	112.1	V161 S163 R164 N169 T170 D281	V161-R166 VanDerWaalsContact CG1-CZ 3.41Å; S163-R166 PolarHBondContact O-N 2.84Å; R164-R166 VanDerWaalsContact C-N 3.33Å; R164-R166 PolarHBondContact O-N 2.95Å; R166-N169 WeakPolarHBondContact O-CB 3.49Å; R166-N169 PolarHBondContact O-N 2.94Å; R166-T170 PolarHBondContact O-N 3.5Å; R166-T170 PolarHBondContact O-OG1 2.65Å; R166-D281 IonicContact CZ-OD2 2.68Å; R166-D281 IonicContact NH1-OD2 3.73Å; R166-D281 PolarHBondContact NH1-OD2 3.41Å; R166-D281 IonicContact NH2-OD2 3.7Å; R166-D281 PolarHBondContact NH2-OD2 2.94Å
167	Q	94.3	Very high	82.5	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.019	29%	0.286	C	S	.	.	H	α-helix	trans	-62.6	-44.9	179	-69.9	169.9	-85.3	0	0	111.8	P84 T85 V114 S163 R164 A165 N169 T170 A171	P84-Q167 HydrophobicContact CB-CB 3.85Å; P84-Q167 HydrophobicContact CB-CG 4.49Å; T85-Q167 PolarHBondContact O-NE2 2.86Å; V114-Q167 HydrophobicContact CB-CB 4.04Å; V114-Q167 HydrophobicContact CG1-CB 3.75Å; V114-Q167 HydrophobicContact CG1-CG 4Å; V114-Q167 PolarHBondContact O-NE2 3.31Å; S163-Q167 VanDerWaalsContact O-CG 3.31Å; S163-Q167 WeakPolarHBondContact O-CG 3.08Å; S163-Q167 PolarHBondContact O-N 3.09Å; S163-Q167 VanDerWaalsContact O-N 3.12Å; S163-Q167 PolarHBondContact O-OE1 3.2Å; S163-Q167 PolarHBondContact OG-OE1 3.08Å; R164-Q167 PolarHBondContact O-N 3.15Å; A165-Q167 PolarHBondContact O-N 2.87Å; Q167-N169 VanDerWaalsContact C-N 3.32Å; Q167-N169 PolarHBondContact O-N 2.79Å; Q167-T170 WeakPolarHBondContact O-CB 3.39Å; Q167-T170 PolarHBondContact O-N 3.39Å; Q167-A171 PolarHBondContact O-N 2.85Å
168	R	96	Very high	85.2	Confident	7 Å²	7	52.9 Å²	52.9	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-62	-41.7	175	-70.1	-179.1	-62	-107.1	-2	110.7	V82 D162 R164 A165 T170 A171 L172 F186 Q279	V82-R168 HydrophobicContact CG1-CG 4.46Å; D162-R168 IonicContact OD2-NH2 3.66Å; D162-R168 PolarHBondContact OD2-NH2 3.1Å; R164-R168 VanDerWaalsContact CB-NH1 3.27Å; R164-R168 WeakPolarHBondContact O-CG 3.35Å; R164-R168 PolarHBondContact O-N 3.4Å; A165-R168 PolarHBondContact O-N 2.8Å; R168-T170 PolarHBondContact O-N 3.22Å; R168-A171 WeakPolarHBondContact O-CB 3.49Å; R168-A171 PolarHBondContact O-N 3.15Å; R168-L172 VanDerWaalsContact O-CG 3.32Å; R168-L172 WeakPolarHBondContact O-CG 3.21Å; R168-L172 PolarHBondContact O-N 3.39Å; R168-F186 HydrophobicContact CB-CD1 4.29Å; R168-F186 HydrophobicContact CB-CE1 3.88Å; R168-F186 HydrophobicContact CG-CD1 3.8Å; R168-F186 HydrophobicContact CG-CE1 3.92Å; R168-Q279 VanDerWaalsContact CD-NE2 3.32Å; R168-Q279 VanDerWaalsContact NE-CD 3.25Å
169	N	95.9	Very high	87.7	Confident	25 Å²	25	51.5 Å²	51.5	13%	0.134	26%	0.263	C	S	.	.	H	α-helix	trans	-61.6	-41.2	173.8	-71.3	-14.8	0	0	0	112.8	A165 R166 Q167 A171 L172 D173 Q279	A165-N169 WeakPolarHBondContact O-CB 3.47Å; A165-N169 VanDerWaalsContact O-CG 3.27Å; A165-N169 PolarHBondContact O-N 2.9Å; R166-N169 WeakPolarHBondContact O-CB 3.49Å; R166-N169 PolarHBondContact O-N 2.94Å; Q167-N169 VanDerWaalsContact C-N 3.32Å; Q167-N169 PolarHBondContact O-N 2.79Å; N169-A171 VanDerWaalsContact C-N 3.29Å; N169-A171 PolarHBondContact O-N 3Å; N169-L172 PolarHBondContact O-N 2.85Å; N169-L172 VanDerWaalsContact O-N 3.1Å; N169-D173 VanDerWaalsContact O-CG 3.28Å; N169-D173 PolarHBondContact O-N 3.13Å; N169-Q279 PolarHBondContact ND2-O 3.42Å; N169-Q279 PolarHBondContact OD1-N 3.18Å
170	T	96.5	Very high	90.1	Very high	33 Å²	33	48.3 Å²	48.3	20%	0.202	24%	0.241	C	C	.	.	H	α-helix	trans	-58.5	-40.6	173.6	-56.2	0	0	0	0	111.8	V114 L137 S139 R166 Q167 R168 H174	V114-T170 HydrophobicContact CG1-CG2 4.24Å; L137-T170 HydrophobicContact CB-CG2 4.49Å; S139-T170 PolarHBondContact OG-OG1 2.67Å; R166-T170 PolarHBondContact O-N 3.5Å; R166-T170 PolarHBondContact O-OG1 2.65Å; Q167-T170 WeakPolarHBondContact O-CB 3.39Å; Q167-T170 PolarHBondContact O-N 3.39Å; R168-T170 PolarHBondContact O-N 3.22Å; T170-H174 WeakPolarHBondContact O-CB 3.49Å; T170-H174 PolarHBondContact O-N 3.28Å; T170-H174 VanDerWaalsContact O-N 3.08Å
171	A	98.1	Very high	92.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.5	-42.6	173	0	0	0	0	0	112.2	V82 V114 Q167 R168 N169 H174 I175	V82-A171 HydrophobicContact CB-CB 4.3Å; V82-A171 HydrophobicContact CG1-CB 3.44Å; V82-A171 VanDerWaalsContact CG1-CB 3.44Å; V82-A171 HydrophobicContact CG2-CB 3.85Å; V114-A171 HydrophobicContact CG2-CB 3.81Å; Q167-A171 PolarHBondContact O-N 2.85Å; R168-A171 WeakPolarHBondContact O-CB 3.49Å; R168-A171 PolarHBondContact O-N 3.15Å; N169-A171 VanDerWaalsContact C-N 3.29Å; N169-A171 PolarHBondContact O-N 3Å; A171-H174 WeakPolarHBondContact O-CB 3.45Å; A171-H174 PolarHBondContact O-N 3.31Å; A171-I175 WeakPolarHBondContact O-CB 3.4Å; A171-I175 WeakPolarHBondContact O-CD1 3.31Å; A171-I175 WeakPolarHBondContact O-CG1 3.14Å; A171-I175 PolarHBondContact O-N 3.18Å
172	L	98.1	Very high	94.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.6	-44.1	177.2	-66.5	173.6	0	0	0	111.7	R168 N169 H174 I175 E176 V184 F186 F258 L263 F292	R168-L172 VanDerWaalsContact O-CG 3.32Å; R168-L172 WeakPolarHBondContact O-CG 3.21Å; R168-L172 PolarHBondContact O-N 3.39Å; N169-L172 PolarHBondContact O-N 2.85Å; N169-L172 VanDerWaalsContact O-N 3.1Å; L172-H174 VanDerWaalsContact C-N 3.28Å; L172-H174 PolarHBondContact O-N 3.4Å; L172-I175 PolarHBondContact O-N 2.89Å; L172-E176 VanDerWaalsContact O-CB 3.29Å; L172-E176 WeakPolarHBondContact O-CB 3.33Å; L172-E176 PolarHBondContact O-N 3.5Å; L172-V184 HydrophobicContact CD2-CG1 4.37Å; L172-F186 HydrophobicContact CD1-CZ 4.43Å; L172-F186 HydrophobicContact CD2-CZ 4.16Å; L172-F186 HydrophobicContact CG-CZ 4.49Å; L172-F258 HydrophobicContact CD2-CZ 3.95Å; L172-L263 HydrophobicContact CD2-CD1 3.9Å; L172-L263 HydrophobicContact CD2-CD2 4.21Å; L172-F292 HydrophobicContact CD1-CE2 3.76Å; L172-F292 HydrophobicContact CD1-CZ 3.81Å
173	D	97.1	Very high	95.5	Very high	62 Å²	62	45.8 Å²	45.8	33%	0.332	21%	0.208	S	C	.	.	H	α-helix	trans	-57.7	-43.6	173.4	-67.4	-37.4	0	0	0	110.9	N169 E176 H177 Y276 R278	N169-D173 VanDerWaalsContact O-CG 3.28Å; N169-D173 PolarHBondContact O-N 3.13Å; D173-E176 PolarHBondContact O-N 2.86Å; D173-H177 WeakPolarHBondContact O-CB 3.45Å; D173-H177 PolarHBondContact O-N 3.4Å; D173-Y276 PolarHBondContact OD1-OH 2.9Å; D173-R278 IonicContact OD1-CZ 3.62Å; D173-R278 IonicContact OD1-NE 2.94Å; D173-R278 PolarHBondContact OD1-NE 2.55Å; D173-R278 IonicContact OD1-NH2 2.66Å; D173-R278 PolarHBondContact OD1-NH2 3.3Å
174	H	98.2	Very high	96.2	Very high	33 Å²	33	44.4 Å²	44.4	15%	0.153	20%	0.199	C	C	.	.	H	α-helix	trans	-66.5	-43.3	179	-176.3	82.8	0	0	0	113	R135 L137 T170 A171 L172 H178	R135-H174 WeakPolarHBondContact CD-NE2 3.37Å; R135-H174 PolarHBondContact NH1-CE1 3.09Å; R135-H174 PolarHBondContact NH1-NE2 2.89Å; L137-H174 HydrophobicContact CD1-CB 3.76Å; T170-H174 WeakPolarHBondContact O-CB 3.49Å; T170-H174 PolarHBondContact O-N 3.28Å; T170-H174 VanDerWaalsContact O-N 3.08Å; A171-H174 WeakPolarHBondContact O-CB 3.45Å; A171-H174 PolarHBondContact O-N 3.31Å; L172-H174 VanDerWaalsContact C-N 3.28Å; L172-H174 PolarHBondContact O-N 3.4Å; H174-H178 AromaticContact CE1-CE1 3.2Å; H174-H178 PolarHBondContact CE1-CE1 3.37Å; H174-H178 AromaticContact CE1-ND1 3.41Å; H174-H178 PolarHBondContact CE1-ND1 3.06Å; H174-H178 AromaticContact CG-ND1 3.88Å; H174-H178 AromaticContact ND1-CE1 3.35Å; H174-H178 PolarHBondContact ND1-CE1 2.8Å; H174-H178 VanDerWaalsContact ND1-CE1 3.35Å; H174-H178 AromaticContact ND1-ND1 3.49Å; H174-H178 PolarHBondContact ND1-ND1 2.02Å; H174-H178 AromaticContact NE2-CE1 3.96Å; H174-H178 AromaticContact NE2-ND1 3.75Å; H174-H178 PolarHBondContact O-N 3.08Å; H174-H178 PolarHBondContact O-ND1 2.9Å
175	I	98.4	Very high	96.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.1	-45.9	176.8	-70.8	164.3	0	0	0	109.9	L80 V82 L112 A171 L172 R179 L180 V184 L263 W264	L80-I175 HydrophobicContact CD1-CD1 4.46Å; L80-I175 HydrophobicContact CD1-CG1 4.38Å; L80-I175 HydrophobicContact CD1-CG2 4Å; V82-I175 HydrophobicContact CG2-CD1 4.01Å; L112-I175 HydrophobicContact CD1-CD1 3.57Å; L112-I175 HydrophobicContact CD1-CG1 3.44Å; L112-I175 VanDerWaalsContact CD1-CG1 3.44Å; A171-I175 WeakPolarHBondContact O-CB 3.4Å; A171-I175 WeakPolarHBondContact O-CD1 3.31Å; A171-I175 WeakPolarHBondContact O-CG1 3.14Å; A171-I175 PolarHBondContact O-N 3.18Å; L172-I175 PolarHBondContact O-N 2.89Å; I175-R179 WeakPolarHBondContact O-CA 3.42Å; I175-R179 PolarHBondContact O-N 2.84Å; I175-L180 HydrophobicContact CG1-CD1 4.34Å; I175-L180 HydrophobicContact CG2-CB 4.32Å; I175-L180 PolarHBondContact O-N 3.28Å; I175-V184 HydrophobicContact CD1-CG1 4.15Å; I175-V184 HydrophobicContact CD1-CG2 4.08Å; I175-V184 HydrophobicContact CG2-CG2 4.43Å; I175-L263 HydrophobicContact CB-CD1 4.36Å; I175-L263 HydrophobicContact CG2-CD1 3.82Å; I175-W264 HydrophobicContact CG2-CH2 4.41Å; I175-W264 HydrophobicContact CG2-CZ3 3.9Å
176	E	96.7	Very high	97	Very high	45 Å²	45	40.4 Å²	40.4	21%	0.21	18%	0.184	C	C	.	.	H	α-helix	trans	-67.2	-46.4	179.7	-172.3	175.6	168.8	0	0	112	L172 D173 H178 R179 L263 W264 R278	L172-E176 VanDerWaalsContact O-CB 3.29Å; L172-E176 WeakPolarHBondContact O-CB 3.33Å; L172-E176 PolarHBondContact O-N 3.5Å; D173-E176 PolarHBondContact O-N 2.86Å; E176-H178 VanDerWaalsContact C-N 3.33Å; E176-H178 PolarHBondContact O-N 3.2Å; E176-R179 PolarHBondContact O-N 3.34Å; E176-R179 VanDerWaalsContact O-N 3.1Å; E176-L263 HydrophobicContact CB-CB 4.31Å; E176-L263 HydrophobicContact CG-CB 4.28Å; E176-W264 HydrophobicContact CB-CE3 4.33Å; E176-W264 HydrophobicContact CG-CB 4.18Å; E176-W264 HydrophobicContact CG-CE3 4.24Å; E176-R278 IonicContact OE2-CZ 3.51Å; E176-R278 VanDerWaalsContact OE2-CZ 3.29Å; E176-R278 IonicContact OE2-NH1 2.82Å; E176-R278 PolarHBondContact OE2-NH1 2.75Å; E176-R278 IonicContact OE2-NH2 3.7Å; E176-R278 PolarHBondContact OE2-NH2 3.07Å
177	H	97	Very high	97.3	Very high	153 Å²	153	36.9 Å²	36.9	71%	0.708	17%	0.17	S	C	*	.	H	α-helix	trans	-59.3	-42.5	-179.7	-177.1	75	0	0	0	112.6	D173	D173-H177 WeakPolarHBondContact O-CB 3.45Å; D173-H177 PolarHBondContact O-N 3.4Å
178	H	97.9	Very high	97.3	Very high	90 Å²	90	37.2 Å²	37.2	42%	0.417	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	2	179	-60.5	91.1	0	0	0	113.3	H174 E176 L180	H174-H178 AromaticContact CE1-CE1 3.2Å; H174-H178 PolarHBondContact CE1-CE1 3.37Å; H174-H178 AromaticContact CE1-ND1 3.41Å; H174-H178 PolarHBondContact CE1-ND1 3.06Å; H174-H178 AromaticContact CG-ND1 3.88Å; H174-H178 AromaticContact ND1-CE1 3.35Å; H174-H178 PolarHBondContact ND1-CE1 2.8Å; H174-H178 VanDerWaalsContact ND1-CE1 3.35Å; H174-H178 AromaticContact ND1-ND1 3.49Å; H174-H178 PolarHBondContact ND1-ND1 2.02Å; H174-H178 AromaticContact NE2-CE1 3.96Å; H174-H178 AromaticContact NE2-ND1 3.75Å; H174-H178 PolarHBondContact O-N 3.08Å; H174-H178 PolarHBondContact O-ND1 2.9Å; E176-H178 VanDerWaalsContact C-N 3.33Å; E176-H178 PolarHBondContact O-N 3.2Å; H178-L180 HydrophobicContact CB-CD2 3.71Å; H178-L180 HydrophobicContact CB-CG 3.88Å; H178-L180 PolarHBondContact O-N 3.04Å
179	R	96.4	Very high	97.2	Very high	172 Å²	172	37.1 Å²	37.1	65%	0.649	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.7	47.3	-174.9	-62.4	-175	170.5	-162.2	-3.5	112.7	I175 E176 H181 W264	I175-R179 WeakPolarHBondContact O-CA 3.42Å; I175-R179 PolarHBondContact O-N 2.84Å; E176-R179 PolarHBondContact O-N 3.34Å; E176-R179 VanDerWaalsContact O-N 3.1Å; R179-H181 PolarHBondContact O-N 3.29Å; R179-W264 HydrophobicContact CB-CZ2 4.29Å; R179-W264 HydrophobicContact CG-CD2 4.31Å; R179-W264 HydrophobicContact CG-CG 4.35Å
180	L	97.8	Very high	97	Very high	22 Å²	22	36.2 Å²	36.2	12%	0.115	17%	0.167	C	C	.	.			trans	-67.8	101.9	-178.8	-56.5	-179.3	0	0	0	109.1	L80 L110 I175 H178 G182 S260 W264	L80-L180 HydrophobicContact CD1-CB 4.04Å; L80-L180 VanDerWaalsContact CD1-O 3.26Å; L80-L180 WeakPolarHBondContact CD1-O 3.43Å; L80-L180 HydrophobicContact CD2-CB 4.03Å; L80-L180 HydrophobicContact CD2-CD1 4.31Å; L110-L180 HydrophobicContact CD2-CD1 3.87Å; I175-L180 HydrophobicContact CG1-CD1 4.34Å; I175-L180 HydrophobicContact CG2-CB 4.32Å; I175-L180 PolarHBondContact O-N 3.28Å; H178-L180 HydrophobicContact CB-CD2 3.71Å; H178-L180 HydrophobicContact CB-CG 3.88Å; H178-L180 PolarHBondContact O-N 3.04Å; L180-G182 PolarHBondContact O-N 3.05Å; L180-S260 WeakPolarHBondContact O-CB 3.28Å; L180-S260 PolarHBondContact O-OG 3.28Å; L180-W264 VanDerWaalsContact O-CH2 3.32Å; L180-W264 WeakPolarHBondContact O-CH2 3.31Å
181	H	97	Very high	97	Very high	125 Å²	125	34.8 Å²	34.8	58%	0.579	16%	0.159	S	C	*	.			trans	-79.3	118.2	-175.9	-173.2	-93.7	0	0	0	111.7	R179 S260	R179-H181 PolarHBondContact O-N 3.29Å; H181-S260 WeakPolarHBondContact CA-OG 3.1Å
182	G	97.5	Very high	96.9	Very high	3 Å²	3	37.6 Å²	37.6	3%	0.031	18%	0.176	C	C	.	.	S	Bend	trans	175.6	-164.9	-177.4	0	0	0	0	0	113.6	L78 L180 S260	L78-G182 CarbonylContact O-C 3.43Å; L78-G182 WeakPolarHBondContact O-CA 3.37Å; L180-G182 PolarHBondContact O-N 3.05Å; G182-S260 PolarHBondContact N-OG 3.42Å; G182-S260 WeakPolarHBondContact O-CB 3.42Å; G182-S260 PolarHBondContact O-N 2.97Å; G182-S260 PolarHBondContact O-OG 3.32Å; G182-S260 VanDerWaalsContact O-OG 3.08Å
183	I	98.4	Very high	96.9	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	115.9	176.3	-56.9	-64.4	0	0	0	108.7	K77 L78 L79 L80 L201 I204 A257 N259	K77-I183 HydrophobicContact CB-CG1 4.37Å; K77-I183 HydrophobicContact CD-CD1 4.23Å; K77-I183 HydrophobicContact CD-CG1 4.21Å; L78-I183 PolarHBondContact O-N 3.1Å; L79-I183 HydrophobicContact CD2-CB 4.04Å; L80-I183 PolarHBondContact N-O 2.99Å; I183-L201 HydrophobicContact CG2-CD2 4.49Å; I183-I204 HydrophobicContact CD1-CB 4.13Å; I183-I204 HydrophobicContact CD1-CG2 4.15Å; I183-I204 HydrophobicContact CG2-CD1 4.31Å; I183-A257 HydrophobicContact CG2-CB 3.82Å; I183-N259 HydrophobicContact CD1-CB 4.38Å
