A0A077YYW8_TRITR Loading...

DUF3456 and EGF CA domain containing protein

AlphaFold DB , UniProt , Accession A0A077YYW8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 354 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.7	Low	45.4	Very low	241 Å²	241	154.2 Å²	154.2	100%	1.187	82%	0.824	S	S	*	*				0	72.5	0	-66	166.5	143.6	0	0	106.6
2	S	39.3	Very low	45.3	Very low	101 Å²	101	155.4 Å²	155.4	71%	0.706	83%	0.829	S	S	*	*				55.5	103	82.6	-98.8	0	0	0	0	114.3
3	W	39.6	Very low	45.3	Very low	222 Å²	222	151.6 Å²	151.6	84%	0.841	82%	0.818	S	S	*	*			trans	69.7	141.3	147.1	-61.1	104	0	0	0	116.2
4	L	45.4	Very low	45.9	Very low	150 Å²	150	151.9 Å²	151.9	79%	0.785	82%	0.817	S	S	*	*			cis	-166.5	147.8	10.3	-89.1	145.9	0	0	0	103.6
5	G	42	Very low	46.1	Very low	77 Å²	77	151.1 Å²	151.1	79%	0.794	81%	0.811	S	S	*	*				136.6	140	61.8	0	0	0	0	0	108.2
6	G	49.3	Very low	46.2	Very low	83 Å²	83	151.5 Å²	151.5	86%	0.856	81%	0.806	S	S	*	*			trans	169.3	66	-178.8	0	0	0	0	0	114.4
7	S	46.5	Very low	46.3	Very low	112 Å²	112	150.5 Å²	150.5	78%	0.783	81%	0.807	S	S	*	*			trans	-59.6	162.5	159.8	-97.1	0	0	0	0	111
8	L	44.4	Very low	46.7	Very low	129 Å²	129	149.3 Å²	149.3	68%	0.675	81%	0.806	S	S	*	*			cis	-179	132.6	38.8	-147.1	70.3	0	0	0	104
9	H	48.9	Very low	46.9	Very low	158 Å²	158	148.9 Å²	148.9	73%	0.731	80%	0.802	S	S	*	*				-179.3	115.1	92.2	-118.8	-90.3	0	0	0	112.1
10	K	48.7	Very low	47	Very low	180 Å²	180	149.3 Å²	149.3	78%	0.783	80%	0.798	S	S	*	*			trans	7.2	111.5	145.2	-58.8	167.4	-179.2	179.5	0	117.9
11	R	43.5	Very low	47.2	Very low	243 Å²	243	148.5 Å²	148.5	92%	0.917	79%	0.793	S	S	*	*				51.6	110.6	88.1	-73.1	-163.4	-174	-144.9	2.1	117.3
12	L	44.8	Very low	47.3	Very low	169 Å²	169	144.4 Å²	144.4	89%	0.885	78%	0.776	S	S	*	*			trans	-152.7	130.7	132.2	-130.4	92	0	0	0	108.9
13	P	45.2	Very low	48	Very low	106 Å²	106	146.4 Å²	146.4	69%	0.688	78%	0.777	S	S	*	*			trans	-100.6	165.6	176.5	37.3	-28.6	0	0	0	111.4
14	I	53.6	Low	48.7	Very low	156 Å²	156	140.1 Å²	140.1	80%	0.8	77%	0.773	S	S	*	*			trans	162.3	110.4	146.4	-81.6	152.6	0	0	0	109.3
15	L	48.3	Very low	48.9	Very low	139 Å²	139	138.2 Å²	138.2	73%	0.728	77%	0.768	S	S	*	*				61.5	137	129.6	-135.2	73	0	0	0	121.6
16	H	48.5	Very low	49.1	Very low	158 Å²	158	140.1 Å²	140.1	73%	0.731	77%	0.766	S	S	*	*			trans	88.6	91	167	-59.9	-76.1	0	0	0	117.7
17	T	48.3	Very low	48.6	Very low	135 Å²	135	142.6 Å²	142.6	83%	0.828	76%	0.764	S	S	*	*				177	95.8	104.7	30	0	0	0	0	108.3	L19	T17-L19 PolarHBondContact O-N 3.22Å
18	V	53.3	Low	48.2	Very low	129 Å²	129	146.6 Å²	146.6	78%	0.782	76%	0.762	S	S	*	*			trans	-75.8	88	160.5	177.8	0	0	0	0	105.4	H20	V18-H20 PolarHBondContact O-N 3.27Å; V18-H20 VanDerWaalsContact O-N 3.1Å
19	L	49.4	Very low	47.9	Very low	141 Å²	141	143.9 Å²	143.9	74%	0.738	75%	0.754	S	S	*	*			trans	-68	104.6	167.3	-178	62.3	0	0	0	106.2	T17 L21	T17-L19 PolarHBondContact O-N 3.22Å; L19-L21 HydrophobicContact CD2-CD1 4.28Å; L19-L21 HydrophobicContact CG-CD1 4.45Å; L19-L21 PolarHBondContact O-N 3.26Å
20	H	50.1	Low	47.8	Very low	156 Å²	156	143.9 Å²	143.9	72%	0.722	75%	0.754	S	S	*	*			trans	-56.8	90.8	167.7	-79.6	-77.6	0	0	0	108.7	V18 L22	V18-H20 PolarHBondContact O-N 3.27Å; V18-H20 VanDerWaalsContact O-N 3.1Å; H20-L22 PolarHBondContact O-N 3.49Å
21	L	50.9	Low	48	Very low	133 Å²	133	139.3 Å²	139.3	70%	0.696	75%	0.745	S	S	*	*			trans	-70.2	80.3	156.5	-121	81.3	0	0	0	106.1	L19 L23	L19-L21 HydrophobicContact CD2-CD1 4.28Å; L19-L21 HydrophobicContact CG-CD1 4.45Å; L19-L21 PolarHBondContact O-N 3.26Å; L21-L23 PolarHBondContact O-N 3.09Å
22	L	52.6	Low	48.7	Very low	156 Å²	156	131.7 Å²	131.7	82%	0.817	72%	0.722	S	S	*	*			trans	-62.9	86.3	153.6	-76.4	165.5	0	0	0	105.5	H20 A24	H20-L22 PolarHBondContact O-N 3.49Å; L22-A24 PolarHBondContact O-N 3.3Å
23	L	54.4	Low	49.4	Very low	142 Å²	142	125.5 Å²	125.5	74%	0.743	69%	0.69	S	S	*	*			trans	-58.1	100.8	156.4	-78.1	160.9	0	0	0	104.9	L21 T25	L21-L23 PolarHBondContact O-N 3.09Å; L23-T25 PolarHBondContact O-N 2.74Å
24	A	55	Low	50.7	Low	91 Å²	91	121.2 Å²	121.2	75%	0.752	66%	0.662	S	S	*	*			trans	-55.7	94.2	159.4	0	0	0	0	0	105.8	L22	L22-A24 PolarHBondContact O-N 3.3Å
25	T	49.5	Very low	52.1	Low	110 Å²	110	115.4 Å²	115.4	68%	0.675	63%	0.632	S	S	*	*			trans	-52.4	128.5	157.3	49.3	0	0	0	0	104.9	L23 V27	L23-T25 PolarHBondContact O-N 2.74Å; T25-V27 PolarHBondContact O-N 3.39Å
26	P	45.4	Very low	54.2	Low	117 Å²	117	114 Å²	114	76%	0.76	62%	0.622	S	S	*	*			trans	-56.1	117.2	170.8	25.8	-30.1	0	0	0	104.7	R28	P26-R28 PolarHBondContact O-N 3.14Å
27	V	39.9	Very low	56.4	Low	134 Å²	134	106.4 Å²	106.4	81%	0.812	59%	0.587	S	S	*	*			trans	-55.3	101	164.9	171.4	0	0	0	0	103.2	T25 S29	T25-V27 PolarHBondContact O-N 3.39Å; V27-S29 PolarHBondContact O-N 2.9Å
28	R	38.4	Very low	58.5	Low	197 Å²	197	103 Å²	103	74%	0.743	56%	0.564	S	S	*	*			trans	-65.3	99.1	174.2	-171.9	170.4	-175.8	172.7	0.7	103.4	P26 E30 D32	P26-R28 PolarHBondContact O-N 3.14Å; R28-E30 PolarHBondContact O-N 3.08Å; R28-D32 IonicContact NE-OD2 3.74Å; R28-D32 IonicContact NH2-OD2 3.81Å
29	S	37.4	Very low	60.4	Low	71 Å²	71	97 Å²	97	50%	0.497	53%	0.527	S	S	.	.			trans	-42.2	126.3	175	169.2	0	0	0	0	107.7	V27 S31	V27-S29 PolarHBondContact O-N 2.9Å; S29-S31 WeakPolarHBondContact CB-OG 3.46Å; S29-S31 PolarHBondContact O-N 3.4Å; S29-S31 PolarHBondContact O-OG 2.87Å; S29-S31 WeakPolarHBondContact OG-CB 3.33Å; S29-S31 PolarHBondContact OG-N 3.4Å; S29-S31 PolarHBondContact OG-OG 3.44Å
30	E	47.2	Very low	62.7	Low	159 Å²	159	90.3 Å²	90.3	74%	0.743	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-56.8	9.7	173.4	-161	89.7	-142.2	0	0	112.5	R28 D32	R28-E30 PolarHBondContact O-N 3.08Å; E30-D32 VanDerWaalsContact C-N 3.32Å; E30-D32 PolarHBondContact O-N 3.2Å
31	S	53	Low	64.8	Low	83 Å²	83	86.5 Å²	86.5	58%	0.58	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-75	-7.9	-175.2	55.3	0	0	0	0	115.5	S29 L33	S29-S31 WeakPolarHBondContact CB-OG 3.46Å; S29-S31 PolarHBondContact O-N 3.4Å; S29-S31 PolarHBondContact O-OG 2.87Å; S29-S31 WeakPolarHBondContact OG-CB 3.33Å; S29-S31 PolarHBondContact OG-N 3.4Å; S29-S31 PolarHBondContact OG-OG 3.44Å; S31-L33 VanDerWaalsContact C-N 3.32Å
32	D	56.7	Low	66.9	Low	84 Å²	84	81.7 Å²	81.7	45%	0.449	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-87.9	-1.5	178.5	-74.2	-12.8	0	0	0	113	R28 E30 N99	R28-D32 IonicContact NE-OD2 3.74Å; R28-D32 IonicContact NH2-OD2 3.81Å; E30-D32 VanDerWaalsContact C-N 3.32Å; E30-D32 PolarHBondContact O-N 3.2Å; D32-N99 PolarHBondContact O-ND2 2.97Å
33	L	61	Low	69	Low	39 Å²	39	74.4 Å²	74.4	20%	0.204	41%	0.408	C	S	.	.	S	Bend	trans	-95.3	133.6	-177.6	-165.7	62.9	0	0	0	111.1	S31 D35 K102 K106	S31-L33 VanDerWaalsContact C-N 3.32Å; L33-D35 PolarHBondContact O-N 3.42Å; L33-K102 HydrophobicContact CD1-CB 4.31Å; L33-K102 HydrophobicContact CD1-CD 3.16Å; L33-K102 HydrophobicContact CD1-CG 3.57Å; L33-K102 VanDerWaalsContact CD1-NZ 3.31Å; L33-K102 HydrophobicContact CG-CD 4.48Å; L33-K106 VanDerWaalsContact CG-NZ 3.26Å
34	P	72.2	Confident	71.1	Confident	15 Å²	15	67.9 Å²	67.9	10%	0.097	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-58.2	132.2	173.9	-9.6	19.7	0	0	0	109	D38 V39 I103 K106	P34-D38 HydrophobicContact CB-CB 4.2Å; P34-V39 HydrophobicContact CB-CG2 4.2Å; P34-I103 HydrophobicContact CG-CB 4.18Å; P34-I103 HydrophobicContact CG-CD1 3.82Å; P34-I103 HydrophobicContact CG-CG1 3.53Å; P34-I103 HydrophobicContact CG-CG2 4.09Å; P34-K106 PolarHBondContact O-NZ 2.82Å
35	D	83.4	Confident	73.1	Confident	34 Å²	34	67.2 Å²	67.2	18%	0.182	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-73.4	163.4	172.2	179.6	38.4	0	0	0	110.2	L33 C37 D38 V39 F178	L33-D35 PolarHBondContact O-N 3.42Å; D35-C37 PolarHBondContact O-N 2.72Å; D35-C37 VanDerWaalsContact O-N 3.16Å; D35-D38 PolarHBondContact O-N 3.12Å; D35-V39 PolarHBondContact O-N 3.45Å; D35-V39 VanDerWaalsContact O-N 3.13Å; D35-F178 VanDerWaalsContact CG-CE2 3.46Å; D35-F178 VanDerWaalsContact OD1-CE2 3.29Å; D35-F178 WeakPolarHBondContact OD1-CE2 3.46Å; D35-F178 WeakPolarHBondContact OD2-CD2 3.31Å; D35-F178 WeakPolarHBondContact OD2-CE2 3.33Å
36	H	91.5	Very high	75.3	Confident	109 Å²	109	62.3 Å²	62.3	51%	0.505	34%	0.335	S	S	.	.	H	α-helix	trans	-52.4	-34.1	176.6	-62	79.4	0	0	0	112.3	C40 V143	H36-C40 WeakPolarHBondContact O-CB 3.5Å; H36-C40 PolarHBondContact O-N 3.07Å; H36-V143 HydrophobicContact CB-CB 3.98Å; H36-V143 HydrophobicContact CB-CG1 3.84Å
37	C	94.6	Very high	77.8	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-64.4	-43	176.4	-176.7	0	0	0	0	112.7	D35 C40 R41 V143 C144 G175	D35-C37 PolarHBondContact O-N 2.72Å; D35-C37 VanDerWaalsContact O-N 3.16Å; C37-C40 PolarHBondContact O-N 3.43Å; C37-R41 WeakPolarHBondContact O-CG 3.43Å; C37-R41 PolarHBondContact O-N 2.85Å; C37-R41 PolarHBondContact SG-NH1 3.42Å; C37-R41 VanDerWaalsContact SG-NH1 3.43Å; C37-R41 PolarHBondContact SG-NH2 2.78Å; C37-R41 VanDerWaalsContact SG-NH2 3.41Å; C37-V143 WeakPolarHBondContact CB-O 3.4Å; C37-C144 WeakPolarHBondContact CA-SG 3.22Å; C37-C144 HydrophobicContact CB-CB 4.15Å; C37-C144 WeakPolarHBondContact CB-SG 3.46Å; C37-C144 PolarHBondContact O-SG 2.84Å; C37-C144 VanDerWaalsContact O-SG 3.37Å; C37-C144 WeakPolarHBondContact SG-CA 3.33Å; C37-C144 WeakPolarHBondContact SG-CB 3.15Å; C37-C144 CovalentContact SG-SG 2.04Å; C37-C144 PolarHBondContact SG-SG 3.21Å; C37-G175 PolarHBondContact SG-O 3.04Å
38	D	92.2	Very high	80.5	Confident	63 Å²	63	53.9 Å²	53.9	34%	0.337	28%	0.278	S	S	.	.	H	α-helix	trans	-69	-38	-179.8	-62.8	-37	0	0	0	111.3	P34 D35 C40 R41 I42	P34-D38 HydrophobicContact CB-CB 4.2Å; D35-D38 PolarHBondContact O-N 3.12Å; D38-C40 VanDerWaalsContact C-N 3.34Å; D38-R41 WeakPolarHBondContact O-CB 3.44Å; D38-R41 PolarHBondContact O-N 3.06Å; D38-R41 IonicContact OD1-NH1 3.9Å; D38-R41 PolarHBondContact OD1-NH1 3.27Å; D38-I42 WeakPolarHBondContact O-CD1 3.16Å; D38-I42 WeakPolarHBondContact O-CG1 3.45Å; D38-I42 PolarHBondContact O-N 3.01Å
39	V	93.8	Very high	83.3	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.018	27%	0.274	C	S	.	.	H	α-helix	trans	-62.6	-42.4	172.5	-176.6	0	0	0	0	110.8	P34 D35 R41 I42 V43 K106 C107 M110	P34-V39 HydrophobicContact CB-CG2 4.2Å; D35-V39 PolarHBondContact O-N 3.45Å; D35-V39 VanDerWaalsContact O-N 3.13Å; V39-R41 VanDerWaalsContact C-N 3.34Å; V39-R41 PolarHBondContact O-N 3.13Å; V39-I42 WeakPolarHBondContact O-CB 3.48Å; V39-I42 PolarHBondContact O-N 3.49Å; V39-I42 VanDerWaalsContact O-N 3.16Å; V39-V43 WeakPolarHBondContact O-CG2 3.23Å; V39-V43 PolarHBondContact O-N 3.47Å; V39-K106 HydrophobicContact CG1-CB 4.25Å; V39-K106 HydrophobicContact CG2-CB 3.93Å; V39-K106 HydrophobicContact CG2-CD 4.09Å; V39-C107 HydrophobicContact CG1-CB 4.37Å; V39-M110 HydrophobicContact CB-CE 3.76Å; V39-M110 HydrophobicContact CB-SD 4.25Å; V39-M110 HydrophobicContact CG1-CB 3.97Å; V39-M110 HydrophobicContact CG1-CE 3.67Å; V39-M110 HydrophobicContact CG1-SD 3.81Å
40	C	96.6	Very high	86.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66	-36	177.4	-163.2	0	0	0	0	112.5	H36 C37 D38 I42 V43 T44 M110 C137 V143	H36-C40 WeakPolarHBondContact O-CB 3.5Å; H36-C40 PolarHBondContact O-N 3.07Å; C37-C40 PolarHBondContact O-N 3.43Å; D38-C40 VanDerWaalsContact C-N 3.34Å; C40-I42 VanDerWaalsContact C-N 3.33Å; C40-I42 PolarHBondContact O-N 2.95Å; C40-V43 PolarHBondContact O-N 3.11Å; C40-T44 WeakPolarHBondContact O-CB 3.39Å; C40-T44 WeakPolarHBondContact O-CG2 3.45Å; C40-T44 PolarHBondContact O-N 3.23Å; C40-T44 PolarHBondContact O-OG1 3.06Å; C40-M110 WeakPolarHBondContact CA-SD 3.45Å; C40-M110 HydrophobicContact CB-CE 4.26Å; C40-M110 HydrophobicContact CB-SD 3.73Å; C40-C137 VanDerWaalsContact C-SG 3.54Å; C40-C137 HydrophobicContact CB-CB 3.89Å; C40-C137 WeakPolarHBondContact CB-SG 3.45Å; C40-C137 PolarHBondContact O-SG 3.35Å; C40-C137 WeakPolarHBondContact SG-CA 3.41Å; C40-C137 WeakPolarHBondContact SG-CB 3.45Å; C40-C137 CovalentContact SG-SG 2.03Å; C40-C137 PolarHBondContact SG-SG 2.9Å; C40-V143 HydrophobicContact CB-CG2 3.76Å
41	R	95.6	Very high	88.4	Confident	77 Å²	77	42 Å²	42	29%	0.291	22%	0.222	S	C	.	.	H	α-helix	trans	-60.4	-42.9	170.8	-73.8	177.9	-179.2	124.9	3.2	112.1	C37 D38 V39 T44 S45 F133 G175	C37-R41 WeakPolarHBondContact O-CG 3.43Å; C37-R41 PolarHBondContact O-N 2.85Å; C37-R41 PolarHBondContact SG-NH1 3.42Å; C37-R41 VanDerWaalsContact SG-NH1 3.43Å; C37-R41 PolarHBondContact SG-NH2 2.78Å; C37-R41 VanDerWaalsContact SG-NH2 3.41Å; D38-R41 WeakPolarHBondContact O-CB 3.44Å; D38-R41 PolarHBondContact O-N 3.06Å; D38-R41 IonicContact OD1-NH1 3.9Å; D38-R41 PolarHBondContact OD1-NH1 3.27Å; V39-R41 VanDerWaalsContact C-N 3.34Å; V39-R41 PolarHBondContact O-N 3.13Å; R41-T44 PolarHBondContact O-OG1 3.29Å; R41-S45 WeakPolarHBondContact O-CB 3.3Å; R41-S45 PolarHBondContact O-N 3.46Å; R41-F133 HydrophobicContact CB-CE2 4.42Å; R41-F133 HydrophobicContact CG-CD2 4.08Å; R41-F133 HydrophobicContact CG-CE2 3.37Å; R41-F133 HydrophobicContact CG-CZ 4.04Å; R41-G175 PolarHBondContact NH2-O 3.19Å
42	I	94.9	Very high	90.4	Very high	32 Å²	32	45.6 Å²	45.6	16%	0.164	23%	0.227	C	C	.	.	H	α-helix	trans	-59.5	-53.9	175.4	-72.5	158.2	0	0	0	109.9	D38 V39 C40 T44 S45 G46 Y93 I103 C107	D38-I42 WeakPolarHBondContact O-CD1 3.16Å; D38-I42 WeakPolarHBondContact O-CG1 3.45Å; D38-I42 PolarHBondContact O-N 3.01Å; V39-I42 WeakPolarHBondContact O-CB 3.48Å; V39-I42 PolarHBondContact O-N 3.49Å; V39-I42 VanDerWaalsContact O-N 3.16Å; C40-I42 VanDerWaalsContact C-N 3.33Å; C40-I42 PolarHBondContact O-N 2.95Å; I42-T44 PolarHBondContact O-N 3.14Å; I42-S45 PolarHBondContact O-N 3.05Å; I42-G46 PolarHBondContact O-N 3.26Å; I42-Y93 HydrophobicContact CB-CE1 4.45Å; I42-Y93 HydrophobicContact CD1-CD1 3.92Å; I42-Y93 HydrophobicContact CD1-CE1 3.7Å; I42-Y93 HydrophobicContact CG1-CD1 4.27Å; I42-Y93 HydrophobicContact CG1-CE1 4.05Å; I42-Y93 HydrophobicContact CG2-CD1 4.48Å; I42-Y93 HydrophobicContact CG2-CE1 3.58Å; I42-I103 HydrophobicContact CD1-CG2 3.47Å; I42-I103 VanDerWaalsContact CD1-CG2 3.47Å; I42-C107 HydrophobicContact CG2-CB 4.34Å; I42-C107 VanDerWaalsContact CG2-SG 3.51Å
43	V	97.1	Very high	92.3	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.012	24%	0.237	C	C	.	.	H	α-helix	trans	-57.1	-50.4	-177.4	169.9	0	0	0	0	110.7	V39 C40 G46 F47 M110 V111 L118	V39-V43 WeakPolarHBondContact O-CG2 3.23Å; V39-V43 PolarHBondContact O-N 3.47Å; C40-V43 PolarHBondContact O-N 3.11Å; V43-G46 PolarHBondContact O-N 3.04Å; V43-F47 WeakPolarHBondContact O-CB 3.44Å; V43-F47 PolarHBondContact O-N 3.25Å; V43-M110 HydrophobicContact CG2-CB 4.21Å; V43-M110 HydrophobicContact CG2-CG 4.13Å; V43-M110 HydrophobicContact CG2-SD 4Å; V43-V111 HydrophobicContact CG1-CG2 4Å; V43-V111 HydrophobicContact CG2-CG2 3.85Å; V43-L118 HydrophobicContact CG1-CD1 4.37Å
44	T	97.5	Very high	93.9	Very high	5 Å²	5	47.1 Å²	47.1	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-67.8	-39.6	-177.9	52.7	0	0	0	0	112.8	C40 R41 I42 L48 L132 L136 C137	C40-T44 WeakPolarHBondContact O-CB 3.39Å; C40-T44 WeakPolarHBondContact O-CG2 3.45Å; C40-T44 PolarHBondContact O-N 3.23Å; C40-T44 PolarHBondContact O-OG1 3.06Å; R41-T44 PolarHBondContact O-OG1 3.29Å; I42-T44 PolarHBondContact O-N 3.14Å; T44-L48 WeakPolarHBondContact O-CB 3.03Å; T44-L48 VanDerWaalsContact O-CG 3.27Å; T44-L48 WeakPolarHBondContact O-CG 3.45Å; T44-L48 PolarHBondContact O-N 3.04Å; T44-L132 HydrophobicContact CG2-CD2 4.19Å; T44-L132 HydrophobicContact CG2-CG 3.88Å; T44-L136 HydrophobicContact CG2-CB 4.33Å; T44-L136 HydrophobicContact CG2-CD2 3.78Å; T44-C137 VanDerWaalsContact CG2-SG 3.55Å
45	S	96.4	Very high	94.9	Very high	78 Å²	78	53.2 Å²	53.2	55%	0.545	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-45.4	174.5	-178	0	0	0	0	111.9	R41 I42 L48 K49	R41-S45 WeakPolarHBondContact O-CB 3.3Å; R41-S45 PolarHBondContact O-N 3.46Å; I42-S45 PolarHBondContact O-N 3.05Å; S45-L48 PolarHBondContact O-N 2.9Å; S45-K49 VanDerWaalsContact O-CB 3.31Å; S45-K49 WeakPolarHBondContact O-CB 3.33Å; S45-K49 PolarHBondContact O-N 3.17Å
46	G	96.5	Very high	95.2	Very high	6 Å²	6	56.1 Å²	56.1	6%	0.062	28%	0.284	C	S	.	.	H	α-helix	trans	-63.8	-43.8	176.5	0	0	0	0	0	112.2	I42 V43 K49 G50 A88	I42-G46 PolarHBondContact O-N 3.26Å; V43-G46 PolarHBondContact O-N 3.04Å; G46-K49 CarbonylContact O-C 3.47Å; G46-K49 WeakPolarHBondContact O-CB 3.45Å; G46-K49 PolarHBondContact O-N 3.05Å; G46-G50 PolarHBondContact O-N 3.05Å; G46-A88 WeakPolarHBondContact CA-O 3.38Å
47	F	97.7	Very high	95.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.7	-47.6	176.9	-166.8	-81.5	0	0	0	111.5	V43 K49 G50 M51 F81 I84 L85 A88 L118 W121 F122 L132	V43-F47 WeakPolarHBondContact O-CB 3.44Å; V43-F47 PolarHBondContact O-N 3.25Å; F47-K49 VanDerWaalsContact C-N 3.3Å; F47-K49 PolarHBondContact O-N 3.45Å; F47-G50 PolarHBondContact O-N 3.17Å; F47-G50 VanDerWaalsContact O-N 3.17Å; F47-M51 HydrophobicContact CD1-CG 3.99Å; F47-M51 HydrophobicContact CE1-CG 3.91Å; F47-M51 HydrophobicContact CE1-SD 4.24Å; F47-M51 WeakPolarHBondContact O-CG 3.26Å; F47-M51 PolarHBondContact O-N 2.96Å; F47-F81 HydrophobicContact CE2-CD2 4.26Å; F47-F81 AromaticContact CE2-CE2 3.85Å; F47-F81 HydrophobicContact CE2-CE2 3.85Å; F47-F81 HydrophobicContact CZ-CD2 4.04Å; F47-F81 AromaticContact CZ-CE2 3.88Å; F47-F81 HydrophobicContact CZ-CE2 3.88Å; F47-I84 HydrophobicContact CB-CG2 4.5Å; F47-I84 HydrophobicContact CD1-CG2 3.85Å; F47-I84 HydrophobicContact CD2-CG2 3.64Å; F47-I84 HydrophobicContact CE1-CG2 3.85Å; F47-I84 HydrophobicContact CE2-CG2 3.64Å; F47-I84 HydrophobicContact CG-CG2 3.74Å; F47-I84 HydrophobicContact CZ-CG2 3.75Å; F47-I84 WeakPolarHBondContact O-CG2 3.45Å; F47-L85 HydrophobicContact CD2-CD2 4.11Å; F47-L85 HydrophobicContact CE2-CD2 3.77Å; F47-L85 HydrophobicContact CE2-CG 4.31Å; F47-A88 HydrophobicContact CB-CB 4.41Å; F47-L118 HydrophobicContact CD2-CD1 4.44Å; F47-L118 HydrophobicContact CD2-CD2 3.92Å; F47-L118 HydrophobicContact CE2-CB 4.11Å; F47-L118 HydrophobicContact CE2-CD2 4.1Å; F47-L118 HydrophobicContact CE2-CG 4.49Å; F47-L118 HydrophobicContact CG-CD2 4.32Å; F47-W121 HydrophobicContact CD1-CZ3 4.4Å; F47-W121 HydrophobicContact CE1-CE3 4.1Å; F47-W121 AromaticContact CE1-CZ3 3.92Å; F47-W121 HydrophobicContact CE1-CZ3 3.92Å; F47-F122 HydrophobicContact CE1-CD2 4.36Å; F47-F122 HydrophobicContact CZ-CB 4.28Å; F47-F122 HydrophobicContact CZ-CD2 4.21Å; F47-L132 HydrophobicContact CB-CD2 4Å; F47-L132 HydrophobicContact CD1-CD2 3.55Å; F47-L132 HydrophobicContact CE1-CD2 4.31Å; F47-L132 HydrophobicContact CG-CD2 3.94Å
48	L	97	Very high	94.6	Very high	74 Å²	74	59.2 Å²	59.2	39%	0.387	30%	0.304	S	S	.	.	H	α-helix	trans	-65.1	-33	176.1	-69.5	175.1	0	0	0	112.5	T44 S45 M51 K52 W121 L132	T44-L48 WeakPolarHBondContact O-CB 3.03Å; T44-L48 VanDerWaalsContact O-CG 3.27Å; T44-L48 WeakPolarHBondContact O-CG 3.45Å; T44-L48 PolarHBondContact O-N 3.04Å; S45-L48 PolarHBondContact O-N 2.9Å; L48-M51 WeakPolarHBondContact O-CB 3.48Å; L48-K52 PolarHBondContact O-N 3.41Å; L48-W121 HydrophobicContact CD2-CH2 4.02Å; L48-L132 HydrophobicContact CD2-CB 4.27Å; L48-L132 HydrophobicContact CD2-CD2 4.39Å; L48-L132 HydrophobicContact CG-CB 4.47Å; L48-L132 HydrophobicContact CG-CD2 4.3Å
49	K	96.3	Very high	94.3	Very high	150 Å²	150	57.2 Å²	57.2	65%	0.652	29%	0.292	S	S	*	.	H	α-helix	trans	-66.6	-41.8	171.9	-174.6	-179.6	179.4	-179.2	0	111.5	S45 G46 F47 K52 K53	S45-K49 VanDerWaalsContact O-CB 3.31Å; S45-K49 WeakPolarHBondContact O-CB 3.33Å; S45-K49 PolarHBondContact O-N 3.17Å; G46-K49 CarbonylContact O-C 3.47Å; G46-K49 WeakPolarHBondContact O-CB 3.45Å; G46-K49 PolarHBondContact O-N 3.05Å; F47-K49 VanDerWaalsContact C-N 3.3Å; F47-K49 PolarHBondContact O-N 3.45Å; K49-K52 PolarHBondContact O-N 2.85Å; K49-K53 WeakPolarHBondContact O-CB 3.35Å; K49-K53 PolarHBondContact O-N 3.37Å
50	G	96.1	Very high	93.5	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-62.2	-44	173.9	0	0	0	0	0	112.1	G46 F47 K52 K53 T54	G46-G50 PolarHBondContact O-N 3.05Å; F47-G50 PolarHBondContact O-N 3.17Å; F47-G50 VanDerWaalsContact O-N 3.17Å; G50-K52 VanDerWaalsContact C-N 3.33Å; G50-K52 PolarHBondContact O-N 2.93Å; G50-K53 PolarHBondContact O-N 3.15Å; G50-K53 VanDerWaalsContact O-N 3.14Å; G50-T54 WeakPolarHBondContact O-CG2 3.36Å; G50-T54 PolarHBondContact O-N 3.29Å; G50-T54 PolarHBondContact O-OG1 3.34Å
51	M	95.9	Very high	92.2	Very high	26 Å²	26	65 Å²	65	13%	0.128	36%	0.362	C	S	.	.	H	α-helix	trans	-52.2	-49	173.5	-82.5	-74.5	-47.3	0	0	112.2	F47 L48 T54 E55 R80 I84 F122 R126	F47-M51 HydrophobicContact CD1-CG 3.99Å; F47-M51 HydrophobicContact CE1-CG 3.91Å; F47-M51 HydrophobicContact CE1-SD 4.24Å; F47-M51 WeakPolarHBondContact O-CG 3.26Å; F47-M51 PolarHBondContact O-N 2.96Å; L48-M51 WeakPolarHBondContact O-CB 3.48Å; M51-T54 PolarHBondContact O-OG1 3.14Å; M51-E55 PolarHBondContact O-N 3.36Å; M51-R80 PolarHBondContact O-NH2 3.15Å; M51-I84 HydrophobicContact CG-CD1 4Å; M51-I84 HydrophobicContact CG-CG2 4.24Å; M51-I84 HydrophobicContact SD-CD1 3.5Å; M51-I84 VanDerWaalsContact SD-CD1 3.5Å; M51-F122 HydrophobicContact CE-CE2 4.47Å; M51-F122 HydrophobicContact SD-CD2 3.52Å; M51-F122 VanDerWaalsContact SD-CD2 3.52Å; M51-F122 HydrophobicContact SD-CE2 3.45Å; M51-F122 WeakPolarHBondContact SD-CE2 3.27Å; M51-R126 VanDerWaalsContact CE-CD 3.48Å
