A0A077Z0A3_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z0A3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 234 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	39	Very low	42.9	Very low	238 Å²	238	154.8 Å²	154.8	100%	1.172	83%	0.826	S	S	*	*				0	129	0	-73	-81.4	173.3	0	0	107.3
2	P	46.2	Very low	42.2	Very low	106 Å²	106	151.4 Å²	151.4	69%	0.688	81%	0.814	S	S	*	*				-130.5	174.7	-58.1	39.7	-26.8	0	0	0	113.9
3	H	47.1	Very low	41.7	Very low	176 Å²	176	148.5 Å²	148.5	82%	0.815	81%	0.811	S	S	*	*			trans	82.3	85.3	155.5	-72.7	-66.4	0	0	0	122
4	E	38.6	Very low	41.3	Very low	178 Å²	178	151.4 Å²	151.4	83%	0.832	81%	0.812	S	S	*	*			trans	-58.9	137.8	139.8	-79.1	172.5	129.3	0	0	111
5	S	50.3	Low	41	Very low	121 Å²	121	154.3 Å²	154.3	85%	0.846	81%	0.814	S	S	*	*			trans	-123.7	113	158.3	39.5	0	0	0	0	108.1
6	T	41.7	Very low	40.5	Very low	117 Å²	117	156.4 Å²	156.4	72%	0.718	82%	0.815	S	S	*	*			trans	-96.8	110.4	178.2	36.7	0	0	0	0	108.9	K8	T6-K8 PolarHBondContact O-N 2.86Å
7	E	46.4	Very low	40.4	Very low	182 Å²	182	154.1 Å²	154.1	85%	0.85	81%	0.809	S	S	*	*			trans	-86.4	104.9	171.5	-161.7	172.6	-168.5	0	0	109	V9	E7-V9 PolarHBondContact O-N 3.23Å; E7-V9 VanDerWaalsContact O-N 3.15Å
8	K	41.8	Very low	40	Very low	202 Å²	202	153.5 Å²	153.5	88%	0.878	81%	0.807	S	S	*	*			trans	-75.8	95	174.5	-77	-178.4	177.5	177.1	0	109.5	T6 G10	T6-K8 PolarHBondContact O-N 2.86Å; K8-G10 PolarHBondContact O-N 3.04Å
9	V	44.1	Very low	40	Very low	123 Å²	123	150.7 Å²	150.7	75%	0.745	80%	0.801	S	S	*	*			trans	-75.7	106.4	164.6	-178.9	0	0	0	0	108.5	E7 K11	E7-V9 PolarHBondContact O-N 3.23Å; E7-V9 VanDerWaalsContact O-N 3.15Å; V9-K11 PolarHBondContact O-N 3.33Å
10	G	35.4	Very low	39.7	Very low	68 Å²	68	152.7 Å²	152.7	70%	0.701	81%	0.806	S	S	*	*			trans	-63.4	113.1	176.1	0	0	0	0	0	111.3	K8 V12	K8-G10 PolarHBondContact O-N 3.04Å; G10-V12 PolarHBondContact O-N 2.71Å
11	K	41	Very low	39.5	Very low	192 Å²	192	154.6 Å²	154.6	84%	0.835	81%	0.807	S	S	*	*			trans	-70.8	107.7	167.1	-76.4	-179.6	176.5	178.1	0	109	V9 C13	V9-K11 PolarHBondContact O-N 3.33Å; K11-C13 PolarHBondContact O-N 3.02Å
12	V	34.7	Very low	39.3	Very low	114 Å²	114	152 Å²	152	69%	0.691	79%	0.792	S	S	*	*			trans	-78.3	98.8	164.4	-179.5	0	0	0	0	107.5	G10 F14	G10-V12 PolarHBondContact O-N 2.71Å; V12-F14 HydrophobicContact CG1-CD2 4.21Å; V12-F14 HydrophobicContact CG1-CE2 3.76Å; V12-F14 HydrophobicContact CG1-CZ 3.93Å; V12-F14 PolarHBondContact O-N 3.41Å
13	C	35.6	Very low	38.7	Very low	114 Å²	114	156.1 Å²	156.1	77%	0.77	80%	0.804	S	S	*	*			trans	-80.6	110	169.7	-73	0	0	0	0	109.2	K11 K15	K11-C13 PolarHBondContact O-N 3.02Å; C13-K15 PolarHBondContact O-N 2.62Å
14	F	36.6	Very low	38.1	Very low	188 Å²	188	153.3 Å²	153.3	83%	0.825	80%	0.804	S	S	*	*			trans	-75	114.6	164.4	-70.3	-82.7	0	0	0	109	V12 K16	V12-F14 HydrophobicContact CG1-CD2 4.21Å; V12-F14 HydrophobicContact CG1-CE2 3.76Å; V12-F14 HydrophobicContact CG1-CZ 3.93Å; V12-F14 PolarHBondContact O-N 3.41Å; F14-K16 PolarHBondContact O-N 2.92Å; F14-K16 VanDerWaalsContact O-N 3.16Å
15	K	36.8	Very low	37.9	Very low	195 Å²	195	150.4 Å²	150.4	85%	0.848	80%	0.804	S	S	*	*			trans	-59.9	115.1	167.4	-95.9	-176.9	173.9	178.5	0	108.4	C13 T17	C13-K15 PolarHBondContact O-N 2.62Å; K15-T17 PolarHBondContact O-N 3.44Å; K15-T17 VanDerWaalsContact O-N 3.13Å
16	K	32.4	Very low	37.4	Very low	189 Å²	189	148 Å²	148	82%	0.822	78%	0.784	S	S	*	*			trans	-72.6	96.5	167.3	-161.6	176.6	-174.5	-178.6	0	107.8	F14 N18	F14-K16 PolarHBondContact O-N 2.92Å; F14-K16 VanDerWaalsContact O-N 3.16Å; K16-N18 PolarHBondContact O-N 3.06Å
17	T	39.5	Very low	37.4	Very low	116 Å²	116	150 Å²	150	71%	0.712	79%	0.789	S	S	*	*			trans	-82.4	107.2	168.3	47.6	0	0	0	0	108.3	K15 S19	K15-T17 PolarHBondContact O-N 3.44Å; K15-T17 VanDerWaalsContact O-N 3.13Å; T17-S19 PolarHBondContact O-N 3.44Å
18	N	33.4	Very low	37	Very low	144 Å²	144	146 Å²	146	77%	0.77	78%	0.78	S	S	*	*			trans	-68.4	101.9	164.4	-69.8	-18.8	0	0	0	107.9	K16	K16-N18 PolarHBondContact O-N 3.06Å
19	S	39.3	Very low	36.8	Very low	100 Å²	100	137.2 Å²	137.2	70%	0.699	75%	0.748	S	S	*	*			trans	-134.5	75.3	161.7	62	0	0	0	0	108.5	T17 K21	T17-S19 PolarHBondContact O-N 3.44Å; S19-K21 VanDerWaalsContact C-N 3.29Å; S19-K21 PolarHBondContact O-N 3.05Å; S19-K21 VanDerWaalsContact O-N 3.12Å
20	E	34.2	Very low	36.6	Very low	191 Å²	191	133.8 Å²	133.8	89%	0.893	74%	0.737	S	S	*	*			trans	-68.5	89.2	157.7	-71.3	175.2	154.5	0	0	107.8
21	K	36.5	Very low	37	Very low	193 Å²	193	135 Å²	135	84%	0.839	74%	0.741	S	S	*	*			trans	176.1	135.7	156.5	-101.8	160.7	-177.8	-177.8	0	107.7	S19	S19-K21 VanDerWaalsContact C-N 3.29Å; S19-K21 PolarHBondContact O-N 3.05Å; S19-K21 VanDerWaalsContact O-N 3.12Å
22	E	34.6	Very low	37.1	Very low	184 Å²	184	129.5 Å²	129.5	86%	0.86	73%	0.731	S	S	*	*			trans	85.3	77.8	173.3	-56.4	-177.3	157.1	0	0	117.6
23	M	33.3	Very low	37.8	Very low	191 Å²	191	125.6 Å²	125.6	94%	0.941	71%	0.708	S	S	*	*			trans	-143.4	46.1	148.8	-78.8	-151.8	-167.7	0	0	111.4