184	V	98.7	Very high	96.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	123.8	176.4	-174.7	0	0	0	0	108.9	L80 V82 L172 I175 F186 A257 F258	L80-V184 HydrophobicContact CB-CG2 4.47Å; L80-V184 HydrophobicContact CD1-CG2 4.08Å; V82-V184 HydrophobicContact CG2-CG1 4.19Å; L172-V184 HydrophobicContact CD2-CG1 4.37Å; I175-V184 HydrophobicContact CD1-CG1 4.15Å; I175-V184 HydrophobicContact CD1-CG2 4.08Å; I175-V184 HydrophobicContact CG2-CG2 4.43Å; V184-F186 HydrophobicContact CG1-CE1 4.47Å; V184-F186 HydrophobicContact CG1-CZ 4.4Å; V184-A257 VanDerWaalsContact O-CA 3.28Å; V184-A257 WeakPolarHBondContact O-CA 3.33Å; V184-A257 VanDerWaalsContact O-CB 3.27Å; V184-A257 WeakPolarHBondContact O-CB 3.44Å; V184-F258 HydrophobicContact CB-CD1 4.32Å; V184-F258 HydrophobicContact CB-CD2 4.46Å; V184-F258 HydrophobicContact CB-CE1 3.89Å; V184-F258 HydrophobicContact CB-CE2 4.05Å; V184-F258 HydrophobicContact CB-CZ 3.75Å; V184-F258 HydrophobicContact CG1-CE1 3.92Å; V184-F258 HydrophobicContact CG1-CZ 3.81Å; V184-F258 HydrophobicContact CG2-CE2 4.03Å; V184-F258 HydrophobicContact CG2-CZ 4.11Å; V184-F258 PolarHBondContact N-O 3.39Å; V184-F258 PolarHBondContact O-N 2.97Å; V184-F258 VanDerWaalsContact O-N 3.15Å
185	Y	98.6	Very high	96.8	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	126.5	176.4	178.8	-125.4	0	0	0	111.1	L80 V81 V82 A187 Y193 L197 L201 W210 S254 A257	L80-Y185 PolarHBondContact O-N 3.02Å; V81-Y185 CarbonylContact C-O 3.54Å; V81-Y185 WeakPolarHBondContact CA-O 3.37Å; V82-Y185 PolarHBondContact N-O 2.87Å; Y185-A187 HydrophobicContact CD1-CB 4.06Å; Y185-A187 HydrophobicContact CE1-CB 3.81Å; Y185-Y193 HydrophobicContact CE1-CD1 4.29Å; Y185-Y193 HydrophobicContact CE1-CE1 4.1Å; Y185-Y193 AromaticContact CZ-CE1 3.95Å; Y185-Y193 WeakPolarHBondContact OH-CD1 3.49Å; Y185-Y193 WeakPolarHBondContact OH-CE1 3.32Å; Y185-L197 HydrophobicContact CE1-CD2 3.81Å; Y185-L197 HydrophobicContact CE2-CD2 4.47Å; Y185-L197 WeakPolarHBondContact OH-CD2 3.13Å; Y185-L201 HydrophobicContact CD1-CD1 3.86Å; Y185-L201 HydrophobicContact CD2-CD1 4.49Å; Y185-L201 HydrophobicContact CD2-CD2 4.26Å; Y185-L201 HydrophobicContact CG-CD1 3.83Å; Y185-L201 HydrophobicContact CG-CD2 4.32Å; Y185-W210 AromaticContact CD2-CH2 3.99Å; Y185-W210 HydrophobicContact CD2-CH2 3.99Å; Y185-W210 HydrophobicContact CD2-CZ2 4.13Å; Y185-W210 AromaticContact CE2-CH2 3.83Å; Y185-W210 HydrophobicContact CE2-CH2 3.83Å; Y185-W210 AromaticContact CE2-CZ2 3.49Å; Y185-W210 HydrophobicContact CE2-CZ2 3.49Å; Y185-W210 VanDerWaalsContact CE2-CZ2 3.49Å; Y185-S254 VanDerWaalsContact CE2-O 3.29Å; Y185-S254 WeakPolarHBondContact CE2-O 3.23Å; Y185-S254 PolarHBondContact OH-O 2.74Å; Y185-A257 HydrophobicContact CD2-CB 4.11Å
186	F	98.1	Very high	96.7	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	112.3	175	-59.3	-66.1	0	0	0	110.4	V82 R168 L172 V184 M253 S254 F256 F258 F292	V82-F186 HydrophobicContact CB-CD1 3.79Å; V82-F186 HydrophobicContact CB-CE1 4.21Å; V82-F186 HydrophobicContact CG1-CD1 3.85Å; V82-F186 HydrophobicContact CG1-CE1 4.1Å; V82-F186 HydrophobicContact CG2-CD1 4.45Å; V82-F186 HydrophobicContact CG2-CE1 4.45Å; R168-F186 HydrophobicContact CB-CD1 4.29Å; R168-F186 HydrophobicContact CB-CE1 3.88Å; R168-F186 HydrophobicContact CG-CD1 3.8Å; R168-F186 HydrophobicContact CG-CE1 3.92Å; L172-F186 HydrophobicContact CD1-CZ 4.43Å; L172-F186 HydrophobicContact CD2-CZ 4.16Å; L172-F186 HydrophobicContact CG-CZ 4.49Å; V184-F186 HydrophobicContact CG1-CE1 4.47Å; V184-F186 HydrophobicContact CG1-CZ 4.4Å; F186-M253 HydrophobicContact CB-CG 3.99Å; F186-M253 HydrophobicContact CB-SD 4.41Å; F186-M253 HydrophobicContact CD2-CG 4.25Å; F186-M253 HydrophobicContact CD2-SD 3.57Å; F186-M253 VanDerWaalsContact CD2-SD 3.57Å; F186-M253 HydrophobicContact CE2-SD 3.97Å; F186-M253 HydrophobicContact CG-CG 4.24Å; F186-M253 HydrophobicContact CG-SD 4.03Å; F186-S254 WeakPolarHBondContact O-CA 3.42Å; F186-S254 WeakPolarHBondContact O-CB 3.34Å; F186-F256 HydrophobicContact CD2-CE2 4.15Å; F186-F256 HydrophobicContact CD2-CZ 4.1Å; F186-F256 HydrophobicContact CE2-CE2 4.02Å; F186-F256 HydrophobicContact CE2-CZ 4.13Å; F186-F258 AromaticContact CE2-CE1 3.94Å; F186-F258 HydrophobicContact CE2-CE1 3.94Å; F186-F258 HydrophobicContact CZ-CE1 4.23Å; F186-F292 HydrophobicContact CE2-CD1 4.47Å; F186-F292 AromaticContact CE2-CE1 3.69Å; F186-F292 HydrophobicContact CE2-CE1 3.69Å; F186-F292 HydrophobicContact CE2-CZ 4.24Å; F186-F292 HydrophobicContact CZ-CE1 4.06Å; F186-F292 HydrophobicContact CZ-CZ 4.14Å
187	A	97.6	Very high	96.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.192	C	C	.	.			trans	-117.5	95.5	179.6	0	0	0	0	0	110.6	V81 V82 T83 L98 Y185 Y193	V81-A187 HydrophobicContact CG1-CB 3.51Å; V82-A187 PolarHBondContact O-N 3.4Å; T83-A187 VanDerWaalsContact CA-O 3.32Å; T83-A187 WeakPolarHBondContact CA-O 3.08Å; T83-A187 VanDerWaalsContact CB-O 3.27Å; T83-A187 WeakPolarHBondContact CB-O 3.36Å; T83-A187 WeakPolarHBondContact CG2-O 3.31Å; T83-A187 PolarHBondContact OG1-O 3.16Å; L98-A187 HydrophobicContact CD2-CB 4.41Å; Y185-A187 HydrophobicContact CD1-CB 4.06Å; Y185-A187 HydrophobicContact CE1-CB 3.81Å; A187-Y193 VanDerWaalsContact C-OH 3.24Å; A187-Y193 WeakPolarHBondContact CA-OH 3.35Å; A187-Y193 HydrophobicContact CB-CE2 4.15Å
188	D	94.4	Very high	96.7	Very high	11 Å²	11	32.4 Å²	32.4	6%	0.059	16%	0.158	C	C	.	.			trans	-59.5	138.6	170.8	-67.7	-20.1	0	0	0	111.2	D190 N191 Y193	D188-D190 VanDerWaalsContact C-N 3.27Å; D188-D190 PolarHBondContact O-N 3.27Å; D188-N191 HydrophobicContact CB-CB 4.47Å; D188-N191 PolarHBondContact O-N 3.11Å; D188-Y193 PolarHBondContact N-OH 2.81Å; D188-Y193 PolarHBondContact O-OH 2.91Å; D188-Y193 VanDerWaalsContact O-OH 3.07Å
189	E	93.5	Very high	96.6	Very high	5 Å²	5	33.8 Å²	33.8	2%	0.023	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-27	-171.8	63	180	-167.5	0	0	114.1	T83 T85 R88 Y94 L95 R97	T83-E189 HydrophobicContact CG2-CB 3.8Å; T85-E189 WeakPolarHBondContact CB-OE2 3.48Å; T85-E189 PolarHBondContact OG1-OE2 3.44Å; R88-E189 IonicContact CZ-OE1 3.06Å; R88-E189 IonicContact NE-OE1 2.75Å; R88-E189 PolarHBondContact NE-OE1 2.94Å; R88-E189 VanDerWaalsContact NH2-CG 3.34Å; R88-E189 IonicContact NH2-OE1 2.75Å; R88-E189 PolarHBondContact NH2-OE1 3.35Å; Y94-E189 WeakPolarHBondContact CB-O 3.47Å; Y94-E189 HydrophobicContact CG-CG 4.45Å; L95-E189 HydrophobicContact CD2-CB 4.23Å; R97-E189 PolarHBondContact NH2-O 3.21Å
190	D	91.8	Very high	96.6	Very high	6 Å²	6	27.4 Å²	27.4	3%	0.032	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-10.3	-178	39.5	15.7	0	0	0	114.2	R88 Y94 R97 R164 D188 L318 L320	R88-D190 IonicContact CZ-OD2 3.72Å; R88-D190 IonicContact NH1-OD2 2.73Å; R88-D190 PolarHBondContact NH1-OD2 2.87Å; R88-D190 IonicContact NH2-OD2 3.12Å; R88-D190 PolarHBondContact NH2-OD2 2.87Å; Y94-D190 HydrophobicContact CD1-CB 3.97Å; Y94-D190 HydrophobicContact CD2-CB 4.44Å; Y94-D190 HydrophobicContact CE1-CB 3.89Å; Y94-D190 HydrophobicContact CE2-CB 4.35Å; Y94-D190 HydrophobicContact CG-CB 4.27Å; R97-D190 PolarHBondContact NH2-O 2.74Å; R164-D190 IonicContact NH2-OD2 3.03Å; D188-D190 VanDerWaalsContact C-N 3.27Å; D188-D190 PolarHBondContact O-N 3.27Å; D190-L318 VanDerWaalsContact O-CD1 3.31Å; D190-L318 WeakPolarHBondContact O-CD1 3.1Å; D190-L320 HydrophobicContact CB-CD1 4.37Å
191	N	95.3	Very high	96.6	Very high	3 Å²	3	26.4 Å²	26.4	2%	0.016	13%	0.133	C	C	.	.	S	Bend	trans	-77.1	163.1	176.9	-73.2	-6.9	0	0	0	112.9	R97 D188 Y193 S254 F316 H317 L318	R97-N191 PolarHBondContact NH2-O 2.74Å; D188-N191 HydrophobicContact CB-CB 4.47Å; D188-N191 PolarHBondContact O-N 3.11Å; N191-Y193 HydrophobicContact CB-CE1 4.09Å; N191-Y193 HydrophobicContact CB-CE2 3.87Å; N191-Y193 VanDerWaalsContact CB-CZ 3.48Å; N191-Y193 VanDerWaalsContact CB-OH 3.23Å; N191-Y193 WeakPolarHBondContact CB-OH 3.44Å; N191-S254 PolarHBondContact ND2-OG 2.91Å; N191-F316 WeakPolarHBondContact CA-O 3.29Å; N191-F316 WeakPolarHBondContact CB-O 3.31Å; N191-H317 VanDerWaalsContact OD1-CA 3.31Å; N191-H317 WeakPolarHBondContact OD1-CA 2.87Å; N191-L318 PolarHBondContact OD1-N 3.34Å
192	V	96.1	Very high	96.6	Very high	59 Å²	59	21.5 Å²	21.5	36%	0.358	11%	0.109	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.2	178.2	-179.2	0	0	0	0	109.4	N315 F316 L318	V192-N315 CarbonylContact O-C 3.54Å; V192-N315 VanDerWaalsContact O-CA 3.27Å; V192-N315 WeakPolarHBondContact O-CA 3.5Å; V192-F316 HydrophobicContact CB-CB 4.26Å; V192-F316 PolarHBondContact N-O 2.84Å; V192-F316 PolarHBondContact O-N 2.79Å; V192-L318 HydrophobicContact CG2-CD1 3.82Å; V192-L318 HydrophobicContact CG2-CD2 4.49Å; V192-L318 HydrophobicContact CG2-CG 4.24Å
193	Y	97.7	Very high	96.4	Very high	15 Å²	15	26.1 Å²	26.1	6%	0.059	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	132.1	-174.7	-54.8	-73.8	0	0	0	111	L98 Y185 A187 D188 N191 L197 N315	L98-Y193 HydrophobicContact CD1-CD2 3.7Å; L98-Y193 HydrophobicContact CD1-CE2 3.78Å; Y185-Y193 HydrophobicContact CE1-CD1 4.29Å; Y185-Y193 HydrophobicContact CE1-CE1 4.1Å; Y185-Y193 AromaticContact CZ-CE1 3.95Å; Y185-Y193 WeakPolarHBondContact OH-CD1 3.49Å; Y185-Y193 WeakPolarHBondContact OH-CE1 3.32Å; A187-Y193 VanDerWaalsContact C-OH 3.24Å; A187-Y193 WeakPolarHBondContact CA-OH 3.35Å; A187-Y193 HydrophobicContact CB-CE2 4.15Å; D188-Y193 PolarHBondContact N-OH 2.81Å; D188-Y193 PolarHBondContact O-OH 2.91Å; D188-Y193 VanDerWaalsContact O-OH 3.07Å; N191-Y193 HydrophobicContact CB-CE1 4.09Å; N191-Y193 HydrophobicContact CB-CE2 3.87Å; N191-Y193 VanDerWaalsContact CB-CZ 3.48Å; N191-Y193 VanDerWaalsContact CB-OH 3.23Å; N191-Y193 WeakPolarHBondContact CB-OH 3.44Å; Y193-L197 HydrophobicContact CD1-CD2 3.9Å; Y193-N315 HydrophobicContact CD1-CB 3.76Å; Y193-N315 HydrophobicContact CE1-CB 4.01Å
194	S	96.8	Very high	96.3	Very high	51 Å²	51	26.1 Å²	26.1	36%	0.357	13%	0.133	S	C	.	.			trans	-75.6	149.3	166.7	-177.4	0	0	0	0	110.4	D196 L197 M314	S194-D196 PolarHBondContact O-N 3.14Å; S194-D196 PolarHBondContact OG-N 2.96Å; S194-L197 WeakPolarHBondContact O-CB 3.27Å; S194-L197 PolarHBondContact O-N 3.17Å; S194-M314 WeakPolarHBondContact CB-O 3.39Å; S194-M314 PolarHBondContact N-O 3.1Å
195	L	97.1	Very high	96.1	Very high	57 Å²	57	34 Å²	34	30%	0.298	16%	0.163	S	C	.	.	H	α-helix	trans	-64.7	-32.3	173.5	-64.5	178.5	0	0	0	111.9	T101 L104 L197 F198 Y199	T101-L195 HydrophobicContact CG2-CD2 4Å; L104-L195 HydrophobicContact CB-CD1 3.91Å; L104-L195 HydrophobicContact CB-CD2 3.71Å; L104-L195 HydrophobicContact CB-CG 4.49Å; L104-L195 HydrophobicContact CD1-CD1 4.29Å; L195-L197 PolarHBondContact O-N 3.12Å; L195-L197 VanDerWaalsContact O-N 3.11Å; L195-F198 PolarHBondContact O-N 3.49Å; L195-Y199 HydrophobicContact CB-CE2 4.17Å; L195-Y199 WeakPolarHBondContact O-CD2 3.29Å; L195-Y199 PolarHBondContact O-N 3Å
196	D	95.6	Very high	95.8	Very high	61 Å²	61	35.9 Å²	35.9	33%	0.326	18%	0.176	S	C	.	.	H	α-helix	trans	-48.4	-38.2	174.2	-80	18.2	0	0	0	112.2	S194 F198 Y199 H200 K312 M314	S194-D196 PolarHBondContact O-N 3.14Å; S194-D196 PolarHBondContact OG-N 2.96Å; D196-F198 VanDerWaalsContact C-N 3.33Å; D196-F198 PolarHBondContact O-N 2.79Å; D196-Y199 PolarHBondContact O-N 3.03Å; D196-H200 PolarHBondContact O-CD2 3.37Å; D196-H200 VanDerWaalsContact O-CD2 3.24Å; D196-H200 PolarHBondContact O-N 2.86Å; D196-H200 VanDerWaalsContact O-N 3.09Å; D196-K312 IonicContact OD2-NZ 3.95Å; D196-K312 PolarHBondContact OD2-NZ 3.07Å; D196-M314 HydrophobicContact CB-SD 4.14Å
197	L	97.7	Very high	95.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-56.2	-48.8	178.5	178.3	57.6	0	0	0	111.2	Y185 Y193 S194 L195 Y199 H200 L201 W210 M314 N315	Y185-L197 HydrophobicContact CE1-CD2 3.81Å; Y185-L197 HydrophobicContact CE2-CD2 4.47Å; Y185-L197 WeakPolarHBondContact OH-CD2 3.13Å; Y193-L197 HydrophobicContact CD1-CD2 3.9Å; S194-L197 WeakPolarHBondContact O-CB 3.27Å; S194-L197 PolarHBondContact O-N 3.17Å; L195-L197 PolarHBondContact O-N 3.12Å; L195-L197 VanDerWaalsContact O-N 3.11Å; L197-Y199 VanDerWaalsContact C-N 3.28Å; L197-Y199 PolarHBondContact O-N 3Å; L197-H200 PolarHBondContact O-N 3.47Å; L197-L201 HydrophobicContact CD1-CD2 4.25Å; L197-L201 HydrophobicContact CD1-CG 4.12Å; L197-L201 HydrophobicContact CG-CD1 4.29Å; L197-L201 HydrophobicContact CG-CG 4.22Å; L197-L201 VanDerWaalsContact O-CG 3.28Å; L197-L201 WeakPolarHBondContact O-CG 3.35Å; L197-L201 PolarHBondContact O-N 3.47Å; L197-W210 HydrophobicContact CD1-CD2 4.04Å; L197-W210 VanDerWaalsContact CD1-CE2 3.49Å; L197-W210 HydrophobicContact CD1-CE3 4.39Å; L197-W210 HydrophobicContact CD1-CH2 3.83Å; L197-W210 HydrophobicContact CD1-CZ2 3.38Å; L197-W210 HydrophobicContact CD1-CZ3 4.3Å; L197-W210 HydrophobicContact CD2-CZ2 4.32Å; L197-W210 HydrophobicContact CG-CZ2 4.44Å; L197-M314 HydrophobicContact CB-CB 3.92Å; L197-M314 HydrophobicContact CB-SD 4.49Å; L197-M314 HydrophobicContact CD1-CB 4.41Å; L197-M314 HydrophobicContact CD1-CE 3.93Å; L197-N315 HydrophobicContact CD2-CB 4.42Å
198	F	97.6	Very high	95.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-71	-23.5	-174.8	-59.3	-82	0	0	0	113.3	L79 V81 T101 L102 A105 L109 L195 D196 L201	L79-F198 HydrophobicContact CD1-CB 4.18Å; L79-F198 HydrophobicContact CD1-CD1 4.18Å; V81-F198 HydrophobicContact CG2-CE1 4.39Å; T101-F198 HydrophobicContact CG2-CE2 3.79Å; T101-F198 HydrophobicContact CG2-CZ 4.38Å; L102-F198 HydrophobicContact CD2-CD1 4.34Å; L102-F198 HydrophobicContact CD2-CE1 3.42Å; L102-F198 VanDerWaalsContact CD2-CE1 3.42Å; L102-F198 HydrophobicContact CD2-CZ 3.53Å; A105-F198 HydrophobicContact CB-CB 3.8Å; A105-F198 HydrophobicContact CB-CD1 4.15Å; A105-F198 HydrophobicContact CB-CD2 4.1Å; A105-F198 HydrophobicContact CB-CG 3.74Å; L109-F198 HydrophobicContact CD1-CD1 4.4Å; L195-F198 PolarHBondContact O-N 3.49Å; D196-F198 VanDerWaalsContact C-N 3.33Å; D196-F198 PolarHBondContact O-N 2.79Å; F198-L201 HydrophobicContact CD1-CD1 4.07Å
199	Y	95.7	Very high	96	Very high	118 Å²	118	35.4 Å²	35.4	46%	0.463	17%	0.173	S	C	.	.	H	α-helix	trans	-69	-52.8	168.5	-64.5	-77.1	0	0	0	109.8	P106 L195 D196 L197 L201 R202	P106-Y199 HydrophobicContact CG-CD1 3.61Å; P106-Y199 HydrophobicContact CG-CE1 3.15Å; L195-Y199 HydrophobicContact CB-CE2 4.17Å; L195-Y199 WeakPolarHBondContact O-CD2 3.29Å; L195-Y199 PolarHBondContact O-N 3Å; D196-Y199 PolarHBondContact O-N 3.03Å; L197-Y199 VanDerWaalsContact C-N 3.28Å; L197-Y199 PolarHBondContact O-N 3Å; Y199-L201 VanDerWaalsContact C-N 3.34Å; Y199-L201 PolarHBondContact O-N 3.22Å; Y199-R202 WeakPolarHBondContact O-CB 3.4Å; Y199-R202 PolarHBondContact O-N 3.26Å; Y199-R202 VanDerWaalsContact O-N 3.13Å