52	K	96.3	Very high	91	Very high	160 Å²	160	64.2 Å²	64.2	70%	0.696	38%	0.378	S	S	*	.	H	α-helix	trans	-67.2	-40	177.7	-175	176.2	-177.5	175.6	0	112	L48 K49 G50 T54 E55	L48-K52 PolarHBondContact O-N 3.41Å; K49-K52 PolarHBondContact O-N 2.85Å; G50-K52 VanDerWaalsContact C-N 3.33Å; G50-K52 PolarHBondContact O-N 2.93Å; K52-T54 VanDerWaalsContact C-N 3.32Å; K52-T54 PolarHBondContact O-N 2.99Å; K52-E55 WeakPolarHBondContact O-CB 3.42Å; K52-E55 PolarHBondContact O-N 3.25Å
53	K	95.8	Very high	90.1	Very high	152 Å²	152	68 Å²	68	66%	0.661	40%	0.399	S	S	*	.	H	α-helix	trans	-68.2	-31.4	-178.9	-176	171.9	161.2	-151.7	0	112.7	K49 G50 M87	K49-K53 WeakPolarHBondContact O-CB 3.35Å; K49-K53 PolarHBondContact O-N 3.37Å; G50-K53 PolarHBondContact O-N 3.15Å; G50-K53 VanDerWaalsContact O-N 3.14Å; K53-M87 HydrophobicContact CB-SD 4.47Å; K53-M87 HydrophobicContact CD-SD 3.6Å; K53-M87 HydrophobicContact CG-SD 4.32Å; K53-M87 PolarHBondContact NZ-SD 2.92Å; K53-M87 VanDerWaalsContact NZ-SD 3.41Å
54	T	95	Very high	88.9	Confident	2 Å²	2	71.2 Å²	71.2	1%	0.012	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	1.9	178.1	58.7	0	0	0	0	113.5	G50 M51 K52 A56 S57 R80 E83 I84 M87	G50-T54 WeakPolarHBondContact O-CG2 3.36Å; G50-T54 PolarHBondContact O-N 3.29Å; G50-T54 PolarHBondContact O-OG1 3.34Å; M51-T54 PolarHBondContact O-OG1 3.14Å; K52-T54 VanDerWaalsContact C-N 3.32Å; K52-T54 PolarHBondContact O-N 2.99Å; T54-A56 VanDerWaalsContact C-N 3.29Å; T54-A56 PolarHBondContact O-N 2.95Å; T54-S57 WeakPolarHBondContact O-CB 3.39Å; T54-S57 PolarHBondContact O-N 3.25Å; T54-S57 VanDerWaalsContact O-N 3.14Å; T54-R80 PolarHBondContact OG1-NE 3.47Å; T54-R80 VanDerWaalsContact OG1-NE 3.08Å; T54-E83 HydrophobicContact CG2-CB 4.24Å; T54-I84 HydrophobicContact CG2-CG1 4.1Å; T54-M87 HydrophobicContact CG2-CE 3.56Å
55	E	93.1	Very high	87.8	Confident	143 Å²	143	76 Å²	76	67%	0.668	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-36.2	-173.4	-173.6	172.7	-156.2	0	0	113.4	M51 K52	M51-E55 PolarHBondContact O-N 3.36Å; K52-E55 WeakPolarHBondContact O-CB 3.42Å; K52-E55 PolarHBondContact O-N 3.25Å
56	A	90.2	Very high	87.1	Confident	95 Å²	95	78.9 Å²	78.9	79%	0.785	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	7.9	178.3	0	0	0	0	0	113.7	T54	T54-A56 VanDerWaalsContact C-N 3.29Å; T54-A56 PolarHBondContact O-N 2.95Å
57	S	88.4	Confident	86.2	Confident	48 Å²	48	78.8 Å²	78.8	34%	0.336	44%	0.441	S	S	.	.			trans	-77.7	163.4	179.1	-67.2	0	0	0	0	111.6	T54 Y74	T54-S57 WeakPolarHBondContact O-CB 3.39Å; T54-S57 PolarHBondContact O-N 3.25Å; T54-S57 VanDerWaalsContact O-N 3.14Å; S57-Y74 VanDerWaalsContact CB-CE1 3.4Å; S57-Y74 WeakPolarHBondContact CB-OH 3.41Å; S57-Y74 WeakPolarHBondContact O-CD1 3.36Å
58	H	85.4	Confident	85	Confident	127 Å²	127	82.5 Å²	82.5	59%	0.588	46%	0.46	S	S	*	.			trans	-139.3	167.1	176.1	45.3	-86.7	0	0	0	108.4	A60	H58-A60 PolarHBondContact O-N 3.08Å
59	F	84.4	Confident	84.2	Confident	20 Å²	20	87 Å²	87	9%	0.088	48%	0.477	C	S	.	.			trans	-57.5	137.2	171.8	-63.5	-75.3	0	0	0	109.5	G61 E67 L71 G72 Y74	F59-G61 PolarHBondContact O-N 3.46Å; F59-E67 VanDerWaalsContact CB-CD 3.46Å; F59-E67 HydrophobicContact CB-CG 4.43Å; F59-E67 VanDerWaalsContact CB-OE1 3.22Å; F59-E67 WeakPolarHBondContact CB-OE1 3.46Å; F59-E67 HydrophobicContact CD2-CB 3.84Å; F59-E67 HydrophobicContact CD2-CG 4.42Å; F59-E67 HydrophobicContact CE2-CB 4.42Å; F59-L71 HydrophobicContact CD1-CD1 4.22Å; F59-L71 HydrophobicContact CD2-CD1 4.3Å; F59-L71 HydrophobicContact CE1-CB 4.42Å; F59-L71 HydrophobicContact CE1-CD1 4.24Å; F59-L71 HydrophobicContact CE2-CB 3.93Å; F59-L71 HydrophobicContact CE2-CD1 4.31Å; F59-L71 HydrophobicContact CG-CD1 4.25Å; F59-L71 HydrophobicContact CZ-CB 3.78Å; F59-L71 HydrophobicContact CZ-CD1 4.27Å; F59-G72 WeakPolarHBondContact CE2-O 3.34Å; F59-Y74 AromaticContact CD1-CD2 3.99Å; F59-Y74 HydrophobicContact CD1-CD2 3.99Å; F59-Y74 HydrophobicContact CD2-CD2 4.43Å; F59-Y74 HydrophobicContact CE1-CD2 4.15Å; F59-Y74 HydrophobicContact CG-CD2 4.14Å; F59-Y74 HydrophobicContact CZ-CD2 4.45Å
60	A	77.8	Confident	83.5	Confident	113 Å²	113	85.5 Å²	85.5	93%	0.934	47%	0.472	S	S	*	.	S	Bend	trans	-73.4	21.9	-174.1	0	0	0	0	0	114	H58	H58-A60 PolarHBondContact O-N 3.08Å
61	G	69.7	Low	82.6	Confident	53 Å²	53	90 Å²	90	55%	0.546	50%	0.495	S	S	.	.	S	Bend	trans	-139.4	43.9	-150.6	0	0	0	0	0	117.1	F59 E67	F59-G61 PolarHBondContact O-N 3.46Å; G61-E67 WeakPolarHBondContact CA-OE1 3.48Å; G61-E67 PolarHBondContact N-OE1 2.97Å
62	G	70.7	Confident	81.9	Confident	62 Å²	62	90.2 Å²	90.2	64%	0.639	50%	0.504	S	S	*	.	S	Bend	trans	100.1	-146.2	165.9	0	0	0	0	0	114.7	T64	G62-T64 PolarHBondContact O-N 3.04Å; G62-T64 VanDerWaalsContact O-N 3.14Å
63	N	74.1	Confident	81.5	Confident	112 Å²	112	89.1 Å²	89.1	60%	0.599	50%	0.499	S	S	*	.			trans	-67.5	111.3	-167.8	-176.2	12.8	0	0	0	111.7	D65 W66 E67	N63-D65 PolarHBondContact O-N 2.97Å; N63-D65 VanDerWaalsContact O-N 3.08Å; N63-D65 PolarHBondContact OD1-N 3.49Å; N63-W66 WeakPolarHBondContact O-CB 3.01Å; N63-W66 PolarHBondContact O-N 3.19Å; N63-E67 PolarHBondContact O-N 3.24Å
64	T	73.2	Confident	81.2	Confident	68 Å²	68	82.5 Å²	82.5	42%	0.417	47%	0.47	S	S	.	.	H	α-helix	trans	-50.5	-35.3	-179.7	-47.2	0	0	0	0	112.9	G62 W66 E67 D68	G62-T64 PolarHBondContact O-N 3.04Å; G62-T64 VanDerWaalsContact O-N 3.14Å; T64-W66 VanDerWaalsContact C-N 3.33Å; T64-W66 PolarHBondContact O-N 3.31Å; T64-E67 PolarHBondContact O-N 2.96Å; T64-D68 WeakPolarHBondContact O-CB 3.45Å; T64-D68 PolarHBondContact O-N 3.49Å
65	D	74.7	Confident	80.9	Confident	105 Å²	105	84.4 Å²	84.4	56%	0.561	49%	0.486	S	S	*	.	H	α-helix	trans	-64.8	-34.9	177.9	-79.4	-3.4	0	0	0	113.5	N63 K69	N63-D65 PolarHBondContact O-N 2.97Å; N63-D65 VanDerWaalsContact O-N 3.08Å; N63-D65 PolarHBondContact OD1-N 3.49Å; D65-K69 WeakPolarHBondContact O-CD 3.45Å; D65-K69 VanDerWaalsContact O-CG 3.31Å; D65-K69 WeakPolarHBondContact O-CG 3.22Å
66	W	80.9	Confident	80.7	Confident	139 Å²	139	83.2 Å²	83.2	53%	0.527	48%	0.481	S	S	.	.	H	α-helix	trans	-73.2	-43.9	175.8	-178.6	92.6	0	0	0	109.5	N63 T64 K69 H70 L71	N63-W66 WeakPolarHBondContact O-CB 3.01Å; N63-W66 PolarHBondContact O-N 3.19Å; T64-W66 VanDerWaalsContact C-N 3.33Å; T64-W66 PolarHBondContact O-N 3.31Å; W66-K69 PolarHBondContact O-N 3.07Å; W66-H70 AromaticContact CD1-CE1 3.37Å; W66-H70 AromaticContact CD1-ND1 3.57Å; W66-H70 AromaticContact CD2-ND1 3.74Å; W66-H70 AromaticContact CE2-CE1 3.84Å; W66-H70 AromaticContact CE2-CG 3.82Å; W66-H70 AromaticContact CE2-ND1 3.61Å; W66-H70 AromaticContact CG-CE1 3.98Å; W66-H70 AromaticContact CG-ND1 3.72Å; W66-H70 HydrophobicContact CH2-CB 4.29Å; W66-H70 HydrophobicContact CZ2-CB 4.25Å; W66-H70 HydrophobicContact CZ3-CB 4.46Å; W66-H70 AromaticContact NE1-CE1 3.26Å; W66-H70 PolarHBondContact NE1-CE1 3.38Å; W66-H70 VanDerWaalsContact NE1-CE1 3.26Å; W66-H70 AromaticContact NE1-ND1 3.49Å; W66-H70 PolarHBondContact NE1-ND1 3.38Å; W66-H70 AromaticContact NE1-NE2 3.66Å; W66-H70 PolarHBondContact O-N 2.97Å; W66-H70 VanDerWaalsContact O-N 3.09Å; W66-H70 PolarHBondContact O-ND1 3.06Å; W66-L71 HydrophobicContact CZ3-CD1 4.44Å
67	E	77.6	Confident	80.8	Confident	5 Å²	5	79.3 Å²	79.3	2%	0.023	45%	0.448	C	S	.	.	H	α-helix	trans	-62.3	-48.6	-179.7	-62.6	175.2	144.9	0	0	111.4	F59 G61 N63 T64 K69 H70 L71 G72	F59-E67 VanDerWaalsContact CB-CD 3.46Å; F59-E67 HydrophobicContact CB-CG 4.43Å; F59-E67 VanDerWaalsContact CB-OE1 3.22Å; F59-E67 WeakPolarHBondContact CB-OE1 3.46Å; F59-E67 HydrophobicContact CD2-CB 3.84Å; F59-E67 HydrophobicContact CD2-CG 4.42Å; F59-E67 HydrophobicContact CE2-CB 4.42Å; G61-E67 WeakPolarHBondContact CA-OE1 3.48Å; G61-E67 PolarHBondContact N-OE1 2.97Å; N63-E67 PolarHBondContact O-N 3.24Å; T64-E67 PolarHBondContact O-N 2.96Å; E67-K69 PolarHBondContact O-N 3.45Å; E67-H70 PolarHBondContact O-N 2.97Å; E67-H70 VanDerWaalsContact O-N 3.12Å; E67-L71 HydrophobicContact CB-CD1 4.27Å; E67-L71 HydrophobicContact CG-CD1 4.35Å; E67-L71 WeakPolarHBondContact O-CA 3.03Å; E67-L71 WeakPolarHBondContact O-CB 3.05Å; E67-L71 PolarHBondContact O-N 3.46Å; E67-G72 PolarHBondContact O-N 3.4Å
68	D	73.7	Confident	81.1	Confident	77 Å²	77	81 Å²	81	41%	0.412	45%	0.45	S	S	.	.	H	α-helix	trans	-61	-32.9	179.2	-80.8	-12.1	0	0	0	112.6	T64 G72	T64-D68 WeakPolarHBondContact O-CB 3.45Å; T64-D68 PolarHBondContact O-N 3.49Å; D68-G72 WeakPolarHBondContact O-CA 3.27Å; D68-G72 PolarHBondContact O-N 3.29Å
69	K	79.2	Confident	81.5	Confident	168 Å²	168	78.3 Å²	78.3	73%	0.73	44%	0.443	S	S	*	.	H	α-helix	trans	-76.3	-29.4	177.8	-75.9	176.4	-174.9	169.6	0	113.8	D65 W66 E67	D65-K69 WeakPolarHBondContact O-CD 3.45Å; D65-K69 VanDerWaalsContact O-CG 3.31Å; D65-K69 WeakPolarHBondContact O-CG 3.22Å; W66-K69 PolarHBondContact O-N 3.07Å; E67-K69 PolarHBondContact O-N 3.45Å
70	H	81.5	Confident	82	Confident	120 Å²	120	78 Å²	78	56%	0.556	44%	0.441	S	S	*	.	H	α-helix	trans	-110.5	-32.1	-171	-64.1	82.6	0	0	0	113.5	W66 E67	W66-H70 AromaticContact CD1-CE1 3.37Å; W66-H70 AromaticContact CD1-ND1 3.57Å; W66-H70 AromaticContact CD2-ND1 3.74Å; W66-H70 AromaticContact CE2-CE1 3.84Å; W66-H70 AromaticContact CE2-CG 3.82Å; W66-H70 AromaticContact CE2-ND1 3.61Å; W66-H70 AromaticContact CG-CE1 3.98Å; W66-H70 AromaticContact CG-ND1 3.72Å; W66-H70 HydrophobicContact CH2-CB 4.29Å; W66-H70 HydrophobicContact CZ2-CB 4.25Å; W66-H70 HydrophobicContact CZ3-CB 4.46Å; W66-H70 AromaticContact NE1-CE1 3.26Å; W66-H70 PolarHBondContact NE1-CE1 3.38Å; W66-H70 VanDerWaalsContact NE1-CE1 3.26Å; W66-H70 AromaticContact NE1-ND1 3.49Å; W66-H70 PolarHBondContact NE1-ND1 3.38Å; W66-H70 AromaticContact NE1-NE2 3.66Å; W66-H70 PolarHBondContact O-N 2.97Å; W66-H70 VanDerWaalsContact O-N 3.09Å; W66-H70 PolarHBondContact O-ND1 3.06Å; E67-H70 PolarHBondContact O-N 2.97Å; E67-H70 VanDerWaalsContact O-N 3.12Å
71	L	76.6	Confident	82.9	Confident	95 Å²	95	72.7 Å²	72.7	50%	0.497	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-12.5	-177.3	-55.6	178	0	0	0	112.6	F59 W66 E67	F59-L71 HydrophobicContact CD1-CD1 4.22Å; F59-L71 HydrophobicContact CD2-CD1 4.3Å; F59-L71 HydrophobicContact CE1-CB 4.42Å; F59-L71 HydrophobicContact CE1-CD1 4.24Å; F59-L71 HydrophobicContact CE2-CB 3.93Å; F59-L71 HydrophobicContact CE2-CD1 4.31Å; F59-L71 HydrophobicContact CG-CD1 4.25Å; F59-L71 HydrophobicContact CZ-CB 3.78Å; F59-L71 HydrophobicContact CZ-CD1 4.27Å; W66-L71 HydrophobicContact CZ3-CD1 4.44Å; E67-L71 HydrophobicContact CB-CD1 4.27Å; E67-L71 HydrophobicContact CG-CD1 4.35Å; E67-L71 WeakPolarHBondContact O-CA 3.03Å; E67-L71 WeakPolarHBondContact O-CB 3.05Å; E67-L71 PolarHBondContact O-N 3.46Å
72	G	82.4	Confident	84.2	Confident	30 Å²	30	73.2 Å²	73.2	31%	0.309	39%	0.386	S	S	.	.			trans	77.5	-170.8	-171.3	0	0	0	0	0	111.8	F59 E67 D68	F59-G72 WeakPolarHBondContact CE2-O 3.34Å; E67-G72 PolarHBondContact O-N 3.4Å; D68-G72 WeakPolarHBondContact O-CA 3.27Å; D68-G72 PolarHBondContact O-N 3.29Å
73	K	86.8	Confident	85.4	Confident	137 Å²	137	73.3 Å²	73.3	60%	0.596	37%	0.37	S	S	*	.			trans	-75.3	129.9	-177.1	-65.6	-180	180	176.9	0	110.6	A75 E76 S77	K73-A75 PolarHBondContact O-N 3.23Å; K73-E76 PolarHBondContact O-N 3.06Å; K73-S77 PolarHBondContact O-N 3.05Å
74	Y	89.8	Confident	86.5	Confident	14 Å²	14	68 Å²	68	6%	0.055	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-49.5	-38	172.6	176.8	-94.4	0	0	0	112.3	S57 F59 E76 S77 T79 R80 E83	S57-Y74 VanDerWaalsContact CB-CE1 3.4Å; S57-Y74 WeakPolarHBondContact CB-OH 3.41Å; S57-Y74 WeakPolarHBondContact O-CD1 3.36Å; F59-Y74 AromaticContact CD1-CD2 3.99Å; F59-Y74 HydrophobicContact CD1-CD2 3.99Å; F59-Y74 HydrophobicContact CD2-CD2 4.43Å; F59-Y74 HydrophobicContact CE1-CD2 4.15Å; F59-Y74 HydrophobicContact CG-CD2 4.14Å; F59-Y74 HydrophobicContact CZ-CD2 4.45Å; Y74-E76 PolarHBondContact O-N 2.91Å; Y74-S77 WeakPolarHBondContact O-CB 3.45Å; Y74-S77 PolarHBondContact O-N 3.37Å; Y74-S77 PolarHBondContact O-OG 2.83Å; Y74-T79 HydrophobicContact CE2-CG2 4.47Å; Y74-R80 HydrophobicContact CD1-CB 4.27Å; Y74-R80 HydrophobicContact CD1-CG 4.3Å; Y74-R80 HydrophobicContact CD2-CB 4.45Å; Y74-R80 HydrophobicContact CE1-CB 3.82Å; Y74-R80 HydrophobicContact CE1-CG 3.64Å; Y74-R80 HydrophobicContact CE2-CB 4.06Å; Y74-R80 VanDerWaalsContact O-CB 3.23Å; Y74-R80 WeakPolarHBondContact O-CB 3.25Å; Y74-R80 WeakPolarHBondContact O-CD 3.35Å; Y74-E83 PolarHBondContact OH-OE1 3.49Å; Y74-E83 PolarHBondContact OH-OE2 3.01Å
75	A	89.4	Confident	87.6	Confident	42 Å²	42	65.7 Å²	65.7	35%	0.347	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-56.5	-24.1	-178.9	0	0	0	0	0	115.3	K73 R80	K73-A75 PolarHBondContact O-N 3.23Å; A75-R80 PolarHBondContact O-NH1 3.25Å
76	E	88.1	Confident	88.6	Confident	117 Å²	117	67.8 Å²	67.8	55%	0.547	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-120.7	7.9	-179	-64.2	172.5	-177.3	0	0	112	K73 Y74 H123	K73-E76 PolarHBondContact O-N 3.06Å; Y74-E76 PolarHBondContact O-N 2.91Å; E76-H123 PolarHBondContact O-CE1 3.41Å; E76-H123 PolarHBondContact O-ND1 2.04Å
77	S	93.1	Very high	89.2	Confident	13 Å²	13	63.5 Å²	63.5	9%	0.091	32%	0.32	C	S	.	.			trans	-79.1	152.9	-175.4	71.8	0	0	0	0	112.9	K73 Y74 T79 R80 F81	K73-S77 PolarHBondContact O-N 3.05Å; Y74-S77 WeakPolarHBondContact O-CB 3.45Å; Y74-S77 PolarHBondContact O-N 3.37Å; Y74-S77 PolarHBondContact O-OG 2.83Å; S77-T79 VanDerWaalsContact C-N 3.27Å; S77-T79 PolarHBondContact O-N 3.11Å; S77-R80 PolarHBondContact O-N 3.01Å; S77-R80 PolarHBondContact OG-N 3.11Å; S77-F81 PolarHBondContact O-N 2.9Å
78	E	93.7	Very high	90.1	Very high	85 Å²	85	63.3 Å²	63.3	40%	0.397	32%	0.319	S	S	.	.	H	α-helix	trans	-59.3	-38.2	171.3	-175.5	58.3	-159.1	0	0	111.8	R80 F81 I82 H123	E78-R80 VanDerWaalsContact C-N 3.32Å; E78-R80 PolarHBondContact O-N 3.26Å; E78-F81 WeakPolarHBondContact O-CB 3.27Å; E78-F81 PolarHBondContact O-N 3.02Å; E78-I82 HydrophobicContact CG-CG1 4.47Å; E78-I82 WeakPolarHBondContact O-CG1 3.31Å; E78-I82 PolarHBondContact O-N 3.17Å; E78-H123 IonicContact OE2-NE2 3.06Å
79	T	93.5	Very high	91.2	Very high	70 Å²	70	60.2 Å²	60.2	43%	0.429	30%	0.303	S	S	.	.	H	α-helix	trans	-57	-46.3	176.8	-54.3	0	0	0	0	111.6	Y74 S77 F81 I82 E83	Y74-T79 HydrophobicContact CE2-CG2 4.47Å; S77-T79 VanDerWaalsContact C-N 3.27Å; S77-T79 PolarHBondContact O-N 3.11Å; T79-F81 VanDerWaalsContact C-N 3.32Å; T79-F81 PolarHBondContact O-N 3.33Å; T79-I82 PolarHBondContact O-N 2.81Å; T79-E83 WeakPolarHBondContact O-CG 3.41Å; T79-E83 PolarHBondContact O-N 3.48Å
80	R	95.3	Very high	91.6	Very high	14 Å²	14	54.1 Å²	54.1	5%	0.053	28%	0.281	C	S	.	.	H	α-helix	trans	-64	-39	176.4	-174.6	-178.8	178.3	-160.9	5.5	111.4	M51 T54 Y74 A75 S77 E78 E83 I84 F122	M51-R80 PolarHBondContact O-NH2 3.15Å; T54-R80 PolarHBondContact OG1-NE 3.47Å; T54-R80 VanDerWaalsContact OG1-NE 3.08Å; Y74-R80 HydrophobicContact CD1-CB 4.27Å; Y74-R80 HydrophobicContact CD1-CG 4.3Å; Y74-R80 HydrophobicContact CD2-CB 4.45Å; Y74-R80 HydrophobicContact CE1-CB 3.82Å; Y74-R80 HydrophobicContact CE1-CG 3.64Å; Y74-R80 HydrophobicContact CE2-CB 4.06Å; Y74-R80 VanDerWaalsContact O-CB 3.23Å; Y74-R80 WeakPolarHBondContact O-CB 3.25Å; Y74-R80 WeakPolarHBondContact O-CD 3.35Å; A75-R80 PolarHBondContact O-NH1 3.25Å; S77-R80 PolarHBondContact O-N 3.01Å; S77-R80 PolarHBondContact OG-N 3.11Å; E78-R80 VanDerWaalsContact C-N 3.32Å; E78-R80 PolarHBondContact O-N 3.26Å; R80-E83 PolarHBondContact O-N 2.99Å; R80-I84 HydrophobicContact CG-CD1 3.81Å; R80-I84 HydrophobicContact CG-CG1 4.45Å; R80-I84 VanDerWaalsContact O-CD1 3.3Å; R80-I84 WeakPolarHBondContact O-CD1 3.21Å; R80-I84 WeakPolarHBondContact O-CG1 3.46Å; R80-I84 PolarHBondContact O-N 3.33Å; R80-F122 HydrophobicContact CB-CZ 4.36Å; R80-F122 HydrophobicContact CG-CZ 4.24Å
81	F	97	Very high	91.6	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.5	-48.9	177.5	175.1	-115.4	0	0	0	111.9	F47 S77 E78 T79 E83 I84 L85 E115 L118 E119 F122	F47-F81 HydrophobicContact CE2-CD2 4.26Å; F47-F81 AromaticContact CE2-CE2 3.85Å; F47-F81 HydrophobicContact CE2-CE2 3.85Å; F47-F81 HydrophobicContact CZ-CD2 4.04Å; F47-F81 AromaticContact CZ-CE2 3.88Å; F47-F81 HydrophobicContact CZ-CE2 3.88Å; S77-F81 PolarHBondContact O-N 2.9Å; E78-F81 WeakPolarHBondContact O-CB 3.27Å; E78-F81 PolarHBondContact O-N 3.02Å; T79-F81 VanDerWaalsContact C-N 3.32Å; T79-F81 PolarHBondContact O-N 3.33Å; F81-E83 PolarHBondContact O-N 3.07Å; F81-I84 WeakPolarHBondContact O-CB 3.44Å; F81-I84 PolarHBondContact O-N 2.96Å; F81-I84 VanDerWaalsContact O-N 3.15Å; F81-L85 HydrophobicContact CD1-CD1 3.97Å; F81-L85 HydrophobicContact CD2-CG 4.39Å; F81-L85 HydrophobicContact CE1-CD1 3.36Å; F81-L85 HydrophobicContact CE1-CG 4.12Å; F81-L85 HydrophobicContact CE2-CD1 4.08Å; F81-L85 HydrophobicContact CE2-CD2 4.08Å; F81-L85 HydrophobicContact CE2-CG 3.94Å; F81-L85 HydrophobicContact CZ-CD1 3.42Å; F81-L85 VanDerWaalsContact CZ-CD1 3.42Å; F81-L85 HydrophobicContact CZ-CD2 3.97Å; F81-L85 HydrophobicContact CZ-CG 3.79Å; F81-L85 PolarHBondContact O-N 3.4Å; F81-E115 HydrophobicContact CE1-CG 4.45Å; F81-L118 HydrophobicContact CE2-CB 4.05Å; F81-L118 HydrophobicContact CZ-CB 4.13Å; F81-E119 HydrophobicContact CD1-CG 4.39Å; F81-E119 HydrophobicContact CE1-CB 3.72Å; F81-E119 HydrophobicContact CE1-CG 3.98Å; F81-E119 HydrophobicContact CE2-CB 4.16Å; F81-E119 HydrophobicContact CZ-CB 3.5Å; F81-E119 HydrophobicContact CZ-CG 4.21Å; F81-E119 VanDerWaalsContact CZ-N 3.33Å; F81-F122 HydrophobicContact CB-CD1 4.04Å; F81-F122 HydrophobicContact CB-CE1 3.94Å; F81-F122 HydrophobicContact CB-CZ 4.34Å; F81-F122 HydrophobicContact CD2-CB 3.91Å; F81-F122 HydrophobicContact CD2-CD1 4.09Å; F81-F122 HydrophobicContact CD2-CD2 4.31Å; F81-F122 AromaticContact CD2-CG 3.86Å; F81-F122 HydrophobicContact CD2-CG 3.86Å; F81-F122 HydrophobicContact CE2-CB 4.23Å; F81-F122 HydrophobicContact CG-CD1 4.38Å
82	I	96.5	Very high	91.7	Very high	64 Å²	64	60.7 Å²	60.7	33%	0.328	31%	0.306	S	S	.	.	H	α-helix	trans	-60.9	-45.6	177.1	-61.3	-56.8	0	0	0	111.7	E78 T79 I84 L85 E86	E78-I82 HydrophobicContact CG-CG1 4.47Å; E78-I82 WeakPolarHBondContact O-CG1 3.31Å; E78-I82 PolarHBondContact O-N 3.17Å; T79-I82 PolarHBondContact O-N 2.81Å; I82-I84 PolarHBondContact O-N 3.4Å; I82-L85 HydrophobicContact CD1-CD1 4.22Å; I82-L85 WeakPolarHBondContact O-CB 3.22Å; I82-L85 PolarHBondContact O-N 3.18Å; I82-L85 VanDerWaalsContact O-N 3.13Å; I82-E86 WeakPolarHBondContact O-CG 3.4Å; I82-E86 PolarHBondContact O-N 2.92Å
83	E	95.7	Very high	91.4	Very high	64 Å²	64	60.6 Å²	60.6	30%	0.299	30%	0.297	S	S	.	.	H	α-helix	trans	-56.8	-39.9	175.4	-75.3	-178.1	-131.3	0	0	111.9	T54 Y74 T79 R80 F81 M87	T54-E83 HydrophobicContact CG2-CB 4.24Å; Y74-E83 PolarHBondContact OH-OE1 3.49Å; Y74-E83 PolarHBondContact OH-OE2 3.01Å; T79-E83 WeakPolarHBondContact O-CG 3.41Å; T79-E83 PolarHBondContact O-N 3.48Å; R80-E83 PolarHBondContact O-N 2.99Å; F81-E83 PolarHBondContact O-N 3.07Å; E83-M87 HydrophobicContact CB-CE 4.41Å; E83-M87 WeakPolarHBondContact O-CE 3.4Å
84	I	97.2	Very high	90.5	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-68.4	-42.6	177.6	-67	161.9	0	0	0	111.2	F47 M51 T54 R80 F81 I82 E86 M87 A88 F122	F47-I84 HydrophobicContact CB-CG2 4.5Å; F47-I84 HydrophobicContact CD1-CG2 3.85Å; F47-I84 HydrophobicContact CD2-CG2 3.64Å; F47-I84 HydrophobicContact CE1-CG2 3.85Å; F47-I84 HydrophobicContact CE2-CG2 3.64Å; F47-I84 HydrophobicContact CG-CG2 3.74Å; F47-I84 HydrophobicContact CZ-CG2 3.75Å; F47-I84 WeakPolarHBondContact O-CG2 3.45Å; M51-I84 HydrophobicContact CG-CD1 4Å; M51-I84 HydrophobicContact CG-CG2 4.24Å; M51-I84 HydrophobicContact SD-CD1 3.5Å; M51-I84 VanDerWaalsContact SD-CD1 3.5Å; T54-I84 HydrophobicContact CG2-CG1 4.1Å; R80-I84 HydrophobicContact CG-CD1 3.81Å; R80-I84 HydrophobicContact CG-CG1 4.45Å; R80-I84 VanDerWaalsContact O-CD1 3.3Å; R80-I84 WeakPolarHBondContact O-CD1 3.21Å; R80-I84 WeakPolarHBondContact O-CG1 3.46Å; R80-I84 PolarHBondContact O-N 3.33Å; F81-I84 WeakPolarHBondContact O-CB 3.44Å; F81-I84 PolarHBondContact O-N 2.96Å; F81-I84 VanDerWaalsContact O-N 3.15Å; I82-I84 PolarHBondContact O-N 3.4Å; I84-E86 VanDerWaalsContact C-N 3.32Å; I84-E86 PolarHBondContact O-N 3.08Å; I84-M87 CarbonylContact O-C 3.56Å; I84-M87 PolarHBondContact O-N 3.17Å; I84-A88 PolarHBondContact O-N 2.81Å; I84-A88 VanDerWaalsContact O-N 3.17Å; I84-F122 HydrophobicContact CD1-CD2 4.16Å; I84-F122 HydrophobicContact CD1-CE2 3.48Å; I84-F122 VanDerWaalsContact CD1-CE2 3.48Å; I84-F122 HydrophobicContact CD1-CZ 4.28Å
85	L	97.2	Very high	89.2	Confident	20 Å²	20	68.9 Å²	68.9	11%	0.105	34%	0.342	C	S	.	.	H	α-helix	trans	-59.6	-41.5	177.4	-76.5	178.4	0	0	0	111.9	F47 F81 I82 M87 A88 V111 E115 L118	F47-L85 HydrophobicContact CD2-CD2 4.11Å; F47-L85 HydrophobicContact CE2-CD2 3.77Å; F47-L85 HydrophobicContact CE2-CG 4.31Å; F81-L85 HydrophobicContact CD1-CD1 3.97Å; F81-L85 HydrophobicContact CD2-CG 4.39Å; F81-L85 HydrophobicContact CE1-CD1 3.36Å; F81-L85 HydrophobicContact CE1-CG 4.12Å; F81-L85 HydrophobicContact CE2-CD1 4.08Å; F81-L85 HydrophobicContact CE2-CD2 4.08Å; F81-L85 HydrophobicContact CE2-CG 3.94Å; F81-L85 HydrophobicContact CZ-CD1 3.42Å; F81-L85 VanDerWaalsContact CZ-CD1 3.42Å; F81-L85 HydrophobicContact CZ-CD2 3.97Å; F81-L85 HydrophobicContact CZ-CG 3.79Å; F81-L85 PolarHBondContact O-N 3.4Å; I82-L85 HydrophobicContact CD1-CD1 4.22Å; I82-L85 WeakPolarHBondContact O-CB 3.22Å; I82-L85 PolarHBondContact O-N 3.18Å; I82-L85 VanDerWaalsContact O-N 3.13Å; L85-M87 PolarHBondContact O-N 2.83Å; L85-M87 VanDerWaalsContact O-N 3.17Å; L85-A88 VanDerWaalsContact O-CB 3.26Å; L85-A88 WeakPolarHBondContact O-CB 3.32Å; L85-A88 PolarHBondContact O-N 3.17Å; L85-V111 HydrophobicContact CD2-CG1 3.92Å; L85-E115 HydrophobicContact CD1-CG 4.14Å; L85-L118 HydrophobicContact CD2-CB 4.25Å; L85-L118 HydrophobicContact CD2-CD1 3.64Å