24	S	35	Very low	38.7	Very low	117 Å²	117	122.8 Å²	122.8	82%	0.818	69%	0.685	S	S	*	*			trans	-109.1	22.6	179.8	69.7	0	0	0	0	114.7	V26	S24-V26 VanDerWaalsContact C-N 3.34Å; S24-V26 PolarHBondContact O-N 3.29Å
25	S	34	Very low	39.8	Very low	117 Å²	117	117.7 Å²	117.7	82%	0.818	66%	0.663	S	S	*	*			trans	-99.7	61.8	165.6	69.3	0	0	0	0	109.9
26	V	40.2	Very low	40.7	Very low	70 Å²	70	111.9 Å²	111.9	42%	0.424	64%	0.637	S	S	.	*			trans	-77.7	122.2	164.7	178.6	0	0	0	0	104.9	S24 S28	S24-V26 VanDerWaalsContact C-N 3.34Å; S24-V26 PolarHBondContact O-N 3.29Å; V26-S28 PolarHBondContact O-N 3.15Å
27	I	40.4	Very low	41.9	Very low	161 Å²	161	104.3 Å²	104.3	83%	0.826	61%	0.607	S	S	*	*			trans	-47.8	111.5	173.1	-60.2	166.5	0	0	0	106.9	G29	I27-G29 PolarHBondContact O-N 3.38Å; I27-G29 VanDerWaalsContact O-N 3.11Å
28	S	38.8	Very low	43.1	Very low	96 Å²	96	104 Å²	104	67%	0.671	60%	0.598	S	S	*	*			trans	-63.9	112.8	175	170.1	0	0	0	0	106.6	V26	V26-S28 PolarHBondContact O-N 3.15Å
29	G	37.1	Very low	44.5	Very low	19 Å²	19	97.1 Å²	97.1	20%	0.196	56%	0.561	C	S	.	*			trans	-78.2	163.6	169.6	0	0	0	0	0	109	I27 T33 D34	I27-G29 PolarHBondContact O-N 3.38Å; I27-G29 VanDerWaalsContact O-N 3.11Å; G29-T33 WeakPolarHBondContact CA-OG1 3.09Å; G29-D34 PolarHBondContact N-OD1 3.4Å
30	G	39.7	Very low	45.6	Very low	51 Å²	51	94.3 Å²	94.3	53%	0.526	54%	0.539	S	S	.	.			trans	-54.5	168.1	167.3	0	0	0	0	0	111.9	A32 T33 D34	G30-A32 PolarHBondContact O-N 3.4Å; G30-T33 PolarHBondContact N-OG1 3.27Å; G30-T33 PolarHBondContact O-N 3.2Å; G30-T33 PolarHBondContact O-OG1 3.36Å; G30-T33 VanDerWaalsContact O-OG1 3.08Å; G30-D34 PolarHBondContact O-N 2.95Å
31	A	43.5	Very low	47	Very low	93 Å²	93	91.9 Å²	91.9	77%	0.769	52%	0.522	S	S	*	.	H	α-helix	trans	-48.9	-33.3	-174.9	0	0	0	0	0	114.3	H35	A31-H35 WeakPolarHBondContact O-CB 3.18Å; A31-H35 PolarHBondContact O-N 2.86Å
32	A	44.1	Very low	48.3	Very low	77 Å²	77	84.8 Å²	84.8	64%	0.636	50%	0.495	S	S	*	.	H	α-helix	trans	-71.3	-39.7	175.5	0	0	0	0	0	113.8	G30 Y36	G30-A32 PolarHBondContact O-N 3.4Å; A32-Y36 WeakPolarHBondContact O-CB 3.44Å; A32-Y36 PolarHBondContact O-N 3.4Å
33	T	49.2	Very low	49.6	Very low	32 Å²	32	78 Å²	78	20%	0.196	46%	0.464	C	S	.	.	H	α-helix	trans	-83.4	-29.3	-178.1	34.9	0	0	0	0	112.9	G29 G30 Y36 S37	G29-T33 WeakPolarHBondContact CA-OG1 3.09Å; G30-T33 PolarHBondContact N-OG1 3.27Å; G30-T33 PolarHBondContact O-N 3.2Å; G30-T33 PolarHBondContact O-OG1 3.36Å; G30-T33 VanDerWaalsContact O-OG1 3.08Å; T33-Y36 PolarHBondContact O-N 3.39Å; T33-S37 WeakPolarHBondContact O-CB 3.26Å; T33-S37 PolarHBondContact O-N 3.44Å
34	D	54.5	Low	51	Low	54 Å²	54	75.7 Å²	75.7	29%	0.289	45%	0.449	S	S	.	.	H	α-helix	trans	-63.5	-43.9	168.7	-83.1	-7.7	0	0	0	110.6	G29 G30 S37 Q38	G29-D34 PolarHBondContact N-OD1 3.4Å; G30-D34 PolarHBondContact O-N 2.95Å; D34-S37 PolarHBondContact O-N 2.79Å; D34-S37 PolarHBondContact O-OG 3.17Å; D34-Q38 WeakPolarHBondContact O-CB 2.93Å; D34-Q38 WeakPolarHBondContact O-CG 3.21Å; D34-Q38 PolarHBondContact O-N 2.84Å
35	H	59.2	Low	52.3	Low	81 Å²	81	71.3 Å²	71.3	38%	0.375	42%	0.422	S	S	.	.	H	α-helix	trans	-65.4	-38.4	175	-154.3	-116.4	0	0	0	112	A31 Q38 F39 F60	A31-H35 WeakPolarHBondContact O-CB 3.18Å; A31-H35 PolarHBondContact O-N 2.86Å; H35-Q38 PolarHBondContact O-N 3.03Å; H35-F39 VanDerWaalsContact O-CB 3.26Å; H35-F39 WeakPolarHBondContact O-CB 3.49Å; H35-F39 PolarHBondContact O-N 3.32Å; H35-F60 AromaticContact CE1-CD1 3.64Å; H35-F60 AromaticContact NE2-CD1 3.78Å
36	Y	57	Low	53.2	Low	74 Å²	74	78.2 Å²	78.2	29%	0.29	43%	0.431	S	S	.	.	H	α-helix	trans	-63	-46.9	172.2	176.7	-104.2	0	0	0	112.3	A32 T33 Q38 F39 V40 A71 L75	A32-Y36 WeakPolarHBondContact O-CB 3.44Å; A32-Y36 PolarHBondContact O-N 3.4Å; T33-Y36 PolarHBondContact O-N 3.39Å; Y36-Q38 VanDerWaalsContact C-N 3.31Å; Y36-Q38 PolarHBondContact O-N 2.83Å; Y36-F39 WeakPolarHBondContact O-CB 3.15Å; Y36-F39 PolarHBondContact O-N 2.71Å; Y36-F39 VanDerWaalsContact O-N 3.17Å; Y36-V40 HydrophobicContact CD1-CG2 4.31Å; Y36-V40 HydrophobicContact CD2-CG2 4.16Å; Y36-V40 HydrophobicContact CE1-CG2 3.89Å; Y36-V40 HydrophobicContact CE2-CG2 3.72Å; Y36-V40 HydrophobicContact CG-CG2 4.44Å; Y36-V40 WeakPolarHBondContact O-CG2 3.47Å; Y36-V40 PolarHBondContact O-N 3.37Å; Y36-A71 HydrophobicContact CD2-CB 3.56Å; Y36-A71 HydrophobicContact CE2-CB 3.84Å; Y36-A71 HydrophobicContact CG-CB 4.19Å; Y36-L75 HydrophobicContact CE2-CD1 4.02Å
37	S	57.3	Low	53.8	Low	29 Å²	29	80.9 Å²	80.9	20%	0.203	44%	0.443	C	S	.	.	H	α-helix	trans	-63.4	-39.3	179.6	80.4	0	0	0	0	111.4	T33 D34 R41	T33-S37 WeakPolarHBondContact O-CB 3.26Å; T33-S37 PolarHBondContact O-N 3.44Å; D34-S37 PolarHBondContact O-N 2.79Å; D34-S37 PolarHBondContact O-OG 3.17Å; S37-R41 VanDerWaalsContact O-CB 3.27Å; S37-R41 WeakPolarHBondContact O-CB 3.43Å; S37-R41 WeakPolarHBondContact O-CG 3.26Å; S37-R41 PolarHBondContact O-N 2.82Å