200	H	96.4	Very high	96.2	Very high	39 Å²	39	35.1 Å²	35.1	18%	0.181	17%	0.172	C	C	.	.	H	α-helix	trans	-68.2	-28.1	-176.7	-74.9	-50.4	0	0	0	114.5	D196 L197 R202 D203 V306 M314	D196-H200 PolarHBondContact O-CD2 3.37Å; D196-H200 VanDerWaalsContact O-CD2 3.24Å; D196-H200 PolarHBondContact O-N 2.86Å; D196-H200 VanDerWaalsContact O-N 3.09Å; L197-H200 PolarHBondContact O-N 3.47Å; H200-R202 PolarHBondContact O-N 2.88Å; H200-R202 VanDerWaalsContact O-N 3.12Å; H200-D203 IonicContact ND1-OD2 2.74Å; H200-D203 PolarHBondContact ND1-OD2 3.47Å; H200-D203 WeakPolarHBondContact O-CB 3.29Å; H200-D203 PolarHBondContact O-N 2.85Å; H200-V306 HydrophobicContact CB-CG1 3.53Å; H200-M314 VanDerWaalsContact CD2-SD 3.59Å
201	L	97.6	Very high	96.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.6	172.4	-77.6	179.7	0	0	0	112.2	L79 I183 Y185 L197 F198 Y199 D203 I204 W210 A257	L79-L201 HydrophobicContact CD1-CB 4.48Å; L79-L201 HydrophobicContact CD1-CD1 4.45Å; L79-L201 HydrophobicContact CD2-CB 3.78Å; I183-L201 HydrophobicContact CG2-CD2 4.49Å; Y185-L201 HydrophobicContact CD1-CD1 3.86Å; Y185-L201 HydrophobicContact CD2-CD1 4.49Å; Y185-L201 HydrophobicContact CD2-CD2 4.26Å; Y185-L201 HydrophobicContact CG-CD1 3.83Å; Y185-L201 HydrophobicContact CG-CD2 4.32Å; L197-L201 HydrophobicContact CD1-CD2 4.25Å; L197-L201 HydrophobicContact CD1-CG 4.12Å; L197-L201 HydrophobicContact CG-CD1 4.29Å; L197-L201 HydrophobicContact CG-CG 4.22Å; L197-L201 VanDerWaalsContact O-CG 3.28Å; L197-L201 WeakPolarHBondContact O-CG 3.35Å; L197-L201 PolarHBondContact O-N 3.47Å; F198-L201 HydrophobicContact CD1-CD1 4.07Å; Y199-L201 VanDerWaalsContact C-N 3.34Å; Y199-L201 PolarHBondContact O-N 3.22Å; L201-D203 VanDerWaalsContact C-N 3.33Å; L201-I204 HydrophobicContact CD2-CD1 3.83Å; L201-W210 HydrophobicContact CD2-CH2 3.5Å; L201-W210 HydrophobicContact CD2-CZ2 4.44Å; L201-W210 HydrophobicContact CD2-CZ3 3.85Å; L201-A257 HydrophobicContact CD2-CB 3.4Å; L201-A257 VanDerWaalsContact CD2-CB 3.4Å
202	R	95.5	Very high	96.4	Very high	22 Å²	22	35.3 Å²	35.3	8%	0.083	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-21.9	-178.7	-61.6	-179.9	176.4	-81.1	-6.8	112.7	R76 K77 L79 P106 S107 P108 Y199 H200 I204	R76-R202 VanDerWaalsContact CB-NH1 3.26Å; K77-R202 WeakPolarHBondContact CD-O 3.45Å; K77-R202 WeakPolarHBondContact CE-O 3.42Å; K77-R202 PolarHBondContact NZ-O 2.81Å; K77-R202 PolarHBondContact O-NH1 3.24Å; L79-R202 HydrophobicContact CD1-CG 4.45Å; L79-R202 HydrophobicContact CD2-CG 3.97Å; L79-R202 HydrophobicContact CG-CG 4.38Å; P106-R202 PolarHBondContact O-NH2 3.18Å; S107-R202 VanDerWaalsContact C-NH2 3.3Å; S107-R202 PolarHBondContact O-NH2 3.11Å; P108-R202 PolarHBondContact O-NH2 3.11Å; Y199-R202 WeakPolarHBondContact O-CB 3.4Å; Y199-R202 PolarHBondContact O-N 3.26Å; Y199-R202 VanDerWaalsContact O-N 3.13Å; H200-R202 PolarHBondContact O-N 2.88Å; H200-R202 VanDerWaalsContact O-N 3.12Å; R202-I204 VanDerWaalsContact C-N 3.28Å; R202-I204 PolarHBondContact O-N 2.92Å
203	D	94.2	Very high	96.4	Very high	101 Å²	101	32.6 Å²	32.6	54%	0.54	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-20.2	179.4	-58.2	-30.8	0	0	0	112	H200 L201 R205	H200-D203 IonicContact ND1-OD2 2.74Å; H200-D203 PolarHBondContact ND1-OD2 3.47Å; H200-D203 WeakPolarHBondContact O-CB 3.29Å; H200-D203 PolarHBondContact O-N 2.85Å; L201-D203 VanDerWaalsContact C-N 3.33Å; D203-R205 PolarHBondContact O-N 2.92Å
204	I	96.3	Very high	96.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.16	C	C	.	.			trans	-59.2	122.7	-178.3	-63.5	173.3	0	0	0	110.7	K77 I183 L201 R202 W210 A257 E304 V306	K77-I204 PolarHBondContact NZ-O 3.27Å; I183-I204 HydrophobicContact CD1-CB 4.13Å; I183-I204 HydrophobicContact CD1-CG2 4.15Å; I183-I204 HydrophobicContact CG2-CD1 4.31Å; L201-I204 HydrophobicContact CD2-CD1 3.83Å; R202-I204 VanDerWaalsContact C-N 3.28Å; R202-I204 PolarHBondContact O-N 2.92Å; I204-W210 HydrophobicContact CD1-CZ3 4.18Å; I204-A257 HydrophobicContact CD1-CB 3.73Å; I204-E304 VanDerWaalsContact CA-OE1 3.29Å; I204-E304 WeakPolarHBondContact CA-OE1 3.27Å; I204-E304 WeakPolarHBondContact CG2-OE1 3.49Å; I204-V306 HydrophobicContact CG1-CG2 4.03Å
205	R	93.9	Very high	95.6	Very high	166 Å²	166	33.7 Å²	33.7	63%	0.626	16%	0.161	S	C	*	.	S	Bend	trans	-84.1	-46.5	175.1	-65.8	-171.5	-57.9	-60.7	-10.2	111.1	D203 N259 E304	D203-R205 PolarHBondContact O-N 2.92Å; R205-N259 PolarHBondContact O-ND2 3.03Å; R205-E304 IonicContact CZ-OE2 3.04Å; R205-E304 PolarHBondContact N-OE1 3.43Å; R205-E304 IonicContact NH1-OE2 2.74Å; R205-E304 PolarHBondContact NH1-OE2 2.93Å; R205-E304 IonicContact NH2-OE2 2.95Å; R205-E304 PolarHBondContact NH2-OE2 2.86Å
206	S	93.8	Very high	94.7	Very high	39 Å²	39	32 Å²	32	27%	0.273	16%	0.155	S	C	.	.	S	Bend	trans	-134.8	-63.3	-170.6	177.6	0	0	0	0	112.5	F258 N259 K262 E304	S206-F258 CarbonylContact O-C 3.53Å; S206-F258 WeakPolarHBondContact O-CA 3.25Å; S206-N259 PolarHBondContact O-N 3.46Å; S206-K262 WeakPolarHBondContact O-CE 3.4Å; S206-K262 WeakPolarHBondContact OG-CE 3.42Å; S206-K262 PolarHBondContact OG-NZ 3.37Å; S206-K262 VanDerWaalsContact OG-NZ 3.17Å; S206-E304 PolarHBondContact N-OE1 3.15Å
207	F	96.9	Very high	93.4	Very high	1 Å²	1	33.3 Å²	33.3	0%	0.004	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	115.2	-179.8	-178.3	-80.1	0	0	0	108.7	T209 F256 F258 I293 L296 V297 M303 E304	F207-T209 HydrophobicContact CE1-CG2 4.38Å; F207-F256 HydrophobicContact CE1-CB 4.14Å; F207-F256 HydrophobicContact CE2-CB 4.33Å; F207-F256 AromaticContact CE2-CD2 3.73Å; F207-F256 HydrophobicContact CE2-CD2 3.73Å; F207-F256 HydrophobicContact CE2-CE2 4.41Å; F207-F256 HydrophobicContact CE2-CG 4.23Å; F207-F256 HydrophobicContact CZ-CB 3.68Å; F207-F256 AromaticContact CZ-CD2 3.85Å; F207-F256 HydrophobicContact CZ-CD2 3.85Å; F207-F256 AromaticContact CZ-CG 3.86Å; F207-F256 HydrophobicContact CZ-CG 3.86Å; F207-F258 HydrophobicContact CD2-CB 3.89Å; F207-I293 HydrophobicContact CE2-CG1 4.18Å; F207-I293 HydrophobicContact CE2-CG2 4.19Å; F207-I293 HydrophobicContact CZ-CD1 4.15Å; F207-I293 HydrophobicContact CZ-CG1 3.97Å; F207-I293 HydrophobicContact CZ-CG2 3.88Å; F207-L296 HydrophobicContact CD2-CB 4.37Å; F207-L296 HydrophobicContact CD2-CD1 4.32Å; F207-L296 HydrophobicContact CE2-CD1 4.03Å; F207-V297 HydrophobicContact CB-CG1 3.83Å; F207-V297 HydrophobicContact CD2-CG1 4.12Å; F207-V297 HydrophobicContact CG-CG1 3.96Å; F207-M303 HydrophobicContact CD1-CB 3.87Å; F207-M303 HydrophobicContact CD1-CG 3.58Å; F207-M303 HydrophobicContact CD1-SD 4.2Å; F207-M303 HydrophobicContact CE1-CB 4.36Å; F207-M303 HydrophobicContact CE1-CE 4.34Å; F207-M303 HydrophobicContact CE1-CG 3.87Å; F207-M303 HydrophobicContact CE1-SD 3.84Å; F207-M303 HydrophobicContact CG-CG 4.47Å; F207-E304 WeakPolarHBondContact O-CG 3.34Å; F207-E304 PolarHBondContact O-N 3.11Å
208	G	97.7	Very high	91.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	144.2	179	0	0	0	0	0	111.8	F256 A257 E304	G208-F256 CarbonylContact O-C 3.4Å; G208-F256 WeakPolarHBondContact O-CA 3.47Å; G208-F256 WeakPolarHBondContact O-CB 3.46Å; G208-A257 PolarHBondContact N-O 2.9Å; G208-A257 PolarHBondContact O-N 2.86Å; G208-E304 CarbonylContact C-O 3.35Å; G208-E304 VanDerWaalsContact CA-O 3.3Å; G208-E304 WeakPolarHBondContact CA-O 3.43Å
209	T	98	Very high	90.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	152.9	-179.9	-180	0	0	0	0	111.5	F207 P227 V234 W237 G255 M303 E304 V306	F207-T209 HydrophobicContact CE1-CG2 4.38Å; T209-P227 HydrophobicContact CG2-CB 3.95Å; T209-P227 HydrophobicContact CG2-CG 3.87Å; T209-V234 HydrophobicContact CG2-CG2 3.72Å; T209-W237 HydrophobicContact CG2-CH2 4.34Å; T209-G255 WeakPolarHBondContact CA-O 3.43Å; T209-G255 PolarHBondContact OG1-O 2.84Å; T209-M303 HydrophobicContact CG2-CB 4.45Å; T209-E304 PolarHBondContact N-O 3.41Å; T209-V306 PolarHBondContact O-N 3.3Å
210	W	98	Very high	89	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.264	C	S	.	.			trans	-154.8	164.6	-177	58.2	84.4	0	0	0	113	Y185 L197 L201 I204 P227 S254 G255 F256 A257 V306 M314 N315	Y185-W210 AromaticContact CD2-CH2 3.99Å; Y185-W210 HydrophobicContact CD2-CH2 3.99Å; Y185-W210 HydrophobicContact CD2-CZ2 4.13Å; Y185-W210 AromaticContact CE2-CH2 3.83Å; Y185-W210 HydrophobicContact CE2-CH2 3.83Å; Y185-W210 AromaticContact CE2-CZ2 3.49Å; Y185-W210 HydrophobicContact CE2-CZ2 3.49Å; Y185-W210 VanDerWaalsContact CE2-CZ2 3.49Å; L197-W210 HydrophobicContact CD1-CD2 4.04Å; L197-W210 VanDerWaalsContact CD1-CE2 3.49Å; L197-W210 HydrophobicContact CD1-CE3 4.39Å; L197-W210 HydrophobicContact CD1-CH2 3.83Å; L197-W210 HydrophobicContact CD1-CZ2 3.38Å; L197-W210 HydrophobicContact CD1-CZ3 4.3Å; L197-W210 HydrophobicContact CD2-CZ2 4.32Å; L197-W210 HydrophobicContact CG-CZ2 4.44Å; L201-W210 HydrophobicContact CD2-CH2 3.5Å; L201-W210 HydrophobicContact CD2-CZ2 4.44Å; L201-W210 HydrophobicContact CD2-CZ3 3.85Å; I204-W210 HydrophobicContact CD1-CZ3 4.18Å; W210-P227 VanDerWaalsContact C-CD 3.44Å; W210-S254 WeakPolarHBondContact CZ2-O 3.42Å; W210-G255 PolarHBondContact N-O 3.44Å; W210-F256 VanDerWaalsContact CH2-C 3.5Å; W210-A257 HydrophobicContact CH2-CB 3.87Å; W210-A257 HydrophobicContact CZ3-CB 4.15Å; W210-V306 WeakPolarHBondContact CB-O 3.23Å; W210-V306 HydrophobicContact CE3-CB 4.3Å; W210-M314 HydrophobicContact CB-CE 4.2Å; W210-M314 HydrophobicContact CD2-CE 4.29Å; W210-M314 HydrophobicContact CG-CE 4.01Å; W210-N315 PolarHBondContact NE1-OD1 2.95Å
211	P	96.9	Very high	88.1	Confident	13 Å²	13	51.5 Å²	51.5	8%	0.084	29%	0.29	C	S	.	.			trans	-69.5	138.4	178.8	-19.6	33	0	0	0	113.6	L224 Q225 C310 I313	P211-L224 HydrophobicContact CB-CD1 4.08Å; P211-Q225 WeakPolarHBondContact CA-O 3.41Å; P211-C310 HydrophobicContact CG-CB 4.19Å; P211-C310 VanDerWaalsContact CG-O 3.31Å; P211-C310 WeakPolarHBondContact CG-O 3.33Å; P211-I313 HydrophobicContact CB-CG1 4.32Å
212	V	95.9	Very high	87.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	129.1	177.2	-174.4	0	0	0	0	109.8	Q225 D252 N315 H317	V212-Q225 PolarHBondContact N-O 2.86Å; V212-Q225 PolarHBondContact O-N 3.02Å; V212-Q225 VanDerWaalsContact O-N 3.1Å; V212-D252 HydrophobicContact CB-CB 3.99Å; V212-D252 HydrophobicContact CG1-CB 3.91Å; V212-D252 HydrophobicContact CG2-CB 3.87Å; V212-N315 WeakPolarHBondContact CG1-ND2 3.37Å; V212-N315 VanDerWaalsContact CG2-ND2 3.28Å; V212-N315 WeakPolarHBondContact CG2-ND2 3.08Å; V212-N315 WeakPolarHBondContact CG2-OD1 3.07Å; V212-H317 HydrophobicContact CG1-CB 4.08Å
213	A	94.3	Very high	87.4	Confident	2 Å²	2	55.9 Å²	55.9	2%	0.017	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	126.9	170.6	0	0	0	0	0	110.2	T222 I223 I313 N315 F316 H317	A213-T222 HydrophobicContact CB-CG2 3.95Å; A213-I223 CarbonylContact C-O 3.44Å; A213-I223 WeakPolarHBondContact CA-O 3.43Å; A213-I313 HydrophobicContact CB-CD1 4.37Å; A213-I313 HydrophobicContact CB-CG2 3.83Å; A213-N315 PolarHBondContact N-O 3.2Å; A213-F316 HydrophobicContact CB-CD1 3.62Å; A213-F316 HydrophobicContact CB-CE1 3.73Å; A213-F316 CarbonylContact O-C 3.59Å; A213-F316 VanDerWaalsContact O-CA 3.24Å; A213-F316 WeakPolarHBondContact O-CA 3.4Å; A213-H317 PolarHBondContact O-N 2.8Å
214	T	91.5	Very high	87.3	Confident	19 Å²	19	53.7 Å²	53.7	12%	0.117	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	125	174.7	-56.8	0	0	0	0	110.2	I223 H317	T214-I223 PolarHBondContact N-O 2.98Å; T214-I223 PolarHBondContact O-N 3.09Å; T214-H317 CarbonylContact C-O 3.55Å; T214-H317 WeakPolarHBondContact CA-O 3.45Å; T214-H317 HydrophobicContact CG2-CB 4.3Å
215	L	87.4	Confident	87.1	Confident	69 Å²	69	53.9 Å²	53.9	36%	0.361	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	120.8	175.9	-61.2	176.9	0	0	0	109.4	T222 F316 H317 L318 H319	L215-T222 HydrophobicContact CD2-CG2 3.92Å; L215-T222 WeakPolarHBondContact CD2-OG1 3.32Å; L215-F316 HydrophobicContact CD1-CD1 4.14Å; L215-F316 HydrophobicContact CG-CD1 4.4Å; L215-H317 PolarHBondContact N-O 3.33Å; L215-L318 HydrophobicContact CB-CD2 4.02Å; L215-L318 HydrophobicContact CD1-CD2 3.88Å; L215-L318 HydrophobicContact CG-CD2 4.36Å; L215-H319 PolarHBondContact O-N 2.83Å
216	A	78	Confident	87.1	Confident	21 Å²	21	46.1 Å²	46.1	17%	0.174	28%	0.279	C	S	.	.			trans	-111.2	128.7	176.9	0	0	0	0	0	110.6	G218 K219 H319	A216-G218 PolarHBondContact O-N 2.9Å; A216-K219 HydrophobicContact CB-CB 4.28Å; A216-K219 HydrophobicContact CB-CD 4.03Å; A216-K219 HydrophobicContact CB-CG 4.38Å; A216-K219 PolarHBondContact O-N 2.98Å; A216-H319 HydrophobicContact CB-CB 4.39Å
217	P	67.2	Low	87.3	Confident	89 Å²	89	44.7 Å²	44.7	58%	0.578	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	134.5	175.8	-23	32.2	0	0	0	111.8	K219 H319 L320	P217-K219 PolarHBondContact O-N 3.49Å; P217-H319 WeakPolarHBondContact CD-O 3.33Å; P217-H319 WeakPolarHBondContact CG-O 3.39Å; P217-L320 HydrophobicContact CG-CD2 4.37Å
218	G	67.6	Low	87.2	Confident	90 Å²	90	47.8 Å²	47.8	93%	0.928	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	-5.8	176	0	0	0	0	0	115.9	A216	A216-G218 PolarHBondContact O-N 2.9Å
219	K	63.6	Low	87.2	Confident	148 Å²	148	48.9 Å²	48.9	64%	0.643	29%	0.294	S	S	*	.			trans	-99.8	115.9	169	-63	-178.2	-176.2	174	0	107.8	A216 P217 K221	A216-K219 HydrophobicContact CB-CB 4.28Å; A216-K219 HydrophobicContact CB-CD 4.03Å; A216-K219 HydrophobicContact CB-CG 4.38Å; A216-K219 PolarHBondContact O-N 2.98Å; P217-K219 PolarHBondContact O-N 3.49Å; K219-K221 PolarHBondContact O-N 2.82Å
220	S	67.6	Low	87.1	Confident	134 Å²	134	54.7 Å²	54.7	94%	0.937	32%	0.321	S	S	*	.	S	Bend	trans	-66.9	19.3	171.8	-41.3	0	0	0	0	113.6
221	K	78.8	Confident	87	Confident	168 Å²	168	56.7 Å²	56.7	73%	0.73	34%	0.342	S	S	*	.			trans	-123.7	112.9	-174.1	-65.1	-173.9	-179.2	-177.7	0	108.9	K219	K219-K221 PolarHBondContact O-N 2.82Å
222	T	88.4	Confident	86.9	Confident	80 Å²	80	58.9 Å²	58.9	49%	0.491	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-74.2	131.6	163.8	-56.3	0	0	0	0	108.5	A213 L215	A213-T222 HydrophobicContact CB-CG2 3.95Å; L215-T222 HydrophobicContact CD2-CG2 3.92Å; L215-T222 WeakPolarHBondContact CD2-OG1 3.32Å