86	E	94.9	Very high	87.9	Confident	149 Å²	149	70.4 Å²	70.4	70%	0.696	34%	0.344	S	S	*	.	H	α-helix	trans	-59.6	-26.2	175.3	-70.9	-178.5	170	0	0	112.7	I82 I84	I82-E86 WeakPolarHBondContact O-CG 3.4Å; I82-E86 PolarHBondContact O-N 2.92Å; I84-E86 VanDerWaalsContact C-N 3.32Å; I84-E86 PolarHBondContact O-N 3.08Å
87	M	94.8	Very high	86.4	Confident	50 Å²	50	71.5 Å²	71.5	25%	0.246	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-2.8	178.5	-67	-175.6	-87.5	0	0	114.1	K53 T54 E83 I84 L85 C89	K53-M87 HydrophobicContact CB-SD 4.47Å; K53-M87 HydrophobicContact CD-SD 3.6Å; K53-M87 HydrophobicContact CG-SD 4.32Å; K53-M87 PolarHBondContact NZ-SD 2.92Å; K53-M87 VanDerWaalsContact NZ-SD 3.41Å; T54-M87 HydrophobicContact CG2-CE 3.56Å; E83-M87 HydrophobicContact CB-CE 4.41Å; E83-M87 WeakPolarHBondContact O-CE 3.4Å; I84-M87 CarbonylContact O-C 3.56Å; I84-M87 PolarHBondContact O-N 3.17Å; L85-M87 PolarHBondContact O-N 2.83Å; L85-M87 VanDerWaalsContact O-N 3.17Å; M87-C89 VanDerWaalsContact C-N 3.25Å; M87-C89 PolarHBondContact O-N 3.14Å
88	A	96.8	Very high	85	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	38%	0.381	C	S	.	.	S	Bend	trans	-65.8	-28	-176.8	0	0	0	0	0	113	G46 F47 I84 L85 V111	G46-A88 WeakPolarHBondContact CA-O 3.38Å; F47-A88 HydrophobicContact CB-CB 4.41Å; I84-A88 PolarHBondContact O-N 2.81Å; I84-A88 VanDerWaalsContact O-N 3.17Å; L85-A88 VanDerWaalsContact O-CB 3.26Å; L85-A88 WeakPolarHBondContact O-CB 3.32Å; L85-A88 PolarHBondContact O-N 3.17Å; A88-V111 HydrophobicContact CB-CG2 3.92Å
89	C	95.5	Very high	84.2	Confident	12 Å²	12	73.8 Å²	73.8	8%	0.081	38%	0.376	C	S	.	.	S	Bend	trans	-110.3	109.7	175.8	-63.7	0	0	0	0	110.2	M87 C107 H108	M87-C89 VanDerWaalsContact C-N 3.25Å; M87-C89 PolarHBondContact O-N 3.14Å; C89-C107 WeakPolarHBondContact CA-SG 3.42Å; C89-C107 HydrophobicContact CB-CB 3.93Å; C89-C107 WeakPolarHBondContact CB-SG 3.44Å; C89-C107 WeakPolarHBondContact SG-CB 3.38Å; C89-C107 CovalentContact SG-SG 2.04Å; C89-C107 PolarHBondContact SG-SG 3.01Å; C89-H108 PolarHBondContact SG-N 3.14Å
90	P	87.8	Confident	83.8	Confident	41 Å²	41	72.9 Å²	72.9	27%	0.266	37%	0.371	S	S	.	.			trans	-76.1	144.7	-176.9	30.9	-34.7	0	0	0	111.9	K92 Y93	P90-K92 PolarHBondContact O-N 3.13Å; P90-Y93 HydrophobicContact CG-CD1 4.26Å; P90-Y93 HydrophobicContact CG-CE1 3.93Å; P90-Y93 WeakPolarHBondContact O-CE2 3.33Å
91	E	80.7	Confident	83.3	Confident	179 Å²	179	80.6 Å²	80.6	84%	0.836	41%	0.405	S	S	*	.	S	Bend	trans	-65.6	-22	173.3	-61.6	-180	169.2	0	0	113.2
92	K	80.4	Confident	82.8	Confident	173 Å²	173	85.4 Å²	85.4	75%	0.752	43%	0.425	S	S	*	.			trans	-123.4	121.9	-179.2	-65.3	-177.4	-176.9	177	0	110	P90	P90-K92 PolarHBondContact O-N 3.13Å
93	Y	75.3	Confident	82.4	Confident	28 Å²	28	82.3 Å²	82.3	11%	0.11	41%	0.41	C	S	.	.			trans	-103.8	120.6	176	-65.6	-91.4	0	0	0	108.9	I42 P90 H95 V100 I103 E104	I42-Y93 HydrophobicContact CB-CE1 4.45Å; I42-Y93 HydrophobicContact CD1-CD1 3.92Å; I42-Y93 HydrophobicContact CD1-CE1 3.7Å; I42-Y93 HydrophobicContact CG1-CD1 4.27Å; I42-Y93 HydrophobicContact CG1-CE1 4.05Å; I42-Y93 HydrophobicContact CG2-CD1 4.48Å; I42-Y93 HydrophobicContact CG2-CE1 3.58Å; P90-Y93 HydrophobicContact CG-CD1 4.26Å; P90-Y93 HydrophobicContact CG-CE1 3.93Å; P90-Y93 WeakPolarHBondContact O-CE2 3.33Å; Y93-H95 PolarHBondContact O-N 3.18Å; Y93-V100 HydrophobicContact CD2-CG1 3.96Å; Y93-V100 HydrophobicContact CE2-CG1 4.47Å; Y93-I103 HydrophobicContact CD1-CG2 4Å; Y93-I103 HydrophobicContact CE1-CG2 3.73Å; Y93-E104 HydrophobicContact CE2-CB 4.22Å
94	D	67.3	Low	82.2	Confident	137 Å²	137	82.9 Å²	82.9	73%	0.733	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	136.7	176.1	-69	-30.7	0	0	0	110	L96	D94-L96 PolarHBondContact O-N 3.21Å
95	H	62.7	Low	82	Confident	189 Å²	189	85.8 Å²	85.8	88%	0.875	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	11.5	171.2	-52.6	-69.4	0	0	0	119	Y93	Y93-H95 PolarHBondContact O-N 3.18Å
96	L	61.6	Low	81.8	Confident	74 Å²	74	87.4 Å²	87.4	39%	0.387	44%	0.442	S	S	.	.			trans	-113.4	103.5	173.6	-76.7	118.8	0	0	0	112.2	D94 V100 I103	D94-L96 PolarHBondContact O-N 3.21Å; L96-V100 VanDerWaalsContact O-CG2 3.23Å; L96-V100 WeakPolarHBondContact O-CG2 3.46Å; L96-I103 HydrophobicContact CB-CD1 4.03Å; L96-I103 HydrophobicContact CD1-CD1 3.79Å; L96-I103 HydrophobicContact CD2-CD1 3.42Å; L96-I103 VanDerWaalsContact CD2-CD1 3.42Å; L96-I103 HydrophobicContact CG-CD1 3.9Å
97	T	57	Low	81.8	Confident	140 Å²	140	80.3 Å²	80.3	86%	0.859	41%	0.409	S	S	*	.	S	Bend	trans	-88.7	-15.4	175	51.3	0	0	0	0	113.1
98	T	65	Low	81.9	Confident	90 Å²	90	82.3 Å²	82.3	55%	0.552	42%	0.418	S	S	*	.	S	Bend	trans	-125.2	143.4	176.8	57.8	0	0	0	0	108.8
99	N	77.3	Confident	81.8	Confident	55 Å²	55	89.2 Å²	89.2	29%	0.294	45%	0.445	S	S	.	.			trans	78.1	5.3	176.9	-52.7	-34.6	0	0	0	119	D32 K101 K102 I103	D32-N99 PolarHBondContact O-ND2 2.97Å; N99-K101 VanDerWaalsContact C-N 3.35Å; N99-K101 PolarHBondContact O-N 3.44Å; N99-K101 VanDerWaalsContact O-N 3.14Å; N99-K102 WeakPolarHBondContact O-CA 3.44Å; N99-K102 WeakPolarHBondContact O-CB 3.47Å; N99-K102 PolarHBondContact O-N 2.95Å; N99-I103 WeakPolarHBondContact O-CG1 3.41Å; N99-I103 PolarHBondContact O-N 2.81Å; N99-I103 VanDerWaalsContact O-N 3.13Å
100	V	83.2	Confident	81.9	Confident	51 Å²	51	89.2 Å²	89.2	31%	0.309	44%	0.444	S	S	.	.	H	α-helix	trans	-42.1	-54.1	-179.3	179.8	0	0	0	0	113.6	Y93 L96 K102 I103 E104	Y93-V100 HydrophobicContact CD2-CG1 3.96Å; Y93-V100 HydrophobicContact CE2-CG1 4.47Å; L96-V100 VanDerWaalsContact O-CG2 3.23Å; L96-V100 WeakPolarHBondContact O-CG2 3.46Å; V100-K102 PolarHBondContact O-N 3.48Å; V100-I103 WeakPolarHBondContact O-CB 3.31Å; V100-I103 PolarHBondContact O-N 3.03Å; V100-E104 PolarHBondContact O-N 3.16Å
101	K	85.7	Confident	82.3	Confident	177 Å²	177	88 Å²	88	77%	0.77	44%	0.436	S	S	*	.	H	α-helix	trans	-57.4	-33.8	179.6	-66.2	-171.8	177	-173	0	113.8	N99 A105	N99-K101 VanDerWaalsContact C-N 3.35Å; N99-K101 PolarHBondContact O-N 3.44Å; N99-K101 VanDerWaalsContact O-N 3.14Å; K101-A105 WeakPolarHBondContact O-CB 3.37Å; K101-A105 PolarHBondContact O-N 3.38Å
102	K	87.2	Confident	83.1	Confident	100 Å²	100	85.8 Å²	85.8	44%	0.435	43%	0.425	S	S	.	.	H	α-helix	trans	-77.5	-30.1	179.7	-160	171.1	173.1	-164	0	111.2	L33 N99 V100 K106	L33-K102 HydrophobicContact CD1-CB 4.31Å; L33-K102 HydrophobicContact CD1-CD 3.16Å; L33-K102 HydrophobicContact CD1-CG 3.57Å; L33-K102 VanDerWaalsContact CD1-NZ 3.31Å; L33-K102 HydrophobicContact CG-CD 4.48Å; N99-K102 WeakPolarHBondContact O-CA 3.44Å; N99-K102 WeakPolarHBondContact O-CB 3.47Å; N99-K102 PolarHBondContact O-N 2.95Å; V100-K102 PolarHBondContact O-N 3.48Å; K102-K106 WeakPolarHBondContact O-CB 3.23Å; K102-K106 VanDerWaalsContact O-CG 3.31Å; K102-K106 WeakPolarHBondContact O-CG 3.43Å; K102-K106 PolarHBondContact O-N 3.34Å
103	I	88	Confident	83.9	Confident	0 Å²	0	82.2 Å²	82.2	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-68.9	-49.1	172	-43.2	-168.6	0	0	0	110	P34 I42 Y93 L96 N99 V100 A105 K106 C107	P34-I103 HydrophobicContact CG-CB 4.18Å; P34-I103 HydrophobicContact CG-CD1 3.82Å; P34-I103 HydrophobicContact CG-CG1 3.53Å; P34-I103 HydrophobicContact CG-CG2 4.09Å; I42-I103 HydrophobicContact CD1-CG2 3.47Å; I42-I103 VanDerWaalsContact CD1-CG2 3.47Å; Y93-I103 HydrophobicContact CD1-CG2 4Å; Y93-I103 HydrophobicContact CE1-CG2 3.73Å; L96-I103 HydrophobicContact CB-CD1 4.03Å; L96-I103 HydrophobicContact CD1-CD1 3.79Å; L96-I103 HydrophobicContact CD2-CD1 3.42Å; L96-I103 VanDerWaalsContact CD2-CD1 3.42Å; L96-I103 HydrophobicContact CG-CD1 3.9Å; N99-I103 WeakPolarHBondContact O-CG1 3.41Å; N99-I103 PolarHBondContact O-N 2.81Å; N99-I103 VanDerWaalsContact O-N 3.13Å; V100-I103 WeakPolarHBondContact O-CB 3.31Å; V100-I103 PolarHBondContact O-N 3.03Å; I103-A105 PolarHBondContact O-N 2.83Å; I103-K106 PolarHBondContact O-N 3.49Å; I103-C107 WeakPolarHBondContact O-CB 3.35Å; I103-C107 PolarHBondContact O-N 3.42Å
104	E	90.9	Very high	84.9	Confident	75 Å²	75	83 Å²	83	35%	0.35	42%	0.416	S	S	.	.	H	α-helix	trans	-54.8	-53.1	177.6	-176.9	-178.1	-171.5	0	0	110.8	Y93 V100 K106 C107 H108	Y93-E104 HydrophobicContact CE2-CB 4.22Å; V100-E104 PolarHBondContact O-N 3.16Å; E104-K106 VanDerWaalsContact C-N 3.32Å; E104-K106 PolarHBondContact O-N 2.95Å; E104-C107 WeakPolarHBondContact O-CB 3.46Å; E104-C107 PolarHBondContact O-N 3.42Å; E104-C107 VanDerWaalsContact O-N 3.07Å; E104-H108 PolarHBondContact O-CD2 3.16Å; E104-H108 PolarHBondContact O-N 2.83Å
105	A	92	Very high	86.4	Confident	61 Å²	61	80.5 Å²	80.5	50%	0.504	40%	0.4	S	S	.	.	H	α-helix	trans	-57.7	-41.7	177	0	0	0	0	0	113	K101 I103 Y109	K101-A105 WeakPolarHBondContact O-CB 3.37Å; K101-A105 PolarHBondContact O-N 3.38Å; I103-A105 PolarHBondContact O-N 2.83Å; A105-Y109 WeakPolarHBondContact O-CB 3.35Å; A105-Y109 PolarHBondContact O-N 3.06Å
106	K	93.6	Very high	88	Confident	54 Å²	54	79.3 Å²	79.3	24%	0.235	40%	0.395	C	S	.	.	H	α-helix	trans	-67.5	-36.3	176	-79.5	-174.8	169.5	-152.5	0	112.9	L33 P34 V39 K102 I103 E104 M110	L33-K106 VanDerWaalsContact CG-NZ 3.26Å; P34-K106 PolarHBondContact O-NZ 2.82Å; V39-K106 HydrophobicContact CG1-CB 4.25Å; V39-K106 HydrophobicContact CG2-CB 3.93Å; V39-K106 HydrophobicContact CG2-CD 4.09Å; K102-K106 WeakPolarHBondContact O-CB 3.23Å; K102-K106 VanDerWaalsContact O-CG 3.31Å; K102-K106 WeakPolarHBondContact O-CG 3.43Å; K102-K106 PolarHBondContact O-N 3.34Å; I103-K106 PolarHBondContact O-N 3.49Å; E104-K106 VanDerWaalsContact C-N 3.32Å; E104-K106 PolarHBondContact O-N 2.95Å; K106-M110 WeakPolarHBondContact O-CB 3.49Å; K106-M110 PolarHBondContact O-N 3.46Å
107	C	95.5	Very high	89.7	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-63.5	-53.3	177.5	-175.8	0	0	0	0	110.1	V39 I42 C89 I103 E104 Y109 M110 V111	V39-C107 HydrophobicContact CG1-CB 4.37Å; I42-C107 HydrophobicContact CG2-CB 4.34Å; I42-C107 VanDerWaalsContact CG2-SG 3.51Å; C89-C107 WeakPolarHBondContact CA-SG 3.42Å; C89-C107 HydrophobicContact CB-CB 3.93Å; C89-C107 WeakPolarHBondContact CB-SG 3.44Å; C89-C107 WeakPolarHBondContact SG-CB 3.38Å; C89-C107 CovalentContact SG-SG 2.04Å; C89-C107 PolarHBondContact SG-SG 3.01Å; I103-C107 WeakPolarHBondContact O-CB 3.35Å; I103-C107 PolarHBondContact O-N 3.42Å; E104-C107 WeakPolarHBondContact O-CB 3.46Å; E104-C107 PolarHBondContact O-N 3.42Å; E104-C107 VanDerWaalsContact O-N 3.07Å; C107-Y109 VanDerWaalsContact C-N 3.32Å; C107-Y109 PolarHBondContact O-N 2.8Å; C107-M110 WeakPolarHBondContact O-CB 3.27Å; C107-M110 PolarHBondContact O-N 2.86Å; C107-V111 WeakPolarHBondContact O-CG2 3.38Å; C107-V111 PolarHBondContact O-N 3.26Å
108	H	95.7	Very high	91.7	Very high	92 Å²	92	71 Å²	71	43%	0.426	35%	0.345	S	S	.	.	H	α-helix	trans	-60	-42.6	178.6	-73.4	-68.8	0	0	0	112.1	C89 E104 M110 V111 E112	C89-H108 PolarHBondContact SG-N 3.14Å; E104-H108 PolarHBondContact O-CD2 3.16Å; E104-H108 PolarHBondContact O-N 2.83Å; H108-M110 VanDerWaalsContact C-N 3.31Å; H108-M110 PolarHBondContact O-N 2.8Å; H108-V111 PolarHBondContact O-N 3.29Å; H108-E112 WeakPolarHBondContact O-CB 3.18Å; H108-E112 PolarHBondContact O-N 2.75Å
109	Y	95.7	Very high	93.3	Very high	145 Å²	145	70.3 Å²	70.3	57%	0.569	34%	0.336	S	S	*	.	H	α-helix	trans	-58.2	-42.2	173.2	178.4	-99.6	0	0	0	112.2	A105 C107 E112 Q113	A105-Y109 WeakPolarHBondContact O-CB 3.35Å; A105-Y109 PolarHBondContact O-N 3.06Å; C107-Y109 VanDerWaalsContact C-N 3.32Å; C107-Y109 PolarHBondContact O-N 2.8Å; Y109-E112 PolarHBondContact O-N 3.16Å; Y109-Q113 HydrophobicContact CD1-CG 4.18Å; Y109-Q113 HydrophobicContact CD2-CG 4.3Å; Y109-Q113 HydrophobicContact CE1-CG 3.76Å; Y109-Q113 HydrophobicContact CE2-CG 3.91Å; Y109-Q113 HydrophobicContact CG-CG 4.44Å; Y109-Q113 WeakPolarHBondContact O-CB 3.43Å; Y109-Q113 VanDerWaalsContact O-CG 3.22Å; Y109-Q113 WeakPolarHBondContact O-CG 3.42Å; Y109-Q113 PolarHBondContact O-N 3.13Å
110	M	96.6	Very high	94.2	Very high	13 Å²	13	72.1 Å²	72.1	6%	0.064	34%	0.341	C	S	.	.	H	α-helix	trans	-67	-40.4	177.5	-177.7	173.6	-69.5	0	0	112.5	V39 C40 V43 K106 C107 H108 Q113 Q114 M141	V39-M110 HydrophobicContact CB-CE 3.76Å; V39-M110 HydrophobicContact CB-SD 4.25Å; V39-M110 HydrophobicContact CG1-CB 3.97Å; V39-M110 HydrophobicContact CG1-CE 3.67Å; V39-M110 HydrophobicContact CG1-SD 3.81Å; C40-M110 WeakPolarHBondContact CA-SD 3.45Å; C40-M110 HydrophobicContact CB-CE 4.26Å; C40-M110 HydrophobicContact CB-SD 3.73Å; V43-M110 HydrophobicContact CG2-CB 4.21Å; V43-M110 HydrophobicContact CG2-CG 4.13Å; V43-M110 HydrophobicContact CG2-SD 4Å; K106-M110 WeakPolarHBondContact O-CB 3.49Å; K106-M110 PolarHBondContact O-N 3.46Å; C107-M110 WeakPolarHBondContact O-CB 3.27Å; C107-M110 PolarHBondContact O-N 2.86Å; H108-M110 VanDerWaalsContact C-N 3.31Å; H108-M110 PolarHBondContact O-N 2.8Å; M110-Q113 PolarHBondContact O-N 3.3Å; M110-Q114 HydrophobicContact CG-CG 4.24Å; M110-Q114 WeakPolarHBondContact O-CB 3.49Å; M110-Q114 VanDerWaalsContact O-CG 3.27Å; M110-Q114 WeakPolarHBondContact O-CG 3.49Å; M110-Q114 PolarHBondContact O-N 2.92Å; M110-M141 HydrophobicContact CE-CE 4.02Å; M110-M141 HydrophobicContact CG-CE 4.12Å; M110-M141 HydrophobicContact SD-CE 4.02Å
111	V	97.6	Very high	94.9	Very high	16 Å²	16	69.9 Å²	69.9	10%	0.097	33%	0.327	C	S	.	.	H	α-helix	trans	-59.4	-49.4	175.7	173.6	0	0	0	0	110.1	V43 L85 A88 C107 H108 Q113 Q114 E115	V43-V111 HydrophobicContact CG1-CG2 4Å; V43-V111 HydrophobicContact CG2-CG2 3.85Å; L85-V111 HydrophobicContact CD2-CG1 3.92Å; A88-V111 HydrophobicContact CB-CG2 3.92Å; C107-V111 WeakPolarHBondContact O-CG2 3.38Å; C107-V111 PolarHBondContact O-N 3.26Å; H108-V111 PolarHBondContact O-N 3.29Å; V111-Q113 PolarHBondContact O-N 3.26Å; V111-Q114 CarbonylContact O-C 3.58Å; V111-Q114 PolarHBondContact O-N 3.02Å; V111-E115 PolarHBondContact O-N 3.02Å
112	E	96.9	Very high	95.5	Very high	131 Å²	131	61.6 Å²	61.6	61%	0.612	29%	0.291	S	S	*	.	H	α-helix	trans	-58.3	-47.1	177.1	-177	-173.7	172.3	0	0	111.8	H108 Y109 Q114	H108-E112 WeakPolarHBondContact O-CB 3.18Å; H108-E112 PolarHBondContact O-N 2.75Å; Y109-E112 PolarHBondContact O-N 3.16Å; E112-Q114 VanDerWaalsContact C-N 3.25Å; E112-Q114 PolarHBondContact O-N 3.32Å
113	Q	96.4	Very high	95.9	Very high	99 Å²	99	60.6 Å²	60.6	46%	0.463	29%	0.288	S	S	.	.	H	α-helix	trans	-69.8	-20.4	-178.6	-68.6	-57.4	-68.1	0	0	114	Y109 M110 V111	Y109-Q113 HydrophobicContact CD1-CG 4.18Å; Y109-Q113 HydrophobicContact CD2-CG 4.3Å; Y109-Q113 HydrophobicContact CE1-CG 3.76Å; Y109-Q113 HydrophobicContact CE2-CG 3.91Å; Y109-Q113 HydrophobicContact CG-CG 4.44Å; Y109-Q113 WeakPolarHBondContact O-CB 3.43Å; Y109-Q113 VanDerWaalsContact O-CG 3.22Å; Y109-Q113 WeakPolarHBondContact O-CG 3.42Å; Y109-Q113 PolarHBondContact O-N 3.13Å; M110-Q113 PolarHBondContact O-N 3.3Å; V111-Q113 PolarHBondContact O-N 3.26Å
114	Q	97.3	Very high	96.2	Very high	45 Å²	45	67.1 Å²	67.1	21%	0.21	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	15.8	-172	-53.9	-59.6	-65.1	0	0	112.9	M110 V111 E112 E116 L117 L118 M141	M110-Q114 HydrophobicContact CG-CG 4.24Å; M110-Q114 WeakPolarHBondContact O-CB 3.49Å; M110-Q114 VanDerWaalsContact O-CG 3.27Å; M110-Q114 WeakPolarHBondContact O-CG 3.49Å; M110-Q114 PolarHBondContact O-N 2.92Å; V111-Q114 CarbonylContact O-C 3.58Å; V111-Q114 PolarHBondContact O-N 3.02Å; E112-Q114 VanDerWaalsContact C-N 3.25Å; E112-Q114 PolarHBondContact O-N 3.32Å; Q114-E116 VanDerWaalsContact C-N 3.34Å; Q114-E116 PolarHBondContact O-N 2.85Å; Q114-L117 PolarHBondContact O-N 2.94Å; Q114-L117 VanDerWaalsContact O-N 3.11Å; Q114-L117 VanDerWaalsContact OE1-CD1 3.3Å; Q114-L118 WeakPolarHBondContact O-CG 3.45Å; Q114-L118 PolarHBondContact O-N 3.37Å; Q114-M141 HydrophobicContact CG-CE 3.7Å; Q114-M141 HydrophobicContact CG-SD 3.82Å
115	E	97.8	Very high	96.4	Very high	84 Å²	84	65 Å²	65	39%	0.393	31%	0.309	S	S	.	.	H	α-helix	trans	-52.5	-48.7	179.3	-172.9	176.6	162	0	0	111.8	F81 L85 V111 L117 L118 E119	F81-E115 HydrophobicContact CE1-CG 4.45Å; L85-E115 HydrophobicContact CD1-CG 4.14Å; V111-E115 PolarHBondContact O-N 3.02Å; E115-L117 VanDerWaalsContact C-N 3.3Å; E115-L117 PolarHBondContact O-N 2.03Å; E115-L118 PolarHBondContact O-N 3.47Å; E115-L118 VanDerWaalsContact O-N 3.11Å; E115-E119 WeakPolarHBondContact O-CB 3.01Å; E115-E119 PolarHBondContact O-N 3.14Å
116	E	97.5	Very high	96.5	Very high	163 Å²	163	64.5 Å²	64.5	76%	0.762	29%	0.294	S	S	*	.	H	α-helix	trans	-59.2	-37.3	179	-63.9	-175.5	176.3	0	0	113.1	Q114 K120	Q114-E116 VanDerWaalsContact C-N 3.34Å; Q114-E116 PolarHBondContact O-N 2.85Å; E116-K120 VanDerWaalsContact O-CB 3.25Å; E116-K120 WeakPolarHBondContact O-CB 3.4Å; E116-K120 PolarHBondContact O-N 2.96Å
117	L	97.8	Very high	96.5	Very high	40 Å²	40	69.3 Å²	69.3	21%	0.209	32%	0.321	C	S	.	.	H	α-helix	trans	-73.1	-39.4	177.6	-69.5	-174.7	0	0	0	111.3	Q114 E115 W121 W135 L136 Q140	Q114-L117 PolarHBondContact O-N 2.94Å; Q114-L117 VanDerWaalsContact O-N 3.11Å; Q114-L117 VanDerWaalsContact OE1-CD1 3.3Å; E115-L117 VanDerWaalsContact C-N 3.3Å; E115-L117 PolarHBondContact O-N 2.03Å; L117-W121 WeakPolarHBondContact O-CB 3.37Å; L117-W121 PolarHBondContact O-N 3.32Å; L117-W135 HydrophobicContact CB-CH2 3.96Å; L117-W135 HydrophobicContact CB-CZ3 4.11Å; L117-W135 HydrophobicContact CD2-CH2 4.05Å; L117-W135 WeakPolarHBondContact O-CH2 3.07Å; L117-W135 VanDerWaalsContact O-CZ3 3.27Å; L117-W135 WeakPolarHBondContact O-CZ3 3.32Å; L117-L136 HydrophobicContact CB-CD1 3.83Å; L117-L136 HydrophobicContact CD1-CD1 3.81Å; L117-Q140 HydrophobicContact CD1-CB 3.99Å; L117-Q140 HydrophobicContact CD1-CG 4.45Å
118	L	98.2	Very high	96.6	Very high	0 Å²	0	73.5 Å²	73.5	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-64.5	-43.4	176.5	-70.6	168.1	0	0	0	110.9	V43 F47 F81 L85 Q114 E115 W121 F122 L132 L136	V43-L118 HydrophobicContact CG1-CD1 4.37Å; F47-L118 HydrophobicContact CD2-CD1 4.44Å; F47-L118 HydrophobicContact CD2-CD2 3.92Å; F47-L118 HydrophobicContact CE2-CB 4.11Å; F47-L118 HydrophobicContact CE2-CD2 4.1Å; F47-L118 HydrophobicContact CE2-CG 4.49Å; F47-L118 HydrophobicContact CG-CD2 4.32Å; F81-L118 HydrophobicContact CE2-CB 4.05Å; F81-L118 HydrophobicContact CZ-CB 4.13Å; L85-L118 HydrophobicContact CD2-CB 4.25Å; L85-L118 HydrophobicContact CD2-CD1 3.64Å; Q114-L118 WeakPolarHBondContact O-CG 3.45Å; Q114-L118 PolarHBondContact O-N 3.37Å; E115-L118 PolarHBondContact O-N 3.47Å; E115-L118 VanDerWaalsContact O-N 3.11Å; L118-W121 PolarHBondContact O-N 2.95Å; L118-F122 WeakPolarHBondContact O-CB 3.28Å; L118-F122 PolarHBondContact O-N 2.84Å; L118-L132 HydrophobicContact CD2-CD1 4.33Å; L118-L132 HydrophobicContact CD2-CD2 4.42Å; L118-L136 HydrophobicContact CD2-CD2 3.74Å; L118-L136 HydrophobicContact CG-CD2 4.42Å
119	E	97.6	Very high	96.6	Very high	76 Å²	76	72 Å²	72	36%	0.355	34%	0.344	S	S	.	.	H	α-helix	trans	-62	-50.7	176.5	-172.4	-173.2	166.4	0	0	110.7	F81 E115 W121 F122 H123	F81-E119 HydrophobicContact CD1-CG 4.39Å; F81-E119 HydrophobicContact CE1-CB 3.72Å; F81-E119 HydrophobicContact CE1-CG 3.98Å; F81-E119 HydrophobicContact CE2-CB 4.16Å; F81-E119 HydrophobicContact CZ-CB 3.5Å; F81-E119 HydrophobicContact CZ-CG 4.21Å; F81-E119 VanDerWaalsContact CZ-N 3.33Å; E115-E119 WeakPolarHBondContact O-CB 3.01Å; E115-E119 PolarHBondContact O-N 3.14Å; E119-W121 VanDerWaalsContact C-N 3.28Å; E119-W121 PolarHBondContact O-N 3.44Å; E119-F122 PolarHBondContact O-N 2.88Å; E119-F122 VanDerWaalsContact O-N 3.15Å; E119-H123 PolarHBondContact O-CD2 3.11Å; E119-H123 PolarHBondContact O-N 3.05Å
120	K	97.7	Very high	96.6	Very high	93 Å²	93	69.6 Å²	69.6	40%	0.404	35%	0.347	S	S	.	.	H	α-helix	trans	-55.1	-44.4	175.7	180	179.7	-178.9	178.5	0	111.7	E116 Q124 L125 W135	E116-K120 VanDerWaalsContact O-CB 3.25Å; E116-K120 WeakPolarHBondContact O-CB 3.4Å; E116-K120 PolarHBondContact O-N 2.96Å; K120-Q124 WeakPolarHBondContact O-CB 3.12Å; K120-Q124 PolarHBondContact O-N 3.44Å; K120-L125 HydrophobicContact CG-CD1 4.23Å; K120-L125 PolarHBondContact O-N 3.38Å; K120-W135 HydrophobicContact CD-CZ2 4.49Å