38	Q	63.2	Low	54.5	Low	109 Å²	109	75.7 Å²	75.7	51%	0.509	42%	0.419	S	S	.	.	H	α-helix	trans	-66.2	-41.7	173.2	-74.2	-178.5	9.3	0	0	111.6	D34 H35 Y36 R41 T42	D34-Q38 WeakPolarHBondContact O-CB 2.93Å; D34-Q38 WeakPolarHBondContact O-CG 3.21Å; D34-Q38 PolarHBondContact O-N 2.84Å; H35-Q38 PolarHBondContact O-N 3.03Å; Y36-Q38 VanDerWaalsContact C-N 3.31Å; Y36-Q38 PolarHBondContact O-N 2.83Å; Q38-R41 PolarHBondContact O-N 2.81Å; Q38-T42 VanDerWaalsContact O-CB 3.27Å; Q38-T42 WeakPolarHBondContact O-CB 3.27Å; Q38-T42 PolarHBondContact O-N 3.42Å; Q38-T42 PolarHBondContact O-OG1 3.42Å
39	F	64.1	Low	55.2	Low	1 Å²	1	76.8 Å²	76.8	0%	0.004	42%	0.417	C	S	.	.	H	α-helix	trans	-60.5	-52.4	176.3	175.8	-103.9	0	0	0	111.7	H35 Y36 R41 T42 L43 L57 F60 T72 L75 K76	H35-F39 VanDerWaalsContact O-CB 3.26Å; H35-F39 WeakPolarHBondContact O-CB 3.49Å; H35-F39 PolarHBondContact O-N 3.32Å; Y36-F39 WeakPolarHBondContact O-CB 3.15Å; Y36-F39 PolarHBondContact O-N 2.71Å; Y36-F39 VanDerWaalsContact O-N 3.17Å; F39-R41 VanDerWaalsContact C-N 3.33Å; F39-R41 PolarHBondContact O-N 3.06Å; F39-T42 CarbonylContact O-C 3.59Å; F39-T42 PolarHBondContact O-N 2.85Å; F39-L43 HydrophobicContact CE1-CD1 4.01Å; F39-L43 HydrophobicContact CE2-CD1 4.03Å; F39-L43 HydrophobicContact CZ-CD1 3.53Å; F39-L43 WeakPolarHBondContact O-CB 3.02Å; F39-L43 PolarHBondContact O-N 3.5Å; F39-L57 HydrophobicContact CE2-CD2 3.56Å; F39-L57 HydrophobicContact CZ-CD2 3.81Å; F39-F60 HydrophobicContact CB-CD1 4.41Å; F39-F60 HydrophobicContact CB-CE1 4.22Å; F39-F60 HydrophobicContact CB-CZ 4.48Å; F39-F60 HydrophobicContact CD2-CB 4.31Å; F39-F60 HydrophobicContact CD2-CD1 4.14Å; F39-F60 AromaticContact CD2-CD2 3.64Å; F39-F60 HydrophobicContact CD2-CD2 3.64Å; F39-F60 HydrophobicContact CD2-CE1 4.37Å; F39-F60 AromaticContact CD2-CE2 3.89Å; F39-F60 HydrophobicContact CD2-CE2 3.89Å; F39-F60 AromaticContact CD2-CG 3.77Å; F39-F60 HydrophobicContact CD2-CG 3.77Å; F39-F60 HydrophobicContact CD2-CZ 4.26Å; F39-F60 HydrophobicContact CE2-CD2 4.08Å; F39-F60 HydrophobicContact CE2-CG 4.41Å; F39-T72 HydrophobicContact CB-CG2 4.17Å; F39-T72 HydrophobicContact CD1-CG2 3.97Å; F39-T72 HydrophobicContact CD2-CG2 3.68Å; F39-T72 HydrophobicContact CE1-CG2 4.22Å; F39-T72 HydrophobicContact CE2-CG2 3.96Å; F39-T72 HydrophobicContact CG-CG2 3.67Å; F39-T72 HydrophobicContact CZ-CG2 4.22Å; F39-L75 HydrophobicContact CE1-CB 4.12Å; F39-L75 HydrophobicContact CE1-CD2 3.71Å; F39-L75 HydrophobicContact CE1-CG 4.46Å; F39-K76 HydrophobicContact CE2-CG 4.29Å; F39-K76 HydrophobicContact CZ-CG 3.93Å
40	V	61.2	Low	56.1	Low	40 Å²	40	83.9 Å²	83.9	24%	0.242	45%	0.45	C	S	.	.	H	α-helix	trans	-60.1	-44.1	177.6	174	0	0	0	0	110.5	Y36 T42 L43 F44	Y36-V40 HydrophobicContact CD1-CG2 4.31Å; Y36-V40 HydrophobicContact CD2-CG2 4.16Å; Y36-V40 HydrophobicContact CE1-CG2 3.89Å; Y36-V40 HydrophobicContact CE2-CG2 3.72Å; Y36-V40 HydrophobicContact CG-CG2 4.44Å; Y36-V40 WeakPolarHBondContact O-CG2 3.47Å; Y36-V40 PolarHBondContact O-N 3.37Å; V40-T42 VanDerWaalsContact C-N 3.27Å; V40-T42 PolarHBondContact O-N 2.92Å; V40-L43 PolarHBondContact O-N 3.16Å; V40-F44 HydrophobicContact CG1-CD2 3.79Å; V40-F44 HydrophobicContact CG1-CE2 4.28Å; V40-F44 WeakPolarHBondContact O-CB 3.39Å; V40-F44 VanDerWaalsContact O-CD2 3.32Å; V40-F44 WeakPolarHBondContact O-CD2 3.44Å; V40-F44 PolarHBondContact O-N 3.12Å
41	R	64.3	Low	56.9	Low	141 Å²	141	88 Å²	88	53%	0.532	45%	0.45	S	S	.	.	H	α-helix	trans	-62.6	-33.4	174.7	-77.7	175	-179.5	164.8	8.1	113.2	S37 Q38 F39 G45	S37-R41 VanDerWaalsContact O-CB 3.27Å; S37-R41 WeakPolarHBondContact O-CB 3.43Å; S37-R41 WeakPolarHBondContact O-CG 3.26Å; S37-R41 PolarHBondContact O-N 2.82Å; Q38-R41 PolarHBondContact O-N 2.81Å; F39-R41 VanDerWaalsContact C-N 3.33Å; F39-R41 PolarHBondContact O-N 3.06Å; R41-G45 WeakPolarHBondContact O-CA 3.34Å; R41-G45 PolarHBondContact O-N 3.18Å
42	T	64.6	Low	57.7	Low	44 Å²	44	90.4 Å²	90.4	27%	0.27	45%	0.449	S	S	.	.	H	α-helix	trans	-77.1	-37.5	178.7	-58.8	0	0	0	0	110.9	Q38 F39 V40 T48 L56 F60	Q38-T42 VanDerWaalsContact O-CB 3.27Å; Q38-T42 WeakPolarHBondContact O-CB 3.27Å; Q38-T42 PolarHBondContact O-N 3.42Å; Q38-T42 PolarHBondContact O-OG1 3.42Å; F39-T42 CarbonylContact O-C 3.59Å; F39-T42 PolarHBondContact O-N 2.85Å; V40-T42 VanDerWaalsContact C-N 3.27Å; V40-T42 PolarHBondContact O-N 2.92Å; T42-T48 WeakPolarHBondContact O-CG2 3.46Å; T42-L56 HydrophobicContact CG2-CD2 3.85Å; T42-F60 HydrophobicContact CG2-CE2 3.94Å; T42-F60 HydrophobicContact CG2-CZ 3.99Å
43	L	61.7	Low	58.3	Low	40 Å²	40	91.3 Å²	91.3	21%	0.209	44%	0.442	C	S	.	.	H	α-helix	trans	-73.7	-39.1	-179	-156.1	125	0	0	0	112.1	F39 V40 L57 V79	F39-L43 HydrophobicContact CE1-CD1 4.01Å; F39-L43 HydrophobicContact CE2-CD1 4.03Å; F39-L43 HydrophobicContact CZ-CD1 3.53Å; F39-L43 WeakPolarHBondContact O-CB 3.02Å; F39-L43 PolarHBondContact O-N 3.5Å; V40-L43 PolarHBondContact O-N 3.16Å; L43-L57 HydrophobicContact CD1-CD2 4.01Å; L43-V79 HydrophobicContact CD1-CG2 4.4Å; L43-V79 HydrophobicContact CD2-CG2 4.07Å