223	I	89.5	Confident	86.9	Confident	33 Å²	33	65.8 Å²	65.8	17%	0.169	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	122.2	171.1	-65	166.3	0	0	0	107.7	A213 T214 T240 D241	A213-I223 CarbonylContact C-O 3.44Å; A213-I223 WeakPolarHBondContact CA-O 3.43Å; T214-I223 PolarHBondContact N-O 2.98Å; T214-I223 PolarHBondContact O-N 3.09Å; I223-T240 WeakPolarHBondContact CA-OG1 3.28Å; I223-D241 HydrophobicContact CD1-CB 4.18Å; I223-D241 HydrophobicContact CG1-CB 4.36Å; I223-D241 HydrophobicContact CG2-CB 3.75Å
224	L	92.2	Very high	87.1	Confident	56 Å²	56	65.9 Å²	65.9	29%	0.293	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.6	171.7	-177.8	63.3	0	0	0	108.5	P211 T239 T240 I313	P211-L224 HydrophobicContact CB-CD1 4.08Å; L224-T239 CarbonylContact O-C 3.58Å; L224-T239 WeakPolarHBondContact O-CA 3.47Å; L224-T240 HydrophobicContact CB-CG2 4.09Å; L224-T240 PolarHBondContact N-OG1 2.8Å; L224-T240 PolarHBondContact O-N 3.07Å; L224-I313 HydrophobicContact CD1-CD1 3.66Å; L224-I313 HydrophobicContact CD1-CG1 4Å
225	Q	92.4	Very high	87.2	Confident	4 Å²	4	68.7 Å²	68.7	2%	0.019	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.1	175	64.1	-173.5	9.1	0	0	110.1	P211 V212 H238	P211-Q225 WeakPolarHBondContact CA-O 3.41Å; V212-Q225 PolarHBondContact N-O 2.86Å; V212-Q225 PolarHBondContact O-N 3.02Å; V212-Q225 VanDerWaalsContact O-N 3.1Å; Q225-H238 CarbonylContact C-O 3.5Å; Q225-H238 VanDerWaalsContact CA-O 3.28Å; Q225-H238 WeakPolarHBondContact CA-O 3.49Å
226	G	94.3	Very high	87.6	Confident	3 Å²	3	66.4 Å²	66.4	3%	0.031	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.6	-176.5	178.8	0	0	0	0	0	114.6	W237 H238 H250	G226-W237 WeakPolarHBondContact O-CA 3.25Å; G226-H238 PolarHBondContact N-O 3.47Å; G226-H238 PolarHBondContact O-N 3.31Å; G226-H250 WeakPolarHBondContact CA-O 3.5Å; G226-H250 PolarHBondContact N-O 2.94Å; G226-H250 VanDerWaalsContact N-O 3.09Å
227	P	96.6	Very high	88.3	Confident	8 Å²	8	67.4 Å²	67.4	5%	0.052	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	150	178.2	34.3	-38.4	0	0	0	111.6	T209 W210 V234 G236 W237 C310	T209-P227 HydrophobicContact CG2-CB 3.95Å; T209-P227 HydrophobicContact CG2-CG 3.87Å; W210-P227 VanDerWaalsContact C-CD 3.44Å; P227-V234 HydrophobicContact CB-CG1 3.87Å; P227-V234 HydrophobicContact CB-CG2 4.17Å; P227-G236 WeakPolarHBondContact CA-O 3.45Å; P227-W237 HydrophobicContact CB-CE3 4.28Å; P227-W237 HydrophobicContact CB-CZ3 4.13Å; P227-C310 HydrophobicContact CG-CB 4.18Å; P227-C310 VanDerWaalsContact CG-SG 3.59Å
228	V	96.3	Very high	89.6	Confident	67 Å²	67	67.3 Å²	67.3	41%	0.406	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	128.6	164	-178.7	0	0	0	0	106.8	V235 G236 H238	V228-V235 HydrophobicContact CB-CG2 4.33Å; V228-V235 HydrophobicContact CG1-CG2 3.97Å; V228-V235 VanDerWaalsContact O-CG2 3.29Å; V228-V235 WeakPolarHBondContact O-CG2 3.33Å; V228-V235 PolarHBondContact O-N 3.07Å; V228-G236 PolarHBondContact N-O 2.94Å; V228-G236 PolarHBondContact O-N 2.93Å; V228-H238 HydrophobicContact CG2-CB 3.88Å
229	C	97.1	Very high	90.7	Very high	22 Å²	22	64.1 Å²	64.1	15%	0.149	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	138.6	-167	-54.6	0	0	0	0	112.3	R233 C310	C229-R233 CarbonylContact C-O 3.6Å; C229-R233 WeakPolarHBondContact CA-O 3.04Å; C229-C310 HydrophobicContact CB-CB 3.66Å; C229-C310 WeakPolarHBondContact CB-SG 3.34Å; C229-C310 WeakPolarHBondContact SG-CB 3.41Å; C229-C310 CovalentContact SG-SG 2.02Å; C229-C310 PolarHBondContact SG-SG 3.21Å
230	E	95.9	Very high	91.9	Very high	122 Å²	122	60.3 Å²	60.3	57%	0.57	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	102.7	167.3	-173.3	-179.8	-161	0	0	107.9	S232 R233 V235	E230-S232 PolarHBondContact O-N 3.41Å; E230-R233 PolarHBondContact N-O 3.31Å; E230-R233 PolarHBondContact O-N 3.24Å; E230-R233 VanDerWaalsContact O-N 3.09Å; E230-R233 IonicContact OE2-CZ 3.62Å; E230-R233 IonicContact OE2-NE 2.86Å; E230-R233 IonicContact OE2-NH2 3.43Å; E230-R233 PolarHBondContact OE2-NH2 2.63Å; E230-V235 HydrophobicContact CB-CG1 3.91Å
231	G	94.8	Very high	92.7	Very high	43 Å²	43	55.1 Å²	55.1	44%	0.443	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	-132.2	-164	0	0	0	0	0	110.4	R233 G309	G231-R233 VanDerWaalsContact C-N 3.32Å; G231-G309 WeakPolarHBondContact O-CA 3.18Å; G231-G309 PolarHBondContact O-N 3.14Å
232	S	95.7	Very high	92.6	Very high	58 Å²	58	57.8 Å²	57.8	41%	0.406	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-3.8	176.1	64	0	0	0	0	114	E230 E304 G305	E230-S232 PolarHBondContact O-N 3.41Å; S232-E304 CarbonylContact O-C 3.56Å; S232-E304 VanDerWaalsContact O-CA 3.29Å; S232-E304 WeakPolarHBondContact O-CA 3.46Å; S232-G305 PolarHBondContact O-N 3.18Å
233	R	96.5	Very high	91.9	Very high	145 Å²	145	58.6 Å²	58.6	55%	0.547	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	127.3	-177.7	-178.7	174.3	66	-176.4	1.8	110.2	C229 E230 G231 V235	C229-R233 CarbonylContact C-O 3.6Å; C229-R233 WeakPolarHBondContact CA-O 3.04Å; E230-R233 PolarHBondContact N-O 3.31Å; E230-R233 PolarHBondContact O-N 3.24Å; E230-R233 VanDerWaalsContact O-N 3.09Å; E230-R233 IonicContact OE2-CZ 3.62Å; E230-R233 IonicContact OE2-NE 2.86Å; E230-R233 IonicContact OE2-NH2 3.43Å; E230-R233 PolarHBondContact OE2-NH2 2.63Å; G231-R233 VanDerWaalsContact C-N 3.32Å; R233-V235 HydrophobicContact CG-CG1 4.35Å
234	V	97	Very high	90.8	Very high	5 Å²	5	59.7 Å²	59.7	3%	0.03	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	123.8	170.9	-177.9	0	0	0	0	108.6	T209 P227 W237 E300 M303	T209-V234 HydrophobicContact CG2-CG2 3.72Å; P227-V234 HydrophobicContact CB-CG1 3.87Å; P227-V234 HydrophobicContact CB-CG2 4.17Å; V234-W237 HydrophobicContact CG1-CZ2 4.47Å; V234-E300 HydrophobicContact CB-CB 4.4Å; V234-E300 HydrophobicContact CG1-CB 4.29Å; V234-E300 HydrophobicContact CG1-CG 4.06Å; V234-M303 HydrophobicContact CB-CB 4.29Å; V234-M303 HydrophobicContact CG2-CB 3.85Å
235	V	95.2	Very high	89.6	Confident	78 Å²	78	61.5 Å²	61.5	47%	0.473	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-7.9	-179.1	-62.3	0	0	0	0	113	V228 E230 R233	V228-V235 HydrophobicContact CB-CG2 4.33Å; V228-V235 HydrophobicContact CG1-CG2 3.97Å; V228-V235 VanDerWaalsContact O-CG2 3.29Å; V228-V235 WeakPolarHBondContact O-CG2 3.33Å; V228-V235 PolarHBondContact O-N 3.07Å; E230-V235 HydrophobicContact CB-CG1 3.91Å; R233-V235 HydrophobicContact CG-CG1 4.35Å
236	G	94.2	Very high	88.6	Confident	20 Å²	20	69.2 Å²	69.2	21%	0.206	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.8	-164	178.5	0	0	0	0	0	112	P227 V228	P227-G236 WeakPolarHBondContact CA-O 3.45Å; V228-G236 PolarHBondContact N-O 2.94Å; V228-G236 PolarHBondContact O-N 2.93Å
237	W	94.3	Very high	87.9	Confident	43 Å²	43	70.6 Å²	70.6	16%	0.163	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.6	-173.2	-61.3	91.6	0	0	0	111.6	T209 G226 P227 V234 F249 H250 V251 E300 M303	T209-W237 HydrophobicContact CG2-CH2 4.34Å; G226-W237 WeakPolarHBondContact O-CA 3.25Å; P227-W237 HydrophobicContact CB-CE3 4.28Å; P227-W237 HydrophobicContact CB-CZ3 4.13Å; V234-W237 HydrophobicContact CG1-CZ2 4.47Å; W237-F249 HydrophobicContact CD2-CD1 4.48Å; W237-F249 AromaticContact CE2-CD1 3.49Å; W237-F249 VanDerWaalsContact CE2-CD1 3.49Å; W237-F249 HydrophobicContact CH2-CB 4.32Å; W237-F249 HydrophobicContact CH2-CD1 4.35Å; W237-F249 HydrophobicContact CZ2-CB 4.12Å; W237-F249 AromaticContact CZ2-CD1 3.4Å; W237-F249 HydrophobicContact CZ2-CD1 3.4Å; W237-F249 VanDerWaalsContact CZ2-CD1 3.4Å; W237-F249 HydrophobicContact CZ2-CE1 4.1Å; W237-F249 HydrophobicContact CZ2-CG 4.04Å; W237-F249 AromaticContact NE1-CD1 3.45Å; W237-F249 AromaticContact NE1-CE1 4Å; W237-H250 HydrophobicContact CB-CB 4.13Å; W237-V251 HydrophobicContact CH2-CB 4.39Å; W237-V251 HydrophobicContact CZ3-CB 3.83Å; W237-V251 HydrophobicContact CZ3-CG2 4.25Å; W237-E300 PolarHBondContact NE1-OE1 3.12Å; W237-M303 HydrophobicContact CH2-SD 4.01Å; W237-M303 HydrophobicContact CZ2-CE 4.05Å; W237-M303 HydrophobicContact CZ2-SD 3.56Å; W237-M303 VanDerWaalsContact CZ2-SD 3.56Å
238	H	93	Very high	87.3	Confident	87 Å²	87	75.4 Å²	75.4	40%	0.403	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	140.1	177.8	-178.2	78.4	0	0	0	110.2	Q225 G226 V228 T240	Q225-H238 CarbonylContact C-O 3.5Å; Q225-H238 VanDerWaalsContact CA-O 3.28Å; Q225-H238 WeakPolarHBondContact CA-O 3.49Å; G226-H238 PolarHBondContact N-O 3.47Å; G226-H238 PolarHBondContact O-N 3.31Å; V228-H238 HydrophobicContact CG2-CB 3.88Å; H238-T240 WeakPolarHBondContact NE2-CG2 3.27Å
239	T	91.5	Very high	87	Confident	22 Å²	22	72.2 Å²	72.2	14%	0.135	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	137.5	164.5	-178.3	0	0	0	0	110	L224 D241 H250	L224-T239 CarbonylContact O-C 3.58Å; L224-T239 WeakPolarHBondContact O-CA 3.47Å; T239-D241 VanDerWaalsContact C-N 3.3Å; T239-D241 PolarHBondContact OG1-N 3.21Å; T239-H250 VanDerWaalsContact CG2-CE1 3.45Å; T239-H250 WeakPolarHBondContact CG2-CE1 3.48Å; T239-H250 WeakPolarHBondContact CG2-ND1 3.19Å
240	T	89.2	Confident	86.7	Confident	68 Å²	68	72.2 Å²	72.2	42%	0.417	36%	0.363	S	S	.	.	S	Bend	trans	-84.5	-9.5	168.2	62.1	0	0	0	0	112.2	I223 L224 H238 R242	I223-T240 WeakPolarHBondContact CA-OG1 3.28Å; L224-T240 HydrophobicContact CB-CG2 4.09Å; L224-T240 PolarHBondContact N-OG1 2.8Å; L224-T240 PolarHBondContact O-N 3.07Å; H238-T240 WeakPolarHBondContact NE2-CG2 3.27Å; T240-R242 PolarHBondContact O-N 2.9Å
241	D	84	Confident	86.4	Confident	26 Å²	26	66.5 Å²	66.5	14%	0.139	34%	0.336	C	S	.	.			trans	-86.5	96.6	178.4	-171.9	-6.5	0	0	0	111.6	I223 T239 S243 K244 N245	I223-D241 HydrophobicContact CD1-CB 4.18Å; I223-D241 HydrophobicContact CG1-CB 4.36Å; I223-D241 HydrophobicContact CG2-CB 3.75Å; T239-D241 VanDerWaalsContact C-N 3.3Å; T239-D241 PolarHBondContact OG1-N 3.21Å; D241-S243 VanDerWaalsContact CG-OG 3.29Å; D241-S243 PolarHBondContact O-N 3.23Å; D241-S243 VanDerWaalsContact O-N 3.15Å; D241-S243 WeakPolarHBondContact OD1-CB 3.35Å; D241-S243 PolarHBondContact OD1-N 2.91Å; D241-S243 PolarHBondContact OD1-OG 2.91Å; D241-S243 PolarHBondContact OD2-OG 3.46Å; D241-K244 HydrophobicContact CB-CB 4.46Å; D241-K244 HydrophobicContact CB-CD 4.17Å; D241-K244 HydrophobicContact CB-CG 4.42Å; D241-K244 PolarHBondContact O-N 3.22Å; D241-K244 VanDerWaalsContact O-N 3.11Å; D241-K244 WeakPolarHBondContact OD2-CD 3.4Å; D241-K244 WeakPolarHBondContact OD2-CE 3.49Å; D241-K244 WeakPolarHBondContact OD2-CG 3.42Å; D241-K244 IonicContact OD2-NZ 3.31Å; D241-N245 PolarHBondContact O-OD1 3.47Å
242	R	76.7	Confident	86.3	Confident	223 Å²	223	64.9 Å²	64.9	84%	0.842	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-60	-22	178.2	-63.9	-174.7	175.1	-174.6	-2.5	114	T240 K244	T240-R242 PolarHBondContact O-N 2.9Å; R242-K244 PolarHBondContact O-N 3.41Å
243	S	73.6	Confident	86.2	Confident	98 Å²	98	62.3 Å²	62.3	69%	0.685	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-73.8	-16.8	179.5	73.1	0	0	0	0	112.8	D241	D241-S243 VanDerWaalsContact CG-OG 3.29Å; D241-S243 PolarHBondContact O-N 3.23Å; D241-S243 VanDerWaalsContact O-N 3.15Å; D241-S243 WeakPolarHBondContact OD1-CB 3.35Å; D241-S243 PolarHBondContact OD1-N 2.91Å; D241-S243 PolarHBondContact OD1-OG 2.91Å; D241-S243 PolarHBondContact OD2-OG 3.46Å
244	K	67	Low	86.1	Confident	55 Å²	55	55.4 Å²	55.4	24%	0.239	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-106.6	11.1	-172.2	-67.8	178.3	178.7	-178.3	0	114.2	D241 R242 Q246 R247 H250	D241-K244 HydrophobicContact CB-CB 4.46Å; D241-K244 HydrophobicContact CB-CD 4.17Å; D241-K244 HydrophobicContact CB-CG 4.42Å; D241-K244 PolarHBondContact O-N 3.22Å; D241-K244 VanDerWaalsContact O-N 3.11Å; D241-K244 WeakPolarHBondContact OD2-CD 3.4Å; D241-K244 WeakPolarHBondContact OD2-CE 3.49Å; D241-K244 WeakPolarHBondContact OD2-CG 3.42Å; D241-K244 IonicContact OD2-NZ 3.31Å; R242-K244 PolarHBondContact O-N 3.41Å; K244-Q246 PolarHBondContact O-N 3.38Å; K244-R247 PolarHBondContact O-N 3.18Å; K244-H250 PolarHBondContact O-CE1 2.91Å; K244-H250 VanDerWaalsContact O-CE1 3.23Å
245	N	66.6	Low	86.1	Confident	95 Å²	95	55.2 Å²	55.2	51%	0.508	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	3	-174.3	-75	10.6	0	0	0	116.1	D241	D241-N245 PolarHBondContact O-OD1 3.47Å
246	Q	71.2	Confident	86.2	Confident	165 Å²	165	51.5 Å²	51.5	77%	0.771	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.4	5.8	-178.5	-60.9	-65.3	-44	0	0	113.2	K244	K244-Q246 PolarHBondContact O-N 3.38Å
247	R	80.6	Confident	86.4	Confident	32 Å²	32	50.5 Å²	50.5	12%	0.121	24%	0.239	C	C	.	.			trans	-90.3	139.7	-179.6	-59.8	175.6	-170.9	-159.1	-2.9	110	K244 G286 F287	K244-R247 PolarHBondContact O-N 3.18Å; R247-G286 WeakPolarHBondContact CD-O 3.31Å; R247-G286 PolarHBondContact NE-O 3.16Å; R247-G286 VanDerWaalsContact NE-O 3.07Å; R247-G286 PolarHBondContact NH1-O 3.21Å; R247-F287 HydrophobicContact CG-CE1 4.43Å
248	R	83.4	Confident	86.6	Confident	109 Å²	109	48.5 Å²	48.5	41%	0.411	23%	0.231	S	C	.	.	S	Bend	trans	-65.6	-44.9	172.7	-177.1	-175.4	176.3	-177.6	-5.6	111.2	T290 E294 E298	R248-T290 HydrophobicContact CB-CG2 3.7Å; R248-E294 WeakPolarHBondContact CD-OE1 3.38Å; R248-E294 IonicContact CZ-OE1 4Å; R248-E294 IonicContact NE-OE1 3.17Å; R248-E294 IonicContact NH1-OE1 3.29Å; R248-E294 PolarHBondContact NH1-OE1 3.03Å; R248-E298 PolarHBondContact NH2-O 3.12Å
249	F	89.4	Confident	86.8	Confident	1 Å²	1	45.4 Å²	45.4	0%	0.004	22%	0.218	C	C	.	.	S	Bend	trans	-115.4	119.4	178.1	-55.6	-50.6	0	0	0	110.6	W237 V251 T290 I293 E294 E300 M303	W237-F249 HydrophobicContact CD2-CD1 4.48Å; W237-F249 AromaticContact CE2-CD1 3.49Å; W237-F249 VanDerWaalsContact CE2-CD1 3.49Å; W237-F249 HydrophobicContact CH2-CB 4.32Å; W237-F249 HydrophobicContact CH2-CD1 4.35Å; W237-F249 HydrophobicContact CZ2-CB 4.12Å; W237-F249 AromaticContact CZ2-CD1 3.4Å; W237-F249 HydrophobicContact CZ2-CD1 3.4Å; W237-F249 VanDerWaalsContact CZ2-CD1 3.4Å; W237-F249 HydrophobicContact CZ2-CE1 4.1Å; W237-F249 HydrophobicContact CZ2-CG 4.04Å; W237-F249 AromaticContact NE1-CD1 3.45Å; W237-F249 AromaticContact NE1-CE1 4Å; F249-V251 HydrophobicContact CB-CG1 4.11Å; F249-V251 PolarHBondContact O-N 2.76Å; F249-T290 HydrophobicContact CD2-CG2 4.01Å; F249-T290 PolarHBondContact O-OG1 3.24Å; F249-I293 HydrophobicContact CD2-CB 3.82Å; F249-I293 HydrophobicContact CD2-CD1 4.45Å; F249-I293 HydrophobicContact CD2-CG2 3.61Å; F249-I293 HydrophobicContact CE2-CB 4Å; F249-I293 HydrophobicContact CE2-CG2 3.51Å; F249-I293 HydrophobicContact CG-CG2 4.38Å; F249-I293 HydrophobicContact CZ-CG2 4.18Å; F249-E294 HydrophobicContact CE2-CG 3.75Å; F249-E300 WeakPolarHBondContact CE1-OE1 3.49Å; F249-M303 HydrophobicContact CD1-CE 4.09Å; F249-M303 HydrophobicContact CE1-CE 3.55Å; F249-M303 HydrophobicContact CE2-CE 4.18Å; F249-M303 HydrophobicContact CZ-CE 3.6Å