121	W	98	Very high	96.6	Very high	4 Å²	4	73 Å²	73	2%	0.015	37%	0.366	C	S	.	.	I	π-helix	trans	-64.7	-48	178.1	-176.4	89.4	0	0	0	111.6	F47 L48 L117 L118 E119 H123 L125 R126 I129 L132 W135	F47-W121 HydrophobicContact CD1-CZ3 4.4Å; F47-W121 HydrophobicContact CE1-CE3 4.1Å; F47-W121 AromaticContact CE1-CZ3 3.92Å; F47-W121 HydrophobicContact CE1-CZ3 3.92Å; L48-W121 HydrophobicContact CD2-CH2 4.02Å; L117-W121 WeakPolarHBondContact O-CB 3.37Å; L117-W121 PolarHBondContact O-N 3.32Å; L118-W121 PolarHBondContact O-N 2.95Å; E119-W121 VanDerWaalsContact C-N 3.28Å; E119-W121 PolarHBondContact O-N 3.44Å; W121-H123 PolarHBondContact O-N 3.07Å; W121-L125 CarbonylContact O-C 3.59Å; W121-L125 PolarHBondContact O-N 3.25Å; W121-L125 VanDerWaalsContact O-N 3.07Å; W121-R126 HydrophobicContact CD2-CB 4.37Å; W121-R126 HydrophobicContact CE3-CB 4.26Å; W121-R126 HydrophobicContact CH2-CB 4.08Å; W121-R126 HydrophobicContact CH2-CG 3.6Å; W121-R126 HydrophobicContact CZ2-CB 4.16Å; W121-R126 HydrophobicContact CZ2-CG 4Å; W121-R126 HydrophobicContact CZ3-CB 4.11Å; W121-R126 HydrophobicContact CZ3-CG 3.89Å; W121-R126 WeakPolarHBondContact O-CB 3.49Å; W121-R126 PolarHBondContact O-N 3.36Å; W121-I129 PolarHBondContact NE1-O 2.92Å; W121-L132 HydrophobicContact CB-CD1 4.19Å; W121-L132 HydrophobicContact CD2-CB 4.29Å; W121-L132 HydrophobicContact CD2-CD1 3.59Å; W121-L132 HydrophobicContact CD2-CG 4.38Å; W121-L132 HydrophobicContact CE3-CD1 4Å; W121-L132 HydrophobicContact CE3-CD2 4.41Å; W121-L132 HydrophobicContact CG-CD1 3.65Å; W121-L132 HydrophobicContact CH2-CB 4.07Å; W121-L132 HydrophobicContact CZ2-CB 3.71Å; W121-L132 HydrophobicContact CZ3-CD2 4.37Å; W121-W135 HydrophobicContact CB-CE3 3.96Å; W121-W135 HydrophobicContact CB-CH2 4.09Å; W121-W135 HydrophobicContact CB-CZ3 3.61Å; W121-W135 AromaticContact CD1-CD2 3.86Å; W121-W135 AromaticContact CD1-CE3 3.62Å; W121-W135 HydrophobicContact CG-CE3 4.05Å; W121-W135 HydrophobicContact CG-CZ3 4.21Å
122	F	97.6	Very high	96.6	Very high	3 Å²	3	72.3 Å²	72.3	1%	0.013	36%	0.361	C	S	.	.	I	π-helix	trans	-59.4	-47.4	-177.4	177.5	-93	0	0	0	112.6	F47 M51 R80 F81 I84 L118 E119 R126	F47-F122 HydrophobicContact CE1-CD2 4.36Å; F47-F122 HydrophobicContact CZ-CB 4.28Å; F47-F122 HydrophobicContact CZ-CD2 4.21Å; M51-F122 HydrophobicContact CE-CE2 4.47Å; M51-F122 HydrophobicContact SD-CD2 3.52Å; M51-F122 VanDerWaalsContact SD-CD2 3.52Å; M51-F122 HydrophobicContact SD-CE2 3.45Å; M51-F122 WeakPolarHBondContact SD-CE2 3.27Å; R80-F122 HydrophobicContact CB-CZ 4.36Å; R80-F122 HydrophobicContact CG-CZ 4.24Å; F81-F122 HydrophobicContact CB-CD1 4.04Å; F81-F122 HydrophobicContact CB-CE1 3.94Å; F81-F122 HydrophobicContact CB-CZ 4.34Å; F81-F122 HydrophobicContact CD2-CB 3.91Å; F81-F122 HydrophobicContact CD2-CD1 4.09Å; F81-F122 HydrophobicContact CD2-CD2 4.31Å; F81-F122 AromaticContact CD2-CG 3.86Å; F81-F122 HydrophobicContact CD2-CG 3.86Å; F81-F122 HydrophobicContact CE2-CB 4.23Å; F81-F122 HydrophobicContact CG-CD1 4.38Å; I84-F122 HydrophobicContact CD1-CD2 4.16Å; I84-F122 HydrophobicContact CD1-CE2 3.48Å; I84-F122 VanDerWaalsContact CD1-CE2 3.48Å; I84-F122 HydrophobicContact CD1-CZ 4.28Å; L118-F122 WeakPolarHBondContact O-CB 3.28Å; L118-F122 PolarHBondContact O-N 2.84Å; E119-F122 PolarHBondContact O-N 2.88Å; E119-F122 VanDerWaalsContact O-N 3.15Å; F122-R126 VanDerWaalsContact CD2-NH1 3.29Å
123	H	94.9	Very high	96.7	Very high	78 Å²	78	68.3 Å²	68.3	36%	0.361	34%	0.342	S	S	.	.	I	π-helix	trans	-85.5	-32	-175.7	-68.3	-72	0	0	0	114.1	E76 E78 E119 W121	E76-H123 PolarHBondContact O-CE1 3.41Å; E76-H123 PolarHBondContact O-ND1 2.04Å; E78-H123 IonicContact OE2-NE2 3.06Å; E119-H123 PolarHBondContact O-CD2 3.11Å; E119-H123 PolarHBondContact O-N 3.05Å; W121-H123 PolarHBondContact O-N 3.07Å
124	Q	94.8	Very high	96.8	Very high	138 Å²	138	66.6 Å²	66.6	65%	0.645	33%	0.334	S	S	*	.	I	π-helix	trans	-118	-30.8	-167.5	-55.3	177.1	4.4	0	0	114.6	K120	K120-Q124 WeakPolarHBondContact O-CB 3.12Å; K120-Q124 PolarHBondContact O-N 3.44Å
125	L	96	Very high	96.8	Very high	31 Å²	31	65.1 Å²	65.1	16%	0.162	33%	0.326	C	S	.	.	I	π-helix	trans	-114.4	-16.9	-167.4	-54.4	175.9	0	0	0	114.2	K120 W121 I127 S128 I129 W135	K120-L125 HydrophobicContact CG-CD1 4.23Å; K120-L125 PolarHBondContact O-N 3.38Å; W121-L125 CarbonylContact O-C 3.59Å; W121-L125 PolarHBondContact O-N 3.25Å; W121-L125 VanDerWaalsContact O-N 3.07Å; L125-I127 PolarHBondContact O-N 2.84Å; L125-I127 VanDerWaalsContact O-N 3.08Å; L125-S128 PolarHBondContact O-N 3.01Å; L125-S128 PolarHBondContact O-OG 3.23Å; L125-I129 HydrophobicContact CB-CD1 4.43Å; L125-I129 HydrophobicContact CD2-CD1 4.45Å; L125-I129 WeakPolarHBondContact O-CA 3.34Å; L125-I129 PolarHBondContact O-N 2.04Å; L125-W135 HydrophobicContact CD1-CD2 4.43Å; L125-W135 HydrophobicContact CD1-CH2 4.25Å; L125-W135 HydrophobicContact CD1-CZ2 3.43Å; L125-W135 VanDerWaalsContact CD1-CZ2 3.43Å
126	R	94.4	Very high	96.8	Very high	50 Å²	50	61.1 Å²	61.1	19%	0.189	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-38.4	-173.3	178.1	175.7	70.2	-156.7	0.3	114.4	M51 W121 F122 P130	M51-R126 VanDerWaalsContact CE-CD 3.48Å; W121-R126 HydrophobicContact CD2-CB 4.37Å; W121-R126 HydrophobicContact CE3-CB 4.26Å; W121-R126 HydrophobicContact CH2-CB 4.08Å; W121-R126 HydrophobicContact CH2-CG 3.6Å; W121-R126 HydrophobicContact CZ2-CB 4.16Å; W121-R126 HydrophobicContact CZ2-CG 4Å; W121-R126 HydrophobicContact CZ3-CB 4.11Å; W121-R126 HydrophobicContact CZ3-CG 3.89Å; W121-R126 WeakPolarHBondContact O-CB 3.49Å; W121-R126 PolarHBondContact O-N 3.36Å; F122-R126 VanDerWaalsContact CD2-NH1 3.29Å; R126-P130 WeakPolarHBondContact O-CA 3.44Å
127	I	93.1	Very high	96.8	Very high	155 Å²	155	53.4 Å²	53.4	80%	0.795	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-41.6	-179.5	-60.9	174.9	0	0	0	111.3	L125	L125-I127 PolarHBondContact O-N 2.84Å; L125-I127 VanDerWaalsContact O-N 3.08Å
128	S	96.6	Very high	96.8	Very high	87 Å²	87	52.1 Å²	52.1	61%	0.608	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-25.7	-176.7	54.5	0	0	0	0	113.2	L125	L125-S128 PolarHBondContact O-N 3.01Å; L125-S128 PolarHBondContact O-OG 3.23Å
129	I	95.6	Very high	96.7	Very high	60 Å²	60	55.8 Å²	55.8	31%	0.308	29%	0.285	S	S	.	.			trans	-135.5	75.5	-178	-48.5	178.5	0	0	0	108.9	W121 L125 D131 W135	W121-I129 PolarHBondContact NE1-O 2.92Å; L125-I129 HydrophobicContact CB-CD1 4.43Å; L125-I129 HydrophobicContact CD2-CD1 4.45Å; L125-I129 WeakPolarHBondContact O-CA 3.34Å; L125-I129 PolarHBondContact O-N 2.04Å; I129-D131 VanDerWaalsContact C-N 3.27Å; I129-D131 PolarHBondContact O-N 3.41Å; I129-W135 HydrophobicContact CG2-CB 3.82Å; I129-W135 HydrophobicContact CG2-CG 4.17Å
130	P	96.4	Very high	96.7	Very high	96 Å²	96	56.3 Å²	56.3	62%	0.623	29%	0.287	S	S	*	.			trans	-69.4	-20.7	-174.1	26.5	-35.4	0	0	0	114.2	R126 L132	R126-P130 WeakPolarHBondContact O-CA 3.44Å; P130-L132 PolarHBondContact O-N 3.12Å; P130-L132 VanDerWaalsContact O-N 3.14Å
131	D	97.1	Very high	96.6	Very high	85 Å²	85	53.8 Å²	53.8	46%	0.455	28%	0.277	S	S	.	.			trans	-83.7	88.2	177.6	-168.5	-20.6	0	0	0	110.9	I129 F133 Q134 W135	I129-D131 VanDerWaalsContact C-N 3.27Å; I129-D131 PolarHBondContact O-N 3.41Å; D131-F133 VanDerWaalsContact C-N 3.26Å; D131-F133 PolarHBondContact O-N 3.42Å; D131-F133 PolarHBondContact OD1-N 2.99Å; D131-F133 VanDerWaalsContact OD1-N 3.11Å; D131-Q134 HydrophobicContact CB-CB 3.92Å; D131-Q134 VanDerWaalsContact CG-CB 3.41Å; D131-Q134 PolarHBondContact O-N 2.77Å; D131-Q134 PolarHBondContact OD1-N 3.43Å; D131-W135 PolarHBondContact O-N 2.99Å
132	L	98	Very high	96.5	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-58.4	-36.6	176.7	176.8	60.4	0	0	0	112.2	T44 F47 L48 L118 W121 P130 W135 L136	T44-L132 HydrophobicContact CG2-CD2 4.19Å; T44-L132 HydrophobicContact CG2-CG 3.88Å; F47-L132 HydrophobicContact CB-CD2 4Å; F47-L132 HydrophobicContact CD1-CD2 3.55Å; F47-L132 HydrophobicContact CE1-CD2 4.31Å; F47-L132 HydrophobicContact CG-CD2 3.94Å; L48-L132 HydrophobicContact CD2-CB 4.27Å; L48-L132 HydrophobicContact CD2-CD2 4.39Å; L48-L132 HydrophobicContact CG-CB 4.47Å; L48-L132 HydrophobicContact CG-CD2 4.3Å; L118-L132 HydrophobicContact CD2-CD1 4.33Å; L118-L132 HydrophobicContact CD2-CD2 4.42Å; W121-L132 HydrophobicContact CB-CD1 4.19Å; W121-L132 HydrophobicContact CD2-CB 4.29Å; W121-L132 HydrophobicContact CD2-CD1 3.59Å; W121-L132 HydrophobicContact CD2-CG 4.38Å; W121-L132 HydrophobicContact CE3-CD1 4Å; W121-L132 HydrophobicContact CE3-CD2 4.41Å; W121-L132 HydrophobicContact CG-CD1 3.65Å; W121-L132 HydrophobicContact CH2-CB 4.07Å; W121-L132 HydrophobicContact CZ2-CB 3.71Å; W121-L132 HydrophobicContact CZ3-CD2 4.37Å; P130-L132 PolarHBondContact O-N 3.12Å; P130-L132 VanDerWaalsContact O-N 3.14Å; L132-W135 HydrophobicContact CD1-CE3 4.28Å; L132-L136 HydrophobicContact CD1-CB 4.06Å; L132-L136 HydrophobicContact CD1-CD2 4.4Å; L132-L136 WeakPolarHBondContact O-CB 3.29Å; L132-L136 PolarHBondContact O-N 3.02Å
133	F	98.1	Very high	96.4	Very high	48 Å²	48	61.2 Å²	61.2	21%	0.211	31%	0.311	C	S	.	.	H	α-helix	trans	-67.3	-46.5	-179	173.3	-98.6	0	0	0	111.5	R41 D131 C137 I138 C144	R41-F133 HydrophobicContact CB-CE2 4.42Å; R41-F133 HydrophobicContact CG-CD2 4.08Å; R41-F133 HydrophobicContact CG-CE2 3.37Å; R41-F133 HydrophobicContact CG-CZ 4.04Å; D131-F133 VanDerWaalsContact C-N 3.26Å; D131-F133 PolarHBondContact O-N 3.42Å; D131-F133 PolarHBondContact OD1-N 2.99Å; D131-F133 VanDerWaalsContact OD1-N 3.11Å; F133-C137 HydrophobicContact CD2-CB 3.78Å; F133-C137 WeakPolarHBondContact CD2-SG 3.38Å; F133-C137 HydrophobicContact CE2-CB 3.63Å; F133-C137 HydrophobicContact CZ-CB 4.28Å; F133-C137 VanDerWaalsContact O-CB 3.27Å; F133-C137 WeakPolarHBondContact O-CB 3.05Å; F133-C137 PolarHBondContact O-N 2.79Å; F133-I138 HydrophobicContact CD1-CD1 4.19Å; F133-I138 HydrophobicContact CE1-CD1 3.66Å; F133-I138 HydrophobicContact CE1-CG1 4.13Å; F133-I138 HydrophobicContact CZ-CD1 4.39Å; F133-I138 HydrophobicContact CZ-CG1 4.44Å; F133-C144 HydrophobicContact CE2-CB 4.25Å; F133-C144 HydrophobicContact CZ-CB 3.8Å
134	Q	97.5	Very high	96.5	Very high	63 Å²	63	57.5 Å²	57.5	29%	0.294	29%	0.294	S	S	.	.	I	π-helix	trans	-58.9	-51.1	175.7	178.9	61.5	50.5	0	0	110.6	D131 I138 D139	D131-Q134 HydrophobicContact CB-CB 3.92Å; D131-Q134 VanDerWaalsContact CG-CB 3.41Å; D131-Q134 PolarHBondContact O-N 2.77Å; D131-Q134 PolarHBondContact OD1-N 3.43Å; Q134-I138 WeakPolarHBondContact O-CB 3.16Å; Q134-I138 PolarHBondContact O-N 2.88Å; Q134-I138 VanDerWaalsContact OE1-CD1 3.28Å; Q134-D139 PolarHBondContact NE2-OD1 2.74Å; Q134-D139 PolarHBondContact NE2-OD2 2.83Å; Q134-D139 PolarHBondContact O-N 3.04Å
135	W	98.1	Very high	96.6	Very high	13 Å²	13	51 Å²	51	5%	0.049	26%	0.264	C	S	.	.	I	π-helix	trans	-65.1	-53.3	-177.6	-178.5	79.8	0	0	0	112.5	L117 K120 W121 L125 I129 D131 L132 D139 Q140	L117-W135 HydrophobicContact CB-CH2 3.96Å; L117-W135 HydrophobicContact CB-CZ3 4.11Å; L117-W135 HydrophobicContact CD2-CH2 4.05Å; L117-W135 WeakPolarHBondContact O-CH2 3.07Å; L117-W135 VanDerWaalsContact O-CZ3 3.27Å; L117-W135 WeakPolarHBondContact O-CZ3 3.32Å; K120-W135 HydrophobicContact CD-CZ2 4.49Å; W121-W135 HydrophobicContact CB-CE3 3.96Å; W121-W135 HydrophobicContact CB-CH2 4.09Å; W121-W135 HydrophobicContact CB-CZ3 3.61Å; W121-W135 AromaticContact CD1-CD2 3.86Å; W121-W135 AromaticContact CD1-CE3 3.62Å; W121-W135 HydrophobicContact CG-CE3 4.05Å; W121-W135 HydrophobicContact CG-CZ3 4.21Å; L125-W135 HydrophobicContact CD1-CD2 4.43Å; L125-W135 HydrophobicContact CD1-CH2 4.25Å; L125-W135 HydrophobicContact CD1-CZ2 3.43Å; L125-W135 VanDerWaalsContact CD1-CZ2 3.43Å; I129-W135 HydrophobicContact CG2-CB 3.82Å; I129-W135 HydrophobicContact CG2-CG 4.17Å; D131-W135 PolarHBondContact O-N 2.99Å; L132-W135 HydrophobicContact CD1-CE3 4.28Å; W135-D139 WeakPolarHBondContact O-CB 3.32Å; W135-D139 PolarHBondContact O-N 3.07Å; W135-Q140 HydrophobicContact CD2-CG 3.92Å; W135-Q140 HydrophobicContact CE3-CG 4.23Å; W135-Q140 HydrophobicContact CH2-CG 4.02Å; W135-Q140 HydrophobicContact CZ2-CG 3.67Å; W135-Q140 HydrophobicContact CZ3-CG 4.27Å; W135-Q140 WeakPolarHBondContact O-CG 3.24Å; W135-Q140 PolarHBondContact O-N 3.17Å
136	L	98.2	Very high	96.6	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	27%	0.269	C	S	.	.	I	π-helix	trans	-74.1	-56.8	-174.1	-175.4	64.6	0	0	0	111.7	T44 L117 L118 L132 M141	T44-L136 HydrophobicContact CG2-CB 4.33Å; T44-L136 HydrophobicContact CG2-CD2 3.78Å; L117-L136 HydrophobicContact CB-CD1 3.83Å; L117-L136 HydrophobicContact CD1-CD1 3.81Å; L118-L136 HydrophobicContact CD2-CD2 3.74Å; L118-L136 HydrophobicContact CG-CD2 4.42Å; L132-L136 HydrophobicContact CD1-CB 4.06Å; L132-L136 HydrophobicContact CD1-CD2 4.4Å; L132-L136 WeakPolarHBondContact O-CB 3.29Å; L132-L136 PolarHBondContact O-N 3.02Å; L136-M141 HydrophobicContact CD1-CG 4.07Å; L136-M141 HydrophobicContact CD1-SD 3.92Å; L136-M141 HydrophobicContact CD2-SD 4.43Å; L136-M141 HydrophobicContact CG-CG 4.35Å; L136-M141 HydrophobicContact CG-SD 3.83Å; L136-M141 VanDerWaalsContact O-CB 3.28Å; L136-M141 WeakPolarHBondContact O-CB 3.46Å; L136-M141 WeakPolarHBondContact O-CG 3.18Å; L136-M141 PolarHBondContact O-N 3.19Å
137	C	98.1	Very high	96.5	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.301	C	S	.	.	I	π-helix	trans	-81.1	-32.2	-167.4	-56.7	0	0	0	0	113.6	C40 T44 F133 K142 V143 C144	C40-C137 VanDerWaalsContact C-SG 3.54Å; C40-C137 HydrophobicContact CB-CB 3.89Å; C40-C137 WeakPolarHBondContact CB-SG 3.45Å; C40-C137 PolarHBondContact O-SG 3.35Å; C40-C137 WeakPolarHBondContact SG-CA 3.41Å; C40-C137 WeakPolarHBondContact SG-CB 3.45Å; C40-C137 CovalentContact SG-SG 2.03Å; C40-C137 PolarHBondContact SG-SG 2.9Å; T44-C137 VanDerWaalsContact CG2-SG 3.55Å; F133-C137 HydrophobicContact CD2-CB 3.78Å; F133-C137 WeakPolarHBondContact CD2-SG 3.38Å; F133-C137 HydrophobicContact CE2-CB 3.63Å; F133-C137 HydrophobicContact CZ-CB 4.28Å; F133-C137 VanDerWaalsContact O-CB 3.27Å; F133-C137 WeakPolarHBondContact O-CB 3.05Å; F133-C137 PolarHBondContact O-N 2.79Å; C137-K142 PolarHBondContact O-N 2.73Å; C137-V143 HydrophobicContact CB-CG2 4.28Å; C137-V143 WeakPolarHBondContact O-CG2 3.45Å; C137-V143 PolarHBondContact O-N 3.45Å; C137-C144 HydrophobicContact CB-CB 4.04Å; C137-C144 PolarHBondContact O-N 2.74Å
138	I	97.4	Very high	96.5	Very high	13 Å²	13	54.7 Å²	54.7	7%	0.067	28%	0.275	C	S	.	.	I	π-helix	trans	-96.4	-50.6	-177	-59.7	172.7	0	0	0	110.9	F133 Q134 K142 C144 P146	F133-I138 HydrophobicContact CD1-CD1 4.19Å; F133-I138 HydrophobicContact CE1-CD1 3.66Å; F133-I138 HydrophobicContact CE1-CG1 4.13Å; F133-I138 HydrophobicContact CZ-CD1 4.39Å; F133-I138 HydrophobicContact CZ-CG1 4.44Å; Q134-I138 WeakPolarHBondContact O-CB 3.16Å; Q134-I138 PolarHBondContact O-N 2.88Å; Q134-I138 VanDerWaalsContact OE1-CD1 3.28Å; I138-K142 WeakPolarHBondContact O-CA 3.05Å; I138-K142 WeakPolarHBondContact O-CG 3.42Å; I138-C144 HydrophobicContact CG1-CB 3.9Å; I138-P146 HydrophobicContact CG2-CG 4.02Å
139	D	96.4	Very high	96.5	Very high	78 Å²	78	53.9 Å²	53.9	42%	0.417	26%	0.258	S	S	.	.	I	π-helix	trans	-87	-49.4	-169.9	-57.6	-27.3	0	0	0	113	Q134 W135	Q134-D139 PolarHBondContact NE2-OD1 2.74Å; Q134-D139 PolarHBondContact NE2-OD2 2.83Å; Q134-D139 PolarHBondContact O-N 3.04Å; W135-D139 WeakPolarHBondContact O-CB 3.32Å; W135-D139 PolarHBondContact O-N 3.07Å
140	Q	96.7	Very high	96.4	Very high	86 Å²	86	52.5 Å²	52.5	40%	0.402	25%	0.25	S	C	.	.	I	π-helix	trans	-78.6	-64	-179.2	-62.8	-48	-72	0	0	112.1	L117 W135	L117-Q140 HydrophobicContact CD1-CB 3.99Å; L117-Q140 HydrophobicContact CD1-CG 4.45Å; W135-Q140 HydrophobicContact CD2-CG 3.92Å; W135-Q140 HydrophobicContact CE3-CG 4.23Å; W135-Q140 HydrophobicContact CH2-CG 4.02Å; W135-Q140 HydrophobicContact CZ2-CG 3.67Å; W135-Q140 HydrophobicContact CZ3-CG 4.27Å; W135-Q140 WeakPolarHBondContact O-CG 3.24Å; W135-Q140 PolarHBondContact O-N 3.17Å
141	M	95.9	Very high	96.3	Very high	40 Å²	40	48 Å²	48	20%	0.197	22%	0.222	C	C	.	.	S	Bend	trans	-78.6	-21.3	-173	-64	-179.8	70.1	0	0	113.1	M110 Q114 L136 V143	M110-M141 HydrophobicContact CE-CE 4.02Å; M110-M141 HydrophobicContact CG-CE 4.12Å; M110-M141 HydrophobicContact SD-CE 4.02Å; Q114-M141 HydrophobicContact CG-CE 3.7Å; Q114-M141 HydrophobicContact CG-SD 3.82Å; L136-M141 HydrophobicContact CD1-CG 4.07Å; L136-M141 HydrophobicContact CD1-SD 3.92Å; L136-M141 HydrophobicContact CD2-SD 4.43Å; L136-M141 HydrophobicContact CG-CG 4.35Å; L136-M141 HydrophobicContact CG-SD 3.83Å; L136-M141 VanDerWaalsContact O-CB 3.28Å; L136-M141 WeakPolarHBondContact O-CB 3.46Å; L136-M141 WeakPolarHBondContact O-CG 3.18Å; L136-M141 PolarHBondContact O-N 3.19Å; M141-V143 HydrophobicContact CB-CG1 4.15Å; M141-V143 HydrophobicContact CB-CG2 4.05Å; M141-V143 HydrophobicContact CE-CG1 4.43Å; M141-V143 PolarHBondContact O-N 3.42Å; M141-V143 VanDerWaalsContact O-N 3.14Å
142	K	95.7	Very high	96.2	Very high	139 Å²	139	48.7 Å²	48.7	60%	0.604	23%	0.23	S	C	*	.			trans	51	37.1	-178.1	-67.6	-178.8	-177.1	177.6	0	113.4	C137 I138 R177	C137-K142 PolarHBondContact O-N 2.73Å; I138-K142 WeakPolarHBondContact O-CA 3.05Å; I138-K142 WeakPolarHBondContact O-CG 3.42Å; K142-R177 VanDerWaalsContact C-NH2 3.26Å; K142-R177 PolarHBondContact O-NE 2.74Å; K142-R177 PolarHBondContact O-NH2 3.22Å; K142-R177 VanDerWaalsContact O-NH2 3.12Å
143	V	95.3	Very high	96	Very high	24 Å²	24	56.2 Å²	56.2	15%	0.145	27%	0.265	C	S	.	.			trans	-93.5	-25.7	177	-66.5	0	0	0	0	112.1	H36 C37 C40 C137 M141 R177	H36-V143 HydrophobicContact CB-CB 3.98Å; H36-V143 HydrophobicContact CB-CG1 3.84Å; C37-V143 WeakPolarHBondContact CB-O 3.4Å; C40-V143 HydrophobicContact CB-CG2 3.76Å; C137-V143 HydrophobicContact CB-CG2 4.28Å; C137-V143 WeakPolarHBondContact O-CG2 3.45Å; C137-V143 PolarHBondContact O-N 3.45Å; M141-V143 HydrophobicContact CB-CG1 4.15Å; M141-V143 HydrophobicContact CB-CG2 4.05Å; M141-V143 HydrophobicContact CE-CG1 4.43Å; M141-V143 PolarHBondContact O-N 3.42Å; M141-V143 VanDerWaalsContact O-N 3.14Å; V143-R177 WeakPolarHBondContact O-CG 3.48Å
144	C	97.4	Very high	95.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-114.4	151.5	179.3	-70	0	0	0	0	112.8	C37 F133 C137 I138 R177	C37-C144 WeakPolarHBondContact CA-SG 3.22Å; C37-C144 HydrophobicContact CB-CB 4.15Å; C37-C144 WeakPolarHBondContact CB-SG 3.46Å; C37-C144 PolarHBondContact O-SG 2.84Å; C37-C144 VanDerWaalsContact O-SG 3.37Å; C37-C144 WeakPolarHBondContact SG-CA 3.33Å; C37-C144 WeakPolarHBondContact SG-CB 3.15Å; C37-C144 CovalentContact SG-SG 2.04Å; C37-C144 PolarHBondContact SG-SG 3.21Å; F133-C144 HydrophobicContact CE2-CB 4.25Å; F133-C144 HydrophobicContact CZ-CB 3.8Å; C137-C144 HydrophobicContact CB-CB 4.04Å; C137-C144 PolarHBondContact O-N 2.74Å; I138-C144 HydrophobicContact CG1-CB 3.9Å; C144-R177 PolarHBondContact O-NH1 2.88Å; C144-R177 PolarHBondContact O-NH2 3.06Å
145	C	96.7	Very high	95.9	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.007	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-92.7	154.1	169.3	-72	0	0	0	0	111.6	R149 C154 G175 T176 R177	C145-R149 HydrophobicContact CB-CB 4.02Å; C145-C154 WeakPolarHBondContact CA-SG 3.33Å; C145-C154 HydrophobicContact CB-CB 3.86Å; C145-C154 WeakPolarHBondContact CB-SG 3.36Å; C145-C154 WeakPolarHBondContact SG-CA 3.15Å; C145-C154 WeakPolarHBondContact SG-CB 3.42Å; C145-C154 CovalentContact SG-SG 2.04Å; C145-C154 PolarHBondContact SG-SG 3.07Å; C145-G175 PolarHBondContact N-O 2.96Å; C145-G175 WeakPolarHBondContact O-CA 3.46Å; C145-T176 PolarHBondContact SG-O 2.04Å; C145-R177 PolarHBondContact SG-NH1 3.29Å
146	P	95.1	Very high	95.7	Very high	42 Å²	42	59.8 Å²	59.8	27%	0.273	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-55.7	164.5	164.8	-20	30.2	0	0	0	111.8	I138 R149	I138-P146 HydrophobicContact CG2-CG 4.02Å; P146-R149 PolarHBondContact O-N 3.28Å
147	R	92.8	Very high	95.6	Very high	229 Å²	229	60.2 Å²	60.2	86%	0.864	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	144	176.5	-66	-175	179.9	179.4	0.8	111	R149	R147-R149 VanDerWaalsContact C-N 3.27Å; R147-R149 PolarHBondContact O-N 2.9Å
148	N	93.5	Very high	95.5	Very high	44 Å²	44	62.2 Å²	62.2	24%	0.235	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	25.5	177.7	-54.5	-17	0	0	0	115	C157 T161 P164	N148-C157 WeakPolarHBondContact O-CB 3.46Å; N148-C157 PolarHBondContact O-N 2.65Å; N148-T161 PolarHBondContact ND2-O 2.73Å; N148-P164 HydrophobicContact CB-CG 3.83Å; N148-P164 WeakPolarHBondContact OD1-CG 3.05Å
149	R	95.9	Very high	95.2	Very high	69 Å²	69	63.4 Å²	63.4	26%	0.26	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	153.7	175.5	-67.8	174	177.6	-88	8.1	111.5	C145 P146 R147 C154 T155 F156 S174 G175	C145-R149 HydrophobicContact CB-CB 4.02Å; P146-R149 PolarHBondContact O-N 3.28Å; R147-R149 VanDerWaalsContact C-N 3.27Å; R147-R149 PolarHBondContact O-N 2.9Å; R149-C154 HydrophobicContact CB-CB 3.99Å; R149-C154 VanDerWaalsContact CD-O 3.32Å; R149-C154 WeakPolarHBondContact CD-O 3.47Å; R149-C154 WeakPolarHBondContact CG-O 3.36Å; R149-C154 PolarHBondContact NH1-O 3.18Å; R149-T155 CarbonylContact C-O 3.58Å; R149-T155 WeakPolarHBondContact CA-O 3.45Å; R149-T155 WeakPolarHBondContact CB-O 3.35Å; R149-F156 HydrophobicContact CG-CD1 4.3Å; R149-F156 VanDerWaalsContact CZ-CZ 3.41Å; R149-F156 VanDerWaalsContact NH2-CE1 3.3Å; R149-S174 CarbonylContact O-C 3.57Å; R149-G175 PolarHBondContact O-N 3.45Å
150	F	94.8	Very high	94.6	Very high	31 Å²	31	63.1 Å²	63.1	14%	0.136	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	166.7	-177.6	76.1	-80.9	0	0	0	112.4	C154 T155 F156 G173 T176 T180 G181	F150-C154 CarbonylContact O-C 3.55Å; F150-C154 WeakPolarHBondContact O-CA 3.4Å; F150-T155 WeakPolarHBondContact CD1-O 3.08Å; F150-T155 WeakPolarHBondContact CE1-OG1 3.31Å; F150-T155 VanDerWaalsContact CZ-OG1 3.3Å; F150-T155 WeakPolarHBondContact CZ-OG1 3.03Å; F150-T155 PolarHBondContact N-O 2.04Å; F150-T155 PolarHBondContact O-N 3.23Å; F150-T155 PolarHBondContact O-OG1 3.29Å; F150-F156 WeakPolarHBondContact CE1-O 3.44Å; F150-G173 WeakPolarHBondContact CB-O 2.93Å; F150-T176 CarbonylContact C-O 3.01Å; F150-T176 WeakPolarHBondContact CA-O 3.32Å; F150-T180 VanDerWaalsContact CE2-C 3.49Å; F150-G181 VanDerWaalsContact CD2-CA 3.45Å; F150-G181 VanDerWaalsContact CD2-N 3.28Å