44	F	63.1	Low	58.6	Low	143 Å²	143	92.2 Å²	92.2	63%	0.627	46%	0.458	S	S	*	.	H	α-helix	trans	-109.2	2.1	-176.9	-59.4	-74.4	0	0	0	114	V40 L75	V40-F44 HydrophobicContact CG1-CD2 3.79Å; V40-F44 HydrophobicContact CG1-CE2 4.28Å; V40-F44 WeakPolarHBondContact O-CB 3.39Å; V40-F44 VanDerWaalsContact O-CD2 3.32Å; V40-F44 WeakPolarHBondContact O-CD2 3.44Å; V40-F44 PolarHBondContact O-N 3.12Å; F44-L75 HydrophobicContact CE2-CD2 4.44Å
45	G	61.5	Low	59	Low	25 Å²	25	92 Å²	92	26%	0.258	46%	0.461	S	S	.	.			trans	-70.8	137.3	179	0	0	0	0	0	111.7	R41 N47 T48	R41-G45 WeakPolarHBondContact O-CA 3.34Å; R41-G45 PolarHBondContact O-N 3.18Å; G45-N47 PolarHBondContact O-N 3.43Å; G45-T48 PolarHBondContact O-N 3.36Å
46	R	52.6	Low	59	Low	262 Å²	262	89 Å²	89	99%	0.989	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-0.6	177.3	-75.5	-176.7	169.8	175.6	-3	115.4
47	N	53.2	Low	59	Low	127 Å²	127	85.9 Å²	85.9	68%	0.679	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	19.1	-171.8	-145.1	0.5	0	0	0	113.4	G45 N49	G45-N47 PolarHBondContact O-N 3.43Å; N47-N49 VanDerWaalsContact C-N 3.25Å; N47-N49 PolarHBondContact O-N 3.44Å; N47-N49 PolarHBondContact OD1-OD1 3.22Å
48	T	53.9	Low	59.2	Low	52 Å²	52	87.8 Å²	87.8	32%	0.319	45%	0.449	S	S	.	.			trans	-71	87.8	165.4	51.4	0	0	0	0	107.8	T42 G45 N50 L56	T42-T48 WeakPolarHBondContact O-CG2 3.46Å; G45-T48 PolarHBondContact O-N 3.36Å; T48-N50 PolarHBondContact O-N 2.96Å; T48-L56 HydrophobicContact CG2-CD1 3.63Å
49	N	55.5	Low	59.2	Low	119 Å²	119	88 Å²	88	64%	0.636	45%	0.45	S	S	*	.			trans	-57.3	63.4	-177.2	-70.6	-49.4	0	0	0	114.2	N47 R51	N47-N49 VanDerWaalsContact C-N 3.25Å; N47-N49 PolarHBondContact O-N 3.44Å; N47-N49 PolarHBondContact OD1-OD1 3.22Å; N49-R51 PolarHBondContact O-N 2.85Å
50	N	54.7	Low	58.8	Low	168 Å²	168	89.2 Å²	89.2	90%	0.898	46%	0.455	S	S	*	.	S	Bend	trans	47.5	27.9	-170.4	-73.4	-14.7	0	0	0	114	T48 L52	T48-N50 PolarHBondContact O-N 2.96Å; N50-L52 PolarHBondContact O-N 2.7Å
51	R	57.8	Low	58.3	Low	138 Å²	138	92.9 Å²	92.9	52%	0.521	47%	0.465	S	S	.	.			trans	-71.6	128.2	176.8	-72.1	-172.6	177.4	-174.8	-0.1	108.8	N49 I53 L56	N49-R51 PolarHBondContact O-N 2.85Å; R51-I53 PolarHBondContact O-N 2.76Å; R51-L56 HydrophobicContact CB-CD1 4.05Å; R51-L56 HydrophobicContact CB-CD2 4.32Å; R51-L56 HydrophobicContact CB-CG 3.97Å
52	L	59.6	Low	57.7	Low	143 Å²	143	90.9 Å²	90.9	75%	0.749	47%	0.465	S	S	*	.			trans	-54	129.4	171.7	-70.7	168.5	0	0	0	108.7	N50 G54 S55 L56	N50-L52 PolarHBondContact O-N 2.7Å; L52-G54 PolarHBondContact O-N 3.35Å; L52-S55 PolarHBondContact O-N 3.29Å; L52-S55 PolarHBondContact O-OG 3.43Å; L52-L56 PolarHBondContact O-N 2.97Å
53	I	57	Low	57.2	Low	96 Å²	96	96.3 Å²	96.3	49%	0.492	49%	0.493	S	S	.	.	H	α-helix	trans	-46	-42.1	179.7	-75	166.4	0	0	0	110.9	R51 S55 L56 L57 V79	R51-I53 PolarHBondContact O-N 2.76Å; I53-S55 VanDerWaalsContact C-N 3.31Å; I53-S55 PolarHBondContact O-N 3.04Å; I53-L56 WeakPolarHBondContact O-CB 3.36Å; I53-L56 PolarHBondContact O-N 3.05Å; I53-L57 HydrophobicContact CG2-CD1 3.62Å; I53-L57 HydrophobicContact CG2-CG 3.86Å; I53-L57 VanDerWaalsContact O-CG 3.26Å; I53-L57 WeakPolarHBondContact O-CG 3.27Å; I53-L57 PolarHBondContact O-N 3.44Å; I53-V79 HydrophobicContact CG2-CG1 4.43Å
54	G	55.5	Low	56.8	Low	51 Å²	51	102.6 Å²	102.6	53%	0.526	52%	0.521	S	S	.	.	H	α-helix	trans	-54.5	-39.2	177	0	0	0	0	0	115	L52 L57 S58	L52-G54 PolarHBondContact O-N 3.35Å; G54-L57 PolarHBondContact O-N 3.38Å; G54-S58 PolarHBondContact O-N 3.04Å
55	S	61.2	Low	56.1	Low	49 Å²	49	104.7 Å²	104.7	34%	0.343	53%	0.526	S	S	.	.	H	α-helix	trans	-77.3	-21	178.2	70.3	0	0	0	0	114.3	L52 I53 S58 Q59	L52-S55 PolarHBondContact O-N 3.29Å; L52-S55 PolarHBondContact O-OG 3.43Å; I53-S55 VanDerWaalsContact C-N 3.31Å; I53-S55 PolarHBondContact O-N 3.04Å; S55-S58 PolarHBondContact O-OG 2.94Å; S55-Q59 PolarHBondContact O-NE2 3.3Å
56	L	61.1	Low	55.1	Low	18 Å²	18	106.2 Å²	106.2	9%	0.094	54%	0.542	C	S	.	.	H	α-helix	trans	-79.2	-42.9	170.3	-72.5	165.1	0	0	0	109.4	T42 T48 R51 L52 I53 S58 Q59 F60	T42-L56 HydrophobicContact CG2-CD2 3.85Å; T48-L56 HydrophobicContact CG2-CD1 3.63Å; R51-L56 HydrophobicContact CB-CD1 4.05Å; R51-L56 HydrophobicContact CB-CD2 4.32Å; R51-L56 HydrophobicContact CB-CG 3.97Å; L52-L56 PolarHBondContact O-N 2.97Å; I53-L56 WeakPolarHBondContact O-CB 3.36Å; I53-L56 PolarHBondContact O-N 3.05Å; L56-S58 VanDerWaalsContact C-N 3.31Å; L56-S58 PolarHBondContact O-N 2.98Å; L56-Q59 PolarHBondContact O-N 2.78Å; L56-F60 WeakPolarHBondContact O-CD2 3.4Å; L56-F60 WeakPolarHBondContact O-CE2 3.04Å
57	L	56.5	Low	54.4	Low	8 Å²	8	100.1 Å²	100.1	4%	0.042	54%	0.536	C	S	.	.	H	α-helix	trans	-62.5	-37.7	179.4	-66.3	179.9	0	0	0	111.9	F39 L43 I53 G54 Q59 F60 Y61 K76	F39-L57 HydrophobicContact CE2-CD2 3.56Å; F39-L57 HydrophobicContact CZ-CD2 3.81Å; L43-L57 HydrophobicContact CD1-CD2 4.01Å; I53-L57 HydrophobicContact CG2-CD1 3.62Å; I53-L57 HydrophobicContact CG2-CG 3.86Å; I53-L57 VanDerWaalsContact O-CG 3.26Å; I53-L57 WeakPolarHBondContact O-CG 3.27Å; I53-L57 PolarHBondContact O-N 3.44Å; G54-L57 PolarHBondContact O-N 3.38Å; L57-Q59 PolarHBondContact O-N 2.7Å; L57-F60 PolarHBondContact O-N 3.39Å; L57-Y61 HydrophobicContact CB-CD2 4.44Å; L57-Y61 HydrophobicContact CB-CE2 3.95Å; L57-Y61 WeakPolarHBondContact O-CD2 3.19Å; L57-Y61 PolarHBondContact O-N 3.12Å; L57-K76 HydrophobicContact CD2-CG 4.22Å