250	H	90	Very high	87	Confident	22 Å²	22	44.4 Å²	44.4	10%	0.102	21%	0.212	C	C	.	.			trans	-88.8	75.8	175.2	-65.6	-69.6	0	0	0	110.9	G226 W237 T239 K244	G226-H250 WeakPolarHBondContact CA-O 3.5Å; G226-H250 PolarHBondContact N-O 2.94Å; G226-H250 VanDerWaalsContact N-O 3.09Å; W237-H250 HydrophobicContact CB-CB 4.13Å; T239-H250 VanDerWaalsContact CG2-CE1 3.45Å; T239-H250 WeakPolarHBondContact CG2-CE1 3.48Å; T239-H250 WeakPolarHBondContact CG2-ND1 3.19Å; K244-H250 PolarHBondContact O-CE1 2.91Å; K244-H250 VanDerWaalsContact O-CE1 3.23Å
251	V	91	Very high	87.3	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.006	19%	0.193	C	C	.	.			trans	-136.5	148.9	-173.9	69.3	0	0	0	0	111.1	W237 F249 F256 E289 I293	W237-V251 HydrophobicContact CH2-CB 4.39Å; W237-V251 HydrophobicContact CZ3-CB 3.83Å; W237-V251 HydrophobicContact CZ3-CG2 4.25Å; F249-V251 HydrophobicContact CB-CG1 4.11Å; F249-V251 PolarHBondContact O-N 2.76Å; V251-F256 HydrophobicContact CG1-CD1 4.39Å; V251-F256 HydrophobicContact CG2-CB 4.46Å; V251-F256 HydrophobicContact CG2-CD1 3.89Å; V251-E289 HydrophobicContact CG1-CB 4.05Å; V251-I293 HydrophobicContact CB-CD1 4.5Å; V251-I293 HydrophobicContact CG1-CD1 3.29Å
252	D	92	Very high	87.8	Confident	10 Å²	10	40.2 Å²	40.2	5%	0.053	19%	0.187	C	C	.	.			trans	-85.8	156.2	170.3	-168	-111.2	0	0	0	110.6	V212 S254 G255 F256 H317	V212-D252 HydrophobicContact CB-CB 3.99Å; V212-D252 HydrophobicContact CG1-CB 3.91Å; V212-D252 HydrophobicContact CG2-CB 3.87Å; D252-S254 PolarHBondContact O-N 2.78Å; D252-S254 VanDerWaalsContact O-N 3.12Å; D252-S254 WeakPolarHBondContact OD1-CB 3.47Å; D252-S254 PolarHBondContact OD1-N 3.46Å; D252-S254 PolarHBondContact OD1-OG 2.76Å; D252-G255 PolarHBondContact O-N 2.7Å; D252-F256 WeakPolarHBondContact O-CD1 3.34Å; D252-H317 IonicContact OD1-ND1 3.67Å; D252-H317 PolarHBondContact OD1-ND1 3.34Å; D252-H317 IonicContact OD2-CE1 2.79Å; D252-H317 IonicContact OD2-CG 2.88Å; D252-H317 IonicContact OD2-ND1 3.75Å; D252-H317 PolarHBondContact OD2-ND1 3.42Å
253	M	93.2	Very high	88.6	Confident	4 Å²	4	29.6 Å²	29.6	2%	0.02	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-31.2	171.8	-173.8	58.7	61.2	0	0	112.8	F186 F256 Q279 E289	F186-M253 HydrophobicContact CB-CG 3.99Å; F186-M253 HydrophobicContact CB-SD 4.41Å; F186-M253 HydrophobicContact CD2-CG 4.25Å; F186-M253 HydrophobicContact CD2-SD 3.57Å; F186-M253 VanDerWaalsContact CD2-SD 3.57Å; F186-M253 HydrophobicContact CE2-SD 3.97Å; F186-M253 HydrophobicContact CG-CG 4.24Å; F186-M253 HydrophobicContact CG-SD 4.03Å; M253-F256 HydrophobicContact SD-CE1 4.27Å; M253-F256 HydrophobicContact SD-CZ 3.95Å; M253-Q279 VanDerWaalsContact CE-OE1 3.27Å; M253-Q279 PolarHBondContact SD-NE2 3.27Å; M253-E289 HydrophobicContact CB-CG 4.45Å; M253-E289 HydrophobicContact CE-CG 4.14Å
254	S	95.4	Very high	89.5	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	7.1	176.6	70.6	0	0	0	0	114.6	Y185 F186 N191 W210 D252 N315	Y185-S254 VanDerWaalsContact CE2-O 3.29Å; Y185-S254 WeakPolarHBondContact CE2-O 3.23Å; Y185-S254 PolarHBondContact OH-O 2.74Å; F186-S254 WeakPolarHBondContact O-CA 3.42Å; F186-S254 WeakPolarHBondContact O-CB 3.34Å; N191-S254 PolarHBondContact ND2-OG 2.91Å; W210-S254 WeakPolarHBondContact CZ2-O 3.42Å; D252-S254 PolarHBondContact O-N 2.78Å; D252-S254 VanDerWaalsContact O-N 3.12Å; D252-S254 WeakPolarHBondContact OD1-CB 3.47Å; D252-S254 PolarHBondContact OD1-N 3.46Å; D252-S254 PolarHBondContact OD1-OG 2.76Å; S254-N315 PolarHBondContact O-ND2 3.18Å; S254-N315 PolarHBondContact OG-ND2 3.49Å
255	G	96.7	Very high	90.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.125	C	C	.	.	S	Bend	trans	-95.7	5.5	-177.5	0	0	0	0	0	115.4	T209 W210 D252	T209-G255 WeakPolarHBondContact CA-O 3.43Å; T209-G255 PolarHBondContact OG1-O 2.84Å; W210-G255 PolarHBondContact N-O 3.44Å; D252-G255 PolarHBondContact O-N 2.7Å
256	F	97.7	Very high	91.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	162.2	177.9	66.9	-89.5	0	0	0	111.7	F186 F207 G208 W210 V251 D252 M253 F258 F292 I293	F186-F256 HydrophobicContact CD2-CE2 4.15Å; F186-F256 HydrophobicContact CD2-CZ 4.1Å; F186-F256 HydrophobicContact CE2-CE2 4.02Å; F186-F256 HydrophobicContact CE2-CZ 4.13Å; F207-F256 HydrophobicContact CE1-CB 4.14Å; F207-F256 HydrophobicContact CE2-CB 4.33Å; F207-F256 AromaticContact CE2-CD2 3.73Å; F207-F256 HydrophobicContact CE2-CD2 3.73Å; F207-F256 HydrophobicContact CE2-CE2 4.41Å; F207-F256 HydrophobicContact CE2-CG 4.23Å; F207-F256 HydrophobicContact CZ-CB 3.68Å; F207-F256 AromaticContact CZ-CD2 3.85Å; F207-F256 HydrophobicContact CZ-CD2 3.85Å; F207-F256 AromaticContact CZ-CG 3.86Å; F207-F256 HydrophobicContact CZ-CG 3.86Å; G208-F256 CarbonylContact O-C 3.4Å; G208-F256 WeakPolarHBondContact O-CA 3.47Å; G208-F256 WeakPolarHBondContact O-CB 3.46Å; W210-F256 VanDerWaalsContact CH2-C 3.5Å; V251-F256 HydrophobicContact CG1-CD1 4.39Å; V251-F256 HydrophobicContact CG2-CB 4.46Å; V251-F256 HydrophobicContact CG2-CD1 3.89Å; D252-F256 WeakPolarHBondContact O-CD1 3.34Å; M253-F256 HydrophobicContact SD-CE1 4.27Å; M253-F256 HydrophobicContact SD-CZ 3.95Å; F256-F258 HydrophobicContact CD2-CD1 4.38Å; F256-F258 HydrophobicContact CE2-CD1 4.26Å; F256-F258 HydrophobicContact CE2-CE1 4.46Å; F256-F292 HydrophobicContact CE2-CD1 4.06Å; F256-F292 AromaticContact CE2-CE1 3.97Å; F256-F292 HydrophobicContact CE2-CE1 3.97Å; F256-F292 AromaticContact CZ-CD1 3.84Å; F256-F292 HydrophobicContact CZ-CD1 3.84Å; F256-F292 HydrophobicContact CZ-CE1 4.15Å; F256-I293 HydrophobicContact CD1-CD1 3.91Å; F256-I293 HydrophobicContact CD1-CG1 4.44Å; F256-I293 HydrophobicContact CE1-CD1 3.93Å; F256-I293 HydrophobicContact CE1-CG1 4.2Å; F256-I293 HydrophobicContact CE2-CG1 4.39Å; F256-I293 HydrophobicContact CG-CD1 4.37Å; F256-I293 HydrophobicContact CZ-CD1 4.42Å; F256-I293 HydrophobicContact CZ-CG1 4.19Å
257	A	98.4	Very high	92.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	156.8	171.9	0	0	0	0	0	110.2	I183 V184 Y185 L201 I204 G208 W210	I183-A257 HydrophobicContact CG2-CB 3.82Å; V184-A257 VanDerWaalsContact O-CA 3.28Å; V184-A257 WeakPolarHBondContact O-CA 3.33Å; V184-A257 VanDerWaalsContact O-CB 3.27Å; V184-A257 WeakPolarHBondContact O-CB 3.44Å; Y185-A257 HydrophobicContact CD2-CB 4.11Å; L201-A257 HydrophobicContact CD2-CB 3.4Å; L201-A257 VanDerWaalsContact CD2-CB 3.4Å; I204-A257 HydrophobicContact CD1-CB 3.73Å; G208-A257 PolarHBondContact N-O 2.9Å; G208-A257 PolarHBondContact O-N 2.86Å; W210-A257 HydrophobicContact CH2-CB 3.87Å; W210-A257 HydrophobicContact CZ3-CB 4.15Å
258	F	97.8	Very high	92.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	156.8	-174.9	64.4	-85.2	0	0	0	112.4	L172 V184 F186 S206 F207 F256 S260 K262 L263 F292 L296	L172-F258 HydrophobicContact CD2-CZ 3.95Å; V184-F258 HydrophobicContact CB-CD1 4.32Å; V184-F258 HydrophobicContact CB-CD2 4.46Å; V184-F258 HydrophobicContact CB-CE1 3.89Å; V184-F258 HydrophobicContact CB-CE2 4.05Å; V184-F258 HydrophobicContact CB-CZ 3.75Å; V184-F258 HydrophobicContact CG1-CE1 3.92Å; V184-F258 HydrophobicContact CG1-CZ 3.81Å; V184-F258 HydrophobicContact CG2-CE2 4.03Å; V184-F258 HydrophobicContact CG2-CZ 4.11Å; V184-F258 PolarHBondContact N-O 3.39Å; V184-F258 PolarHBondContact O-N 2.97Å; V184-F258 VanDerWaalsContact O-N 3.15Å; F186-F258 AromaticContact CE2-CE1 3.94Å; F186-F258 HydrophobicContact CE2-CE1 3.94Å; F186-F258 HydrophobicContact CZ-CE1 4.23Å; S206-F258 CarbonylContact O-C 3.53Å; S206-F258 WeakPolarHBondContact O-CA 3.25Å; F207-F258 HydrophobicContact CD2-CB 3.89Å; F256-F258 HydrophobicContact CD2-CD1 4.38Å; F256-F258 HydrophobicContact CE2-CD1 4.26Å; F256-F258 HydrophobicContact CE2-CE1 4.46Å; F258-S260 PolarHBondContact O-N 3.22Å; F258-K262 HydrophobicContact CB-CD 4.38Å; F258-K262 HydrophobicContact CD2-CD 4.36Å; F258-L263 HydrophobicContact CE2-CD1 4.46Å; F258-L263 HydrophobicContact CE2-CD2 4.04Å; F258-L263 HydrophobicContact CE2-CG 4.17Å; F258-L263 HydrophobicContact CZ-CD2 4.44Å; F258-F292 AromaticContact CE1-CE1 3.95Å; F258-F292 HydrophobicContact CE1-CE1 3.95Å; F258-F292 HydrophobicContact CE1-CZ 4.14Å; F258-F292 HydrophobicContact CZ-CE1 4.38Å; F258-F292 HydrophobicContact CZ-CZ 4.11Å; F258-L296 HydrophobicContact CD1-CD1 3.77Å; F258-L296 HydrophobicContact CD1-CD2 4.47Å; F258-L296 HydrophobicContact CD2-CD1 4.38Å; F258-L296 HydrophobicContact CD2-CD2 3.62Å; F258-L296 HydrophobicContact CE1-CD1 4.01Å; F258-L296 HydrophobicContact CE2-CD2 3.75Å; F258-L296 HydrophobicContact CG-CD1 3.98Å; F258-L296 HydrophobicContact CG-CD2 4.01Å; F258-L296 HydrophobicContact CZ-CD1 4.4Å; F258-L296 HydrophobicContact CZ-CD2 4.24Å
259	N	96.9	Very high	92.2	Very high	23 Å²	23	24.8 Å²	24.8	12%	0.123	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	124.2	174.9	-169.1	-34.6	0	0	0	110	I183 R205 S206 S261 K262	I183-N259 HydrophobicContact CD1-CB 4.38Å; R205-N259 PolarHBondContact O-ND2 3.03Å; S206-N259 PolarHBondContact O-N 3.46Å; N259-S261 PolarHBondContact O-N 3.41Å; N259-S261 VanDerWaalsContact O-N 3.11Å; N259-S261 WeakPolarHBondContact OD1-CB 3.42Å; N259-S261 PolarHBondContact OD1-N 3.19Å; N259-S261 PolarHBondContact OD1-OG 3.32Å; N259-S261 VanDerWaalsContact OD1-OG 3.08Å; N259-K262 WeakPolarHBondContact O-CB 3.49Å; N259-K262 PolarHBondContact O-N 3.15Å
260	S	97.3	Very high	91.4	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-57.2	-27.1	-179	63.8	0	0	0	0	113.1	L180 H181 G182 F258 K262 L263 W264	L180-S260 WeakPolarHBondContact O-CB 3.28Å; L180-S260 PolarHBondContact O-OG 3.28Å; H181-S260 WeakPolarHBondContact CA-OG 3.1Å; G182-S260 PolarHBondContact N-OG 3.42Å; G182-S260 WeakPolarHBondContact O-CB 3.42Å; G182-S260 PolarHBondContact O-N 2.97Å; G182-S260 PolarHBondContact O-OG 3.32Å; G182-S260 VanDerWaalsContact O-OG 3.08Å; F258-S260 PolarHBondContact O-N 3.22Å; S260-K262 PolarHBondContact O-N 3.05Å; S260-K262 VanDerWaalsContact O-N 3.08Å; S260-L263 WeakPolarHBondContact O-CB 3.09Å; S260-L263 WeakPolarHBondContact O-CG 3.33Å; S260-L263 PolarHBondContact O-N 2.93Å; S260-W264 VanDerWaalsContact CB-CH2 3.49Å; S260-W264 WeakPolarHBondContact O-CH2 3.45Å; S260-W264 WeakPolarHBondContact O-CZ3 3.32Å; S260-W264 VanDerWaalsContact OG-CH2 3.23Å; S260-W264 WeakPolarHBondContact OG-CH2 3.43Å
261	S	94.9	Very high	90.8	Very high	4 Å²	4	26.7 Å²	26.7	3%	0.028	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-55.4	-27.9	179.2	68.6	0	0	0	0	112.9	N259 L263 W264 D265 N268	N259-S261 PolarHBondContact O-N 3.41Å; N259-S261 VanDerWaalsContact O-N 3.11Å; N259-S261 WeakPolarHBondContact OD1-CB 3.42Å; N259-S261 PolarHBondContact OD1-N 3.19Å; N259-S261 PolarHBondContact OD1-OG 3.32Å; N259-S261 VanDerWaalsContact OD1-OG 3.08Å; S261-L263 PolarHBondContact O-N 2.87Å; S261-L263 VanDerWaalsContact O-N 3.09Å; S261-W264 PolarHBondContact O-N 3.47Å; S261-D265 WeakPolarHBondContact O-CA 3.42Å; S261-D265 VanDerWaalsContact O-CB 3.31Å; S261-D265 WeakPolarHBondContact O-CB 3.32Å; S261-D265 PolarHBondContact O-N 2.84Å; S261-N268 WeakPolarHBondContact OG-CB 3.26Å; S261-N268 PolarHBondContact OG-ND2 2.84Å
262	K	93.9	Very high	90.1	Very high	3 Å²	3	31.8 Å²	31.8	1%	0.013	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-53.9	-28.7	174	-72.9	-179.7	172.7	-69.9	0	113.6	S206 F258 N259 S260 N268 R269 I277 L296	S206-K262 WeakPolarHBondContact O-CE 3.4Å; S206-K262 WeakPolarHBondContact OG-CE 3.42Å; S206-K262 PolarHBondContact OG-NZ 3.37Å; S206-K262 VanDerWaalsContact OG-NZ 3.17Å; F258-K262 HydrophobicContact CB-CD 4.38Å; F258-K262 HydrophobicContact CD2-CD 4.36Å; N259-K262 WeakPolarHBondContact O-CB 3.49Å; N259-K262 PolarHBondContact O-N 3.15Å; S260-K262 PolarHBondContact O-N 3.05Å; S260-K262 VanDerWaalsContact O-N 3.08Å; K262-N268 WeakPolarHBondContact CG-O 3.02Å; K262-N268 PolarHBondContact NZ-O 2.88Å; K262-R269 VanDerWaalsContact O-CG 3.23Å; K262-R269 WeakPolarHBondContact O-CG 3.43Å; K262-R269 PolarHBondContact O-NE 2.73Å; K262-I277 HydrophobicContact CB-CD1 4.49Å; K262-I277 WeakPolarHBondContact O-CD1 3.38Å; K262-L296 HydrophobicContact CB-CD2 4.15Å; K262-L296 HydrophobicContact CD-CD2 3.98Å; K262-L296 PolarHBondContact NZ-O 3.49Å; K262-L296 VanDerWaalsContact NZ-O 3.12Å
263	L	94.7	Very high	89.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-70.4	-40.9	-176.9	-59	175.4	0	0	0	111.7	L172 I175 E176 F258 S260 S261 R269 I277	L172-L263 HydrophobicContact CD2-CD1 3.9Å; L172-L263 HydrophobicContact CD2-CD2 4.21Å; I175-L263 HydrophobicContact CB-CD1 4.36Å; I175-L263 HydrophobicContact CG2-CD1 3.82Å; E176-L263 HydrophobicContact CB-CB 4.31Å; E176-L263 HydrophobicContact CG-CB 4.28Å; F258-L263 HydrophobicContact CE2-CD1 4.46Å; F258-L263 HydrophobicContact CE2-CD2 4.04Å; F258-L263 HydrophobicContact CE2-CG 4.17Å; F258-L263 HydrophobicContact CZ-CD2 4.44Å; S260-L263 WeakPolarHBondContact O-CB 3.09Å; S260-L263 WeakPolarHBondContact O-CG 3.33Å; S260-L263 PolarHBondContact O-N 2.93Å; S261-L263 PolarHBondContact O-N 2.87Å; S261-L263 VanDerWaalsContact O-N 3.09Å; L263-R269 PolarHBondContact O-NH2 3.12Å; L263-I277 HydrophobicContact CD2-CB 3.99Å; L263-I277 HydrophobicContact CD2-CG2 4.13Å