151	G	94.5	Very high	93.8	Very high	3 Å²	3	63.9 Å²	63.9	3%	0.031	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	177.4	174.5	0	0	0	0	0	113.8	E153 C154 T176 R177 F178	G151-E153 PolarHBondContact O-N 3.12Å; G151-C154 PolarHBondContact O-N 3.04Å; G151-T176 PolarHBondContact N-O 2.88Å; G151-T176 VanDerWaalsContact N-O 3.12Å; G151-R177 CarbonylContact C-O 3.56Å; G151-R177 WeakPolarHBondContact CA-O 3.11Å; G151-R177 CarbonylContact O-C 3.14Å; G151-R177 WeakPolarHBondContact O-CA 3.47Å; G151-F178 PolarHBondContact N-O 3.28Å; G151-F178 VanDerWaalsContact N-O 3.07Å
152	P	93.8	Very high	93.4	Very high	98 Å²	98	65.9 Å²	65.9	64%	0.636	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-34.5	-169.2	20.7	-32.7	0	0	0	112.7	R177	P152-R177 WeakPolarHBondContact CA-O 3.49Å; P152-R177 VanDerWaalsContact O-CD 3.31Å; P152-R177 WeakPolarHBondContact O-CD 3.45Å
153	E	95.1	Very high	93.2	Very high	158 Å²	158	63.2 Å²	63.2	74%	0.738	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	7.3	-179	-57.2	-54.8	133.5	0	0	113.8	G151 T155	G151-E153 PolarHBondContact O-N 3.12Å; E153-T155 VanDerWaalsContact C-N 3.34Å; E153-T155 HydrophobicContact CB-CG2 4.2Å; E153-T155 PolarHBondContact O-N 3.3Å
154	C	96	Very high	93	Very high	15 Å²	15	63.1 Å²	63.1	10%	0.101	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	52.7	-173.3	-61.5	0	0	0	0	114.4	C145 R149 F150 G151 R177	C145-C154 WeakPolarHBondContact CA-SG 3.33Å; C145-C154 HydrophobicContact CB-CB 3.86Å; C145-C154 WeakPolarHBondContact CB-SG 3.36Å; C145-C154 WeakPolarHBondContact SG-CA 3.15Å; C145-C154 WeakPolarHBondContact SG-CB 3.42Å; C145-C154 CovalentContact SG-SG 2.04Å; C145-C154 PolarHBondContact SG-SG 3.07Å; R149-C154 HydrophobicContact CB-CB 3.99Å; R149-C154 VanDerWaalsContact CD-O 3.32Å; R149-C154 WeakPolarHBondContact CD-O 3.47Å; R149-C154 WeakPolarHBondContact CG-O 3.36Å; R149-C154 PolarHBondContact NH1-O 3.18Å; F150-C154 CarbonylContact O-C 3.55Å; F150-C154 WeakPolarHBondContact O-CA 3.4Å; G151-C154 PolarHBondContact O-N 3.04Å; C154-R177 PolarHBondContact SG-NH1 2.94Å
155	T	95.6	Very high	92.9	Very high	69 Å²	69	63.1 Å²	63.1	42%	0.423	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	150.3	175.2	62.1	0	0	0	0	110.2	R149 F150 E153 C157	R149-T155 CarbonylContact C-O 3.58Å; R149-T155 WeakPolarHBondContact CA-O 3.45Å; R149-T155 WeakPolarHBondContact CB-O 3.35Å; F150-T155 WeakPolarHBondContact CD1-O 3.08Å; F150-T155 WeakPolarHBondContact CE1-OG1 3.31Å; F150-T155 VanDerWaalsContact CZ-OG1 3.3Å; F150-T155 WeakPolarHBondContact CZ-OG1 3.03Å; F150-T155 PolarHBondContact N-O 2.04Å; F150-T155 PolarHBondContact O-N 3.23Å; F150-T155 PolarHBondContact O-OG1 3.29Å; E153-T155 VanDerWaalsContact C-N 3.34Å; E153-T155 HydrophobicContact CB-CG2 4.2Å; E153-T155 PolarHBondContact O-N 3.3Å; T155-C157 PolarHBondContact O-N 2.82Å
156	F	95.8	Very high	92.8	Very high	115 Å²	115	64.7 Å²	64.7	50%	0.504	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	136.3	179.8	-72.7	-83.2	0	0	0	111.1	R149 F150 T161	R149-F156 HydrophobicContact CG-CD1 4.3Å; R149-F156 VanDerWaalsContact CZ-CZ 3.41Å; R149-F156 VanDerWaalsContact NH2-CE1 3.3Å; F150-F156 WeakPolarHBondContact CE1-O 3.44Å; F156-T161 HydrophobicContact CE1-CG2 4.1Å
157	C	95.9	Very high	92.7	Very high	11 Å²	11	64.3 Å²	64.3	7%	0.074	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-59.3	144.8	167.5	-75	0	0	0	0	110.4	N148 T155 P164 C171	N148-C157 WeakPolarHBondContact O-CB 3.46Å; N148-C157 PolarHBondContact O-N 2.65Å; T155-C157 PolarHBondContact O-N 2.82Å; C157-P164 HydrophobicContact CB-CB 4.11Å; C157-P164 HydrophobicContact CB-CG 4.44Å; C157-C171 HydrophobicContact CB-CB 3.57Å; C157-C171 WeakPolarHBondContact CB-SG 3.31Å; C157-C171 WeakPolarHBondContact SG-CB 3.36Å; C157-C171 CovalentContact SG-SG 2.04Å; C157-C171 PolarHBondContact SG-SG 3.17Å
158	P	94.8	Very high	92.9	Very high	42 Å²	42	53.8 Å²	53.8	27%	0.273	30%	0.304	S	S	.	.	S	Bend	trans	-66	147.2	179.1	29.9	-36.7	0	0	0	111	C165 G181 L193	P158-C165 PolarHBondContact O-N 2.83Å; P158-G181 WeakPolarHBondContact CD-O 3.35Å; P158-G181 WeakPolarHBondContact CG-O 3.17Å; P158-L193 HydrophobicContact CB-CD2 3.64Å; P158-L193 HydrophobicContact CG-CD2 4.29Å
159	G	90.7	Very high	93	Very high	37 Å²	37	51.9 Å²	51.9	38%	0.381	30%	0.295	S	S	.	.	B	Isolated β-bridge	trans	122.2	-146.7	-176.6	0	0	0	0	0	112
160	D	84	Confident	93	Very high	72 Å²	72	53.1 Å²	53.1	39%	0.385	31%	0.307	S	S	.	.			trans	-91.2	146.7	169.9	-178.6	-12	0	0	0	108.7	S162 R163	D160-S162 PolarHBondContact O-N 3.36Å; D160-S162 VanDerWaalsContact O-N 3.11Å; D160-S162 PolarHBondContact OD1-N 2.89Å; D160-R163 HydrophobicContact CB-CB 4.25Å; D160-R163 PolarHBondContact N-O 2.74Å; D160-R163 CarbonylContact O-C 3.3Å; D160-R163 PolarHBondContact O-N 3.36Å
161	T	81.5	Confident	93	Very high	102 Å²	102	52.1 Å²	52.1	63%	0.626	30%	0.303	S	S	*	.	S	Bend	trans	-50.5	-35.7	178.4	-49.6	0	0	0	0	112.6	N148 F156	N148-T161 PolarHBondContact ND2-O 2.73Å; F156-T161 HydrophobicContact CE1-CG2 4.1Å
162	S	86.6	Confident	93.1	Very high	82 Å²	82	55.9 Å²	55.9	57%	0.573	32%	0.32	S	S	*	.	S	Bend	trans	-88.4	-23.7	177.9	64	0	0	0	0	113.7	D160	D160-S162 PolarHBondContact O-N 3.36Å; D160-S162 VanDerWaalsContact O-N 3.11Å; D160-S162 PolarHBondContact OD1-N 2.89Å
163	R	90.9	Very high	93	Very high	83 Å²	83	52 Å²	52	31%	0.313	30%	0.298	S	S	.	.	S	Bend	trans	-134.3	85.4	-170.8	-64.2	171.8	66.3	-147.8	4.4	110.2	D160 C165 F166 H210	D160-R163 HydrophobicContact CB-CB 4.25Å; D160-R163 PolarHBondContact N-O 2.74Å; D160-R163 CarbonylContact O-C 3.3Å; D160-R163 PolarHBondContact O-N 3.36Å; R163-C165 PolarHBondContact O-N 3.24Å; R163-F166 PolarHBondContact NH2-O 2.9Å; R163-F166 PolarHBondContact O-N 2.79Å; R163-H210 PolarHBondContact NH2-ND1 3.32Å
164	P	92.4	Very high	93	Very high	22 Å²	22	46.7 Å²	46.7	14%	0.143	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-50	141.8	170.9	-25.3	33.7	0	0	0	110.9	N148 C157 F166 G167 C171	N148-P164 HydrophobicContact CB-CG 3.83Å; N148-P164 WeakPolarHBondContact OD1-CG 3.05Å; C157-P164 HydrophobicContact CB-CB 4.11Å; C157-P164 HydrophobicContact CB-CG 4.44Å; P164-F166 PolarHBondContact O-N 2.87Å; P164-G167 PolarHBondContact O-N 3.17Å; P164-C171 HydrophobicContact CB-CB 4.28Å
165	C	95.4	Very high	92.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	53.5	32.9	177.9	-54.5	0	0	0	0	113.4	P158 R163 G167 N168 G169 C183	P158-C165 PolarHBondContact O-N 2.83Å; R163-C165 PolarHBondContact O-N 3.24Å; C165-G167 PolarHBondContact O-N 2.88Å; C165-G167 VanDerWaalsContact O-N 3.12Å; C165-N168 PolarHBondContact O-N 2.86Å; C165-N168 VanDerWaalsContact O-N 3.07Å; C165-G169 WeakPolarHBondContact CB-O 3.29Å; C165-C183 WeakPolarHBondContact CA-SG 3.5Å; C165-C183 HydrophobicContact CB-CB 3.72Å; C165-C183 WeakPolarHBondContact CB-SG 3.46Å; C165-C183 WeakPolarHBondContact SG-CA 3Å; C165-C183 WeakPolarHBondContact SG-CB 3.03Å; C165-C183 CovalentContact SG-SG 2.03Å; C165-C183 PolarHBondContact SG-SG 3.46Å
166	F	93.5	Very high	92.9	Very high	34 Å²	34	43.8 Å²	43.8	15%	0.149	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	56.4	23.4	-176	-62.7	-93.8	0	0	0	113.8	R163 P164 N168 L193 R195 T209	R163-F166 PolarHBondContact NH2-O 2.9Å; R163-F166 PolarHBondContact O-N 2.79Å; P164-F166 PolarHBondContact O-N 2.87Å; F166-N168 VanDerWaalsContact C-N 3.29Å; F166-N168 PolarHBondContact O-N 2.9Å; F166-L193 HydrophobicContact CD2-CB 4.01Å; F166-L193 HydrophobicContact CE2-CB 3.91Å; F166-L193 HydrophobicContact CE2-CD1 3.94Å; F166-L193 HydrophobicContact CE2-CD2 4.38Å; F166-L193 HydrophobicContact CE2-CG 4.29Å; F166-R195 HydrophobicContact CB-CG 4.11Å; F166-R195 HydrophobicContact CD1-CG 4.44Å; F166-R195 VanDerWaalsContact CD2-CD 3.49Å; F166-R195 HydrophobicContact CD2-CG 3.55Å; F166-R195 HydrophobicContact CE2-CG 4.09Å; F166-R195 HydrophobicContact CG-CG 3.76Å; F166-T209 WeakPolarHBondContact CD1-O 3.31Å
167	G	94	Very high	92.8	Very high	35 Å²	35	40.4 Å²	40.4	36%	0.361	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	76.7	9	-178.1	0	0	0	0	0	114.9	P164 C165	P164-G167 PolarHBondContact O-N 3.17Å; C165-G167 PolarHBondContact O-N 2.88Å; C165-G167 VanDerWaalsContact O-N 3.12Å
168	N	95.8	Very high	92.5	Very high	8 Å²	8	45.9 Å²	45.9	4%	0.043	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	17.2	-176.7	-67.1	-13.9	0	0	0	112.4	C165 F166 H186 Y189 C194 V211	C165-N168 PolarHBondContact O-N 2.86Å; C165-N168 VanDerWaalsContact O-N 3.07Å; F166-N168 VanDerWaalsContact C-N 3.29Å; F166-N168 PolarHBondContact O-N 2.9Å; N168-H186 PolarHBondContact O-N 3.06Å; N168-Y189 HydrophobicContact CB-CD1 3.83Å; N168-Y189 HydrophobicContact CB-CD2 3.96Å; N168-Y189 HydrophobicContact CB-CE1 4.15Å; N168-Y189 HydrophobicContact CB-CE2 4.26Å; N168-Y189 HydrophobicContact CB-CG 3.72Å; N168-Y189 WeakPolarHBondContact ND2-CD1 3.46Å; N168-Y189 WeakPolarHBondContact ND2-CE1 3.43Å; N168-C194 HydrophobicContact CB-CB 3.8Å; N168-C194 VanDerWaalsContact CB-O 3.29Å; N168-C194 WeakPolarHBondContact CB-O 3.48Å; N168-C194 PolarHBondContact ND2-O 2.76Å; N168-C194 VanDerWaalsContact O-CB 3.23Å; N168-C194 WeakPolarHBondContact O-CB 3.43Å; N168-V211 PolarHBondContact ND2-O 3.48Å; N168-V211 VanDerWaalsContact ND2-O 3.16Å
169	G	96.1	Very high	92.4	Very high	4 Å²	4	45.4 Å²	45.4	4%	0.041	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.7	170.6	179.2	0	0	0	0	0	112.8	C165 I184 H186	C165-G169 WeakPolarHBondContact CB-O 3.29Å; G169-I184 CarbonylContact C-O 3.53Å; G169-I184 WeakPolarHBondContact CA-O 3.3Å; G169-H186 PolarHBondContact N-CE1 3.04Å; G169-H186 PolarHBondContact N-ND1 2.94Å
170	D	95.8	Very high	92.5	Very high	95 Å²	95	47.5 Å²	47.5	51%	0.508	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	137.2	-179.9	-55.2	-48.2	0	0	0	110.5	H172 C183 I184 H186	D170-H172 PolarHBondContact O-N 3.31Å; D170-C183 CarbonylContact O-C 3.46Å; D170-C183 WeakPolarHBondContact O-CA 3.15Å; D170-I184 PolarHBondContact N-O 2.96Å; D170-I184 PolarHBondContact O-N 2.04Å; D170-H186 IonicContact OD1-CE1 3.44Å; D170-H186 IonicContact OD1-NE2 2.84Å; D170-H186 PolarHBondContact OD1-NE2 3.1Å; D170-H186 IonicContact OD2-CD2 2.74Å; D170-H186 IonicContact OD2-NE2 3.61Å; D170-H186 PolarHBondContact OD2-NE2 3.09Å
171	C	95.6	Very high	93	Very high	9 Å²	9	44.3 Å²	44.3	6%	0.061	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	117.8	177.4	173	0	0	0	0	110	C157 P164 G173 S174	C157-C171 HydrophobicContact CB-CB 3.57Å; C157-C171 WeakPolarHBondContact CB-SG 3.31Å; C157-C171 WeakPolarHBondContact SG-CB 3.36Å; C157-C171 CovalentContact SG-SG 2.04Å; C157-C171 PolarHBondContact SG-SG 3.17Å; P164-C171 HydrophobicContact CB-CB 4.28Å; C171-G173 PolarHBondContact O-N 2.92Å; C171-G173 VanDerWaalsContact O-N 3.11Å; C171-S174 VanDerWaalsContact O-CB 3.31Å; C171-S174 WeakPolarHBondContact O-CB 3.49Å; C171-S174 PolarHBondContact O-N 3.43Å
172	H	95.3	Very high	93.7	Very high	83 Å²	83	46.5 Å²	46.5	38%	0.384	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	113.8	-179.5	-179.3	-115.3	0	0	0	111.5	D170 T180 G181 K182 I184	D170-H172 PolarHBondContact O-N 3.31Å; H172-T180 PolarHBondContact ND1-N 2.96Å; H172-T180 VanDerWaalsContact ND1-N 3.17Å; H172-T180 PolarHBondContact ND1-OG1 3.27Å; H172-T180 PolarHBondContact O-N 2.84Å; H172-G181 PolarHBondContact O-N 3.11Å; H172-K182 VanDerWaalsContact CB-O 3.29Å; H172-K182 WeakPolarHBondContact CB-O 3.02Å; H172-K182 PolarHBondContact N-O 3.07Å; H172-I184 HydrophobicContact CB-CD1 3.98Å; H172-I184 HydrophobicContact CB-CG1 4.27Å
173	G	93.1	Very high	94.3	Very high	16 Å²	16	43.5 Å²	43.5	17%	0.165	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.3	10.4	-174.8	0	0	0	0	0	114.9	F150 C171 G175 T176	F150-G173 WeakPolarHBondContact CB-O 2.93Å; C171-G173 PolarHBondContact O-N 2.92Å; C171-G173 VanDerWaalsContact O-N 3.11Å; G173-G175 PolarHBondContact O-N 3.34Å; G173-T176 WeakPolarHBondContact CA-OG1 3.46Å; G173-T176 WeakPolarHBondContact O-CB 3.13Å; G173-T176 PolarHBondContact O-N 3.08Å; G173-T176 PolarHBondContact O-OG1 3.48Å
174	S	94.3	Very high	94.6	Very high	46 Å²	46	44.2 Å²	44.2	32%	0.322	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	128.6	177.2	-170.3	0	0	0	0	111.9	R149 C171 T176	R149-S174 CarbonylContact O-C 3.57Å; C171-S174 VanDerWaalsContact O-CB 3.31Å; C171-S174 WeakPolarHBondContact O-CB 3.49Å; C171-S174 PolarHBondContact O-N 3.43Å; S174-T176 PolarHBondContact O-N 2.93Å
175	G	94.2	Very high	94.8	Very high	4 Å²	4	45 Å²	45	4%	0.041	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	3.1	-176.7	0	0	0	0	0	114.8	C37 R41 C145 R149 G173	C37-G175 PolarHBondContact SG-O 3.04Å; R41-G175 PolarHBondContact NH2-O 3.19Å; C145-G175 PolarHBondContact N-O 2.96Å; C145-G175 WeakPolarHBondContact O-CA 3.46Å; R149-G175 PolarHBondContact O-N 3.45Å; G173-G175 PolarHBondContact O-N 3.34Å
176	T	94.7	Very high	94.9	Very high	20 Å²	20	48.5 Å²	48.5	12%	0.123	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-112.6	156.2	-179.4	75.5	0	0	0	0	111.2	C145 F150 G151 G173 S174 F178	C145-T176 PolarHBondContact SG-O 2.04Å; F150-T176 CarbonylContact C-O 3.01Å; F150-T176 WeakPolarHBondContact CA-O 3.32Å; G151-T176 PolarHBondContact N-O 2.88Å; G151-T176 VanDerWaalsContact N-O 3.12Å; G173-T176 WeakPolarHBondContact CA-OG1 3.46Å; G173-T176 WeakPolarHBondContact O-CB 3.13Å; G173-T176 PolarHBondContact O-N 3.08Å; G173-T176 PolarHBondContact O-OG1 3.48Å; S174-T176 PolarHBondContact O-N 2.93Å; T176-F178 PolarHBondContact O-N 3.46Å; T176-F178 PolarHBondContact OG1-N 3.34Å; T176-F178 PolarHBondContact OG1-O 2.89Å; T176-F178 VanDerWaalsContact OG1-O 3.07Å
177	R	94	Very high	95.1	Very high	44 Å²	44	51.2 Å²	51.2	17%	0.166	30%	0.299	C	S	.	.	S	Bend	trans	-74	5	170.7	-71.6	-85.5	-169.1	-75.4	-0.9	113.1	K142 V143 C144 C145 G151 P152 C154	K142-R177 VanDerWaalsContact C-NH2 3.26Å; K142-R177 PolarHBondContact O-NE 2.74Å; K142-R177 PolarHBondContact O-NH2 3.22Å; K142-R177 VanDerWaalsContact O-NH2 3.12Å; V143-R177 WeakPolarHBondContact O-CG 3.48Å; C144-R177 PolarHBondContact O-NH1 2.88Å; C144-R177 PolarHBondContact O-NH2 3.06Å; C145-R177 PolarHBondContact SG-NH1 3.29Å; G151-R177 CarbonylContact C-O 3.56Å; G151-R177 WeakPolarHBondContact CA-O 3.11Å; G151-R177 CarbonylContact O-C 3.14Å; G151-R177 WeakPolarHBondContact O-CA 3.47Å; P152-R177 WeakPolarHBondContact CA-O 3.49Å; P152-R177 VanDerWaalsContact O-CD 3.31Å; P152-R177 WeakPolarHBondContact O-CD 3.45Å; C154-R177 PolarHBondContact SG-NH1 2.94Å
178	F	91	Very high	95.2	Very high	125 Å²	125	49.8 Å²	49.8	55%	0.548	28%	0.284	S	S	.	.			trans	-126.6	-167.8	179.9	-63.2	-82.2	0	0	0	110.9	D35 G151 T176	D35-F178 VanDerWaalsContact CG-CE2 3.46Å; D35-F178 VanDerWaalsContact OD1-CE2 3.29Å; D35-F178 WeakPolarHBondContact OD1-CE2 3.46Å; D35-F178 WeakPolarHBondContact OD2-CD2 3.31Å; D35-F178 WeakPolarHBondContact OD2-CE2 3.33Å; G151-F178 PolarHBondContact N-O 3.28Å; G151-F178 VanDerWaalsContact N-O 3.07Å; T176-F178 PolarHBondContact O-N 3.46Å; T176-F178 PolarHBondContact OG1-N 3.34Å; T176-F178 PolarHBondContact OG1-O 2.89Å; T176-F178 VanDerWaalsContact OG1-O 3.07Å
179	G	90.7	Very high	95.3	Very high	33 Å²	33	51.3 Å²	51.3	34%	0.34	29%	0.29	S	S	.	.	S	Bend	trans	88.7	170.1	-179.2	0	0	0	0	0	113.6
180	T	94.5	Very high	95.4	Very high	80 Å²	80	55.6 Å²	55.6	49%	0.491	31%	0.308	S	S	.	.			trans	-100.9	-10.7	-170.6	59.8	0	0	0	0	112.6	F150 H172 K182	F150-T180 VanDerWaalsContact CE2-C 3.49Å; H172-T180 PolarHBondContact ND1-N 2.96Å; H172-T180 VanDerWaalsContact ND1-N 3.17Å; H172-T180 PolarHBondContact ND1-OG1 3.27Å; H172-T180 PolarHBondContact O-N 2.84Å; T180-K182 PolarHBondContact O-N 2.9Å; T180-K182 VanDerWaalsContact O-N 3.09Å
181	G	94.1	Very high	95.4	Very high	5 Å²	5	53.1 Å²	53.1	5%	0.052	31%	0.306	C	S	.	.			trans	68.8	0.3	-174.5	0	0	0	0	0	114.8	F150 P158 H172	F150-G181 VanDerWaalsContact CD2-CA 3.45Å; F150-G181 VanDerWaalsContact CD2-N 3.28Å; P158-G181 WeakPolarHBondContact CD-O 3.35Å; P158-G181 WeakPolarHBondContact CG-O 3.17Å; H172-G181 PolarHBondContact O-N 3.11Å
182	K	96.7	Very high	95.4	Very high	149 Å²	149	62 Å²	62	65%	0.648	34%	0.343	S	S	*	.			trans	-68.6	141.6	176.8	-66.3	-179.7	-178.8	175.3	0	109.3	H172 T180	H172-K182 VanDerWaalsContact CB-O 3.29Å; H172-K182 WeakPolarHBondContact CB-O 3.02Å; H172-K182 PolarHBondContact N-O 3.07Å; T180-K182 PolarHBondContact O-N 2.9Å; T180-K182 VanDerWaalsContact O-N 3.09Å
183	C	97.3	Very high	95.4	Very high	18 Å²	18	61.3 Å²	61.3	12%	0.122	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	130.8	173.6	-67.1	0	0	0	0	111.4	C165 D170 K192 C194	C165-C183 WeakPolarHBondContact CA-SG 3.5Å; C165-C183 HydrophobicContact CB-CB 3.72Å; C165-C183 WeakPolarHBondContact CB-SG 3.46Å; C165-C183 WeakPolarHBondContact SG-CA 3Å; C165-C183 WeakPolarHBondContact SG-CB 3.03Å; C165-C183 CovalentContact SG-SG 2.03Å; C165-C183 PolarHBondContact SG-SG 3.46Å; D170-C183 CarbonylContact O-C 3.46Å; D170-C183 WeakPolarHBondContact O-CA 3.15Å; C183-K192 WeakPolarHBondContact CB-O 3.37Å; C183-C194 VanDerWaalsContact CB-SG 3.55Å
184	I	97.4	Very high	95.5	Very high	98 Å²	98	60.5 Å²	60.5	50%	0.503	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	105.1	167.6	-56.2	171.3	0	0	0	105.8	G169 D170 H172	G169-I184 CarbonylContact C-O 3.53Å; G169-I184 WeakPolarHBondContact CA-O 3.3Å; D170-I184 PolarHBondContact N-O 2.96Å; D170-I184 PolarHBondContact O-N 2.04Å; H172-I184 HydrophobicContact CB-CD1 3.98Å; H172-I184 HydrophobicContact CB-CG1 4.27Å
185	C	97.8	Very high	95.6	Very high	39 Å²	39	62 Å²	62	26%	0.264	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	142.1	-171.1	-57.4	0	0	0	0	112.6	Y189 G191 C194	C185-Y189 WeakPolarHBondContact CB-O 2.92Å; C185-G191 PolarHBondContact SG-O 2.94Å; C185-G191 VanDerWaalsContact SG-O 3.33Å; C185-C194 WeakPolarHBondContact CA-SG 3.35Å; C185-C194 HydrophobicContact CB-CB 3.76Å; C185-C194 WeakPolarHBondContact CB-SG 3.2Å; C185-C194 WeakPolarHBondContact SG-CA 3.13Å; C185-C194 WeakPolarHBondContact SG-CB 2.96Å; C185-C194 CovalentContact SG-SG 2.04Å; C185-C194 PolarHBondContact SG-SG 3.37Å
186	H	97.6	Very high	95.6	Very high	74 Å²	74	68.6 Å²	68.6	34%	0.343	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-65.7	159.6	169.5	-57.5	153	0	0	0	110.2	N168 G169 D170 G188 Y189	N168-H186 PolarHBondContact O-N 3.06Å; G169-H186 PolarHBondContact N-CE1 3.04Å; G169-H186 PolarHBondContact N-ND1 2.94Å; D170-H186 IonicContact OD1-CE1 3.44Å; D170-H186 IonicContact OD1-NE2 2.84Å; D170-H186 PolarHBondContact OD1-NE2 3.1Å; D170-H186 IonicContact OD2-CD2 2.74Å; D170-H186 IonicContact OD2-NE2 3.61Å; D170-H186 PolarHBondContact OD2-NE2 3.09Å; H186-G188 PolarHBondContact O-N 3.08Å; H186-Y189 HydrophobicContact CB-CD2 4.35Å; H186-Y189 PolarHBondContact O-N 3.23Å; H186-Y189 VanDerWaalsContact O-N 3.08Å
187	A	96.9	Very high	95.7	Very high	91 Å²	91	68.4 Å²	68.4	75%	0.752	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	134.4	178.3	0	0	0	0	0	111.2
188	G	97	Very high	95.9	Very high	5 Å²	5	67.3 Å²	67.3	5%	0.052	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.4	-5.6	-176.1	0	0	0	0	0	115.5	H186 C197 A198 Y201	H186-G188 PolarHBondContact O-N 3.08Å; G188-C197 CarbonylContact O-C 3.48Å; G188-C197 WeakPolarHBondContact O-CA 3.48Å; G188-A198 VanDerWaalsContact C-CB 3.45Å; G188-A198 PolarHBondContact O-N 2.81Å; G188-Y201 VanDerWaalsContact CA-CD1 3.46Å; G188-Y201 VanDerWaalsContact CA-CZ 3.41Å
189	Y	97.9	Very high	96.1	Very high	40 Å²	40	67.1 Å²	67.1	16%	0.157	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	153.8	177.4	-58.4	-84.1	0	0	0	112.2	N168 C185 H186 K196 V211 C213	N168-Y189 HydrophobicContact CB-CD1 3.83Å; N168-Y189 HydrophobicContact CB-CD2 3.96Å; N168-Y189 HydrophobicContact CB-CE1 4.15Å; N168-Y189 HydrophobicContact CB-CE2 4.26Å; N168-Y189 HydrophobicContact CB-CG 3.72Å; N168-Y189 WeakPolarHBondContact ND2-CD1 3.46Å; N168-Y189 WeakPolarHBondContact ND2-CE1 3.43Å; C185-Y189 WeakPolarHBondContact CB-O 2.92Å; H186-Y189 HydrophobicContact CB-CD2 4.35Å; H186-Y189 PolarHBondContact O-N 3.23Å; H186-Y189 VanDerWaalsContact O-N 3.08Å; Y189-K196 CarbonylContact C-O 3.49Å; Y189-K196 VanDerWaalsContact CA-O 3.29Å; Y189-K196 WeakPolarHBondContact CA-O 3.46Å; Y189-V211 HydrophobicContact CD1-CG1 4.28Å; Y189-V211 HydrophobicContact CE1-CG1 4.14Å; Y189-V211 WeakPolarHBondContact CE1-O 2.93Å; Y189-C213 HydrophobicContact CD1-CB 4.2Å; Y189-C213 HydrophobicContact CE1-CB 3.68Å; Y189-C213 WeakPolarHBondContact CE1-SG 3.11Å; Y189-C213 PolarHBondContact OH-N 2.78Å
190	Q	96.7	Very high	96.3	Very high	93 Å²	93	68.3 Å²	68.3	44%	0.435	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	173	179.3	69.6	179.4	-7.5	0	0	112.8	C194 K196 C197 A198	Q190-C194 WeakPolarHBondContact O-CA 3.38Å; Q190-K196 HydrophobicContact CG-CB 3.94Å; Q190-K196 PolarHBondContact N-O 2.03Å; Q190-K196 PolarHBondContact O-N 2.81Å; Q190-C197 VanDerWaalsContact CD-O 3.3Å; Q190-C197 WeakPolarHBondContact CG-O 3.31Å; Q190-C197 PolarHBondContact NE2-O 3.08Å; Q190-A198 HydrophobicContact CB-CB 4.46Å