58	S	61.3	Low	54	Low	70 Å²	70	98.1 Å²	98.1	49%	0.49	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-59	-26.3	178.4	65.4	0	0	0	0	114.2	G54 S55 L56 F60 Y61	G54-S58 PolarHBondContact O-N 3.04Å; S55-S58 PolarHBondContact O-OG 2.94Å; L56-S58 VanDerWaalsContact C-N 3.31Å; L56-S58 PolarHBondContact O-N 2.98Å; S58-F60 PolarHBondContact O-N 3.15Å; S58-Y61 PolarHBondContact O-N 2.79Å
59	Q	63	Low	53.9	Low	112 Å²	112	99.6 Å²	99.6	52%	0.523	55%	0.546	S	S	.	.	G	3₁₀ helix	trans	-71.1	-18.3	175.6	-67.9	169.4	48.9	0	0	112.9	S55 L56 L57	S55-Q59 PolarHBondContact O-NE2 3.3Å; L56-Q59 PolarHBondContact O-N 2.78Å; L57-Q59 PolarHBondContact O-N 2.7Å
60	F	54.9	Low	54	Low	27 Å²	27	96.6 Å²	96.6	12%	0.118	54%	0.535	C	S	.	.	G	3₁₀ helix	trans	-108.5	8.7	179.3	-54.9	-81.7	0	0	0	112	H35 F39 T42 L56 L57 S58 K76	H35-F60 AromaticContact CE1-CD1 3.64Å; H35-F60 AromaticContact NE2-CD1 3.78Å; F39-F60 HydrophobicContact CB-CD1 4.41Å; F39-F60 HydrophobicContact CB-CE1 4.22Å; F39-F60 HydrophobicContact CB-CZ 4.48Å; F39-F60 HydrophobicContact CD2-CB 4.31Å; F39-F60 HydrophobicContact CD2-CD1 4.14Å; F39-F60 AromaticContact CD2-CD2 3.64Å; F39-F60 HydrophobicContact CD2-CD2 3.64Å; F39-F60 HydrophobicContact CD2-CE1 4.37Å; F39-F60 AromaticContact CD2-CE2 3.89Å; F39-F60 HydrophobicContact CD2-CE2 3.89Å; F39-F60 AromaticContact CD2-CG 3.77Å; F39-F60 HydrophobicContact CD2-CG 3.77Å; F39-F60 HydrophobicContact CD2-CZ 4.26Å; F39-F60 HydrophobicContact CE2-CD2 4.08Å; F39-F60 HydrophobicContact CE2-CG 4.41Å; T42-F60 HydrophobicContact CG2-CE2 3.94Å; T42-F60 HydrophobicContact CG2-CZ 3.99Å; L56-F60 WeakPolarHBondContact O-CD2 3.4Å; L56-F60 WeakPolarHBondContact O-CE2 3.04Å; L57-F60 PolarHBondContact O-N 3.39Å; S58-F60 PolarHBondContact O-N 3.15Å; F60-K76 PolarHBondContact O-NZ 3.32Å
61	Y	50.7	Low	54	Low	117 Å²	117	90.4 Å²	90.4	46%	0.459	51%	0.507	S	S	.	.			trans	-96.4	116.5	170.3	-80.8	-82.4	0	0	0	108	L57 S58 K76	L57-Y61 HydrophobicContact CB-CD2 4.44Å; L57-Y61 HydrophobicContact CB-CE2 3.95Å; L57-Y61 WeakPolarHBondContact O-CD2 3.19Å; L57-Y61 PolarHBondContact O-N 3.12Å; S58-Y61 PolarHBondContact O-N 2.79Å; Y61-K76 HydrophobicContact CE1-CD 4.28Å; Y61-K76 HydrophobicContact CE2-CD 4.25Å
62	D	52.9	Low	53.8	Low	99 Å²	99	84.1 Å²	84.1	53%	0.529	48%	0.484	S	S	.	.			trans	-115.1	110.5	164.6	-159.1	-9.5	0	0	0	105.6	E64 Y65	D62-E64 PolarHBondContact O-N 2.91Å; D62-E64 VanDerWaalsContact O-N 3.15Å; D62-Y65 HydrophobicContact CB-CD2 4.22Å; D62-Y65 PolarHBondContact O-N 3.41Å
63	D	54.1	Low	53.7	Low	159 Å²	159	79.3 Å²	79.3	85%	0.85	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-11.8	-174.6	-74	-22.8	0	0	0	111.9
64	E	53	Low	53.7	Low	171 Å²	171	80.3 Å²	80.3	80%	0.799	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-14.5	-178	-70.1	-167.6	160.9	0	0	114.6	D62	D62-E64 PolarHBondContact O-N 2.91Å; D62-E64 VanDerWaalsContact O-N 3.15Å
65	Y	48.1	Very low	53.8	Low	187 Å²	187	79.6 Å²	79.6	73%	0.733	45%	0.451	S	S	*	.			trans	-104.3	97.9	-177.2	-73.1	-83.8	0	0	0	112.1	D62	D62-Y65 HydrophobicContact CB-CD2 4.22Å; D62-Y65 PolarHBondContact O-N 3.41Å
66	G	41.3	Very low	53.6	Low	58 Å²	58	78.1 Å²	78.1	60%	0.598	44%	0.439	S	S	*	.			trans	-60	178.8	173.4	0	0	0	0	0	114.9	A68	G66-A68 VanDerWaalsContact C-N 3.32Å; G66-A68 PolarHBondContact O-N 3.03Å
67	P	38.5	Very low	53.2	Low	133 Å²	133	78.1 Å²	78.1	86%	0.864	44%	0.441	S	S	*	.	S	Bend	trans	-80.3	65.3	-148.8	36.2	-38.1	0	0	0	113.5
68	A	43	Very low	53.1	Low	85 Å²	85	82.3 Å²	82.3	70%	0.702	46%	0.463	S	S	*	.			trans	-80.1	110.2	146.8	0	0	0	0	0	105.7	G66 S70	G66-A68 VanDerWaalsContact C-N 3.32Å; G66-A68 PolarHBondContact O-N 3.03Å; A68-S70 PolarHBondContact O-N 2.87Å
69	V	53.6	Low	53	Low	84 Å²	84	81.1 Å²	81.1	51%	0.509	45%	0.453	S	S	.	.			trans	-63.8	85.8	-178.2	-177.1	0	0	0	0	108.5	Q74	V69-Q74 HydrophobicContact CG1-CB 4.18Å
70	S	57.4	Low	52.6	Low	56 Å²	56	80 Å²	80	39%	0.392	45%	0.45	S	S	.	.			trans	-65.3	150.2	176.1	79.9	0	0	0	0	108.3	A68 T72 A73 Q74	A68-S70 PolarHBondContact O-N 2.87Å; S70-T72 PolarHBondContact O-N 3.41Å; S70-T72 WeakPolarHBondContact OG-CB 3.32Å; S70-T72 PolarHBondContact OG-N 2.66Å; S70-A73 WeakPolarHBondContact O-CA 3.43Å; S70-A73 WeakPolarHBondContact O-CB 3.3Å; S70-A73 PolarHBondContact O-N 3.36Å; S70-A73 PolarHBondContact OG-N 3.35Å; S70-A73 VanDerWaalsContact OG-N 3.12Å; S70-Q74 PolarHBondContact O-N 2.95Å
71	A	53	Low	52.3	Low	38 Å²	38	82.6 Å²	82.6	31%	0.314	47%	0.465	S	S	.	.	H	α-helix	trans	-52.3	-29.4	173.3	0	0	0	0	0	111.7	Y36 L75	Y36-A71 HydrophobicContact CD2-CB 3.56Å; Y36-A71 HydrophobicContact CE2-CB 3.84Å; Y36-A71 HydrophobicContact CG-CB 4.19Å; A71-L75 WeakPolarHBondContact O-CB 3.44Å; A71-L75 PolarHBondContact O-N 2.91Å