264	W	92.1	Very high	88.9	Confident	50 Å²	50	39.6 Å²	39.6	19%	0.189	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-22.5	-174.2	58.8	84.2	0	0	0	115.8	I175 E176 R179 L180 S260 S261	I175-W264 HydrophobicContact CG2-CH2 4.41Å; I175-W264 HydrophobicContact CG2-CZ3 3.9Å; E176-W264 HydrophobicContact CB-CE3 4.33Å; E176-W264 HydrophobicContact CG-CB 4.18Å; E176-W264 HydrophobicContact CG-CE3 4.24Å; R179-W264 HydrophobicContact CB-CZ2 4.29Å; R179-W264 HydrophobicContact CG-CD2 4.31Å; R179-W264 HydrophobicContact CG-CG 4.35Å; L180-W264 VanDerWaalsContact O-CH2 3.32Å; L180-W264 WeakPolarHBondContact O-CH2 3.31Å; S260-W264 VanDerWaalsContact CB-CH2 3.49Å; S260-W264 WeakPolarHBondContact O-CH2 3.45Å; S260-W264 WeakPolarHBondContact O-CZ3 3.32Å; S260-W264 VanDerWaalsContact OG-CH2 3.23Å; S260-W264 WeakPolarHBondContact OG-CH2 3.43Å; S261-W264 PolarHBondContact O-N 3.47Å
265	D	89.8	Confident	88.3	Confident	52 Å²	52	45.3 Å²	45.3	28%	0.278	23%	0.233	S	C	.	.			trans	-94.7	106.9	-176.8	-176.2	1.5	0	0	0	110.7	S261 K267 N268 R269	S261-D265 WeakPolarHBondContact O-CA 3.42Å; S261-D265 VanDerWaalsContact O-CB 3.31Å; S261-D265 WeakPolarHBondContact O-CB 3.32Å; S261-D265 PolarHBondContact O-N 2.84Å; D265-K267 PolarHBondContact O-N 3.2Å; D265-K267 VanDerWaalsContact O-N 3.16Å; D265-K267 PolarHBondContact OD1-N 3.36Å; D265-N268 HydrophobicContact CB-CB 4.21Å; D265-N268 PolarHBondContact O-N 2.74Å; D265-N268 PolarHBondContact OD2-ND2 2.76Å; D265-R269 PolarHBondContact O-N 3.1Å
266	A	85.5	Confident	87.9	Confident	51 Å²	51	51.5 Å²	51.5	42%	0.421	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-32.3	179.6	0	0	0	0	0	113.2	N268 R269 Q272	A266-N268 VanDerWaalsContact C-N 3.3Å; A266-N268 PolarHBondContact O-N 3Å; A266-R269 PolarHBondContact O-N 2.96Å; A266-Q272 PolarHBondContact O-NE2 3.34Å
267	K	86	Confident	87.6	Confident	192 Å²	192	51.6 Å²	51.6	84%	0.835	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-27.5	179.4	-65	-177.3	179.1	-178.8	0	112.8	D265	D265-K267 PolarHBondContact O-N 3.2Å; D265-K267 VanDerWaalsContact O-N 3.16Å; D265-K267 PolarHBondContact OD1-N 3.36Å
268	N	82.8	Confident	87.4	Confident	75 Å²	75	52.2 Å²	52.2	40%	0.401	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-7.3	-177.7	-76.4	-40.2	0	0	0	113.1	S261 K262 D265 A266 G270	S261-N268 WeakPolarHBondContact OG-CB 3.26Å; S261-N268 PolarHBondContact OG-ND2 2.84Å; K262-N268 WeakPolarHBondContact CG-O 3.02Å; K262-N268 PolarHBondContact NZ-O 2.88Å; D265-N268 HydrophobicContact CB-CB 4.21Å; D265-N268 PolarHBondContact O-N 2.74Å; D265-N268 PolarHBondContact OD2-ND2 2.76Å; A266-N268 VanDerWaalsContact C-N 3.3Å; A266-N268 PolarHBondContact O-N 3Å; N268-G270 PolarHBondContact O-N 3Å
269	R	81.5	Confident	87.1	Confident	33 Å²	33	52.5 Å²	52.5	13%	0.125	26%	0.261	C	S	.	.			trans	-64.8	123.4	174.9	-75.1	178.8	-175.9	173.3	-6.1	109.9	K262 L263 D265 A266 H271 Q272 N275	K262-R269 VanDerWaalsContact O-CG 3.23Å; K262-R269 WeakPolarHBondContact O-CG 3.43Å; K262-R269 PolarHBondContact O-NE 2.73Å; L263-R269 PolarHBondContact O-NH2 3.12Å; D265-R269 PolarHBondContact O-N 3.1Å; A266-R269 PolarHBondContact O-N 2.96Å; R269-H271 VanDerWaalsContact C-N 3.3Å; R269-Q272 PolarHBondContact O-NE2 2.98Å; R269-Q272 VanDerWaalsContact O-NE2 3.09Å; R269-N275 PolarHBondContact NH1-O 3.33Å; R269-N275 PolarHBondContact NH1-OD1 3.5Å; R269-N275 PolarHBondContact NH2-O 3.31Å
270	G	72.4	Confident	86.6	Confident	10 Å²	10	55.3 Å²	55.3	10%	0.103	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-74.8	-23.4	177.5	0	0	0	0	0	112.5	N268 L296 E298	N268-G270 PolarHBondContact O-N 3Å; G270-L296 WeakPolarHBondContact CA-O 3.29Å; G270-L296 PolarHBondContact N-O 3.33Å; G270-E298 WeakPolarHBondContact O-CG 3.46Å
271	H	77.9	Confident	85.6	Confident	52 Å²	52	57.2 Å²	57.2	24%	0.241	29%	0.286	C	S	.	.			trans	-129.2	109.3	175.4	-167	-7.3	0	0	0	110.5	R269 A273 W274 E294 E298	R269-H271 VanDerWaalsContact C-N 3.3Å; H271-A273 WeakPolarHBondContact CE1-CB 3.43Å; H271-A273 PolarHBondContact ND1-N 3.03Å; H271-A273 PolarHBondContact O-N 3.07Å; H271-W274 AromaticContact CD2-CD1 3.4Å; H271-W274 AromaticContact CD2-NE1 3.5Å; H271-W274 PolarHBondContact CD2-NE1 3.43Å; H271-W274 AromaticContact CG-CD1 3.6Å; H271-W274 AromaticContact NE2-CD1 3.79Å; H271-W274 AromaticContact NE2-NE1 3.59Å; H271-W274 PolarHBondContact O-N 3.28Å; H271-E294 PolarHBondContact CD2-O 2.86Å; H271-E298 WeakPolarHBondContact CA-OE1 3.35Å; H271-E298 HydrophobicContact CB-CG 3.73Å; H271-E298 IonicContact ND1-OE1 3.03Å
272	Q	75.2	Confident	84.5	Confident	109 Å²	109	61.3 Å²	61.3	51%	0.509	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13	-173.5	-65.6	-64.7	-41.4	0	0	114.1	A266 R269 W274	A266-Q272 PolarHBondContact O-NE2 3.34Å; R269-Q272 PolarHBondContact O-NE2 2.98Å; R269-Q272 VanDerWaalsContact O-NE2 3.09Å; Q272-W274 VanDerWaalsContact C-N 3.3Å; Q272-W274 PolarHBondContact O-N 3.23Å
273	A	79.5	Confident	83.3	Confident	69 Å²	69	62.3 Å²	62.3	57%	0.57	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-19.4	178.9	0	0	0	0	0	113.3	H271	H271-A273 WeakPolarHBondContact CE1-CB 3.43Å; H271-A273 PolarHBondContact ND1-N 3.03Å; H271-A273 PolarHBondContact O-N 3.07Å
274	W	80.3	Confident	82	Confident	109 Å²	109	70.3 Å²	70.3	41%	0.413	35%	0.354	S	S	.	.			trans	-106.3	104	-172.9	-64.3	97.6	0	0	0	111.5	H271 Q272 Q295	H271-W274 AromaticContact CD2-CD1 3.4Å; H271-W274 AromaticContact CD2-NE1 3.5Å; H271-W274 PolarHBondContact CD2-NE1 3.43Å; H271-W274 AromaticContact CG-CD1 3.6Å; H271-W274 AromaticContact NE2-CD1 3.79Å; H271-W274 AromaticContact NE2-NE1 3.59Å; H271-W274 PolarHBondContact O-N 3.28Å; Q272-W274 VanDerWaalsContact C-N 3.3Å; Q272-W274 PolarHBondContact O-N 3.23Å; W274-Q295 HydrophobicContact CB-CB 4.19Å; W274-Q295 HydrophobicContact CB-CG 4.47Å; W274-Q295 HydrophobicContact CD2-CB 4.28Å; W274-Q295 HydrophobicContact CD2-CG 3.65Å; W274-Q295 HydrophobicContact CE3-CG 3.8Å; W274-Q295 HydrophobicContact CG-CB 4.03Å; W274-Q295 HydrophobicContact CG-CG 3.95Å; W274-Q295 HydrophobicContact CZ2-CG 4.44Å; W274-Q295 HydrophobicContact CZ3-CG 4.26Å
275	N	82.8	Confident	80.5	Confident	119 Å²	119	76.7 Å²	76.7	64%	0.636	39%	0.386	S	S	*	.	S	Bend	trans	-83.6	-19.1	-179.3	-75.5	-37.3	0	0	0	114.6	R269	R269-N275 PolarHBondContact NH1-O 3.33Å; R269-N275 PolarHBondContact NH1-OD1 3.5Å; R269-N275 PolarHBondContact NH2-O 3.31Å
276	Y	88.5	Confident	79.4	Confident	131 Å²	131	74.6 Å²	74.6	51%	0.514	38%	0.377	S	S	.	.	S	Bend	trans	-139.3	105	-177.1	-176.5	-117.2	0	0	0	109.1	D173 R278	D173-Y276 PolarHBondContact OD1-OH 2.9Å; Y276-R278 HydrophobicContact CD1-CB 4.48Å; Y276-R278 HydrophobicContact CD1-CG 3.84Å; Y276-R278 HydrophobicContact CD2-CG 4.48Å; Y276-R278 HydrophobicContact CE1-CB 4.14Å; Y276-R278 HydrophobicContact CE1-CG 3.28Å; Y276-R278 HydrophobicContact CE2-CG 4Å; Y276-R278 VanDerWaalsContact CE2-CZ 3.41Å; Y276-R278 VanDerWaalsContact CE2-NH2 3.33Å; Y276-R278 HydrophobicContact CG-CG 4.41Å; Y276-R278 PolarHBondContact OH-NE 2.73Å
277	I	91.9	Very high	79.1	Confident	1 Å²	1	76.1 Å²	76.1	1%	0.005	37%	0.374	C	S	.	.			trans	-92.4	105.8	-170.6	-59.8	176.2	0	0	0	109.4	K262 L263 F292 Q295 L296	K262-I277 HydrophobicContact CB-CD1 4.49Å; K262-I277 WeakPolarHBondContact O-CD1 3.38Å; L263-I277 HydrophobicContact CD2-CB 3.99Å; L263-I277 HydrophobicContact CD2-CG2 4.13Å; I277-F292 HydrophobicContact CG2-CD2 4.39Å; I277-F292 HydrophobicContact CG2-CE2 3.71Å; I277-F292 HydrophobicContact CG2-CZ 4.17Å; I277-Q295 VanDerWaalsContact CA-OE1 3.32Å; I277-Q295 HydrophobicContact CB-CB 4.49Å; I277-Q295 HydrophobicContact CG1-CB 4.31Å; I277-Q295 HydrophobicContact CG2-CB 3.98Å; I277-L296 HydrophobicContact CD1-CD2 4.04Å; I277-L296 HydrophobicContact CG2-CD2 3.79Å; I277-L296 HydrophobicContact CG2-CG 4Å
278	R	93.7	Very high	79	Confident	14 Å²	14	68 Å²	68	5%	0.053	34%	0.339	C	S	.	.			trans	-146.1	156	-179.2	-68.5	-58.6	178.9	-84.9	-2.5	112.1	D173 E176 Y276 Q295	D173-R278 IonicContact OD1-CZ 3.62Å; D173-R278 IonicContact OD1-NE 2.94Å; D173-R278 PolarHBondContact OD1-NE 2.55Å; D173-R278 IonicContact OD1-NH2 2.66Å; D173-R278 PolarHBondContact OD1-NH2 3.3Å; E176-R278 IonicContact OE2-CZ 3.51Å; E176-R278 VanDerWaalsContact OE2-CZ 3.29Å; E176-R278 IonicContact OE2-NH1 2.82Å; E176-R278 PolarHBondContact OE2-NH1 2.75Å; E176-R278 IonicContact OE2-NH2 3.7Å; E176-R278 PolarHBondContact OE2-NH2 3.07Å; Y276-R278 HydrophobicContact CD1-CB 4.48Å; Y276-R278 HydrophobicContact CD1-CG 3.84Å; Y276-R278 HydrophobicContact CD2-CG 4.48Å; Y276-R278 HydrophobicContact CE1-CB 4.14Å; Y276-R278 HydrophobicContact CE1-CG 3.28Å; Y276-R278 HydrophobicContact CE2-CG 4Å; Y276-R278 VanDerWaalsContact CE2-CZ 3.41Å; Y276-R278 VanDerWaalsContact CE2-NH2 3.33Å; Y276-R278 HydrophobicContact CG-CG 4.41Å; Y276-R278 PolarHBondContact OH-NE 2.73Å; R278-Q295 PolarHBondContact O-NE2 3.03Å; R278-Q295 PolarHBondContact O-OE1 3.06Å; R278-Q295 VanDerWaalsContact O-OE1 3.11Å
279	Q	91.3	Very high	79.3	Confident	5 Å²	5	65.7 Å²	65.7	2%	0.023	33%	0.326	C	S	.	.			trans	-74.7	138.4	174.5	-60.9	-169.1	18.8	0	0	110.8	A165 R168 N169 M253 F292	A165-Q279 HydrophobicContact CB-CB 4.13Å; R168-Q279 VanDerWaalsContact CD-NE2 3.32Å; R168-Q279 VanDerWaalsContact NE-CD 3.25Å; N169-Q279 PolarHBondContact ND2-O 3.42Å; N169-Q279 PolarHBondContact OD1-N 3.18Å; M253-Q279 VanDerWaalsContact CE-OE1 3.27Å; M253-Q279 PolarHBondContact SD-NE2 3.27Å; Q279-F292 HydrophobicContact CB-CD2 4.41Å; Q279-F292 HydrophobicContact CG-CB 4.16Å; Q279-F292 HydrophobicContact CG-CD1 4.4Å; Q279-F292 HydrophobicContact CG-CD2 3.5Å; Q279-F292 HydrophobicContact CG-CE2 3.93Å; Q279-F292 HydrophobicContact CG-CG 3.75Å
280	L	86.3	Confident	79.7	Confident	82 Å²	82	64.5 Å²	64.5	43%	0.429	32%	0.323	S	S	.	.			trans	-79	120.5	173.5	-60.3	178.4	0	0	0	109.2	T282 A283 A291	L280-T282 PolarHBondContact O-N 3.33Å; L280-A283 HydrophobicContact CB-CB 3.89Å; L280-A291 HydrophobicContact CD1-CB 4.04Å
281	D	76.2	Confident	80.6	Confident	40 Å²	40	65 Å²	65	21%	0.214	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-10.1	178.2	64.6	-18.7	0	0	0	113.8	R166	R166-D281 IonicContact CZ-OD2 2.68Å; R166-D281 IonicContact NH1-OD2 3.73Å; R166-D281 PolarHBondContact NH1-OD2 3.41Å; R166-D281 IonicContact NH2-OD2 3.7Å; R166-D281 PolarHBondContact NH2-OD2 2.94Å
282	T	73.1	Confident	81.3	Confident	91 Å²	91	62.5 Å²	62.5	56%	0.558	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-1	-177.4	46.8	0	0	0	0	113.5	L280	L280-T282 PolarHBondContact O-N 3.33Å
283	A	67.4	Low	82.2	Confident	23 Å²	23	57.3 Å²	57.3	19%	0.19	29%	0.289	C	S	.	.	S	Bend	trans	-64.1	142.2	177.5	0	0	0	0	0	110.7	L280 Q288	L280-A283 HydrophobicContact CB-CB 3.89Å; A283-Q288 HydrophobicContact CB-CG 3.79Å
284	K	66.9	Low	82.8	Confident	168 Å²	168	56.8 Å²	56.8	73%	0.73	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-54	142.4	175.5	-70.1	-179.2	-179.4	177.6	0	109.6	G286 F287	K284-G286 PolarHBondContact O-N 3.33Å; K284-G286 VanDerWaalsContact O-N 3.14Å; K284-F287 HydrophobicContact CB-CD2 3.84Å; K284-F287 HydrophobicContact CB-CE2 4.48Å; K284-F287 PolarHBondContact O-N 2.87Å
285	E	62.2	Low	83.4	Confident	185 Å²	185	52 Å²	52	86%	0.864	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	122.6	178.3	-171	175.2	-178.6	0	0	110.4
286	G	65.4	Low	83.9	Confident	8 Å²	8	46.3 Å²	46.3	8%	0.082	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.7	-4.4	-178.6	0	0	0	0	0	118.2	R247 K284	R247-G286 WeakPolarHBondContact CD-O 3.31Å; R247-G286 PolarHBondContact NE-O 3.16Å; R247-G286 VanDerWaalsContact NE-O 3.07Å; R247-G286 PolarHBondContact NH1-O 3.21Å; K284-G286 PolarHBondContact O-N 3.33Å; K284-G286 VanDerWaalsContact O-N 3.14Å
287	F	79.2	Confident	84.1	Confident	83 Å²	83	40.1 Å²	40.1	36%	0.364	20%	0.203	S	C	.	.			trans	-105.3	-4.7	173	-68.2	-89	0	0	0	112.4	R247 K284 T290 A291	R247-F287 HydrophobicContact CG-CE1 4.43Å; K284-F287 HydrophobicContact CB-CD2 3.84Å; K284-F287 HydrophobicContact CB-CE2 4.48Å; K284-F287 PolarHBondContact O-N 2.87Å; F287-T290 PolarHBondContact O-N 3.11Å; F287-A291 WeakPolarHBondContact O-CB 3.48Å; F287-A291 PolarHBondContact O-N 3.09Å
288	Q	84.1	Confident	84	Confident	21 Å²	21	44.1 Å²	44.1	10%	0.098	22%	0.221	C	C	.	.	H	α-helix	trans	-62	-45.8	-179.8	-75.1	-178.1	4.7	0	0	111.9	D162 A283 F292	D162-Q288 PolarHBondContact OD2-OE1 2.87Å; D162-Q288 VanDerWaalsContact OD2-OE1 3.09Å; A283-Q288 HydrophobicContact CB-CG 3.79Å; Q288-F292 WeakPolarHBondContact O-CB 3.48Å; Q288-F292 PolarHBondContact O-N 2.96Å
289	E	89.6	Confident	83.8	Confident	27 Å²	27	46.1 Å²	46.1	13%	0.126	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-47.6	178.4	-60.5	77.4	-176.7	0	0	110.3	V251 M253 F292 I293	V251-E289 HydrophobicContact CG1-CB 4.05Å; M253-E289 HydrophobicContact CB-CG 4.45Å; M253-E289 HydrophobicContact CE-CG 4.14Å; E289-F292 PolarHBondContact O-N 3.12Å; E289-I293 WeakPolarHBondContact O-CD1 3.35Å; E289-I293 VanDerWaalsContact O-CG1 3.25Å; E289-I293 WeakPolarHBondContact O-CG1 3.46Å; E289-I293 PolarHBondContact O-N 3.44Å
290	T	90.1	Very high	83.9	Confident	8 Å²	8	48.2 Å²	48.2	5%	0.049	24%	0.243	C	C	.	.	H	α-helix	trans	-60.8	-53.6	179.9	-64.3	0	0	0	0	111.1	R248 F249 F287 F292 I293 E294	R248-T290 HydrophobicContact CB-CG2 3.7Å; F249-T290 HydrophobicContact CD2-CG2 4.01Å; F249-T290 PolarHBondContact O-OG1 3.24Å; F287-T290 PolarHBondContact O-N 3.11Å; T290-F292 PolarHBondContact O-N 3Å; T290-I293 PolarHBondContact O-N 3.07Å; T290-I293 VanDerWaalsContact O-N 3.14Å; T290-E294 HydrophobicContact CG2-CG 4.39Å; T290-E294 WeakPolarHBondContact O-CG 3.31Å; T290-E294 PolarHBondContact O-N 3.18Å
291	A	90.3	Very high	84.1	Confident	19 Å²	19	49.4 Å²	49.4	16%	0.157	25%	0.254	C	S	.	.	H	α-helix	trans	-62.3	-27.3	-178.6	0	0	0	0	0	112.9	L280 F287 Q295	L280-A291 HydrophobicContact CD1-CB 4.04Å; F287-A291 WeakPolarHBondContact O-CB 3.48Å; F287-A291 PolarHBondContact O-N 3.09Å; A291-Q295 WeakPolarHBondContact O-CG 3.24Å; A291-Q295 PolarHBondContact O-NE2 3.04Å