191	G	95.7	Very high	96.4	Very high	44 Å²	44	68 Å²	68	45%	0.454	35%	0.349	S	S	.	.	S	Bend	trans	89.9	171.2	-179.8	0	0	0	0	0	113	C185 L193 C194	C185-G191 PolarHBondContact SG-O 2.94Å; C185-G191 VanDerWaalsContact SG-O 3.33Å; G191-L193 PolarHBondContact O-N 3.1Å; G191-C194 PolarHBondContact O-N 2.86Å; G191-C194 VanDerWaalsContact O-N 3.17Å
192	K	95.7	Very high	96.6	Very high	196 Å²	196	69.8 Å²	69.8	85%	0.852	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-26.5	-171.6	-66	-175.1	178.7	-179	0	114.8	C183	C183-K192 WeakPolarHBondContact CB-O 3.37Å
193	L	95.2	Very high	96.6	Very high	67 Å²	67	65.8 Å²	65.8	35%	0.351	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.8	11.4	-175.9	-62.1	173	0	0	0	112.5	P158 F166 G191 R195	P158-L193 HydrophobicContact CB-CD2 3.64Å; P158-L193 HydrophobicContact CG-CD2 4.29Å; F166-L193 HydrophobicContact CD2-CB 4.01Å; F166-L193 HydrophobicContact CE2-CB 3.91Å; F166-L193 HydrophobicContact CE2-CD1 3.94Å; F166-L193 HydrophobicContact CE2-CD2 4.38Å; F166-L193 HydrophobicContact CE2-CG 4.29Å; G191-L193 PolarHBondContact O-N 3.1Å; L193-R195 HydrophobicContact CB-CG 4.14Å; L193-R195 WeakPolarHBondContact O-CG 3.21Å; L193-R195 PolarHBondContact O-N 2.74Å; L193-R195 VanDerWaalsContact O-N 3.15Å
194	C	96.6	Very high	96.5	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.36	C	S	.	.	S	Bend	trans	56.6	30.8	-179.3	-46.9	0	0	0	0	114.7	N168 C183 C185 Q190 G191	N168-C194 HydrophobicContact CB-CB 3.8Å; N168-C194 VanDerWaalsContact CB-O 3.29Å; N168-C194 WeakPolarHBondContact CB-O 3.48Å; N168-C194 PolarHBondContact ND2-O 2.76Å; N168-C194 VanDerWaalsContact O-CB 3.23Å; N168-C194 WeakPolarHBondContact O-CB 3.43Å; C183-C194 VanDerWaalsContact CB-SG 3.55Å; C185-C194 WeakPolarHBondContact CA-SG 3.35Å; C185-C194 HydrophobicContact CB-CB 3.76Å; C185-C194 WeakPolarHBondContact CB-SG 3.2Å; C185-C194 WeakPolarHBondContact SG-CA 3.13Å; C185-C194 WeakPolarHBondContact SG-CB 2.96Å; C185-C194 CovalentContact SG-SG 2.04Å; C185-C194 PolarHBondContact SG-SG 3.37Å; Q190-C194 WeakPolarHBondContact O-CA 3.38Å; G191-C194 PolarHBondContact O-N 2.86Å; G191-C194 VanDerWaalsContact O-N 3.17Å
195	R	95	Very high	96.3	Very high	78 Å²	78	68.8 Å²	68.8	29%	0.294	36%	0.358	S	S	.	.			trans	-99.4	13	-178.7	-70.1	-164.9	64.1	-173.8	2	114.1	F166 L193 K208	F166-R195 HydrophobicContact CB-CG 4.11Å; F166-R195 HydrophobicContact CD1-CG 4.44Å; F166-R195 VanDerWaalsContact CD2-CD 3.49Å; F166-R195 HydrophobicContact CD2-CG 3.55Å; F166-R195 HydrophobicContact CE2-CG 4.09Å; F166-R195 HydrophobicContact CG-CG 3.76Å; L193-R195 HydrophobicContact CB-CG 4.14Å; L193-R195 WeakPolarHBondContact O-CG 3.21Å; L193-R195 PolarHBondContact O-N 2.74Å; L193-R195 VanDerWaalsContact O-N 3.15Å; R195-K208 PolarHBondContact NH2-O 2.79Å
196	K	95.8	Very high	96.1	Very high	141 Å²	141	72.6 Å²	72.6	61%	0.613	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	144	177.1	-61.9	-174.8	178.5	-172.9	0	108.6	Y189 Q190	Y189-K196 CarbonylContact C-O 3.49Å; Y189-K196 VanDerWaalsContact CA-O 3.29Å; Y189-K196 WeakPolarHBondContact CA-O 3.46Å; Q190-K196 HydrophobicContact CG-CB 3.94Å; Q190-K196 PolarHBondContact N-O 2.03Å; Q190-K196 PolarHBondContact O-N 2.81Å
197	C	96.9	Very high	95.8	Very high	17 Å²	17	72.3 Å²	72.3	12%	0.115	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	138.3	170.2	-57.2	0	0	0	0	110.1	G188 Q190 V203 C213	G188-C197 CarbonylContact O-C 3.48Å; G188-C197 WeakPolarHBondContact O-CA 3.48Å; Q190-C197 VanDerWaalsContact CD-O 3.3Å; Q190-C197 WeakPolarHBondContact CG-O 3.31Å; Q190-C197 PolarHBondContact NE2-O 3.08Å; C197-V203 WeakPolarHBondContact SG-CG2 3.26Å; C197-C213 WeakPolarHBondContact CA-SG 3.23Å; C197-C213 HydrophobicContact CB-CB 3.8Å; C197-C213 WeakPolarHBondContact CB-SG 3.38Å; C197-C213 WeakPolarHBondContact SG-CB 3.35Å; C197-C213 CovalentContact SG-SG 2.03Å; C197-C213 PolarHBondContact SG-SG 3.37Å
198	A	97.4	Very high	95.3	Very high	21 Å²	21	77 Å²	77	17%	0.174	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-63.9	171.6	173	0	0	0	0	0	111	G188 Q190 N200 Y201	G188-A198 VanDerWaalsContact C-CB 3.45Å; G188-A198 PolarHBondContact O-N 2.81Å; Q190-A198 HydrophobicContact CB-CB 4.46Å; A198-N200 PolarHBondContact O-N 3.07Å; A198-Y201 HydrophobicContact CB-CD2 4.12Å; A198-Y201 PolarHBondContact O-N 2.94Å
199	H	94.5	Very high	94.7	Very high	121 Å²	121	80.5 Å²	80.5	56%	0.56	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	138.6	172.4	-171.1	68.2	0	0	0	110.8	Y201	H199-Y201 VanDerWaalsContact C-N 3.3Å; H199-Y201 WeakPolarHBondContact O-CD2 3.45Å; H199-Y201 PolarHBondContact O-N 3.42Å
200	N	95.5	Very high	94.3	Very high	57 Å²	57	81 Å²	81	31%	0.305	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	24.1	-173	-59.3	-37.7	0	0	0	115.9	A198 P215 C216 G223	A198-N200 PolarHBondContact O-N 3.07Å; N200-P215 WeakPolarHBondContact O-CA 3.4Å; N200-C216 WeakPolarHBondContact O-CB 3.29Å; N200-C216 PolarHBondContact O-N 3Å; N200-C216 PolarHBondContact O-SG 3.2Å; N200-G223 WeakPolarHBondContact OD1-CA 3.34Å; N200-G223 PolarHBondContact OD1-N 3.12Å
201	Y	97.7	Very high	94.2	Very high	75 Å²	75	76.8 Å²	76.8	29%	0.294	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	149.4	167.9	-71.8	-110.9	0	0	0	109.9	G188 A198 H199 C213 T214 P215	G188-Y201 VanDerWaalsContact CA-CD1 3.46Å; G188-Y201 VanDerWaalsContact CA-CZ 3.41Å; A198-Y201 HydrophobicContact CB-CD2 4.12Å; A198-Y201 PolarHBondContact O-N 2.94Å; H199-Y201 VanDerWaalsContact C-N 3.3Å; H199-Y201 WeakPolarHBondContact O-CD2 3.45Å; H199-Y201 PolarHBondContact O-N 3.42Å; Y201-C213 HydrophobicContact CD1-CB 4.31Å; Y201-T214 CarbonylContact C-O 3.58Å; Y201-T214 VanDerWaalsContact CA-O 3.23Å; Y201-T214 WeakPolarHBondContact CA-O 3.37Å; Y201-T214 VanDerWaalsContact CD1-C 3.44Å; Y201-P215 HydrophobicContact CD1-CB 4.24Å; Y201-P215 HydrophobicContact CE1-CB 3.93Å; Y201-P215 HydrophobicContact CE1-CG 4.33Å
202	Y	96.6	Very high	94.2	Very high	42 Å²	42	76.4 Å²	76.4	17%	0.165	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	156.8	174.6	71	-81.5	0	0	0	111.1	V204 C213 T214 P215 C224 G227	Y202-V204 HydrophobicContact CD2-CG2 4.34Å; Y202-V204 HydrophobicContact CE2-CG2 3.65Å; Y202-C213 WeakPolarHBondContact O-CA 3.04Å; Y202-T214 WeakPolarHBondContact CD1-O 3.44Å; Y202-T214 HydrophobicContact CE1-CG2 3.83Å; Y202-T214 PolarHBondContact N-O 3.5Å; Y202-T214 PolarHBondContact O-N 2.85Å; Y202-P215 WeakPolarHBondContact CE1-O 3.37Å; Y202-C224 WeakPolarHBondContact CD1-SG 3.01Å; Y202-G227 VanDerWaalsContact CE2-N 3.34Å; Y202-G227 VanDerWaalsContact CZ-CA 3.41Å; Y202-G227 WeakPolarHBondContact OH-CA 3.43Å; Y202-G227 PolarHBondContact OH-N 3.17Å
203	V	97	Very high	94.3	Very high	64 Å²	64	67.7 Å²	67.7	39%	0.388	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	122.6	177.8	176	0	0	0	0	109	C197 E206 V211	C197-V203 WeakPolarHBondContact SG-CG2 3.26Å; V203-E206 HydrophobicContact CG1-CB 3.68Å; V203-V211 HydrophobicContact CG1-CG2 4.21Å; V203-V211 HydrophobicContact CG2-CG2 4.05Å
204	V	95.7	Very high	94.4	Very high	82 Å²	82	66.8 Å²	66.8	50%	0.497	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	-44.8	169.6	177.9	0	0	0	0	110.5	Y202 S212 T214	Y202-V204 HydrophobicContact CD2-CG2 4.34Å; Y202-V204 HydrophobicContact CE2-CG2 3.65Å; V204-S212 PolarHBondContact N-O 3.06Å; V204-T214 WeakPolarHBondContact CG2-OG1 3.49Å
205	H	93.7	Very high	94.5	Very high	98 Å²	98	70.2 Å²	70.2	45%	0.454	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	132.1	-179.8	174.1	-85.1	0	0	0	109.1	V211 S212	H205-V211 WeakPolarHBondContact O-CA 3.49Å; H205-S212 PolarHBondContact O-N 2.88Å
206	E	93.7	Very high	94.6	Very high	119 Å²	119	67.4 Å²	67.4	56%	0.556	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134	127.7	173.7	-178.1	172.1	-161.4	0	0	109.8	V203 V211	V203-E206 HydrophobicContact CG1-CB 3.68Å; E206-V211 HydrophobicContact CB-CG2 4.33Å; E206-V211 HydrophobicContact CG-CB 4.42Å; E206-V211 HydrophobicContact CG-CG2 4.39Å
207	N	90.4	Very high	94.7	Very high	67 Å²	67	64.2 Å²	64.2	36%	0.358	33%	0.334	S	S	.	.			trans	-128	-173.6	168.6	71.5	19.8	0	0	0	109.6	T209 H210	N207-T209 PolarHBondContact O-N 3.2Å; N207-T209 PolarHBondContact OD1-N 3.49Å; N207-T209 PolarHBondContact OD1-OG1 2.89Å; N207-T209 VanDerWaalsContact OD1-OG1 3.1Å; N207-H210 PolarHBondContact N-O 3.17Å; N207-H210 WeakPolarHBondContact OD1-CA 3.39Å; N207-H210 PolarHBondContact OD1-N 3.43Å; N207-H210 PolarHBondContact OD1-O 2.73Å
208	K	85.8	Confident	94.7	Very high	191 Å²	191	66.2 Å²	66.2	83%	0.83	36%	0.357	S	S	*	.	S	Bend	trans	-61.8	-26.4	-178.6	-67.6	-176.6	179.7	178	0	113.6	R195	R195-K208 PolarHBondContact NH2-O 2.79Å
209	T	85.2	Confident	94.7	Very high	78 Å²	78	65.2 Å²	65.2	48%	0.479	35%	0.348	S	S	.	.	S	Bend	trans	-114.1	-15.3	-170.1	59.7	0	0	0	0	114.4	F166 N207	F166-T209 WeakPolarHBondContact CD1-O 3.31Å; N207-T209 PolarHBondContact O-N 3.2Å; N207-T209 PolarHBondContact OD1-N 3.49Å; N207-T209 PolarHBondContact OD1-OG1 2.89Å; N207-T209 VanDerWaalsContact OD1-OG1 3.1Å
210	H	88.7	Confident	94.8	Very high	51 Å²	51	59.6 Å²	59.6	24%	0.236	32%	0.323	C	S	.	.			trans	-152.6	138.7	-171	-178.6	55.3	0	0	0	111.3	R163 N207	R163-H210 PolarHBondContact NH2-ND1 3.32Å; N207-H210 PolarHBondContact N-O 3.17Å; N207-H210 WeakPolarHBondContact OD1-CA 3.39Å; N207-H210 PolarHBondContact OD1-N 3.43Å; N207-H210 PolarHBondContact OD1-O 2.73Å
211	V	94.8	Very high	94.9	Very high	3 Å²	3	62 Å²	62	2%	0.018	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.9	169	62.5	0	0	0	0	107.8	N168 Y189 V203 H205 E206	N168-V211 PolarHBondContact ND2-O 3.48Å; N168-V211 VanDerWaalsContact ND2-O 3.16Å; Y189-V211 HydrophobicContact CD1-CG1 4.28Å; Y189-V211 HydrophobicContact CE1-CG1 4.14Å; Y189-V211 WeakPolarHBondContact CE1-O 2.93Å; V203-V211 HydrophobicContact CG1-CG2 4.21Å; V203-V211 HydrophobicContact CG2-CG2 4.05Å; H205-V211 WeakPolarHBondContact O-CA 3.49Å; E206-V211 HydrophobicContact CB-CG2 4.33Å; E206-V211 HydrophobicContact CG-CB 4.42Å; E206-V211 HydrophobicContact CG-CG2 4.39Å
212	S	96.7	Very high	94.7	Very high	36 Å²	36	60.2 Å²	60.2	25%	0.252	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.7	174.8	-178.2	0	0	0	0	109.3	V204 H205	V204-S212 PolarHBondContact N-O 3.06Å; H205-S212 PolarHBondContact O-N 2.88Å
213	C	97.6	Very high	94.6	Very high	13 Å²	13	58.5 Å²	58.5	9%	0.088	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	134.9	-175.5	-62.9	0	0	0	0	110.8	Y189 C197 Y201 Y202	Y189-C213 HydrophobicContact CD1-CB 4.2Å; Y189-C213 HydrophobicContact CE1-CB 3.68Å; Y189-C213 WeakPolarHBondContact CE1-SG 3.11Å; Y189-C213 PolarHBondContact OH-N 2.78Å; C197-C213 WeakPolarHBondContact CA-SG 3.23Å; C197-C213 HydrophobicContact CB-CB 3.8Å; C197-C213 WeakPolarHBondContact CB-SG 3.38Å; C197-C213 WeakPolarHBondContact SG-CB 3.35Å; C197-C213 CovalentContact SG-SG 2.03Å; C197-C213 PolarHBondContact SG-SG 3.37Å; Y201-C213 HydrophobicContact CD1-CB 4.31Å; Y202-C213 WeakPolarHBondContact O-CA 3.04Å
214	T	97.4	Very high	94.6	Very high	49 Å²	49	55.9 Å²	55.9	30%	0.301	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.4	177.3	-62.7	0	0	0	0	109.2	Y201 Y202 V204	Y201-T214 CarbonylContact C-O 3.58Å; Y201-T214 VanDerWaalsContact CA-O 3.23Å; Y201-T214 WeakPolarHBondContact CA-O 3.37Å; Y201-T214 VanDerWaalsContact CD1-C 3.44Å; Y202-T214 WeakPolarHBondContact CD1-O 3.44Å; Y202-T214 HydrophobicContact CE1-CG2 3.83Å; Y202-T214 PolarHBondContact N-O 3.5Å; Y202-T214 PolarHBondContact O-N 2.85Å; V204-T214 WeakPolarHBondContact CG2-OG1 3.49Å
215	P	97.6	Very high	94.5	Very high	72 Å²	72	59.2 Å²	59.2	47%	0.468	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	146.6	178.1	26.1	-35.4	0	0	0	111.2	N200 Y201 Y202	N200-P215 WeakPolarHBondContact O-CA 3.4Å; Y201-P215 HydrophobicContact CD1-CB 4.24Å; Y201-P215 HydrophobicContact CE1-CB 3.93Å; Y201-P215 HydrophobicContact CE1-CG 4.33Å; Y202-P215 WeakPolarHBondContact CE1-O 3.37Å
216	C	97.8	Very high	94.6	Very high	19 Å²	19	59.6 Å²	59.6	13%	0.128	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-63.6	161.4	170.7	-64.2	0	0	0	0	111.7	N200 C220 C224	N200-C216 WeakPolarHBondContact O-CB 3.29Å; N200-C216 PolarHBondContact O-N 3Å; N200-C216 PolarHBondContact O-SG 3.2Å; C216-C220 HydrophobicContact CB-CB 4.01Å; C216-C224 WeakPolarHBondContact CA-SG 3.36Å; C216-C224 HydrophobicContact CB-CB 3.71Å; C216-C224 WeakPolarHBondContact CB-SG 3.01Å; C216-C224 WeakPolarHBondContact SG-CB 3.29Å; C216-C224 PolarHBondContact SG-N 2.93Å; C216-C224 CovalentContact SG-SG 2.02Å; C216-C224 PolarHBondContact SG-SG 3.33Å
217	H	97.5	Very high	94.6	Very high	74 Å²	74	55.1 Å²	55.1	34%	0.343	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-58.8	147.2	171.5	-168.9	-96.2	0	0	0	110.8	A219 C220	H217-A219 WeakPolarHBondContact ND1-CB 3.47Å; H217-A219 PolarHBondContact ND1-N 3.11Å; H217-A219 PolarHBondContact O-N 3.34Å; H217-A219 VanDerWaalsContact O-N 3.1Å; H217-C220 WeakPolarHBondContact O-CB 3.47Å; H217-C220 PolarHBondContact O-N 2.65Å
218	G	96.6	Very high	94.9	Very high	58 Å²	58	53.1 Å²	53.1	60%	0.598	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.5	-178.6	0	0	0	0	0	114	C220	G218-C220 PolarHBondContact O-N 2.67Å
219	A	97.4	Very high	95.4	Very high	0 Å²	0	46 Å²	46	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-16.7	174.1	0	0	0	0	0	114.4	H217 C235 Q236 W239 C247	H217-A219 WeakPolarHBondContact ND1-CB 3.47Å; H217-A219 PolarHBondContact ND1-N 3.11Å; H217-A219 PolarHBondContact O-N 3.34Å; H217-A219 VanDerWaalsContact O-N 3.1Å; A219-C235 CarbonylContact O-C 3.59Å; A219-C235 WeakPolarHBondContact O-CA 3.4Å; A219-Q236 PolarHBondContact O-N 3.25Å; A219-W239 HydrophobicContact CB-CD2 3.32Å; A219-W239 HydrophobicContact CB-CE3 3.42Å; A219-W239 VanDerWaalsContact CB-CE3 3.42Å; A219-W239 HydrophobicContact CB-CG 3.84Å; A219-W239 HydrophobicContact CB-CH2 4.07Å; A219-W239 HydrophobicContact CB-CZ2 3.97Å; A219-W239 HydrophobicContact CB-CZ3 3.8Å; A219-C247 HydrophobicContact CB-CB 3.69Å
220	C	97.9	Very high	95.9	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.02	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	135.7	-172.5	-57.4	0	0	0	0	112.5	C216 H217 G218 C232 Q236	C216-C220 HydrophobicContact CB-CB 4.01Å; H217-C220 WeakPolarHBondContact O-CB 3.47Å; H217-C220 PolarHBondContact O-N 2.65Å; G218-C220 PolarHBondContact O-N 2.67Å; C220-C232 WeakPolarHBondContact CA-SG 3.42Å; C220-C232 HydrophobicContact CB-CB 3.73Å; C220-C232 WeakPolarHBondContact CB-SG 3.42Å; C220-C232 PolarHBondContact N-SG 3.37Å; C220-C232 WeakPolarHBondContact SG-CA 3.04Å; C220-C232 WeakPolarHBondContact SG-CB 3.32Å; C220-C232 CovalentContact SG-SG 2.03Å; C220-C232 PolarHBondContact SG-SG 2.89Å; C220-Q236 VanDerWaalsContact O-CG 3.29Å; C220-Q236 WeakPolarHBondContact O-CG 3.42Å; C220-Q236 PolarHBondContact O-NE2 3.15Å
221	K	96.5	Very high	96.2	Very high	109 Å²	109	43.5 Å²	43.5	47%	0.474	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130.4	169.2	-171	179.1	173.2	-168.5	0	109.8	G223 D234 C235 Q236	K221-G223 VanDerWaalsContact C-N 3.34Å; K221-G223 PolarHBondContact O-N 2.04Å; K221-D234 HydrophobicContact CB-CB 4.2Å; K221-D234 PolarHBondContact N-O 2.78Å; K221-C235 WeakPolarHBondContact CB-O 3.15Å; K221-C235 WeakPolarHBondContact CD-O 3.35Å; K221-Q236 HydrophobicContact CB-CG 3.99Å
222	G	93.2	Very high	96.4	Very high	36 Å²	36	43.9 Å²	43.9	37%	0.371	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	73.6	21.1	174.2	0	0	0	0	0	115.2
223	G	94.8	Very high	96.3	Very high	7 Å²	7	50.3 Å²	50.3	7%	0.072	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	98.3	178.6	176.6	0	0	0	0	0	115.5	N200 K221 R233	N200-G223 WeakPolarHBondContact OD1-CA 3.34Å; N200-G223 PolarHBondContact OD1-N 3.12Å; K221-G223 VanDerWaalsContact C-N 3.34Å; K221-G223 PolarHBondContact O-N 2.04Å; G223-R233 PolarHBondContact O-N 2.76Å; G223-R233 VanDerWaalsContact O-N 3.16Å
224	C	96.9	Very high	96.2	Very high	9 Å²	9	53.6 Å²	53.6	6%	0.061	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	162.6	-174.5	62.4	0	0	0	0	111.2	Y202 C216 G231	Y202-C224 WeakPolarHBondContact CD1-SG 3.01Å; C216-C224 WeakPolarHBondContact CA-SG 3.36Å; C216-C224 HydrophobicContact CB-CB 3.71Å; C216-C224 WeakPolarHBondContact CB-SG 3.01Å; C216-C224 WeakPolarHBondContact SG-CB 3.29Å; C216-C224 PolarHBondContact SG-N 2.93Å; C216-C224 CovalentContact SG-SG 2.02Å; C216-C224 PolarHBondContact SG-SG 3.33Å; C224-G231 CarbonylContact C-O 3.45Å; C224-G231 WeakPolarHBondContact CA-O 3.46Å; C224-G231 VanDerWaalsContact CB-O 3.23Å; C224-G231 WeakPolarHBondContact CB-O 3.02Å
225	Q	94.5	Very high	96.3	Very high	151 Å²	151	51.8 Å²	51.8	71%	0.706	29%	0.293	S	S	*	.	S	Bend	trans	-94.9	-29.6	177.1	-58.7	-179.9	29	0	0	112.1	G231	Q225-G231 PolarHBondContact N-O 3.03Å
226	K	95.2	Very high	96.2	Very high	106 Å²	106	52.5 Å²	52.5	46%	0.461	29%	0.29	S	S	.	.	S	Bend	trans	-150.9	174	179.9	56.2	171	169.3	167.5	0	109.7	D230	K226-D230 WeakPolarHBondContact CE-OD2 3.49Å; K226-D230 IonicContact NZ-OD2 2.59Å; K226-D230 PolarHBondContact NZ-OD2 3.11Å
227	G	95	Very high	96.2	Very high	25 Å²	25	56.9 Å²	56.9	26%	0.258	32%	0.321	S	S	.	.	S	Bend	trans	-66.7	156.4	172.1	0	0	0	0	0	111.8	Y202	Y202-G227 VanDerWaalsContact CE2-N 3.34Å; Y202-G227 VanDerWaalsContact CZ-CA 3.41Å; Y202-G227 WeakPolarHBondContact OH-CA 3.43Å; Y202-G227 PolarHBondContact OH-N 3.17Å
228	G	95.8	Very high	96.2	Very high	25 Å²	25	54 Å²	54	26%	0.258	31%	0.311	S	S	.	.	S	Bend	trans	90	166.3	-178.4	0	0	0	0	0	114.3	D230 G231	G228-D230 VanDerWaalsContact C-N 3.27Å; G228-D230 PolarHBondContact O-N 2.57Å; G228-G231 PolarHBondContact O-N 3Å
229	P	95.9	Very high	96.3	Very high	41 Å²	41	53.4 Å²	53.4	27%	0.266	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-68.4	-23.8	179.8	25.2	-32.6	0	0	0	113.8	G231 C232 G246 C247	P229-G231 PolarHBondContact O-N 3.31Å; P229-C232 PolarHBondContact O-N 3.02Å; P229-C232 PolarHBondContact O-SG 2.81Å; P229-G246 WeakPolarHBondContact O-CA 3.39Å; P229-C247 HydrophobicContact CB-CB 4.36Å; P229-C247 WeakPolarHBondContact CB-O 3.34Å; P229-C247 PolarHBondContact O-N 3.35Å
230	D	96.2	Very high	96.2	Very high	75 Å²	75	59.2 Å²	59.2	40%	0.401	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-72.3	-16.1	174.7	68.3	-35.1	0	0	0	113.5	K226 G228 K245	K226-D230 WeakPolarHBondContact CE-OD2 3.49Å; K226-D230 IonicContact NZ-OD2 2.59Å; K226-D230 PolarHBondContact NZ-OD2 3.11Å; G228-D230 VanDerWaalsContact C-N 3.27Å; G228-D230 PolarHBondContact O-N 2.57Å; D230-K245 WeakPolarHBondContact CB-O 3.32Å
231	G	95.8	Very high	96.2	Very high	3 Å²	3	63.5 Å²	63.5	3%	0.031	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-84.3	-8.9	174.4	0	0	0	0	0	114.7	C224 Q225 G228 P229	C224-G231 CarbonylContact C-O 3.45Å; C224-G231 WeakPolarHBondContact CA-O 3.46Å; C224-G231 VanDerWaalsContact CB-O 3.23Å; C224-G231 WeakPolarHBondContact CB-O 3.02Å; Q225-G231 PolarHBondContact N-O 3.03Å; G228-G231 PolarHBondContact O-N 3Å; P229-G231 PolarHBondContact O-N 3.31Å
232	C	97.3	Very high	96.2	Very high	11 Å²	11	59.9 Å²	59.9	7%	0.074	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	142	-173	-59.6	0	0	0	0	112.6	C220 P229 C247	C220-C232 WeakPolarHBondContact CA-SG 3.42Å; C220-C232 HydrophobicContact CB-CB 3.73Å; C220-C232 WeakPolarHBondContact CB-SG 3.42Å; C220-C232 PolarHBondContact N-SG 3.37Å; C220-C232 WeakPolarHBondContact SG-CA 3.04Å; C220-C232 WeakPolarHBondContact SG-CB 3.32Å; C220-C232 CovalentContact SG-SG 2.03Å; C220-C232 PolarHBondContact SG-SG 2.89Å; P229-C232 PolarHBondContact O-N 3.02Å; P229-C232 PolarHBondContact O-SG 2.81Å; C232-C247 WeakPolarHBondContact CB-SG 3.22Å
233	R	95.4	Very high	96.3	Very high	170 Å²	170	64.1 Å²	64.1	64%	0.642	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	-38	171.8	-67.4	-178.3	179.5	-169.4	-1.5	112.3	G223	G223-R233 PolarHBondContact O-N 2.76Å; G223-R233 VanDerWaalsContact O-N 3.16Å
234	D	96.4	Very high	96.1	Very high	82 Å²	82	68 Å²	68	44%	0.439	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	161.4	175.7	-170	17.6	0	0	0	107.9	K221	K221-D234 HydrophobicContact CB-CB 4.2Å; K221-D234 PolarHBondContact N-O 2.78Å
235	C	97.7	Very high	96	Very high	11 Å²	11	73.7 Å²	73.7	7%	0.074	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	144.1	-178.6	-58.3	0	0	0	0	111.2	A219 K221 W239 M241 C247	A219-C235 CarbonylContact O-C 3.59Å; A219-C235 WeakPolarHBondContact O-CA 3.4Å; K221-C235 WeakPolarHBondContact CB-O 3.15Å; K221-C235 WeakPolarHBondContact CD-O 3.35Å; C235-W239 HydrophobicContact CB-CB 3.85Å; C235-M241 PolarHBondContact SG-N 3.15Å; C235-C247 WeakPolarHBondContact CA-SG 3.05Å; C235-C247 HydrophobicContact CB-CB 3.95Å; C235-C247 WeakPolarHBondContact CB-SG 3.35Å; C235-C247 WeakPolarHBondContact SG-CA 3.49Å; C235-C247 WeakPolarHBondContact SG-CB 3.49Å; C235-C247 CovalentContact SG-SG 2.04Å; C235-C247 PolarHBondContact SG-SG 2.98Å
236	Q	97.4	Very high	96.1	Very high	88 Å²	88	66.8 Å²	66.8	41%	0.411	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-68.4	165.4	167.8	-63.1	-148.7	6.7	0	0	110.5	A219 C220 K221 W239	A219-Q236 PolarHBondContact O-N 3.25Å; C220-Q236 VanDerWaalsContact O-CG 3.29Å; C220-Q236 WeakPolarHBondContact O-CG 3.42Å; C220-Q236 PolarHBondContact O-NE2 3.15Å; K221-Q236 HydrophobicContact CB-CG 3.99Å; Q236-W239 WeakPolarHBondContact O-CB 3.03Å; Q236-W239 PolarHBondContact O-N 3.13Å; Q236-W239 VanDerWaalsContact O-N 3.13Å