72	T	54	Low	52.3	Low	6 Å²	6	84.3 Å²	84.3	4%	0.037	48%	0.482	C	S	.	.	H	α-helix	trans	-64.7	-44.4	171.2	-44.1	0	0	0	0	112.3	F39 S70 K76	F39-T72 HydrophobicContact CB-CG2 4.17Å; F39-T72 HydrophobicContact CD1-CG2 3.97Å; F39-T72 HydrophobicContact CD2-CG2 3.68Å; F39-T72 HydrophobicContact CE1-CG2 4.22Å; F39-T72 HydrophobicContact CE2-CG2 3.96Å; F39-T72 HydrophobicContact CG-CG2 3.67Å; F39-T72 HydrophobicContact CZ-CG2 4.22Å; S70-T72 PolarHBondContact O-N 3.41Å; S70-T72 WeakPolarHBondContact OG-CB 3.32Å; S70-T72 PolarHBondContact OG-N 2.66Å; T72-K76 HydrophobicContact CG2-CD 4.46Å; T72-K76 VanDerWaalsContact O-CB 3.3Å; T72-K76 WeakPolarHBondContact O-CB 3.35Å; T72-K76 WeakPolarHBondContact O-CG 3.4Å; T72-K76 PolarHBondContact O-N 3.02Å
73	A	57.2	Low	52.1	Low	41 Å²	41	87.3 Å²	87.3	34%	0.339	49%	0.49	S	S	.	.	H	α-helix	trans	-64.7	-39.8	176.2	0	0	0	0	0	112.1	S70 K76 A77	S70-A73 WeakPolarHBondContact O-CA 3.43Å; S70-A73 WeakPolarHBondContact O-CB 3.3Å; S70-A73 PolarHBondContact O-N 3.36Å; S70-A73 PolarHBondContact OG-N 3.35Å; S70-A73 VanDerWaalsContact OG-N 3.12Å; A73-K76 WeakPolarHBondContact O-CB 3.26Å; A73-K76 PolarHBondContact O-N 2.95Å; A73-A77 PolarHBondContact O-N 2.82Å
74	Q	57.8	Low	51.5	Low	118 Å²	118	86.2 Å²	86.2	55%	0.551	49%	0.492	S	S	*	.	H	α-helix	trans	-67.8	-42.9	178.3	-162.9	165.6	6.3	0	0	112	V69 S70 A77 D78	V69-Q74 HydrophobicContact CG1-CB 4.18Å; S70-Q74 PolarHBondContact O-N 2.95Å; Q74-A77 WeakPolarHBondContact O-CB 3.37Å; Q74-A77 PolarHBondContact O-N 2.79Å; Q74-A77 VanDerWaalsContact O-N 3.15Å; Q74-D78 PolarHBondContact O-N 3.48Å
75	L	58.1	Low	50.9	Low	35 Å²	35	81.3 Å²	81.3	18%	0.183	48%	0.477	C	S	.	.	H	α-helix	trans	-72.8	-29.6	177	-150.6	141.5	0	0	0	112.1	Y36 F39 F44 A71 A77 D78 V79	Y36-L75 HydrophobicContact CE2-CD1 4.02Å; F39-L75 HydrophobicContact CE1-CB 4.12Å; F39-L75 HydrophobicContact CE1-CD2 3.71Å; F39-L75 HydrophobicContact CE1-CG 4.46Å; F44-L75 HydrophobicContact CE2-CD2 4.44Å; A71-L75 WeakPolarHBondContact O-CB 3.44Å; A71-L75 PolarHBondContact O-N 2.91Å; L75-A77 VanDerWaalsContact C-N 3.31Å; L75-D78 PolarHBondContact O-N 3.21Å; L75-V79 HydrophobicContact CD2-CG2 3.93Å; L75-V79 WeakPolarHBondContact O-CB 3.36Å; L75-V79 VanDerWaalsContact O-CG2 3.26Å; L75-V79 WeakPolarHBondContact O-CG2 3.39Å; L75-V79 PolarHBondContact O-N 2.9Å
76	K	57	Low	50.8	Low	19 Å²	19	79.3 Å²	79.3	8%	0.083	48%	0.484	C	S	.	.	H	α-helix	trans	-60	-43	167	-80.7	171.3	179.2	-175.4	0	110.9	F39 L57 F60 Y61 T72 A73 L80	F39-K76 HydrophobicContact CE2-CG 4.29Å; F39-K76 HydrophobicContact CZ-CG 3.93Å; L57-K76 HydrophobicContact CD2-CG 4.22Å; F60-K76 PolarHBondContact O-NZ 3.32Å; Y61-K76 HydrophobicContact CE1-CD 4.28Å; Y61-K76 HydrophobicContact CE2-CD 4.25Å; T72-K76 HydrophobicContact CG2-CD 4.46Å; T72-K76 VanDerWaalsContact O-CB 3.3Å; T72-K76 WeakPolarHBondContact O-CB 3.35Å; T72-K76 WeakPolarHBondContact O-CG 3.4Å; T72-K76 PolarHBondContact O-N 3.02Å; A73-K76 WeakPolarHBondContact O-CB 3.26Å; A73-K76 PolarHBondContact O-N 2.95Å; K76-L80 WeakPolarHBondContact O-CB 3.37Å; K76-L80 WeakPolarHBondContact O-CD1 3.49Å; K76-L80 WeakPolarHBondContact O-CG 3.17Å; K76-L80 PolarHBondContact O-N 2.99Å
77	A	52.3	Low	50.7	Low	17 Å²	17	81.4 Å²	81.4	14%	0.14	48%	0.482	C	S	.	.	H	α-helix	trans	-60.9	-52.1	175	0	0	0	0	0	110	A73 Q74 L75 V79 L80 L81 Y90	A73-A77 PolarHBondContact O-N 2.82Å; Q74-A77 WeakPolarHBondContact O-CB 3.37Å; Q74-A77 PolarHBondContact O-N 2.79Å; Q74-A77 VanDerWaalsContact O-N 3.15Å; L75-A77 VanDerWaalsContact C-N 3.31Å; A77-V79 VanDerWaalsContact C-N 3.33Å; A77-V79 PolarHBondContact O-N 2.97Å; A77-L80 CarbonylContact O-C 3.56Å; A77-L80 PolarHBondContact O-N 2.92Å; A77-L81 HydrophobicContact CB-CD1 4Å; A77-L81 WeakPolarHBondContact O-CB 3.47Å; A77-L81 WeakPolarHBondContact O-CD1 3.5Å; A77-L81 WeakPolarHBondContact O-CG 3.32Å; A77-L81 PolarHBondContact O-N 3.36Å; A77-Y90 WeakPolarHBondContact CB-OH 3.42Å
78	D	54.8	Low	51	Low	97 Å²	97	84.1 Å²	84.1	52%	0.519	48%	0.483	S	S	.	.	H	α-helix	trans	-58.3	-41.8	-179.5	-66.6	-18.7	0	0	0	112.9	Q74 L75 L80 L81 D82	Q74-D78 PolarHBondContact O-N 3.48Å; L75-D78 PolarHBondContact O-N 3.21Å; D78-L80 VanDerWaalsContact C-N 3.33Å; D78-L80 PolarHBondContact O-N 3.49Å; D78-L81 PolarHBondContact O-N 3.24Å; D78-D82 PolarHBondContact O-N 3.49Å
79	V	59.1	Low	50.6	Low	44 Å²	44	87.6 Å²	87.6	27%	0.267	49%	0.488	S	S	.	.	H	α-helix	trans	-67.5	-31.7	177.2	171.2	0	0	0	0	112.6	L43 I53 L75 A77	L43-V79 HydrophobicContact CD1-CG2 4.4Å; L43-V79 HydrophobicContact CD2-CG2 4.07Å; I53-V79 HydrophobicContact CG2-CG1 4.43Å; L75-V79 HydrophobicContact CD2-CG2 3.93Å; L75-V79 WeakPolarHBondContact O-CB 3.36Å; L75-V79 VanDerWaalsContact O-CG2 3.26Å; L75-V79 WeakPolarHBondContact O-CG2 3.39Å; L75-V79 PolarHBondContact O-N 2.9Å; A77-V79 VanDerWaalsContact C-N 3.33Å; A77-V79 PolarHBondContact O-N 2.97Å