292	F	93.1	Very high	84.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-77.2	-42.7	174.7	-177.1	-111.9	0	0	0	112.4	L172 F186 F256 F258 I277 Q279 Q288 E289 T290 E294 Q295 L296	L172-F292 HydrophobicContact CD1-CE2 3.76Å; L172-F292 HydrophobicContact CD1-CZ 3.81Å; F186-F292 HydrophobicContact CE2-CD1 4.47Å; F186-F292 AromaticContact CE2-CE1 3.69Å; F186-F292 HydrophobicContact CE2-CE1 3.69Å; F186-F292 HydrophobicContact CE2-CZ 4.24Å; F186-F292 HydrophobicContact CZ-CE1 4.06Å; F186-F292 HydrophobicContact CZ-CZ 4.14Å; F256-F292 HydrophobicContact CE2-CD1 4.06Å; F256-F292 AromaticContact CE2-CE1 3.97Å; F256-F292 HydrophobicContact CE2-CE1 3.97Å; F256-F292 AromaticContact CZ-CD1 3.84Å; F256-F292 HydrophobicContact CZ-CD1 3.84Å; F256-F292 HydrophobicContact CZ-CE1 4.15Å; F258-F292 AromaticContact CE1-CE1 3.95Å; F258-F292 HydrophobicContact CE1-CE1 3.95Å; F258-F292 HydrophobicContact CE1-CZ 4.14Å; F258-F292 HydrophobicContact CZ-CE1 4.38Å; F258-F292 HydrophobicContact CZ-CZ 4.11Å; I277-F292 HydrophobicContact CG2-CD2 4.39Å; I277-F292 HydrophobicContact CG2-CE2 3.71Å; I277-F292 HydrophobicContact CG2-CZ 4.17Å; Q279-F292 HydrophobicContact CB-CD2 4.41Å; Q279-F292 HydrophobicContact CG-CB 4.16Å; Q279-F292 HydrophobicContact CG-CD1 4.4Å; Q279-F292 HydrophobicContact CG-CD2 3.5Å; Q279-F292 HydrophobicContact CG-CE2 3.93Å; Q279-F292 HydrophobicContact CG-CG 3.75Å; Q288-F292 WeakPolarHBondContact O-CB 3.48Å; Q288-F292 PolarHBondContact O-N 2.96Å; E289-F292 PolarHBondContact O-N 3.12Å; T290-F292 PolarHBondContact O-N 3Å; F292-E294 VanDerWaalsContact C-N 3.34Å; F292-E294 PolarHBondContact O-N 2.75Å; F292-Q295 WeakPolarHBondContact O-CB 3.31Å; F292-Q295 PolarHBondContact O-N 2.68Å; F292-Q295 VanDerWaalsContact O-N 3.12Å; F292-L296 HydrophobicContact CD1-CD1 3.98Å; F292-L296 HydrophobicContact CE1-CD1 3.53Å; F292-L296 HydrophobicContact CE1-CG 4.48Å; F292-L296 HydrophobicContact CZ-CD1 4.01Å
293	I	93.9	Very high	86	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.8	-37.5	-179.8	-69.1	167	0	0	0	111.3	F207 F249 V251 F256 E289 T290 Q295 L296 V297 M303	F207-I293 HydrophobicContact CE2-CG1 4.18Å; F207-I293 HydrophobicContact CE2-CG2 4.19Å; F207-I293 HydrophobicContact CZ-CD1 4.15Å; F207-I293 HydrophobicContact CZ-CG1 3.97Å; F207-I293 HydrophobicContact CZ-CG2 3.88Å; F249-I293 HydrophobicContact CD2-CB 3.82Å; F249-I293 HydrophobicContact CD2-CD1 4.45Å; F249-I293 HydrophobicContact CD2-CG2 3.61Å; F249-I293 HydrophobicContact CE2-CB 4Å; F249-I293 HydrophobicContact CE2-CG2 3.51Å; F249-I293 HydrophobicContact CG-CG2 4.38Å; F249-I293 HydrophobicContact CZ-CG2 4.18Å; V251-I293 HydrophobicContact CB-CD1 4.5Å; V251-I293 HydrophobicContact CG1-CD1 3.29Å; F256-I293 HydrophobicContact CD1-CD1 3.91Å; F256-I293 HydrophobicContact CD1-CG1 4.44Å; F256-I293 HydrophobicContact CE1-CD1 3.93Å; F256-I293 HydrophobicContact CE1-CG1 4.2Å; F256-I293 HydrophobicContact CE2-CG1 4.39Å; F256-I293 HydrophobicContact CG-CD1 4.37Å; F256-I293 HydrophobicContact CZ-CD1 4.42Å; F256-I293 HydrophobicContact CZ-CG1 4.19Å; E289-I293 WeakPolarHBondContact O-CD1 3.35Å; E289-I293 VanDerWaalsContact O-CG1 3.25Å; E289-I293 WeakPolarHBondContact O-CG1 3.46Å; E289-I293 PolarHBondContact O-N 3.44Å; T290-I293 PolarHBondContact O-N 3.07Å; T290-I293 VanDerWaalsContact O-N 3.14Å; I293-Q295 PolarHBondContact O-N 2.98Å; I293-Q295 VanDerWaalsContact O-N 3.1Å; I293-L296 WeakPolarHBondContact O-CB 3.48Å; I293-L296 PolarHBondContact O-N 3.02Å; I293-V297 HydrophobicContact CG2-CG2 3.69Å; I293-V297 WeakPolarHBondContact O-CG2 3.28Å; I293-V297 PolarHBondContact O-N 3.33Å; I293-V297 VanDerWaalsContact O-N 3.09Å; I293-M303 HydrophobicContact CG2-CE 3.55Å
294	E	92	Very high	87.4	Confident	59 Å²	59	46.9 Å²	46.9	28%	0.276	23%	0.231	S	C	.	.	H	α-helix	trans	-58.5	-22.3	173.8	-69.6	-178.4	147.4	0	0	112.8	R248 F249 H271 T290 F292	R248-E294 WeakPolarHBondContact CD-OE1 3.38Å; R248-E294 IonicContact CZ-OE1 4Å; R248-E294 IonicContact NE-OE1 3.17Å; R248-E294 IonicContact NH1-OE1 3.29Å; R248-E294 PolarHBondContact NH1-OE1 3.03Å; F249-E294 HydrophobicContact CE2-CG 3.75Å; H271-E294 PolarHBondContact CD2-O 2.86Å; T290-E294 HydrophobicContact CG2-CG 4.39Å; T290-E294 WeakPolarHBondContact O-CG 3.31Å; T290-E294 PolarHBondContact O-N 3.18Å; F292-E294 VanDerWaalsContact C-N 3.34Å; F292-E294 PolarHBondContact O-N 2.75Å
295	Q	93.1	Very high	88.8	Confident	7 Å²	7	39 Å²	39	3%	0.033	20%	0.197	C	C	.	.	H	α-helix	trans	-81.1	-22.7	174.1	-60.8	170.7	49.2	0	0	112.7	W274 I277 R278 A291 F292 I293	W274-Q295 HydrophobicContact CB-CB 4.19Å; W274-Q295 HydrophobicContact CB-CG 4.47Å; W274-Q295 HydrophobicContact CD2-CB 4.28Å; W274-Q295 HydrophobicContact CD2-CG 3.65Å; W274-Q295 HydrophobicContact CE3-CG 3.8Å; W274-Q295 HydrophobicContact CG-CB 4.03Å; W274-Q295 HydrophobicContact CG-CG 3.95Å; W274-Q295 HydrophobicContact CZ2-CG 4.44Å; W274-Q295 HydrophobicContact CZ3-CG 4.26Å; I277-Q295 VanDerWaalsContact CA-OE1 3.32Å; I277-Q295 HydrophobicContact CB-CB 4.49Å; I277-Q295 HydrophobicContact CG1-CB 4.31Å; I277-Q295 HydrophobicContact CG2-CB 3.98Å; R278-Q295 PolarHBondContact O-NE2 3.03Å; R278-Q295 PolarHBondContact O-OE1 3.06Å; R278-Q295 VanDerWaalsContact O-OE1 3.11Å; A291-Q295 WeakPolarHBondContact O-CG 3.24Å; A291-Q295 PolarHBondContact O-NE2 3.04Å; F292-Q295 WeakPolarHBondContact O-CB 3.31Å; F292-Q295 PolarHBondContact O-N 2.68Å; F292-Q295 VanDerWaalsContact O-N 3.12Å; I293-Q295 PolarHBondContact O-N 2.98Å; I293-Q295 VanDerWaalsContact O-N 3.1Å
296	L	93.5	Very high	90.4	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-92.4	-33.9	-174.4	-73	167.2	0	0	0	113.3	F207 F258 K262 G270 I277 F292 I293	F207-L296 HydrophobicContact CD2-CB 4.37Å; F207-L296 HydrophobicContact CD2-CD1 4.32Å; F207-L296 HydrophobicContact CE2-CD1 4.03Å; F258-L296 HydrophobicContact CD1-CD1 3.77Å; F258-L296 HydrophobicContact CD1-CD2 4.47Å; F258-L296 HydrophobicContact CD2-CD1 4.38Å; F258-L296 HydrophobicContact CD2-CD2 3.62Å; F258-L296 HydrophobicContact CE1-CD1 4.01Å; F258-L296 HydrophobicContact CE2-CD2 3.75Å; F258-L296 HydrophobicContact CG-CD1 3.98Å; F258-L296 HydrophobicContact CG-CD2 4.01Å; F258-L296 HydrophobicContact CZ-CD1 4.4Å; F258-L296 HydrophobicContact CZ-CD2 4.24Å; K262-L296 HydrophobicContact CB-CD2 4.15Å; K262-L296 HydrophobicContact CD-CD2 3.98Å; K262-L296 PolarHBondContact NZ-O 3.49Å; K262-L296 VanDerWaalsContact NZ-O 3.12Å; G270-L296 WeakPolarHBondContact CA-O 3.29Å; G270-L296 PolarHBondContact N-O 3.33Å; I277-L296 HydrophobicContact CD1-CD2 4.04Å; I277-L296 HydrophobicContact CG2-CD2 3.79Å; I277-L296 HydrophobicContact CG2-CG 4Å; F292-L296 HydrophobicContact CD1-CD1 3.98Å; F292-L296 HydrophobicContact CE1-CD1 3.53Å; F292-L296 HydrophobicContact CE1-CG 4.48Å; F292-L296 HydrophobicContact CZ-CD1 4.01Å; I293-L296 WeakPolarHBondContact O-CB 3.48Å; I293-L296 PolarHBondContact O-N 3.02Å
297	V	92.4	Very high	91.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-144.9	143.5	-173.4	-66	0	0	0	0	110.9	F207 I293 H302 M303	F207-V297 HydrophobicContact CB-CG1 3.83Å; F207-V297 HydrophobicContact CD2-CG1 4.12Å; F207-V297 HydrophobicContact CG-CG1 3.96Å; I293-V297 HydrophobicContact CG2-CG2 3.69Å; I293-V297 WeakPolarHBondContact O-CG2 3.28Å; I293-V297 PolarHBondContact O-N 3.33Å; I293-V297 VanDerWaalsContact O-N 3.09Å; V297-H302 HydrophobicContact CB-CB 4.02Å; V297-H302 HydrophobicContact CG1-CB 3.94Å; V297-M303 HydrophobicContact CG2-CE 3.38Å; V297-M303 HydrophobicContact CG2-CG 4.17Å
298	E	89.5	Confident	92.6	Very high	85 Å²	85	30.9 Å²	30.9	40%	0.397	17%	0.167	S	C	.	.	S	Bend	trans	-73.3	-44.8	179.9	-81.5	169.7	-169	0	0	112.3	R248 G270 H271	R248-E298 PolarHBondContact NH2-O 3.12Å; G270-E298 WeakPolarHBondContact O-CG 3.46Å; H271-E298 WeakPolarHBondContact CA-OE1 3.35Å; H271-E298 HydrophobicContact CB-CG 3.73Å; H271-E298 IonicContact ND1-OE1 3.03Å
299	D	89.7	Confident	93.1	Very high	56 Å²	56	31.5 Å²	31.5	30%	0.299	18%	0.179	S	C	.	.	S	Bend	trans	-153.7	-179.2	-179.3	63.7	36.3	0	0	0	112.1	T301 H302	D299-T301 PolarHBondContact O-N 3.06Å; D299-T301 WeakPolarHBondContact OD1-CA 3.4Å; D299-T301 WeakPolarHBondContact OD1-CB 3.16Å; D299-T301 WeakPolarHBondContact OD1-CG2 3.4Å; D299-T301 PolarHBondContact OD1-N 3.12Å; D299-T301 PolarHBondContact OD1-OG1 2.88Å; D299-H302 PolarHBondContact O-N 3.35Å; D299-H302 IonicContact OD1-CD2 3.49Å
300	E	93.3	Very high	93.3	Very high	49 Å²	49	30.9 Å²	30.9	23%	0.229	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-60.2	-22.3	179.6	-71.8	79.6	179.2	0	0	114	V234 W237 F249 H302 M303	V234-E300 HydrophobicContact CB-CB 4.4Å; V234-E300 HydrophobicContact CG1-CB 4.29Å; V234-E300 HydrophobicContact CG1-CG 4.06Å; W237-E300 PolarHBondContact NE1-OE1 3.12Å; F249-E300 WeakPolarHBondContact CE1-OE1 3.49Å; E300-H302 PolarHBondContact O-N 3.29Å; E300-M303 WeakPolarHBondContact O-CB 3.45Å; E300-M303 PolarHBondContact O-N 3.42Å
301	T	91.8	Very high	93.5	Very high	107 Å²	107	34.8 Å²	34.8	66%	0.656	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-68	-21.8	-179.7	75.4	0	0	0	0	112.3	D299 M303	D299-T301 PolarHBondContact O-N 3.06Å; D299-T301 WeakPolarHBondContact OD1-CA 3.4Å; D299-T301 WeakPolarHBondContact OD1-CB 3.16Å; D299-T301 WeakPolarHBondContact OD1-CG2 3.4Å; D299-T301 PolarHBondContact OD1-N 3.12Å; D299-T301 PolarHBondContact OD1-OG1 2.88Å; T301-M303 VanDerWaalsContact C-N 3.34Å
302	H	92	Very high	93.8	Very high	81 Å²	81	38 Å²	38	38%	0.375	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-90	2.7	174.7	-66.4	-78.7	0	0	0	113.7	V297 D299 E300	V297-H302 HydrophobicContact CB-CB 4.02Å; V297-H302 HydrophobicContact CG1-CB 3.94Å; D299-H302 PolarHBondContact O-N 3.35Å; D299-H302 IonicContact OD1-CD2 3.49Å; E300-H302 PolarHBondContact O-N 3.29Å
303	M	95.6	Very high	93.9	Very high	9 Å²	9	41.5 Å²	41.5	4%	0.044	23%	0.233	C	C	.	.			trans	-106.3	147.8	179	-54.1	-174.8	-175.4	0	0	111.3	F207 T209 V234 W237 F249 I293 V297 E300 T301	F207-M303 HydrophobicContact CD1-CB 3.87Å; F207-M303 HydrophobicContact CD1-CG 3.58Å; F207-M303 HydrophobicContact CD1-SD 4.2Å; F207-M303 HydrophobicContact CE1-CB 4.36Å; F207-M303 HydrophobicContact CE1-CE 4.34Å; F207-M303 HydrophobicContact CE1-CG 3.87Å; F207-M303 HydrophobicContact CE1-SD 3.84Å; F207-M303 HydrophobicContact CG-CG 4.47Å; T209-M303 HydrophobicContact CG2-CB 4.45Å; V234-M303 HydrophobicContact CB-CB 4.29Å; V234-M303 HydrophobicContact CG2-CB 3.85Å; W237-M303 HydrophobicContact CH2-SD 4.01Å; W237-M303 HydrophobicContact CZ2-CE 4.05Å; W237-M303 HydrophobicContact CZ2-SD 3.56Å; W237-M303 VanDerWaalsContact CZ2-SD 3.56Å; F249-M303 HydrophobicContact CD1-CE 4.09Å; F249-M303 HydrophobicContact CE1-CE 3.55Å; F249-M303 HydrophobicContact CE2-CE 4.18Å; F249-M303 HydrophobicContact CZ-CE 3.6Å; I293-M303 HydrophobicContact CG2-CE 3.55Å; V297-M303 HydrophobicContact CG2-CE 3.38Å; V297-M303 HydrophobicContact CG2-CG 4.17Å; E300-M303 WeakPolarHBondContact O-CB 3.45Å; E300-M303 PolarHBondContact O-N 3.42Å; T301-M303 VanDerWaalsContact C-N 3.34Å
304	E	96.9	Very high	94.1	Very high	12 Å²	12	41.6 Å²	41.6	6%	0.056	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	137.5	172.1	71.7	-155.9	144.1	0	0	112.2	I204 R205 S206 F207 G208 T209 S232 V306	I204-E304 VanDerWaalsContact CA-OE1 3.29Å; I204-E304 WeakPolarHBondContact CA-OE1 3.27Å; I204-E304 WeakPolarHBondContact CG2-OE1 3.49Å; R205-E304 IonicContact CZ-OE2 3.04Å; R205-E304 PolarHBondContact N-OE1 3.43Å; R205-E304 IonicContact NH1-OE2 2.74Å; R205-E304 PolarHBondContact NH1-OE2 2.93Å; R205-E304 IonicContact NH2-OE2 2.95Å; R205-E304 PolarHBondContact NH2-OE2 2.86Å; S206-E304 PolarHBondContact N-OE1 3.15Å; F207-E304 WeakPolarHBondContact O-CG 3.34Å; F207-E304 PolarHBondContact O-N 3.11Å; G208-E304 CarbonylContact C-O 3.35Å; G208-E304 VanDerWaalsContact CA-O 3.3Å; G208-E304 WeakPolarHBondContact CA-O 3.43Å; T209-E304 PolarHBondContact N-O 3.41Å; S232-E304 CarbonylContact O-C 3.56Å; S232-E304 VanDerWaalsContact O-CA 3.29Å; S232-E304 WeakPolarHBondContact O-CA 3.46Å; E304-V306 HydrophobicContact CG-CG2 3.87Å
305	G	97.4	Very high	94.3	Very high	2 Å²	2	38.8 Å²	38.8	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	125.7	174	0	0	0	0	0	111.4	S232 P307 C310	S232-G305 PolarHBondContact O-N 3.18Å; G305-P307 CarbonylContact C-O 3.57Å; G305-P307 CarbonylContact O-C 3.58Å; G305-C310 WeakPolarHBondContact CA-SG 3.35Å
306	V	96.5	Very high	94.4	Very high	8 Å²	8	41.9 Å²	41.9	5%	0.048	23%	0.234	C	C	.	.	S	Bend	trans	-129.9	117.6	-170.4	177.8	0	0	0	0	111.4	H200 I204 T209 W210 E304 M314	H200-V306 HydrophobicContact CB-CG1 3.53Å; I204-V306 HydrophobicContact CG1-CG2 4.03Å; T209-V306 PolarHBondContact O-N 3.3Å; W210-V306 WeakPolarHBondContact CB-O 3.23Å; W210-V306 HydrophobicContact CE3-CB 4.3Å; E304-V306 HydrophobicContact CG-CG2 3.87Å; V306-M314 VanDerWaalsContact O-CE 3.28Å; V306-M314 WeakPolarHBondContact O-CE 3.37Å
307	P	95.8	Very high	94.3	Very high	10 Å²	10	43.6 Å²	43.6	7%	0.065	24%	0.242	C	C	.	.	S	Bend	cis	-64.1	170.5	-8.5	31.1	-38	0	0	0	111.9	G305 G309 C310 K312	G305-P307 CarbonylContact C-O 3.57Å; G305-P307 CarbonylContact O-C 3.58Å; P307-G309 PolarHBondContact O-N 3.03Å; P307-C310 PolarHBondContact O-N 2.96Å; P307-K312 HydrophobicContact CG-CB 4.09Å; P307-K312 HydrophobicContact CG-CD 4.15Å; P307-K312 HydrophobicContact CG-CG 4.04Å
308	P	94.1	Very high	94.1	Very high	88 Å²	88	45 Å²	45	57%	0.571	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-48.4	137.2	172.6	-27.9	35.4	0	0	0	112.4	C310 S311	P308-C310 VanDerWaalsContact C-N 3.27Å; P308-C310 PolarHBondContact O-N 2.84Å; P308-S311 PolarHBondContact O-OG 2.86Å
309	G	94.6	Very high	93.5	Very high	34 Å²	34	45.1 Å²	45.1	35%	0.351	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	81.4	-0.5	-175.5	0	0	0	0	0	114.1	G231 P307 S311	G231-G309 WeakPolarHBondContact O-CA 3.18Å; G231-G309 PolarHBondContact O-N 3.14Å; P307-G309 PolarHBondContact O-N 3.03Å; G309-S311 PolarHBondContact O-N 2.84Å; G309-S311 VanDerWaalsContact O-N 3.13Å
310	C	94.8	Very high	92.6	Very high	13 Å²	13	45.4 Å²	45.4	9%	0.088	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	50.9	39.8	-178.2	-63.6	0	0	0	0	111.6	P211 P227 C229 G305 P307 P308	P211-C310 HydrophobicContact CG-CB 4.19Å; P211-C310 VanDerWaalsContact CG-O 3.31Å; P211-C310 WeakPolarHBondContact CG-O 3.33Å; P227-C310 HydrophobicContact CG-CB 4.18Å; P227-C310 VanDerWaalsContact CG-SG 3.59Å; C229-C310 HydrophobicContact CB-CB 3.66Å; C229-C310 WeakPolarHBondContact CB-SG 3.34Å; C229-C310 WeakPolarHBondContact SG-CB 3.41Å; C229-C310 CovalentContact SG-SG 2.02Å; C229-C310 PolarHBondContact SG-SG 3.21Å; G305-C310 WeakPolarHBondContact CA-SG 3.35Å; P307-C310 PolarHBondContact O-N 2.96Å; P308-C310 VanDerWaalsContact C-N 3.27Å; P308-C310 PolarHBondContact O-N 2.84Å