237	S	97.1	Very high	96.2	Very high	111 Å²	111	61.9 Å²	61.9	78%	0.776	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	142	169.3	-62.1	0	0	0	0	110.5	W239	S237-W239 VanDerWaalsContact C-N 3.3Å
238	G	96.8	Very high	96.3	Very high	14 Å²	14	63.8 Å²	63.8	14%	0.144	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	-2.9	-170.9	0	0	0	0	0	114.1	I250	G238-I250 WeakPolarHBondContact O-CB 3.15Å; G238-I250 PolarHBondContact O-N 2.02Å
239	W	98.2	Very high	96.4	Very high	44 Å²	44	64.2 Å²	64.2	17%	0.167	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	148.6	178.7	-58.1	79.7	0	0	0	110.8	A219 C235 Q236 S237 C247 E248 D249 P270	A219-W239 HydrophobicContact CB-CD2 3.32Å; A219-W239 HydrophobicContact CB-CE3 3.42Å; A219-W239 VanDerWaalsContact CB-CE3 3.42Å; A219-W239 HydrophobicContact CB-CG 3.84Å; A219-W239 HydrophobicContact CB-CH2 4.07Å; A219-W239 HydrophobicContact CB-CZ2 3.97Å; A219-W239 HydrophobicContact CB-CZ3 3.8Å; C235-W239 HydrophobicContact CB-CB 3.85Å; Q236-W239 WeakPolarHBondContact O-CB 3.03Å; Q236-W239 PolarHBondContact O-N 3.13Å; Q236-W239 VanDerWaalsContact O-N 3.13Å; S237-W239 VanDerWaalsContact C-N 3.3Å; W239-C247 HydrophobicContact CB-CB 4.21Å; W239-C247 HydrophobicContact CE3-CB 4.32Å; W239-E248 CarbonylContact C-O 3.56Å; W239-E248 WeakPolarHBondContact CA-O 3.49Å; W239-D249 HydrophobicContact CE3-CB 4.04Å; W239-D249 VanDerWaalsContact CE3-N 3.3Å; W239-D249 HydrophobicContact CH2-CB 4.23Å; W239-D249 HydrophobicContact CZ3-CB 3.82Å; W239-P270 HydrophobicContact CH2-CB 4Å; W239-P270 HydrophobicContact CZ2-CB 3.8Å
240	R	96.9	Very high	96.5	Very high	122 Å²	122	65 Å²	65	46%	0.46	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	140.6	176.3	63.4	178.1	-177.9	-168.2	-3.4	111.7	V242 C247 E248 I250	R240-V242 HydrophobicContact CG-CG2 4.15Å; R240-V242 PolarHBondContact O-N 2.89Å; R240-C247 WeakPolarHBondContact O-CA 3.29Å; R240-E248 PolarHBondContact N-O 2.82Å; R240-E248 PolarHBondContact O-N 2.85Å; R240-I250 HydrophobicContact CB-CD1 4.19Å; R240-I250 HydrophobicContact CB-CG1 3.95Å; R240-I250 HydrophobicContact CG-CG1 3.99Å
241	M	97.3	Very high	96.5	Very high	94 Å²	94	64.3 Å²	64.3	46%	0.463	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	113.6	176.3	-174	64.4	74.3	0	0	110.1	C235	C235-M241 PolarHBondContact SG-N 3.15Å
242	V	96.7	Very high	96.6	Very high	32 Å²	32	65.8 Å²	65.8	19%	0.194	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	122.4	175.7	-179.6	0	0	0	0	109.5	R240 G244 K245 G246 E248	R240-V242 HydrophobicContact CG-CG2 4.15Å; R240-V242 PolarHBondContact O-N 2.89Å; V242-G244 PolarHBondContact O-N 2.77Å; V242-K245 HydrophobicContact CB-CB 4.15Å; V242-K245 HydrophobicContact CG1-CB 4.12Å; V242-K245 HydrophobicContact CG1-CD 4.06Å; V242-K245 HydrophobicContact CG1-CG 4.25Å; V242-K245 PolarHBondContact O-N 3.34Å; V242-K245 VanDerWaalsContact O-N 3.07Å; V242-G246 PolarHBondContact N-O 2.74Å; V242-G246 PolarHBondContact O-N 3.33Å; V242-E248 HydrophobicContact CB-CB 4.47Å; V242-E248 HydrophobicContact CG2-CB 3.68Å
243	P	94.1	Very high	96.5	Very high	125 Å²	125	66.6 Å²	66.6	81%	0.812	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	126.2	178.5	-26.7	34.8	0	0	0	112.2	K245	P243-K245 VanDerWaalsContact C-N 3.25Å; P243-K245 PolarHBondContact O-N 3.16Å
244	G	91.1	Very high	96.5	Very high	88 Å²	88	65.7 Å²	65.7	91%	0.907	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	-11.1	179.3	0	0	0	0	0	116	V242	V242-G244 PolarHBondContact O-N 2.77Å
245	K	94.6	Very high	96.3	Very high	129 Å²	129	66 Å²	66	56%	0.561	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-23	176	-65.6	-172.6	-175.7	178.7	0	114.1	D230 V242 P243 E248	D230-K245 WeakPolarHBondContact CB-O 3.32Å; V242-K245 HydrophobicContact CB-CB 4.15Å; V242-K245 HydrophobicContact CG1-CB 4.12Å; V242-K245 HydrophobicContact CG1-CD 4.06Å; V242-K245 HydrophobicContact CG1-CG 4.25Å; V242-K245 PolarHBondContact O-N 3.34Å; V242-K245 VanDerWaalsContact O-N 3.07Å; P243-K245 VanDerWaalsContact C-N 3.25Å; P243-K245 PolarHBondContact O-N 3.16Å; K245-E248 WeakPolarHBondContact CD-OE2 3.2Å; K245-E248 IonicContact NZ-OE2 3.28Å; K245-E248 PolarHBondContact NZ-OE2 3.1Å
246	G	96.4	Very high	95.9	Very high	6 Å²	6	70 Å²	70	6%	0.062	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	87	-150.6	-174.5	0	0	0	0	0	113.6	P229 V242 E248	P229-G246 WeakPolarHBondContact O-CA 3.39Å; V242-G246 PolarHBondContact N-O 2.74Å; V242-G246 PolarHBondContact O-N 3.33Å; G246-E248 PolarHBondContact O-N 2.7Å
247	C	98.1	Very high	95.7	Very high	3 Å²	3	68.1 Å²	68.1	2%	0.02	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	106.5	178.4	-63	0	0	0	0	110.9	A219 P229 C232 C235 W239 R240	A219-C247 HydrophobicContact CB-CB 3.69Å; P229-C247 HydrophobicContact CB-CB 4.36Å; P229-C247 WeakPolarHBondContact CB-O 3.34Å; P229-C247 PolarHBondContact O-N 3.35Å; C232-C247 WeakPolarHBondContact CB-SG 3.22Å; C235-C247 WeakPolarHBondContact CA-SG 3.05Å; C235-C247 HydrophobicContact CB-CB 3.95Å; C235-C247 WeakPolarHBondContact CB-SG 3.35Å; C235-C247 WeakPolarHBondContact SG-CA 3.49Å; C235-C247 WeakPolarHBondContact SG-CB 3.49Å; C235-C247 CovalentContact SG-SG 2.04Å; C235-C247 PolarHBondContact SG-SG 2.98Å; W239-C247 HydrophobicContact CB-CB 4.21Å; W239-C247 HydrophobicContact CE3-CB 4.32Å; R240-C247 WeakPolarHBondContact O-CA 3.29Å
248	E	97.7	Very high	95.4	Very high	66 Å²	66	63.5 Å²	63.5	31%	0.308	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	141.4	172	-162.9	169.9	146.7	0	0	108.7	W239 R240 V242 K245 G246	W239-E248 CarbonylContact C-O 3.56Å; W239-E248 WeakPolarHBondContact CA-O 3.49Å; R240-E248 PolarHBondContact N-O 2.82Å; R240-E248 PolarHBondContact O-N 2.85Å; V242-E248 HydrophobicContact CB-CB 4.47Å; V242-E248 HydrophobicContact CG2-CB 3.68Å; K245-E248 WeakPolarHBondContact CD-OE2 3.2Å; K245-E248 IonicContact NZ-OE2 3.28Å; K245-E248 PolarHBondContact NZ-OE2 3.1Å; G246-E248 PolarHBondContact O-N 2.7Å
249	D	98	Very high	94.8	Very high	33 Å²	33	66.8 Å²	66.8	18%	0.176	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	140.6	176.5	-169.7	52.5	0	0	0	110	W239 N268 G271	W239-D249 HydrophobicContact CE3-CB 4.04Å; W239-D249 VanDerWaalsContact CE3-N 3.3Å; W239-D249 HydrophobicContact CH2-CB 4.23Å; W239-D249 HydrophobicContact CZ3-CB 3.82Å; D249-N268 PolarHBondContact OD2-ND2 2.02Å; D249-G271 WeakPolarHBondContact OD1-CA 3.17Å; D249-G271 PolarHBondContact OD1-N 3.29Å
250	I	97.6	Very high	93.7	Very high	57 Å²	57	68.5 Å²	68.5	29%	0.292	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-86.6	116	173.1	-62.6	172.7	0	0	0	106.4	G238 R240 E252 N268	G238-I250 WeakPolarHBondContact O-CB 3.15Å; G238-I250 PolarHBondContact O-N 2.02Å; R240-I250 HydrophobicContact CB-CD1 4.19Å; R240-I250 HydrophobicContact CB-CG1 3.95Å; R240-I250 HydrophobicContact CG-CG1 3.99Å; I250-E252 VanDerWaalsContact C-N 3.32Å; I250-E252 HydrophobicContact CG2-CG 4.18Å; I250-E252 PolarHBondContact O-N 2.92Å; I250-E252 VanDerWaalsContact O-OE2 3.14Å; I250-N268 PolarHBondContact O-OD1 2.92Å
251	D	96.8	Very high	92.9	Very high	62 Å²	62	67 Å²	67	33%	0.332	41%	0.409	S	S	.	.			trans	-75.2	90.8	170.8	-169.8	-19	0	0	0	109.2	C253 E254 N268	D251-C253 PolarHBondContact O-N 2.81Å; D251-C253 WeakPolarHBondContact OD1-CA 3.49Å; D251-C253 WeakPolarHBondContact OD1-CB 3.49Å; D251-C253 PolarHBondContact OD1-N 3.31Å; D251-E254 HydrophobicContact CB-CG 4.04Å; D251-E254 WeakPolarHBondContact O-CB 3.48Å; D251-E254 PolarHBondContact O-N 3.45Å; D251-N268 WeakPolarHBondContact OD1-CB 3.05Å
252	E	96.6	Very high	92.2	Very high	34 Å²	34	64.1 Å²	64.1	16%	0.159	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-63.6	-22.7	179.2	-69.2	94.5	-174.5	0	0	111.9	I250 E254 S255 P257 Y273	I250-E252 VanDerWaalsContact C-N 3.32Å; I250-E252 HydrophobicContact CG2-CG 4.18Å; I250-E252 PolarHBondContact O-N 2.92Å; I250-E252 VanDerWaalsContact O-OE2 3.14Å; E252-E254 PolarHBondContact O-N 3.47Å; E252-S255 PolarHBondContact O-N 3.49Å; E252-S255 PolarHBondContact O-OG 3.17Å; E252-P257 HydrophobicContact CB-CG 4.4Å; E252-P257 WeakPolarHBondContact O-CD 3.24Å; E252-Y273 HydrophobicContact CB-CD1 3.38Å; E252-Y273 HydrophobicContact CB-CE1 3.94Å; E252-Y273 HydrophobicContact CB-CG 3.86Å; E252-Y273 HydrophobicContact CG-CD1 3.66Å; E252-Y273 HydrophobicContact CG-CE1 4.08Å; E252-Y273 WeakPolarHBondContact OE2-CD1 3.35Å
253	C	95.7	Very high	91.9	Very high	27 Å²	27	67.3 Å²	67.3	18%	0.182	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-65.8	-22.4	179.1	-58.8	0	0	0	0	113.3	D251 S255 S256 C266 E267 N268	D251-C253 PolarHBondContact O-N 2.81Å; D251-C253 WeakPolarHBondContact OD1-CA 3.49Å; D251-C253 WeakPolarHBondContact OD1-CB 3.49Å; D251-C253 PolarHBondContact OD1-N 3.31Å; C253-S255 PolarHBondContact O-N 2.04Å; C253-S256 PolarHBondContact O-N 2.67Å; C253-C266 WeakPolarHBondContact CA-SG 3.17Å; C253-C266 HydrophobicContact CB-CB 3.64Å; C253-C266 WeakPolarHBondContact CB-SG 3.44Å; C253-C266 WeakPolarHBondContact SG-CB 3.23Å; C253-C266 CovalentContact SG-SG 2.04Å; C253-C266 PolarHBondContact SG-SG 3.2Å; C253-E267 VanDerWaalsContact SG-C 3.54Å; C253-N268 PolarHBondContact SG-N 3.1Å; C253-N268 VanDerWaalsContact SG-N 3.35Å
254	E	94.7	Very high	91.8	Very high	152 Å²	152	62.7 Å²	62.7	71%	0.71	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-59.4	-25.8	171.2	-67	-173.9	166.4	0	0	112.2	D251 E252	D251-E254 HydrophobicContact CB-CG 4.04Å; D251-E254 WeakPolarHBondContact O-CB 3.48Å; D251-E254 PolarHBondContact O-N 3.45Å; E252-E254 PolarHBondContact O-N 3.47Å
255	S	92.2	Very high	91.8	Very high	89 Å²	89	65.8 Å²	65.8	62%	0.622	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-91.6	1.1	177.9	72.8	0	0	0	0	114.5	E252 C253	E252-S255 PolarHBondContact O-N 3.49Å; E252-S255 PolarHBondContact O-OG 3.17Å; C253-S255 PolarHBondContact O-N 2.04Å
256	S	90.6	Very high	91.8	Very high	95 Å²	95	60.9 Å²	60.9	66%	0.664	34%	0.343	S	S	*	.			trans	50	60.9	-175	-58.3	0	0	0	0	113.4	C253 C258	C253-S256 PolarHBondContact O-N 2.67Å; S256-C258 VanDerWaalsContact C-N 3.31Å; S256-C258 PolarHBondContact O-N 3.01Å
257	P	92.2	Very high	91.8	Very high	47 Å²	47	63.9 Å²	63.9	31%	0.305	36%	0.355	S	S	.	.			trans	-76.4	-21.9	-173	32.6	-35.1	0	0	0	112.5	E252 Y273	E252-P257 HydrophobicContact CB-CG 4.4Å; E252-P257 WeakPolarHBondContact O-CD 3.24Å; P257-Y273 HydrophobicContact CB-CD2 4.32Å; P257-Y273 HydrophobicContact CB-CE1 4.41Å; P257-Y273 HydrophobicContact CB-CE2 3.61Å; P257-Y273 HydrophobicContact CG-CD2 3.61Å; P257-Y273 HydrophobicContact CG-CE1 4.42Å; P257-Y273 HydrophobicContact CG-CE2 3.42Å; P257-Y273 VanDerWaalsContact CG-CE2 3.42Å; P257-Y273 HydrophobicContact CG-CG 4.21Å
258	C	91.2	Very high	91.8	Very high	15 Å²	15	66.4 Å²	66.4	10%	0.101	37%	0.368	C	S	.	.	S	Bend	trans	-80.4	147.9	177	-54.2	0	0	0	0	110.9	S256 A260 E264 C266 C275	S256-C258 VanDerWaalsContact C-N 3.31Å; S256-C258 PolarHBondContact O-N 3.01Å; C258-A260 PolarHBondContact O-N 3.21Å; C258-A260 VanDerWaalsContact O-N 3.15Å; C258-E264 HydrophobicContact CB-CB 4.11Å; C258-C266 HydrophobicContact CB-CB 4.34Å; C258-C266 VanDerWaalsContact SG-CA 3.51Å; C258-C266 WeakPolarHBondContact SG-CB 3.09Å; C258-C275 WeakPolarHBondContact CA-SG 3.37Å; C258-C275 HydrophobicContact CB-CB 3.76Å; C258-C275 WeakPolarHBondContact CB-SG 3.05Å; C258-C275 WeakPolarHBondContact SG-CA 3.47Å; C258-C275 WeakPolarHBondContact SG-CB 3.38Å; C258-C275 CovalentContact SG-SG 2.02Å; C258-C275 PolarHBondContact SG-SG 2.9Å
259	N	84.4	Confident	91.7	Very high	83 Å²	83	65.1 Å²	65.1	44%	0.444	37%	0.365	S	S	.	.			trans	-80.4	104.9	-177.5	-172.5	-4	0	0	0	110.4	S261 T262	N259-S261 PolarHBondContact ND2-OG 2.95Å; N259-S261 VanDerWaalsContact ND2-OG 3.11Å; N259-S261 PolarHBondContact O-N 2.96Å; N259-S261 VanDerWaalsContact O-N 3.13Å; N259-S261 WeakPolarHBondContact OD1-CB 2.96Å; N259-S261 PolarHBondContact OD1-N 3.26Å; N259-S261 PolarHBondContact OD1-OG 2.94Å; N259-T262 HydrophobicContact CB-CG2 4.5Å; N259-T262 WeakPolarHBondContact CB-OG1 3.5Å; N259-T262 PolarHBondContact O-N 3.34Å; N259-T262 PolarHBondContact O-OG1 2.92Å
260	A	75.8	Confident	91.6	Very high	79 Å²	79	68.9 Å²	68.9	65%	0.653	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-59.5	-25.5	177.1	0	0	0	0	0	113	C258 T262 F263	C258-A260 PolarHBondContact O-N 3.21Å; C258-A260 VanDerWaalsContact O-N 3.15Å; A260-T262 PolarHBondContact O-N 2.94Å; A260-F263 PolarHBondContact O-N 3.34Å
261	S	78.8	Confident	91.5	Very high	90 Å²	90	67.2 Å²	67.2	63%	0.629	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-71.1	-14.4	177.4	69.7	0	0	0	0	113.8	N259	N259-S261 PolarHBondContact ND2-OG 2.95Å; N259-S261 VanDerWaalsContact ND2-OG 3.11Å; N259-S261 PolarHBondContact O-N 2.96Å; N259-S261 VanDerWaalsContact O-N 3.13Å; N259-S261 WeakPolarHBondContact OD1-CB 2.96Å; N259-S261 PolarHBondContact OD1-N 3.26Å; N259-S261 PolarHBondContact OD1-OG 2.94Å
262	T	83.2	Confident	91.5	Very high	34 Å²	34	67.1 Å²	67.1	21%	0.209	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-107.7	24.8	178.5	55.6	0	0	0	0	112.5	N259 A260 E264 C288	N259-T262 HydrophobicContact CB-CG2 4.5Å; N259-T262 WeakPolarHBondContact CB-OG1 3.5Å; N259-T262 PolarHBondContact O-N 3.34Å; N259-T262 PolarHBondContact O-OG1 2.92Å; A260-T262 PolarHBondContact O-N 2.94Å; T262-E264 PolarHBondContact O-N 2.69Å; T262-C288 WeakPolarHBondContact O-CB 3.23Å
263	F	89.2	Confident	91.5	Very high	100 Å²	100	69.9 Å²	69.9	44%	0.439	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	36.4	177.4	-52.7	-80.2	0	0	0	113.9	A260 M278 F281 C288	A260-F263 PolarHBondContact O-N 3.34Å; F263-M278 WeakPolarHBondContact O-CG 3.35Å; F263-M278 PolarHBondContact O-N 3.49Å; F263-F281 HydrophobicContact CB-CD1 3.66Å; F263-F281 HydrophobicContact CB-CD2 4.16Å; F263-F281 HydrophobicContact CB-CE1 3.7Å; F263-F281 HydrophobicContact CB-CE2 4.2Å; F263-F281 HydrophobicContact CB-CG 3.92Å; F263-F281 HydrophobicContact CB-CZ 3.99Å; F263-F281 HydrophobicContact CD1-CD1 4.45Å; F263-F281 AromaticContact CD1-CE1 3.63Å; F263-F281 HydrophobicContact CD1-CE1 3.63Å; F263-F281 AromaticContact CD1-CE2 3.95Å; F263-F281 HydrophobicContact CD1-CE2 3.95Å; F263-F281 AromaticContact CD1-CZ 3.34Å; F263-F281 HydrophobicContact CD1-CZ 3.34Å; F263-F281 AromaticContact CD2-CD1 3.93Å; F263-F281 HydrophobicContact CD2-CD1 3.93Å; F263-F281 AromaticContact CD2-CE1 3.39Å; F263-F281 HydrophobicContact CD2-CE1 3.39Å; F263-F281 HydrophobicContact CD2-CZ 4.02Å; F263-F281 HydrophobicContact CE1-CE1 4.05Å; F263-F281 AromaticContact CE1-CZ 3.71Å; F263-F281 HydrophobicContact CE1-CZ 3.71Å; F263-F281 AromaticContact CE2-CE1 3.84Å; F263-F281 HydrophobicContact CE2-CE1 3.84Å; F263-F281 HydrophobicContact CE2-CZ 4.35Å; F263-F281 AromaticContact CG-CD1 3.77Å; F263-F281 HydrophobicContact CG-CD1 3.77Å; F263-F281 AromaticContact CG-CE1 3.28Å; F263-F281 HydrophobicContact CG-CE1 3.28Å; F263-F281 HydrophobicContact CG-CE2 4.16Å; F263-F281 HydrophobicContact CG-CG 4.41Å; F263-F281 AromaticContact CG-CZ 3.51Å; F263-F281 HydrophobicContact CG-CZ 3.51Å; F263-F281 HydrophobicContact CZ-CE1 4.15Å; F263-F281 HydrophobicContact CZ-CZ 4.2Å; F263-C288 HydrophobicContact CB-CB 4.15Å
264	E	92.3	Very high	91.5	Very high	27 Å²	27	72.7 Å²	72.7	13%	0.126	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	140.3	176.3	-67	-174.7	156.5	0	0	111.5	C258 T262 C275 E276 M278 R283 C288	C258-E264 HydrophobicContact CB-CB 4.11Å; T262-E264 PolarHBondContact O-N 2.69Å; E264-C275 HydrophobicContact CB-CB 4.33Å; E264-C275 WeakPolarHBondContact OE2-CB 3.02Å; E264-E276 CarbonylContact C-O 3.46Å; E264-E276 VanDerWaalsContact CA-O 3.26Å; E264-E276 WeakPolarHBondContact CA-O 3.31Å; E264-M278 WeakPolarHBondContact O-CE 3.44Å; E264-R283 IonicContact OE1-CZ 2.74Å; E264-R283 VanDerWaalsContact OE1-CZ 3.23Å; E264-R283 IonicContact OE1-NH1 3.32Å; E264-R283 PolarHBondContact OE1-NH1 3.18Å; E264-R283 IonicContact OE1-NH2 3.68Å; E264-R283 PolarHBondContact OE1-NH2 2.91Å; E264-C288 VanDerWaalsContact CG-SG 3.58Å
265	R	92.1	Very high	91.5	Very high	153 Å²	153	67 Å²	67	58%	0.577	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	135.8	168.9	176.2	176.4	176.5	164.8	-1.8	109.1	C275 E276 M278	R265-C275 WeakPolarHBondContact O-CA 3.45Å; R265-E276 PolarHBondContact N-O 3.19Å; R265-E276 PolarHBondContact O-N 3.19Å; R265-M278 HydrophobicContact CB-CG 4.1Å
266	C	95.2	Very high	91.6	Very high	27 Å²	27	66.4 Å²	66.4	18%	0.182	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	135.4	172.6	-170.3	0	0	0	0	110.9	C253 C258	C253-C266 WeakPolarHBondContact CA-SG 3.17Å; C253-C266 HydrophobicContact CB-CB 3.64Å; C253-C266 WeakPolarHBondContact CB-SG 3.44Å; C253-C266 WeakPolarHBondContact SG-CB 3.23Å; C253-C266 CovalentContact SG-SG 2.04Å; C253-C266 PolarHBondContact SG-SG 3.2Å; C258-C266 HydrophobicContact CB-CB 4.34Å; C258-C266 VanDerWaalsContact SG-CA 3.51Å; C258-C266 WeakPolarHBondContact SG-CB 3.09Å
267	E	95.9	Very high	91.7	Very high	68 Å²	68	63.2 Å²	63.2	32%	0.318	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	119.9	167.9	-55.7	-162.5	153.2	0	0	109.8	C253 Y273 K274 E276	C253-E267 VanDerWaalsContact SG-C 3.54Å; E267-Y273 WeakPolarHBondContact O-CA 3.46Å; E267-K274 HydrophobicContact CB-CG 3.91Å; E267-K274 PolarHBondContact N-O 3.48Å; E267-K274 PolarHBondContact O-N 2.75Å; E267-K274 WeakPolarHBondContact OE2-CE 3.45Å; E267-K274 IonicContact OE2-NZ 3.22Å; E267-K274 PolarHBondContact OE2-NZ 2.91Å; E267-E276 HydrophobicContact CG-CG 4.42Å
268	N	97	Very high	91.6	Very high	56 Å²	56	64.7 Å²	64.7	30%	0.299	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	140.7	177.9	-170.4	47.7	0	0	0	111	D249 I250 D251 C253 S272	D249-N268 PolarHBondContact OD2-ND2 2.02Å; I250-N268 PolarHBondContact O-OD1 2.92Å; D251-N268 WeakPolarHBondContact OD1-CB 3.05Å; C253-N268 PolarHBondContact SG-N 3.1Å; C253-N268 VanDerWaalsContact SG-N 3.35Å; N268-S272 PolarHBondContact OD1-O 2.88Å
269	T	96.6	Very high	91.5	Very high	40 Å²	40	72.7 Å²	72.7	25%	0.245	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	154.2	-179.3	62.2	0	0	0	0	110.5	G271 S272 K274	T269-G271 PolarHBondContact O-N 3.19Å; T269-S272 CarbonylContact C-O 3.46Å; T269-S272 VanDerWaalsContact C-O 3.3Å; T269-S272 WeakPolarHBondContact CA-O 3.45Å; T269-S272 PolarHBondContact N-O 2.03Å; T269-S272 CarbonylContact O-C 3.53Å; T269-S272 PolarHBondContact O-N 2.84Å; T269-S272 PolarHBondContact OG1-O 2.9Å; T269-K274 HydrophobicContact CG2-CD 4.3Å; T269-K274 HydrophobicContact CG2-CG 4.23Å
270	P	96	Very high	91.7	Very high	112 Å²	112	71 Å²	71	73%	0.727	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	110	-178.5	-26.4	35.9	0	0	0	113.4	W239	W239-P270 HydrophobicContact CH2-CB 4Å; W239-P270 HydrophobicContact CZ2-CB 3.8Å
271	G	95.5	Very high	92.5	Very high	22 Å²	22	69.5 Å²	69.5	23%	0.227	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	9	-177.6	0	0	0	0	0	115.3	D249 T269	D249-G271 WeakPolarHBondContact OD1-CA 3.17Å; D249-G271 PolarHBondContact OD1-N 3.29Å; T269-G271 PolarHBondContact O-N 3.19Å
272	S	96.9	Very high	93	Very high	60 Å²	60	70 Å²	70	42%	0.42	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.8	-176.2	-178	-155.4	0	0	0	0	113	N268 T269	N268-S272 PolarHBondContact OD1-O 2.88Å; T269-S272 CarbonylContact C-O 3.46Å; T269-S272 VanDerWaalsContact C-O 3.3Å; T269-S272 WeakPolarHBondContact CA-O 3.45Å; T269-S272 PolarHBondContact N-O 2.03Å; T269-S272 CarbonylContact O-C 3.53Å; T269-S272 PolarHBondContact O-N 2.84Å; T269-S272 PolarHBondContact OG1-O 2.9Å
273	Y	96.7	Very high	93.3	Very high	92 Å²	92	73.9 Å²	73.9	36%	0.361	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	161.1	169.5	66.9	-79	0	0	0	109.6	E252 P257 E267	E252-Y273 HydrophobicContact CB-CD1 3.38Å; E252-Y273 HydrophobicContact CB-CE1 3.94Å; E252-Y273 HydrophobicContact CB-CG 3.86Å; E252-Y273 HydrophobicContact CG-CD1 3.66Å; E252-Y273 HydrophobicContact CG-CE1 4.08Å; E252-Y273 WeakPolarHBondContact OE2-CD1 3.35Å; P257-Y273 HydrophobicContact CB-CD2 4.32Å; P257-Y273 HydrophobicContact CB-CE1 4.41Å; P257-Y273 HydrophobicContact CB-CE2 3.61Å; P257-Y273 HydrophobicContact CG-CD2 3.61Å; P257-Y273 HydrophobicContact CG-CE1 4.42Å; P257-Y273 HydrophobicContact CG-CE2 3.42Å; P257-Y273 VanDerWaalsContact CG-CE2 3.42Å; P257-Y273 HydrophobicContact CG-CG 4.21Å; E267-Y273 WeakPolarHBondContact O-CA 3.46Å
274	K	95.4	Very high	93.4	Very high	85 Å²	85	73 Å²	73	37%	0.37	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143.7	171.3	58.9	-177.4	174.6	136.1	0	110.2	E267 T269 E276	E267-K274 HydrophobicContact CB-CG 3.91Å; E267-K274 PolarHBondContact N-O 3.48Å; E267-K274 PolarHBondContact O-N 2.75Å; E267-K274 WeakPolarHBondContact OE2-CE 3.45Å; E267-K274 IonicContact OE2-NZ 3.22Å; E267-K274 PolarHBondContact OE2-NZ 2.91Å; T269-K274 HydrophobicContact CG2-CD 4.3Å; T269-K274 HydrophobicContact CG2-CG 4.23Å; K274-E276 HydrophobicContact CD-CG 4.24Å; K274-E276 VanDerWaalsContact CD-OE1 3.31Å; K274-E276 WeakPolarHBondContact CD-OE1 3.46Å; K274-E276 WeakPolarHBondContact CE-OE1 3.44Å; K274-E276 HydrophobicContact CG-CG 4.18Å; K274-E276 VanDerWaalsContact NZ-CD 3.31Å; K274-E276 IonicContact NZ-OE1 2.67Å; K274-E276 PolarHBondContact NZ-OE1 3.13Å; K274-E276 IonicContact NZ-OE2 2.65Å