80	L	54.3	Low	49.7	Very low	90 Å²	90	90.2 Å²	90.2	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-83.6	-27.7	176.6	-68.5	171.3	0	0	0	112.4	K76 A77 D78 K83	K76-L80 WeakPolarHBondContact O-CB 3.37Å; K76-L80 WeakPolarHBondContact O-CD1 3.49Å; K76-L80 WeakPolarHBondContact O-CG 3.17Å; K76-L80 PolarHBondContact O-N 2.99Å; A77-L80 CarbonylContact O-C 3.56Å; A77-L80 PolarHBondContact O-N 2.92Å; D78-L80 VanDerWaalsContact C-N 3.33Å; D78-L80 PolarHBondContact O-N 3.49Å; L80-K83 PolarHBondContact O-N 3.13Å
81	L	48	Very low	48.8	Very low	81 Å²	81	95.3 Å²	95.3	42%	0.424	51%	0.51	S	S	.	.	H	α-helix	trans	-80.1	-14.5	-177.5	-73	168.3	0	0	0	114	A77 D78 K83 Y90	A77-L81 HydrophobicContact CB-CD1 4Å; A77-L81 WeakPolarHBondContact O-CB 3.47Å; A77-L81 WeakPolarHBondContact O-CD1 3.5Å; A77-L81 WeakPolarHBondContact O-CG 3.32Å; A77-L81 PolarHBondContact O-N 3.36Å; D78-L81 PolarHBondContact O-N 3.24Å; L81-K83 CarbonylContact O-C 3.42Å; L81-K83 PolarHBondContact O-N 2.88Å; L81-Y90 HydrophobicContact CD1-CE2 4.37Å; L81-Y90 HydrophobicContact CD2-CE2 4.19Å
82	D	51.3	Low	48.1	Very low	153 Å²	153	98.5 Å²	98.5	82%	0.818	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-1.4	166	-105.9	-1.8	0	0	0	112.8	D78	D78-D82 PolarHBondContact O-N 3.49Å
83	K	48.6	Very low	47.6	Very low	161 Å²	161	102.2 Å²	102.2	70%	0.7	55%	0.55	S	S	*	.	S	Bend	trans	-109.3	127.4	161.1	-68.9	-178.9	-180	177.7	0	109.2	L80 L81 S85	L80-K83 PolarHBondContact O-N 3.13Å; L81-K83 CarbonylContact O-C 3.42Å; L81-K83 PolarHBondContact O-N 2.88Å; K83-S85 PolarHBondContact O-N 3Å
84	P	40.9	Very low	46.8	Very low	137 Å²	137	105 Å²	105	89%	0.89	56%	0.559	S	S	*	*			trans	-70	75.7	174.4	31	-34.8	0	0	0	109.2
85	S	41.2	Very low	46	Very low	68 Å²	68	104 Å²	104	48%	0.476	56%	0.557	S	S	.	*			trans	-103.1	117.9	176	73.1	0	0	0	0	108.7	K83 N87	K83-S85 PolarHBondContact O-N 3Å; S85-N87 PolarHBondContact O-N 3.01Å
86	T	45.8	Very low	45.1	Very low	144 Å²	144	105.6 Å²	105.6	88%	0.883	57%	0.571	S	S	*	*			trans	-70	42.7	179.1	51.6	0	0	0	0	112	E88	T86-E88 PolarHBondContact O-N 3.01Å
87	N	38.2	Very low	44.3	Very low	103 Å²	103	108.9 Å²	108.9	55%	0.551	60%	0.595	S	S	*	*			trans	-79.6	118.7	-165.2	-134.9	-5.1	0	0	0	110.9	S85 L89 Y90	S85-N87 PolarHBondContact O-N 3.01Å; N87-L89 PolarHBondContact O-N 2.83Å; N87-Y90 PolarHBondContact O-N 2.94Å
88	E	45.7	Very low	43.8	Very low	190 Å²	190	111.8 Å²	111.8	89%	0.888	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-0.4	-179.2	-63.3	-177.8	161.9	0	0	114.3	T86 Y90	T86-E88 PolarHBondContact O-N 3.01Å; E88-Y90 PolarHBondContact O-N 3.08Å
89	L	35.3	Very low	43.4	Very low	157 Å²	157	109.2 Å²	109.2	82%	0.822	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-2.7	172.4	-75.5	161.8	0	0	0	113.3	N87 M91	N87-L89 PolarHBondContact O-N 2.83Å; L89-M91 PolarHBondContact O-N 3.15Å
90	Y	33.2	Very low	42.6	Very low	140 Å²	140	109.4 Å²	109.4	55%	0.549	61%	0.607	S	S	.	*			trans	-92.4	93.7	172.3	-121	-92.1	0	0	0	110.1	A77 L81 N87 E88 P92	A77-Y90 WeakPolarHBondContact CB-OH 3.42Å; L81-Y90 HydrophobicContact CD1-CE2 4.37Å; L81-Y90 HydrophobicContact CD2-CE2 4.19Å; N87-Y90 PolarHBondContact O-N 2.94Å; E88-Y90 PolarHBondContact O-N 3.08Å; Y90-P92 WeakPolarHBondContact O-CD 3.15Å
91	M	38	Very low	42.2	Very low	163 Å²	163	111.7 Å²	111.7	80%	0.803	62%	0.619	S	S	*	*			trans	-77.5	119.9	146.2	-78	-154.8	75.6	0	0	106	L89 V93	L89-M91 PolarHBondContact O-N 3.15Å; M91-V93 PolarHBondContact O-N 3.11Å
92	P	39.1	Very low	42	Very low	104 Å²	104	110.2 Å²	110.2	68%	0.675	61%	0.61	S	S	*	*			trans	-52.6	113.2	161.3	21.6	-28.4	0	0	0	105.7	Y90 D94	Y90-P92 WeakPolarHBondContact O-CD 3.15Å; P92-D94 VanDerWaalsContact C-N 3.29Å; P92-D94 PolarHBondContact O-N 3.24Å
93	V	43.6	Very low	41.7	Very low	85 Å²	85	105.9 Å²	105.9	52%	0.515	59%	0.586	S	S	.	*			trans	-58.4	109.7	166.6	174.9	0	0	0	0	103	M91 L95	M91-V93 PolarHBondContact O-N 3.11Å; V93-L95 HydrophobicContact CG1-CD2 4.28Å; V93-L95 PolarHBondContact O-N 3.39Å
94	D	40.4	Very low	41.8	Very low	99 Å²	99	102.1 Å²	102.1	53%	0.529	58%	0.58	S	S	.	*			trans	-67.6	87.2	172.5	-159.8	-12.6	0	0	0	105.1	P92 S96 C97 S98	P92-D94 VanDerWaalsContact C-N 3.29Å; P92-D94 PolarHBondContact O-N 3.24Å; D94-S96 PolarHBondContact O-N 3.27Å; D94-S96 VanDerWaalsContact OD1-CB 3.31Å; D94-S96 WeakPolarHBondContact OD1-CB 3.1Å; D94-S96 PolarHBondContact OD1-N 2.87Å; D94-S96 PolarHBondContact OD1-OG 2.71Å; D94-S96 PolarHBondContact OD2-OG 3.02Å; D94-C97 PolarHBondContact O-N 3.45Å; D94-S98 PolarHBondContact O-N 2.85Å
95	L	41.5	Very low	42.4	Very low	96 Å²	96	101.6 Å²	101.6	50%	0.503	57%	0.566	S	S	.	*	H	α-helix	trans	-53.8	-25.2	179.4	-74.7	166.9	0	0	0	109	V93 C97 S98 M99	V93-L95 HydrophobicContact CG1-CD2 4.28Å; V93-L95 PolarHBondContact O-N 3.39Å; L95-C97 VanDerWaalsContact C-N 3.32Å; L95-C97 PolarHBondContact O-N 3.5Å; L95-S98 PolarHBondContact O-N 2.82Å; L95-M99 HydrophobicContact CB-CE 3.85Å; L95-M99 HydrophobicContact CB-SD 4.17Å; L95-M99 HydrophobicContact CD1-CE 4.19Å; L95-M99 HydrophobicContact CD2-CE 3.74Å; L95-M99 HydrophobicContact CG-CE 4.13Å; L95-M99 WeakPolarHBondContact O-CA 3.23Å; L95-M99 WeakPolarHBondContact O-CB 3.48Å; L95-M99 WeakPolarHBondContact O-CG 3.45Å; L95-M99 PolarHBondContact O-N 3.48Å