311	S	93.7	Very high	91.2	Very high	90 Å²	90	48.9 Å²	48.9	63%	0.629	27%	0.267	S	S	*	.			trans	-88.8	-8	-162.4	53.2	0	0	0	0	114.1	P308 G309	P308-S311 PolarHBondContact O-OG 2.86Å; G309-S311 PolarHBondContact O-N 2.84Å; G309-S311 VanDerWaalsContact O-N 3.13Å
312	K	96.2	Very high	89.5	Confident	86 Å²	86	46.2 Å²	46.2	37%	0.374	25%	0.249	S	C	.	.			trans	-125.1	137.7	-176.3	-67.3	-172	176.2	-178.4	0	111.5	D196 P307 M314	D196-K312 IonicContact OD2-NZ 3.95Å; D196-K312 PolarHBondContact OD2-NZ 3.07Å; P307-K312 HydrophobicContact CG-CB 4.09Å; P307-K312 HydrophobicContact CG-CD 4.15Å; P307-K312 HydrophobicContact CG-CG 4.04Å; K312-M314 HydrophobicContact CB-CG 3.85Å; K312-M314 HydrophobicContact CB-SD 4.45Å
313	I	96.1	Very high	87.6	Confident	74 Å²	74	50.5 Å²	50.5	38%	0.379	27%	0.266	S	S	.	.			trans	-90.5	111	163.3	-60.3	165.7	0	0	0	106.7	P211 A213 L224 N315 F316	P211-I313 HydrophobicContact CB-CG1 4.32Å; A213-I313 HydrophobicContact CB-CD1 4.37Å; A213-I313 HydrophobicContact CB-CG2 3.83Å; L224-I313 HydrophobicContact CD1-CD1 3.66Å; L224-I313 HydrophobicContact CD1-CG1 4Å; I313-N315 WeakPolarHBondContact CG2-O 3.45Å; I313-F316 HydrophobicContact CG2-CE1 4.22Å; I313-F316 HydrophobicContact CG2-CE2 4.14Å; I313-F316 HydrophobicContact CG2-CZ 3.92Å
314	M	97.2	Very high	85.5	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	30%	0.297	C	S	.	.			trans	-109.5	-7	-175.2	-56.4	-178.7	-71.8	0	0	113.3	S194 D196 L197 H200 W210 V306 K312	S194-M314 WeakPolarHBondContact CB-O 3.39Å; S194-M314 PolarHBondContact N-O 3.1Å; D196-M314 HydrophobicContact CB-SD 4.14Å; L197-M314 HydrophobicContact CB-CB 3.92Å; L197-M314 HydrophobicContact CB-SD 4.49Å; L197-M314 HydrophobicContact CD1-CB 4.41Å; L197-M314 HydrophobicContact CD1-CE 3.93Å; H200-M314 VanDerWaalsContact CD2-SD 3.59Å; W210-M314 HydrophobicContact CB-CE 4.2Å; W210-M314 HydrophobicContact CD2-CE 4.29Å; W210-M314 HydrophobicContact CG-CE 4.01Å; V306-M314 VanDerWaalsContact O-CE 3.28Å; V306-M314 WeakPolarHBondContact O-CE 3.37Å; K312-M314 HydrophobicContact CB-CG 3.85Å; K312-M314 HydrophobicContact CB-SD 4.45Å
315	N	95.8	Very high	83.4	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	146.4	175.3	66.7	-47.6	0	0	0	111.4	V192 Y193 L197 W210 V212 A213 S254 I313	V192-N315 CarbonylContact O-C 3.54Å; V192-N315 VanDerWaalsContact O-CA 3.27Å; V192-N315 WeakPolarHBondContact O-CA 3.5Å; Y193-N315 HydrophobicContact CD1-CB 3.76Å; Y193-N315 HydrophobicContact CE1-CB 4.01Å; L197-N315 HydrophobicContact CD2-CB 4.42Å; W210-N315 PolarHBondContact NE1-OD1 2.95Å; V212-N315 WeakPolarHBondContact CG1-ND2 3.37Å; V212-N315 VanDerWaalsContact CG2-ND2 3.28Å; V212-N315 WeakPolarHBondContact CG2-ND2 3.08Å; V212-N315 WeakPolarHBondContact CG2-OD1 3.07Å; A213-N315 PolarHBondContact N-O 3.2Å; S254-N315 PolarHBondContact O-ND2 3.18Å; S254-N315 PolarHBondContact OG-ND2 3.49Å; I313-N315 WeakPolarHBondContact CG2-O 3.45Å
316	F	95	Very high	81.4	Confident	72 Å²	72	65.8 Å²	65.8	32%	0.316	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.1	175.7	-64.2	-100.9	0	0	0	109.5	N191 V192 A213 L215 I313 L318	N191-F316 WeakPolarHBondContact CA-O 3.29Å; N191-F316 WeakPolarHBondContact CB-O 3.31Å; V192-F316 HydrophobicContact CB-CB 4.26Å; V192-F316 PolarHBondContact N-O 2.84Å; V192-F316 PolarHBondContact O-N 2.79Å; A213-F316 HydrophobicContact CB-CD1 3.62Å; A213-F316 HydrophobicContact CB-CE1 3.73Å; A213-F316 CarbonylContact O-C 3.59Å; A213-F316 VanDerWaalsContact O-CA 3.24Å; A213-F316 WeakPolarHBondContact O-CA 3.4Å; L215-F316 HydrophobicContact CD1-CD1 4.14Å; L215-F316 HydrophobicContact CG-CD1 4.4Å; I313-F316 HydrophobicContact CG2-CE1 4.22Å; I313-F316 HydrophobicContact CG2-CE2 4.14Å; I313-F316 HydrophobicContact CG2-CZ 3.92Å; F316-L318 HydrophobicContact CB-CD2 4.35Å
317	H	92.7	Very high	79.4	Confident	37 Å²	37	71.3 Å²	71.3	17%	0.171	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	119.4	171.9	-174.4	107.1	0	0	0	109.2	N191 V212 A213 T214 L215 D252	N191-H317 VanDerWaalsContact OD1-CA 3.31Å; N191-H317 WeakPolarHBondContact OD1-CA 2.87Å; V212-H317 HydrophobicContact CG1-CB 4.08Å; A213-H317 PolarHBondContact O-N 2.8Å; T214-H317 CarbonylContact C-O 3.55Å; T214-H317 WeakPolarHBondContact CA-O 3.45Å; T214-H317 HydrophobicContact CG2-CB 4.3Å; L215-H317 PolarHBondContact N-O 3.33Å; D252-H317 IonicContact OD1-ND1 3.67Å; D252-H317 PolarHBondContact OD1-ND1 3.34Å; D252-H317 IonicContact OD2-CE1 2.79Å; D252-H317 IonicContact OD2-CG 2.88Å; D252-H317 IonicContact OD2-ND1 3.75Å; D252-H317 PolarHBondContact OD2-ND1 3.42Å
318	L	88.5	Confident	77.5	Confident	30 Å²	30	73.2 Å²	73.2	16%	0.157	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	115.9	179	-55.2	-167.4	0	0	0	109.9	D190 N191 V192 L215 F316 L320	D190-L318 VanDerWaalsContact O-CD1 3.31Å; D190-L318 WeakPolarHBondContact O-CD1 3.1Å; N191-L318 PolarHBondContact OD1-N 3.34Å; V192-L318 HydrophobicContact CG2-CD1 3.82Å; V192-L318 HydrophobicContact CG2-CD2 4.49Å; V192-L318 HydrophobicContact CG2-CG 4.24Å; L215-L318 HydrophobicContact CB-CD2 4.02Å; L215-L318 HydrophobicContact CD1-CD2 3.88Å; L215-L318 HydrophobicContact CG-CD2 4.36Å; F316-L318 HydrophobicContact CB-CD2 4.35Å; L318-L320 HydrophobicContact CB-CD1 3.98Å; L318-L320 HydrophobicContact CB-CG 3.82Å; L318-L320 HydrophobicContact CD1-CD1 3.95Å; L318-L320 PolarHBondContact O-N 3.03Å
319	H	76.9	Confident	75.7	Confident	88 Å²	88	74.6 Å²	74.6	41%	0.407	39%	0.393	S	S	.	.			trans	-80.4	67.8	175.9	-164.5	70.8	0	0	0	110.9	L215 A216 P217 E321	L215-H319 PolarHBondContact O-N 2.83Å; A216-H319 HydrophobicContact CB-CB 4.39Å; P217-H319 WeakPolarHBondContact CD-O 3.33Å; P217-H319 WeakPolarHBondContact CG-O 3.39Å; H319-E321 IonicContact NE2-OE1 3.18Å; H319-E321 PolarHBondContact O-N 3.5Å
320	L	70.7	Confident	74.1	Confident	62 Å²	62	75.7 Å²	75.7	33%	0.325	41%	0.405	S	S	.	.			trans	-91.1	99.2	179.9	-60.6	176.7	0	0	0	109.8	Y94 D190 P217 L318	Y94-L320 HydrophobicContact CE1-CD1 3.98Å; Y94-L320 WeakPolarHBondContact OH-CD1 3.34Å; D190-L320 HydrophobicContact CB-CD1 4.37Å; P217-L320 HydrophobicContact CG-CD2 4.37Å; L318-L320 HydrophobicContact CB-CD1 3.98Å; L318-L320 HydrophobicContact CB-CG 3.82Å; L318-L320 HydrophobicContact CD1-CD1 3.95Å; L318-L320 PolarHBondContact O-N 3.03Å
321	E	63.2	Low	72.3	Confident	122 Å²	122	79.3 Å²	79.3	57%	0.57	42%	0.417	S	S	*	.			trans	-86	116.4	166.9	-68.3	-171.3	160.4	0	0	110.4	H319 K323	H319-E321 IonicContact NE2-OE1 3.18Å; H319-E321 PolarHBondContact O-N 3.5Å; E321-K323 PolarHBondContact O-N 2.6Å; E321-K323 WeakPolarHBondContact OE2-CE 3.24Å
322	D	56.6	Low	70.6	Confident	50 Å²	50	82 Å²	82	27%	0.267	42%	0.42	S	S	.	.			trans	-76.7	88.7	170.7	-64.6	-45.3	0	0	0	109.3	R88 N324	R88-D322 VanDerWaalsContact CD-OD2 3.31Å; R88-D322 WeakPolarHBondContact CD-OD2 3.15Å; R88-D322 IonicContact CZ-OD2 2.96Å; R88-D322 IonicContact NE-OD2 3.89Å; R88-D322 IonicContact NH1-OD2 3.79Å; R88-D322 PolarHBondContact NH1-OD2 2.98Å; D322-N324 VanDerWaalsContact C-N 3.29Å
323	K	51.8	Low	68.9	Low	171 Å²	171	82.5 Å²	82.5	74%	0.743	43%	0.43	S	S	*	.			trans	-73.2	-19.8	175.7	-68.7	-173.2	178.7	-179.3	0	113.4	E321	E321-K323 PolarHBondContact O-N 2.6Å; E321-K323 WeakPolarHBondContact OE2-CE 3.24Å
324	N	51.7	Low	67.1	Low	127 Å²	127	85.4 Å²	85.4	68%	0.679	45%	0.452	S	S	*	.			trans	-107.6	129.1	-172.6	-71.6	-12.2	0	0	0	112.5	D322 I326	D322-N324 VanDerWaalsContact C-N 3.29Å; N324-I326 VanDerWaalsContact C-N 3.31Å; N324-I326 PolarHBondContact O-N 3.25Å
325	A	53.2	Low	65.2	Low	98 Å²	98	92.6 Å²	92.6	81%	0.81	49%	0.485	S	S	*	.			trans	-87.7	28.6	-175.5	0	0	0	0	0	114.5	Y327	A325-Y327 PolarHBondContact O-N 2.99Å
326	I	54.6	Low	63.3	Low	120 Å²	120	98.9 Å²	98.9	62%	0.615	52%	0.518	S	S	*	.			trans	-80.2	87.7	178.6	-54.9	176.7	0	0	0	108.5	P89 N324 L328	P89-I326 WeakPolarHBondContact CB-O 3.34Å; P89-I326 VanDerWaalsContact CG-O 3.24Å; P89-I326 WeakPolarHBondContact CG-O 3.4Å; N324-I326 VanDerWaalsContact C-N 3.31Å; N324-I326 PolarHBondContact O-N 3.25Å; I326-L328 HydrophobicContact CG2-CD2 4.17Å; I326-L328 HydrophobicContact CG2-CG 4.47Å; I326-L328 PolarHBondContact O-N 3.28Å
327	Y	54.2	Low	62	Low	123 Å²	123	103.5 Å²	103.5	48%	0.482	55%	0.546	S	S	.	.			trans	-75.3	106.5	174	-170	-93.9	0	0	0	109.7	A325 N329	A325-Y327 PolarHBondContact O-N 2.99Å; Y327-N329 PolarHBondContact O-N 3.3Å
328	L	55.9	Low	60.5	Low	51 Å²	51	107.8 Å²	107.8	27%	0.267	57%	0.57	S	S	.	*			trans	-80.6	103.5	174.7	-64.9	172.2	0	0	0	109.1	I326 G330 W331 T333	I326-L328 HydrophobicContact CG2-CD2 4.17Å; I326-L328 HydrophobicContact CG2-CG 4.47Å; I326-L328 PolarHBondContact O-N 3.28Å; L328-G330 PolarHBondContact O-N 2.9Å; L328-W331 HydrophobicContact CD1-CE3 4.19Å; L328-W331 PolarHBondContact O-N 2.69Å; L328-T333 HydrophobicContact CD2-CG2 4.01Å
329	N	56.1	Low	59.5	Low	116 Å²	116	112.1 Å²	112.1	62%	0.62	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-62.9	120	173.6	-168.1	13.7	0	0	0	109.4	Y327 W331 Q332	Y327-N329 PolarHBondContact O-N 3.3Å; N329-W331 PolarHBondContact O-N 3.19Å; N329-Q332 PolarHBondContact O-N 3.41Å; N329-Q332 VanDerWaalsContact O-N 3.12Å
330	G	60.4	Low	59.4	Low	58 Å²	58	115.3 Å²	115.3	60%	0.598	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	58.3	19	-178.1	0	0	0	0	0	115.7	L328 Q332	L328-G330 PolarHBondContact O-N 2.9Å; G330-Q332 PolarHBondContact O-N 2.66Å
331	W	58.3	Low	59.7	Low	88 Å²	88	119.2 Å²	119.2	33%	0.333	64%	0.636	S	S	.	*	G	3₁₀ helix	trans	63.8	18.5	-173.7	-57.4	85.7	0	0	0	115.4	L90 A92 Y93 L328 N329	L90-W331 HydrophobicContact CD2-CH2 3.61Å; L90-W331 HydrophobicContact CD2-CZ3 3.81Å; A92-W331 HydrophobicContact CB-CZ2 3.77Å; Y93-W331 HydrophobicContact CG-CH2 4.38Å; L328-W331 HydrophobicContact CD1-CE3 4.19Å; L328-W331 PolarHBondContact O-N 2.69Å; N329-W331 PolarHBondContact O-N 3.19Å
332	Q	57.4	Low	60.3	Low	147 Å²	147	118.6 Å²	118.6	69%	0.687	64%	0.642	S	S	*	*			trans	-91.4	121.8	175.8	-64.8	-178.2	-9.4	0	0	109.4	N329 G330 T334	N329-Q332 PolarHBondContact O-N 3.41Å; N329-Q332 VanDerWaalsContact O-N 3.12Å; G330-Q332 PolarHBondContact O-N 2.66Å; Q332-T334 PolarHBondContact O-N 2.82Å
333	T	60.5	Low	61.2	Low	96 Å²	96	124.2 Å²	124.2	59%	0.589	67%	0.671	S	S	*	*			trans	-78	106	165.2	58.3	0	0	0	0	107.3	L328 Q335	L328-T333 HydrophobicContact CD2-CG2 4.01Å; T333-Q335 VanDerWaalsContact C-N 3.27Å
334	T	58.5	Low	62.1	Low	136 Å²	136	125.9 Å²	125.9	83%	0.834	68%	0.679	S	S	*	*	S	Bend	trans	-72.8	-25	176	50.2	0	0	0	0	112.3	Q332	Q332-T334 PolarHBondContact O-N 2.82Å
335	Q	57	Low	63	Low	153 Å²	153	129.6 Å²	129.6	72%	0.715	69%	0.688	S	S	*	*	S	Bend	trans	-94	123.6	172.1	-65.7	178.5	-3.4	0	0	107.8	T333	T333-Q335 VanDerWaalsContact C-N 3.27Å
336	N	56.9	Low	63.2	Low	131 Å²	131	134 Å²	134	70%	0.701	69%	0.692	S	S	*	*			trans	-55.1	154.4	161.6	-97.4	-31.5	0	0	0	107.8	D338	N336-D338 WeakPolarHBondContact CB-OD1 3.02Å; N336-D338 PolarHBondContact O-N 2.97Å
337	L	67.4	Low	63.3	Low	170 Å²	170	132.8 Å²	132.8	89%	0.89	70%	0.7	S	S	*	*			trans	-68.3	69.4	170.4	-63.7	168.5	0	0	0	108.2	V339	L337-V339 PolarHBondContact O-N 3.16Å
338	D	60	Low	63.5	Low	127 Å²	127	138.2 Å²	138.2	68%	0.679	72%	0.72	S	S	*	*			trans	-70.3	-6.8	-166.7	-69.7	-31.3	0	0	0	112.7	N336 I340	N336-D338 WeakPolarHBondContact CB-OD1 3.02Å; N336-D338 PolarHBondContact O-N 2.97Å; D338-I340 PolarHBondContact O-N 3.44Å
339	V	68.4	Low	63.5	Low	120 Å²	120	141 Å²	141	73%	0.727	74%	0.741	S	S	*	*			trans	-84.6	93.1	172.9	-173.6	0	0	0	0	109.3	L337 I341	L337-V339 PolarHBondContact O-N 3.16Å; V339-I341 HydrophobicContact CG1-CG1 4.22Å; V339-I341 PolarHBondContact O-N 3.05Å; V339-I341 VanDerWaalsContact O-N 3.16Å
340	I	74.4	Confident	63.5	Low	155 Å²	155	144 Å²	144	80%	0.795	76%	0.756	S	S	*	*			trans	-68.9	106.1	159.5	-57.8	175.1	0	0	0	106.5	D338 P342	D338-I340 PolarHBondContact O-N 3.44Å; I340-P342 WeakPolarHBondContact O-CD 3.15Å
341	I	77.6	Confident	63.6	Low	145 Å²	145	152.4 Å²	152.4	74%	0.744	79%	0.786	S	S	*	*			trans	-70.4	113	173.7	-57.3	174	0	0	0	107.3	V339 L343	V339-I341 HydrophobicContact CG1-CG1 4.22Å; V339-I341 PolarHBondContact O-N 3.05Å; V339-I341 VanDerWaalsContact O-N 3.16Å; I341-L343 PolarHBondContact O-N 3.21Å
342	P	76.3	Confident	63.9	Low	109 Å²	109	155.6 Å²	155.6	71%	0.708	81%	0.808	S	S	*	*			trans	-66.6	135.3	177.5	26.1	-31.3	0	0	0	110.2	I340 K344	I340-P342 WeakPolarHBondContact O-CD 3.15Å; P342-K344 PolarHBondContact O-N 3.04Å
343	L	75.6	Confident	64.2	Low	168 Å²	168	156.1 Å²	156.1	88%	0.88	82%	0.815	S	S	*	*			trans	-58.2	128.3	175.3	-68.6	165.5	0	0	0	109.6	I341 K345	I341-L343 PolarHBondContact O-N 3.21Å; L343-K345 PolarHBondContact O-N 3.34Å
344	K	70.6	Confident	64.4	Low	206 Å²	206	159.4 Å²	159.4	90%	0.896	83%	0.827	S	S	*	*			trans	-66.5	107.9	172.9	-152.9	178.1	-172.4	-178.3	0	107.1	P342 E346	P342-K344 PolarHBondContact O-N 3.04Å; K344-E346 PolarHBondContact O-N 3.25Å
345	K	70.3	Confident	64.7	Low	204 Å²	204	160.8 Å²	160.8	89%	0.887	83%	0.827	S	S	*	*			trans	-53.3	127	176.1	-76.7	-175.3	175.7	-178.3	0	109.5	L343	L343-K345 PolarHBondContact O-N 3.34Å
346	E	57.6	Low	65.2	Low	191 Å²	191	161.3 Å²	161.3	89%	0.893	83%	0.834	S	S	*	*			trans	-63.8	140.5	-178.1	-78.1	177.3	148.2	0	0	113	K344	K344-E346 PolarHBondContact O-N 3.25Å
347	A	56.7	Low	65.8	Low	94 Å²	94	163.3 Å²	163.3	78%	0.777	84%	0.843	S	S	*	*			trans	31.2	121.1	155.4	0	0	0	0	0	120.5
348	R	57.4	Low	65.7	Low	238 Å²	238	162.8 Å²	162.8	90%	0.898	84%	0.84	S	S	*	*			trans	-49.7	136.9	160.3	-75.8	177.6	172.2	-178.1	-3.8	110.3	L350	R348-L350 PolarHBondContact O-N 3.37Å
349	P	57.4	Low	66.1	Low	110 Å²	110	165.5 Å²	165.5	71%	0.714	85%	0.852	S	S	*	*			trans	-64.3	130.5	171.5	25.1	-27.8	0	0	0	109	L351	P349-L351 PolarHBondContact O-N 3.19Å
350	L	55.6	Low	65.9	Low	179 Å²	179	169.3 Å²	169.3	94%	0.937	86%	0.862	S	S	*	*			trans	-57.8	115.6	160.4	-76.1	160.8	0	0	0	106.6	R348	R348-L350 PolarHBondContact O-N 3.37Å
351	L	61.8	Low	65.2	Low	233 Å²	233	170.6 Å²	170.6	100%	1.22	87%	0.868	S	S	*	*			trans	-97.6	0	163.6	-87.5	165.7	0	0	0	108.4	P349	P349-L351 PolarHBondContact O-N 3.19Å

Retrieved 351 of 351 residues in 246 ms (Link to these results)

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