275	C	94.5	Very high	93.2	Very high	34 Å²	34	79.3 Å²	79.3	23%	0.23	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	116.4	172	-58.1	0	0	0	0	108.4	C258 E264 R265 R283	C258-C275 WeakPolarHBondContact CA-SG 3.37Å; C258-C275 HydrophobicContact CB-CB 3.76Å; C258-C275 WeakPolarHBondContact CB-SG 3.05Å; C258-C275 WeakPolarHBondContact SG-CA 3.47Å; C258-C275 WeakPolarHBondContact SG-CB 3.38Å; C258-C275 CovalentContact SG-SG 2.02Å; C258-C275 PolarHBondContact SG-SG 2.9Å; E264-C275 HydrophobicContact CB-CB 4.33Å; E264-C275 WeakPolarHBondContact OE2-CB 3.02Å; R265-C275 WeakPolarHBondContact O-CA 3.45Å; C275-R283 PolarHBondContact O-NH2 2.81Å
276	E	93.3	Very high	92.8	Very high	75 Å²	75	74.4 Å²	74.4	35%	0.35	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	150.7	179.5	-59.1	-156.9	153.8	0	0	110.4	E264 R265 E267 K274 M278	E264-E276 CarbonylContact C-O 3.46Å; E264-E276 VanDerWaalsContact CA-O 3.26Å; E264-E276 WeakPolarHBondContact CA-O 3.31Å; R265-E276 PolarHBondContact N-O 3.19Å; R265-E276 PolarHBondContact O-N 3.19Å; E267-E276 HydrophobicContact CG-CG 4.42Å; K274-E276 HydrophobicContact CD-CG 4.24Å; K274-E276 VanDerWaalsContact CD-OE1 3.31Å; K274-E276 WeakPolarHBondContact CD-OE1 3.46Å; K274-E276 WeakPolarHBondContact CE-OE1 3.44Å; K274-E276 HydrophobicContact CG-CG 4.18Å; K274-E276 VanDerWaalsContact NZ-CD 3.31Å; K274-E276 IonicContact NZ-OE1 2.67Å; K274-E276 PolarHBondContact NZ-OE1 3.13Å; K274-E276 IonicContact NZ-OE2 2.65Å; E276-M278 PolarHBondContact O-N 2.87Å
277	C	92.6	Very high	92.4	Very high	28 Å²	28	77.7 Å²	77.7	19%	0.189	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	138.5	173.8	-62.5	0	0	0	0	109.6	F281 R282 R283 C288	C277-F281 HydrophobicContact CB-CB 3.85Å; C277-F281 WeakPolarHBondContact CB-O 3.04Å; C277-R282 VanDerWaalsContact SG-C 3.57Å; C277-R283 PolarHBondContact SG-N 3.03Å; C277-C288 WeakPolarHBondContact CA-SG 3.5Å; C277-C288 HydrophobicContact CB-CB 3.69Å; C277-C288 WeakPolarHBondContact CB-SG 3.42Å; C277-C288 VanDerWaalsContact SG-CA 3.54Å; C277-C288 WeakPolarHBondContact SG-CB 3.12Å; C277-C288 CovalentContact SG-SG 2.04Å; C277-C288 PolarHBondContact SG-SG 2.83Å
278	M	91.2	Very high	92.2	Very high	79 Å²	79	74.7 Å²	74.7	39%	0.389	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-58	161.2	175	-70.9	-179.7	-178.9	0	0	111	F263 E264 R265 E276 A280 F281	F263-M278 WeakPolarHBondContact O-CG 3.35Å; F263-M278 PolarHBondContact O-N 3.49Å; E264-M278 WeakPolarHBondContact O-CE 3.44Å; R265-M278 HydrophobicContact CB-CG 4.1Å; E276-M278 PolarHBondContact O-N 2.87Å; M278-A280 PolarHBondContact O-N 3.43Å; M278-F281 HydrophobicContact CB-CD2 4.16Å; M278-F281 WeakPolarHBondContact O-CB 3.45Å; M278-F281 PolarHBondContact O-N 2.8Å
279	E	89.2	Confident	91.9	Very high	182 Å²	182	74.7 Å²	74.7	85%	0.85	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	137.2	171.8	-68	179.5	-177.7	0	0	110.5	F281	E279-F281 VanDerWaalsContact C-N 3.34Å; E279-F281 WeakPolarHBondContact O-CD2 3.3Å
280	A	89.1	Confident	91.6	Very high	47 Å²	47	77.2 Å²	77.2	39%	0.388	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	14	-170.8	0	0	0	0	0	117.1	M278 P290 D291 A294	M278-A280 PolarHBondContact O-N 3.43Å; A280-P290 WeakPolarHBondContact O-CA 3.12Å; A280-D291 PolarHBondContact O-N 3.41Å; A280-A294 VanDerWaalsContact CA-CB 3.43Å; A280-A294 HydrophobicContact CB-CB 3.52Å
281	F	91.3	Very high	91.3	Very high	48 Å²	48	74.3 Å²	74.3	21%	0.211	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	148	170.4	-65.2	-103.9	0	0	0	111.4	F263 C277 M278 E279 C288 I289 P290	F263-F281 HydrophobicContact CB-CD1 3.66Å; F263-F281 HydrophobicContact CB-CD2 4.16Å; F263-F281 HydrophobicContact CB-CE1 3.7Å; F263-F281 HydrophobicContact CB-CE2 4.2Å; F263-F281 HydrophobicContact CB-CG 3.92Å; F263-F281 HydrophobicContact CB-CZ 3.99Å; F263-F281 HydrophobicContact CD1-CD1 4.45Å; F263-F281 AromaticContact CD1-CE1 3.63Å; F263-F281 HydrophobicContact CD1-CE1 3.63Å; F263-F281 AromaticContact CD1-CE2 3.95Å; F263-F281 HydrophobicContact CD1-CE2 3.95Å; F263-F281 AromaticContact CD1-CZ 3.34Å; F263-F281 HydrophobicContact CD1-CZ 3.34Å; F263-F281 AromaticContact CD2-CD1 3.93Å; F263-F281 HydrophobicContact CD2-CD1 3.93Å; F263-F281 AromaticContact CD2-CE1 3.39Å; F263-F281 HydrophobicContact CD2-CE1 3.39Å; F263-F281 HydrophobicContact CD2-CZ 4.02Å; F263-F281 HydrophobicContact CE1-CE1 4.05Å; F263-F281 AromaticContact CE1-CZ 3.71Å; F263-F281 HydrophobicContact CE1-CZ 3.71Å; F263-F281 AromaticContact CE2-CE1 3.84Å; F263-F281 HydrophobicContact CE2-CE1 3.84Å; F263-F281 HydrophobicContact CE2-CZ 4.35Å; F263-F281 AromaticContact CG-CD1 3.77Å; F263-F281 HydrophobicContact CG-CD1 3.77Å; F263-F281 AromaticContact CG-CE1 3.28Å; F263-F281 HydrophobicContact CG-CE1 3.28Å; F263-F281 HydrophobicContact CG-CE2 4.16Å; F263-F281 HydrophobicContact CG-CG 4.41Å; F263-F281 AromaticContact CG-CZ 3.51Å; F263-F281 HydrophobicContact CG-CZ 3.51Å; F263-F281 HydrophobicContact CZ-CE1 4.15Å; F263-F281 HydrophobicContact CZ-CZ 4.2Å; C277-F281 HydrophobicContact CB-CB 3.85Å; C277-F281 WeakPolarHBondContact CB-O 3.04Å; M278-F281 HydrophobicContact CB-CD2 4.16Å; M278-F281 WeakPolarHBondContact O-CB 3.45Å; M278-F281 PolarHBondContact O-N 2.8Å; E279-F281 VanDerWaalsContact C-N 3.34Å; E279-F281 WeakPolarHBondContact O-CD2 3.3Å; F281-C288 HydrophobicContact CB-CB 4.01Å; F281-C288 HydrophobicContact CD1-CB 4.38Å; F281-I289 CarbonylContact C-O 3.57Å; F281-I289 WeakPolarHBondContact CA-O 3.18Å; F281-I289 WeakPolarHBondContact CB-O 3.41Å; F281-I289 VanDerWaalsContact CD1-C 3.47Å; F281-P290 HydrophobicContact CD1-CG 4.37Å; F281-P290 HydrophobicContact CE1-CG 3.96Å
282	R	90.6	Very high	90.7	Very high	100 Å²	100	78 Å²	78	38%	0.377	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	153.2	173.3	72.1	179.8	-163.8	-171.5	2.8	110.9	C277 E284 C288 I289 D291	C277-R282 VanDerWaalsContact SG-C 3.57Å; R282-E284 IonicContact CZ-OE2 3.54Å; R282-E284 IonicContact NE-OE2 3.23Å; R282-E284 PolarHBondContact NE-OE2 2.04Å; R282-E284 IonicContact NH2-OE2 2.76Å; R282-E284 PolarHBondContact NH2-OE2 3.46Å; R282-C288 WeakPolarHBondContact O-CA 3.4Å; R282-I289 HydrophobicContact CG-CD1 4.41Å; R282-I289 HydrophobicContact CG-CG1 3.86Å; R282-I289 PolarHBondContact N-O 3.17Å; R282-I289 PolarHBondContact O-N 2.89Å; R282-D291 HydrophobicContact CB-CB 4.26Å; R282-D291 HydrophobicContact CG-CB 4.42Å
283	R	89.6	Confident	90.1	Very high	116 Å²	116	81.4 Å²	81.4	44%	0.438	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	117.3	177.9	-168.9	172.6	-68.6	-75.1	3.1	110.3	E264 C275 C277 G286 I287	E264-R283 IonicContact OE1-CZ 2.74Å; E264-R283 VanDerWaalsContact OE1-CZ 3.23Å; E264-R283 IonicContact OE1-NH1 3.32Å; E264-R283 PolarHBondContact OE1-NH1 3.18Å; E264-R283 IonicContact OE1-NH2 3.68Å; E264-R283 PolarHBondContact OE1-NH2 2.91Å; C275-R283 PolarHBondContact O-NH2 2.81Å; C277-R283 PolarHBondContact SG-N 3.03Å; R283-G286 PolarHBondContact NH1-O 3.26Å; R283-G286 VanDerWaalsContact NH1-O 3.1Å; R283-I287 WeakPolarHBondContact CA-O 3.09Å
284	E	90	Very high	89.3	Confident	83 Å²	83	78.9 Å²	78.9	39%	0.388	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	127.8	173.9	-166.4	167	146.6	0	0	108.6	R282 G286 I287 I289	R282-E284 IonicContact CZ-OE2 3.54Å; R282-E284 IonicContact NE-OE2 3.23Å; R282-E284 PolarHBondContact NE-OE2 2.04Å; R282-E284 IonicContact NH2-OE2 2.76Å; R282-E284 PolarHBondContact NH2-OE2 3.46Å; E284-G286 PolarHBondContact O-N 2.03Å; E284-G286 VanDerWaalsContact O-N 3.08Å; E284-I287 PolarHBondContact N-O 3.25Å; E284-I287 PolarHBondContact O-N 2.82Å; E284-I289 HydrophobicContact CB-CD1 3.75Å; E284-I289 HydrophobicContact CB-CG1 3.98Å; E284-I289 HydrophobicContact CG-CD1 4.26Å; E284-I289 WeakPolarHBondContact OE2-CD1 3.4Å
285	D	87.8	Confident	88.2	Confident	158 Å²	158	80.8 Å²	80.8	85%	0.845	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	34.9	-176.3	-64.3	-34.2	0	0	0	115.1	I287	D285-I287 VanDerWaalsContact C-N 3.28Å; D285-I287 PolarHBondContact O-N 3.16Å
286	G	84.9	Confident	86.7	Confident	51 Å²	51	85.6 Å²	85.6	53%	0.526	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	0.7	179.6	0	0	0	0	0	114.9	R283 E284	R283-G286 PolarHBondContact NH1-O 3.26Å; R283-G286 VanDerWaalsContact NH1-O 3.1Å; E284-G286 PolarHBondContact O-N 2.03Å; E284-G286 VanDerWaalsContact O-N 3.08Å
287	I	87.3	Confident	85	Confident	96 Å²	96	90.4 Å²	90.4	49%	0.492	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	146.5	-179.5	-56.2	171.7	0	0	0	108.9	R283 E284 D285	R283-I287 WeakPolarHBondContact CA-O 3.09Å; E284-I287 PolarHBondContact N-O 3.25Å; E284-I287 PolarHBondContact O-N 2.82Å; D285-I287 VanDerWaalsContact C-N 3.28Å; D285-I287 PolarHBondContact O-N 3.16Å
288	C	91.5	Very high	83.2	Confident	5 Å²	5	96.2 Å²	96.2	3%	0.034	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	119.9	171.4	-58.1	0	0	0	0	110.5	T262 F263 E264 C277 F281 R282	T262-C288 WeakPolarHBondContact O-CB 3.23Å; F263-C288 HydrophobicContact CB-CB 4.15Å; E264-C288 VanDerWaalsContact CG-SG 3.58Å; C277-C288 WeakPolarHBondContact CA-SG 3.5Å; C277-C288 HydrophobicContact CB-CB 3.69Å; C277-C288 WeakPolarHBondContact CB-SG 3.42Å; C277-C288 VanDerWaalsContact SG-CA 3.54Å; C277-C288 WeakPolarHBondContact SG-CB 3.12Å; C277-C288 CovalentContact SG-SG 2.04Å; C277-C288 PolarHBondContact SG-SG 2.83Å; F281-C288 HydrophobicContact CB-CB 4.01Å; F281-C288 HydrophobicContact CD1-CB 4.38Å; R282-C288 WeakPolarHBondContact O-CA 3.4Å
289	I	90.6	Very high	81.4	Confident	55 Å²	55	100.1 Å²	100.1	28%	0.282	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	152.9	175.5	65.2	165.1	0	0	0	109.8	F281 R282 E284 D291	F281-I289 CarbonylContact C-O 3.57Å; F281-I289 WeakPolarHBondContact CA-O 3.18Å; F281-I289 WeakPolarHBondContact CB-O 3.41Å; F281-I289 VanDerWaalsContact CD1-C 3.47Å; R282-I289 HydrophobicContact CG-CD1 4.41Å; R282-I289 HydrophobicContact CG-CG1 3.86Å; R282-I289 PolarHBondContact N-O 3.17Å; R282-I289 PolarHBondContact O-N 2.89Å; E284-I289 HydrophobicContact CB-CD1 3.75Å; E284-I289 HydrophobicContact CB-CG1 3.98Å; E284-I289 HydrophobicContact CG-CD1 4.26Å; E284-I289 WeakPolarHBondContact OE2-CD1 3.4Å; I289-D291 PolarHBondContact O-N 3Å
290	P	89.8	Confident	79.5	Confident	94 Å²	94	97.8 Å²	97.8	61%	0.61	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.8	129.5	174.5	-25.4	34.6	0	0	0	111.1	A280 F281 P292	A280-P290 WeakPolarHBondContact O-CA 3.12Å; F281-P290 HydrophobicContact CD1-CG 4.37Å; F281-P290 HydrophobicContact CE1-CG 3.96Å; P290-P292 WeakPolarHBondContact O-CD 3.34Å
291	D	89.3	Confident	77.8	Confident	50 Å²	50	100.4 Å²	100.4	27%	0.267	54%	0.535	S	S	.	.			trans	-81.5	116.3	177.8	-173.9	-6.5	0	0	0	109.3	A280 R282 I289 D293 A294	A280-D291 PolarHBondContact O-N 3.41Å; R282-D291 HydrophobicContact CB-CB 4.26Å; R282-D291 HydrophobicContact CG-CB 4.42Å; I289-D291 PolarHBondContact O-N 3Å; D291-D293 PolarHBondContact O-N 3.27Å; D291-D293 PolarHBondContact OD1-N 3.44Å; D291-A294 HydrophobicContact CB-CB 4Å; D291-A294 WeakPolarHBondContact O-CB 3.39Å; D291-A294 PolarHBondContact O-N 3.45Å; D291-A294 VanDerWaalsContact O-N 3.17Å
292	P	84.2	Confident	76.1	Confident	100 Å²	100	106.9 Å²	106.9	65%	0.649	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-21.5	-179.6	26.6	-35.7	0	0	0	113.3	P290	P290-P292 WeakPolarHBondContact O-CD 3.34Å
293	D	83.8	Confident	74.5	Confident	131 Å²	131	106.8 Å²	106.8	70%	0.701	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-1.2	-178.1	-62.5	-43	0	0	0	112.9	D291 V295	D291-D293 PolarHBondContact O-N 3.27Å; D291-D293 PolarHBondContact OD1-N 3.44Å; D293-V295 PolarHBondContact O-N 2.59Å
294	A	78.7	Confident	72.6	Confident	39 Å²	39	108.7 Å²	108.7	32%	0.322	60%	0.599	S	S	.	*			trans	-73.1	100.4	-179.6	0	0	0	0	0	112	A280 D291 L296	A280-A294 VanDerWaalsContact CA-CB 3.43Å; A280-A294 HydrophobicContact CB-CB 3.52Å; D291-A294 HydrophobicContact CB-CB 4Å; D291-A294 WeakPolarHBondContact O-CB 3.39Å; D291-A294 PolarHBondContact O-N 3.45Å; D291-A294 VanDerWaalsContact O-N 3.17Å; A294-L296 PolarHBondContact O-N 3.31Å
295	V	73	Confident	70.8	Confident	126 Å²	126	114.4 Å²	114.4	76%	0.764	62%	0.623	S	S	*	*			trans	-71.6	110.8	168.7	-176.4	0	0	0	0	108.2	D293 Q297	D293-V295 PolarHBondContact O-N 2.59Å; V295-Q297 PolarHBondContact O-N 2.95Å
296	L	62.4	Low	68.9	Low	134 Å²	134	113.4 Å²	113.4	70%	0.702	63%	0.627	S	S	*	*			trans	-59.7	99.6	173	-173.7	73.9	0	0	0	109	A294 Q298	A294-L296 PolarHBondContact O-N 3.31Å; L296-Q298 HydrophobicContact CD2-CG 4.04Å; L296-Q298 HydrophobicContact CG-CG 4.27Å; L296-Q298 PolarHBondContact O-N 2.81Å
297	Q	57.3	Low	67.4	Low	176 Å²	176	119.7 Å²	119.7	82%	0.822	65%	0.647	S	S	*	*			trans	-72.7	82.7	174.9	-69.6	-175.1	-16.9	0	0	109.3	V295 E299	V295-Q297 PolarHBondContact O-N 2.95Å; Q297-E299 PolarHBondContact O-N 3.23Å
298	Q	56.7	Low	65.7	Low	151 Å²	151	118.6 Å²	118.6	71%	0.706	66%	0.66	S	S	*	*			trans	-75	79.7	161.9	-82.1	-179	-29.1	0	0	109.3	L296 L300	L296-Q298 HydrophobicContact CD2-CG 4.04Å; L296-Q298 HydrophobicContact CG-CG 4.27Å; L296-Q298 PolarHBondContact O-N 2.81Å; Q298-L300 PolarHBondContact O-N 3.07Å; Q298-L300 VanDerWaalsContact O-N 3.08Å
299	E	52.3	Low	63.8	Low	161 Å²	161	125 Å²	125	75%	0.752	70%	0.703	S	S	*	*			trans	-75.4	85.5	156.7	-73.2	-78.2	155.7	0	0	107.4	Q297	Q297-E299 PolarHBondContact O-N 3.23Å
300	L	50.3	Low	61.8	Low	133 Å²	133	128.8 Å²	128.8	70%	0.696	73%	0.728	S	S	*	*			trans	-60.1	136.1	163.8	-93	137.1	0	0	0	108.5	Q298 Q302	Q298-L300 PolarHBondContact O-N 3.07Å; Q298-L300 VanDerWaalsContact O-N 3.08Å; L300-Q302 PolarHBondContact O-N 3.28Å
301	P	51.6	Low	59.8	Low	101 Å²	101	129.4 Å²	129.4	66%	0.656	73%	0.732	S	S	*	*			trans	-60.8	128.6	-179.5	25.1	-31.4	0	0	0	109.6	S303	P301-S303 PolarHBondContact O-N 3.3Å
302	Q	57.4	Low	57.7	Low	184 Å²	184	136 Å²	136	86%	0.86	76%	0.759	S	S	*	*	S	Bend	trans	-66	24.7	-175.4	-65.2	-175.7	-20.9	0	0	115.2	L300	L300-Q302 PolarHBondContact O-N 3.28Å
303	S	55.3	Low	55.8	Low	98 Å²	98	139.7 Å²	139.7	69%	0.685	77%	0.769	S	S	*	*			trans	-93.4	7.2	-175	60.7	0	0	0	0	115.2	P301	P301-S303 PolarHBondContact O-N 3.3Å
304	L	49.8	Very low	54	Low	157 Å²	157	139.1 Å²	139.1	82%	0.822	78%	0.776	S	S	*	*			trans	-128.4	54	-176.7	-129	82.5	0	0	0	114.1
305	F	52.8	Low	52.5	Low	203 Å²	203	146.9 Å²	146.9	89%	0.89	80%	0.802	S	S	*	*			trans	-135.9	96.7	163.1	-93.3	-89.7	0	0	0	110.6
306	C	49	Very low	51.1	Low	136 Å²	136	144.1 Å²	144.1	92%	0.919	80%	0.799	S	S	*	*			trans	-167.6	75.1	143.8	-100	0	0	0	0	109
307	L	53.1	Low	50.3	Low	184 Å²	184	144.2 Å²	144.2	96%	0.963	80%	0.8	S	S	*	*			trans	-88.1	110.9	157.6	-74.2	168.3	0	0	0	107.5
308	G	51.5	Low	49.5	Very low	73 Å²	73	142.7 Å²	142.7	75%	0.753	79%	0.793	S	S	*	*			trans	96.3	28.5	141.4	0	0	0	0	0	121
309	C	51.6	Low	48.7	Very low	139 Å²	139	142 Å²	142	94%	0.939	79%	0.793	S	S	*	*			trans	-98.3	96.3	162	-78.1	0	0	0	0	111.4
310	V	48.9	Very low	48.2	Very low	134 Å²	134	142.6 Å²	142.6	81%	0.812	80%	0.798	S	S	*	*			trans	-120.9	151.2	165.7	175.6	0	0	0	0	105.4
311	P	47.4	Very low	47.8	Very low	108 Å²	108	141.2 Å²	141.2	70%	0.701	81%	0.806	S	S	*	*			cis	-137	166.2	12.8	17.4	9	0	0	0	116
312	K	44.4	Very low	47.2	Very low	189 Å²	189	142.4 Å²	142.4	82%	0.822	81%	0.811	S	S	*	*				-176.5	113.4	119.8	-100.2	170.5	-176.8	178.1	0	111.9
313	M	44.6	Very low	46.7	Very low	177 Å²	177	140.3 Å²	140.3	87%	0.872	80%	0.804	S	S	*	*			trans	39.1	112.5	136.1	-54.4	172.6	75.3	0	0	118.3
314	S	45.8	Very low	46.1	Very low	119 Å²	119	143.1 Å²	143.1	83%	0.832	81%	0.809	S	S	*	*				175.4	161.5	90.8	-147.8	0	0	0	0	111.2
315	F	46.7	Very low	46.1	Very low	201 Å²	201	142.7 Å²	142.7	88%	0.882	81%	0.807	S	S	*	*			trans	-80	157.7	-158.6	-88.7	-118	0	0	0	116.4	L317	F315-L317 HydrophobicContact CD1-CD1 4.44Å
316	G	44.7	Very low	45.5	Very low	68 Å²	68	140.1 Å²	140.1	70%	0.701	80%	0.803	S	S	*	*			trans	145.7	81.9	159.1	0	0	0	0	0	111.7
317	L	44.4	Very low	45.1	Very low	136 Å²	136	139 Å²	139	71%	0.712	79%	0.794	S	S	*	*				40.5	126.2	88.7	-90.7	92.4	0	0	0	112.1	F315	F315-L317 HydrophobicContact CD1-CD1 4.44Å
318	Q	41.8	Very low	44.5	Very low	144 Å²	144	142.1 Å²	142.1	67%	0.673	79%	0.792	S	S	*	*			cis	-177	148.7	31.5	-165.7	71.3	-14.8	0	0	110
319	L	40.5	Very low	43.6	Very low	136 Å²	136	149.8 Å²	149.8	71%	0.712	80%	0.8	S	S	*	*			trans	61	112.5	149.9	-96.8	65.2	0	0	0	120.6
320	M	40	Very low	43	Very low	175 Å²	175	148 Å²	148	86%	0.862	79%	0.79	S	S	*	*				66.2	112.1	82.1	-63.1	-72.6	179.1	0	0	115.9
321	A	41.8	Very low	42.6	Very low	104 Å²	104	150.1 Å²	150.1	86%	0.86	79%	0.79	S	S	*	*			trans	-164.2	130.7	136.7	0	0	0	0	0	111.7
322	V	40.6	Very low	42.1	Very low	125 Å²	125	152.6 Å²	152.6	76%	0.758	80%	0.798	S	S	*	*			trans	-75.2	151.8	177.1	-175.2	0	0	0	0	108.3
323	I	45.3	Very low	41.9	Very low	141 Å²	141	152.8 Å²	152.8	72%	0.723	80%	0.802	S	S	*	*				165.4	116.6	104.6	-79	167.9	0	0	0	109.2
324	M	43.1	Very low	41.6	Very low	157 Å²	157	151.5 Å²	151.5	77%	0.773	80%	0.798	S	S	*	*			trans	62.1	138	135.1	-52.6	-177.5	95.7	0	0	123.8
325	N	49.5	Very low	41.1	Very low	147 Å²	147	151 Å²	151	79%	0.786	79%	0.794	S	S	*	*			trans	86.8	110	151.4	-63.8	-20.8	0	0	0	118.5
326	N	40.8	Very low	40.9	Very low	150 Å²	150	147.5 Å²	147.5	80%	0.802	79%	0.789	S	S	*	*				158	127	102	-156.4	-23.1	0	0	0	110.1
327	P	40.2	Very low	40.7	Very low	112 Å²	112	147.8 Å²	147.8	73%	0.727	79%	0.792	S	S	*	*			trans	-81.6	135.7	178.5	32.7	-35.2	0	0	0	111.4
328	R	40.8	Very low	40.7	Very low	249 Å²	249	147.5 Å²	147.5	94%	0.94	80%	0.796	S	S	*	*			trans	-166.2	107.7	146.9	-108.6	175.9	-148	-150.5	6.2	110.1
329	Y	32.7	Very low	40.4	Very low	234 Å²	234	146.8 Å²	146.8	92%	0.918	80%	0.801	S	S	*	*			trans	-89	114.5	169.7	-170.1	-94.9	0	0	0	107.6
330	S	39.4	Very low	40.6	Very low	102 Å²	102	148 Å²	148	71%	0.713	81%	0.809	S	S	*	*			trans	-160.1	103.3	158.9	-176.2	0	0	0	0	109.3
331	Q	40.7	Very low	40.7	Very low	178 Å²	178	143.6 Å²	143.6	83%	0.832	81%	0.807	S	S	*	*			trans	47.7	96.4	147.8	-67.9	177.8	-26.9	0	0	118.4
332	D	37	Very low	40.5	Very low	161 Å²	161	142.4 Å²	142.4	86%	0.861	81%	0.806	S	S	*	*			trans	-127.7	111.6	143.2	-91.6	-35.2	0	0	0	107.7
333	Q	40.7	Very low	40.4	Very low	192 Å²	192	145.3 Å²	145.3	90%	0.897	81%	0.813	S	S	*	*			trans	-143.2	99.6	138.6	-80.3	-160.6	-14.2	0	0	106.4
334	L	38	Very low	40.3	Very low	150 Å²	150	148.4 Å²	148.4	79%	0.785	82%	0.822	S	S	*	*				68.8	102.5	80	-149.6	84.4	0	0	0	111.1
335	S	34.1	Very low	40.3	Very low	108 Å²	108	152.6 Å²	152.6	76%	0.755	83%	0.829	S	S	*	*			trans	-38.1	130.4	160.4	49.3	0	0	0	0	114.2
336	V	43.8	Very low	39.8	Very low	129 Å²	129	151.6 Å²	151.6	78%	0.782	83%	0.83	S	S	*	*			trans	-131	111.5	151.6	-179.3	0	0	0	0	107.4
337	G	39.1	Very low	39.8	Very low	74 Å²	74	148.1 Å²	148.1	76%	0.763	83%	0.83	S	S	*	*			trans	-69.6	135.2	171.8	0	0	0	0	0	110.7
338	V	44	Very low	40.2	Very low	130 Å²	130	148.2 Å²	148.2	79%	0.788	83%	0.833	S	S	*	*			trans	-124.5	102	164	180	0	0	0	0	106.6
339	T	37.2	Very low	40.3	Very low	129 Å²	129	143.7 Å²	143.7	79%	0.791	83%	0.828	S	S	*	*			trans	-89.2	120.4	161	49.6	0	0	0	0	107.6
340	N	44.6	Very low	41.2	Very low	162 Å²	162	139.3 Å²	139.3	87%	0.866	83%	0.825	S	S	*	*			trans	-165.9	131	154.4	-99.7	-25.6	0	0	0	112.1
341	G	41.1	Very low	41.6	Very low	81 Å²	81	141 Å²	141	84%	0.835	82%	0.824	S	S	*	*			trans	67.9	110.2	155.9	0	0	0	0	0	116.5
342	G	37.7	Very low	42	Very low	80 Å²	80	140 Å²	140	83%	0.825	83%	0.825	S	S	*	*			cis	94.4	74.1	39.2	0	0	0	0	0	110.7
343	M	39.2	Very low	42.9	Very low	186 Å²	186	140.9 Å²	140.9	92%	0.916	82%	0.824	S	S	*	*			trans	-151.1	85.4	161	-158	75.2	157.8	0	0	109.4
344	K	42.4	Very low	43.2	Very low	206 Å²	206	143.6 Å²	143.6	90%	0.896	84%	0.843	S	S	*	*			trans	-85	128.1	165.2	-86.5	-177.2	174.5	-178.2	0	108.4
345	R	43.4	Very low	43.4	Very low	244 Å²	244	143.3 Å²	143.3	92%	0.921	85%	0.846	S	S	*	*			trans	-86.6	133.2	158.6	-70.5	-173.1	-129.4	-151.7	0.9	108.8
346	P	38.9	Very low	43.9	Very low	126 Å²	126	145.2 Å²	145.2	82%	0.818	85%	0.851	S	S	*	*			trans	-104.9	160	165	36.6	-26.9	0	0	0	111.9
347	G	41.8	Very low	43.9	Very low	77 Å²	77	146.1 Å²	146.1	79%	0.794	86%	0.855	S	S	*	*			trans	115	113.1	171.2	0	0	0	0	0	110.6
348	S	46.7	Very low	44.2	Very low	114 Å²	114	150.3 Å²	150.3	80%	0.797	86%	0.86	S	S	*	*			cis	-159.6	123.4	33.4	48.6	0	0	0	0	111.2
349	D	43.8	Very low	44.2	Very low	155 Å²	155	151.6 Å²	151.6	83%	0.829	87%	0.865	S	S	*	*			trans	-98.4	126.2	151.6	-77.7	-42.5	0	0	0	107.3
350	V	52.4	Low	44.7	Very low	141 Å²	141	153.1 Å²	153.1	86%	0.855	87%	0.87	S	S	*	*			trans	-135.3	106.2	150.2	178.7	0	0	0	0	105.7
351	I	46.8	Very low	44.7	Very low	137 Å²	137	152.4 Å²	152.4	70%	0.703	87%	0.87	S	S	*	*			trans	-94.1	132.3	158	-60.9	169.5	0	0	0	104.5
352	D	50.2	Low	45	Very low	159 Å²	159	157.9 Å²	157.9	85%	0.85	87%	0.873	S	S	*	*			trans	-155.1	133.9	136.9	-102.6	-23.8	0	0	0	110
353	E	53.9	Low	45.6	Very low	179 Å²	179	164.4 Å²	164.4	84%	0.836	88%	0.877	S	S	*	*			trans	-68.5	135.9	174.5	-66.9	177.5	111.7	0	0	111.1
354	L	47.6	Very low	46.2	Very low	249 Å²	249	162.5 Å²	162.5	100%	1.304	87%	0.873	S	S	*	*				-178.1	0	128.5	-97.7	165.9	0	0	0	110.5

Retrieved 354 of 354 residues in 119.1 ms (Link to these results)

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