96	S	38.9	Very low	42.8	Very low	69 Å²	69	98.4 Å²	98.4	48%	0.483	54%	0.544	S	S	.	.	H	α-helix	trans	-59.1	-39.6	173.1	77.3	0	0	0	0	112.9	D94 A100	D94-S96 PolarHBondContact O-N 3.27Å; D94-S96 VanDerWaalsContact OD1-CB 3.31Å; D94-S96 WeakPolarHBondContact OD1-CB 3.1Å; D94-S96 PolarHBondContact OD1-N 2.87Å; D94-S96 PolarHBondContact OD1-OG 2.71Å; D94-S96 PolarHBondContact OD2-OG 3.02Å; S96-A100 WeakPolarHBondContact O-CB 3.23Å; S96-A100 PolarHBondContact O-N 3.37Å
97	C	39.6	Very low	43.1	Very low	88 Å²	88	97.7 Å²	97.7	60%	0.595	53%	0.534	S	S	*	.	H	α-helix	trans	-77.4	-41.2	179.5	-65.7	0	0	0	0	112.6	D94 L95 M99	D94-C97 PolarHBondContact O-N 3.45Å; L95-C97 VanDerWaalsContact C-N 3.32Å; L95-C97 PolarHBondContact O-N 3.5Å; C97-M99 VanDerWaalsContact C-N 3.32Å
98	S	42.7	Very low	44	Very low	78 Å²	78	100 Å²	100	55%	0.545	54%	0.542	S	S	.	.	H	α-helix	trans	-73.8	-25.5	177.6	-174.4	0	0	0	0	112.8	D94 L95	D94-S98 PolarHBondContact O-N 2.85Å; L95-S98 PolarHBondContact O-N 2.82Å
99	M	45.6	Very low	44.3	Very low	43 Å²	43	92.7 Å²	92.7	21%	0.212	51%	0.508	C	S	.	.	H	α-helix	trans	-87.7	-21.1	176.2	-66	179.4	-177.1	0	0	112.4	L95 C97 D101 Q102 I103 L181 Y186	L95-M99 HydrophobicContact CB-CE 3.85Å; L95-M99 HydrophobicContact CB-SD 4.17Å; L95-M99 HydrophobicContact CD1-CE 4.19Å; L95-M99 HydrophobicContact CD2-CE 3.74Å; L95-M99 HydrophobicContact CG-CE 4.13Å; L95-M99 WeakPolarHBondContact O-CA 3.23Å; L95-M99 WeakPolarHBondContact O-CB 3.48Å; L95-M99 WeakPolarHBondContact O-CG 3.45Å; L95-M99 PolarHBondContact O-N 3.48Å; C97-M99 VanDerWaalsContact C-N 3.32Å; M99-D101 VanDerWaalsContact C-N 3.27Å; M99-D101 PolarHBondContact O-N 3.4Å; M99-Q102 CarbonylContact O-C 3.56Å; M99-Q102 WeakPolarHBondContact O-CA 3.31Å; M99-Q102 PolarHBondContact O-N 3.28Å; M99-I103 HydrophobicContact CB-CD1 3.96Å; M99-I103 HydrophobicContact CB-CG1 4.27Å; M99-I103 WeakPolarHBondContact O-CB 3.42Å; M99-I103 WeakPolarHBondContact O-CD1 3.04Å; M99-I103 WeakPolarHBondContact O-CG1 3.49Å; M99-I103 PolarHBondContact O-N 2.89Å; M99-L181 HydrophobicContact CE-CD2 3.46Å; M99-L181 VanDerWaalsContact CE-CD2 3.46Å; M99-L181 HydrophobicContact CG-CD2 4.36Å; M99-L181 HydrophobicContact SD-CD2 4.02Å; M99-Y186 HydrophobicContact CB-CE1 4.29Å; M99-Y186 HydrophobicContact SD-CE1 4.17Å
100	A	43.7	Very low	45.3	Very low	49 Å²	49	88.2 Å²	88.2	41%	0.405	49%	0.488	S	S	.	.	H	α-helix	trans	-51.8	-43.2	-177.2	0	0	0	0	0	113.3	S96 I103	S96-A100 WeakPolarHBondContact O-CB 3.23Å; S96-A100 PolarHBondContact O-N 3.37Å; A100-I103 WeakPolarHBondContact O-CB 3.39Å; A100-I103 PolarHBondContact O-N 2.95Å
101	D	45.4	Very low	46.2	Very low	137 Å²	137	81.6 Å²	81.6	73%	0.733	46%	0.462	S	S	*	.	H	α-helix	trans	-71.8	-35.2	178.7	-65.7	-24.8	0	0	0	112	M99	M99-D101 VanDerWaalsContact C-N 3.27Å; M99-D101 PolarHBondContact O-N 3.4Å
102	Q	44.5	Very low	47.1	Very low	50 Å²	50	77.5 Å²	77.5	23%	0.234	45%	0.454	C	S	.	.	H	α-helix	trans	-76.2	-23.5	175.8	-61.8	-170.1	3.5	0	0	113	M99 S104 E105 A106	M99-Q102 CarbonylContact O-C 3.56Å; M99-Q102 WeakPolarHBondContact O-CA 3.31Å; M99-Q102 PolarHBondContact O-N 3.28Å; Q102-S104 VanDerWaalsContact C-N 3.32Å; Q102-E105 PolarHBondContact O-N 3.09Å; Q102-A106 VanDerWaalsContact O-CB 3.31Å; Q102-A106 WeakPolarHBondContact O-CB 3.35Å; Q102-A106 PolarHBondContact O-N 3.35Å
103	I	44.3	Very low	48.1	Very low	62 Å²	62	75.7 Å²	75.7	32%	0.318	44%	0.439	S	S	.	.	H	α-helix	trans	-64.9	-39.1	175.8	-75	161.3	0	0	0	109.7	M99 A100 E105 A106 D107 Y186	M99-I103 HydrophobicContact CB-CD1 3.96Å; M99-I103 HydrophobicContact CB-CG1 4.27Å; M99-I103 WeakPolarHBondContact O-CB 3.42Å; M99-I103 WeakPolarHBondContact O-CD1 3.04Å; M99-I103 WeakPolarHBondContact O-CG1 3.49Å; M99-I103 PolarHBondContact O-N 2.89Å; A100-I103 WeakPolarHBondContact O-CB 3.39Å; A100-I103 PolarHBondContact O-N 2.95Å; I103-E105 VanDerWaalsContact C-N 3.3Å; I103-E105 PolarHBondContact O-N 3.14Å; I103-A106 PolarHBondContact O-N 3.34Å; I103-D107 PolarHBondContact O-N 2.81Å; I103-D107 VanDerWaalsContact O-N 3.15Å; I103-Y186 HydrophobicContact CD1-CD1 4.35Å; I103-Y186 HydrophobicContact CD1-CE1 3.97Å; I103-Y186 HydrophobicContact CG1-CD1 3.96Å; I103-Y186 HydrophobicContact CG1-CE1 3.31Å; I103-Y186 HydrophobicContact CG1-CE2 4.34Å
104	S	50.7	Low	48.9	Very low	82 Å²	82	72 Å²	72	57%	0.573	42%	0.416	S	S	*	.	H	α-helix	trans	-66.8	-30.3	178.8	-171.1	0	0	0	0	113.3	Q102	Q102-S104 VanDerWaalsContact C-N 3.32Å
105	E	53.2	Low	50	Low	127 Å²	127	71.5 Å²	71.5	59%	0.593	41%	0.41	S	S	*	.	H	α-helix	trans	-80.3	-34.3	173.9	-68.4	-171.4	162.1	0	0	111.3	Q102 I103 D107 Q108	Q102-E105 PolarHBondContact O-N 3.09Å; I103-E105 VanDerWaalsContact C-N 3.3Å; I103-E105 PolarHBondContact O-N 3.14Å; E105-D107 PolarHBondContact O-N 3.07Å; E105-Q108 PolarHBondContact O-N 3.2Å
106	A	48.9	Very low	50.9	Low	1 Å²	1	67.8 Å²	67.8	1%	0.008	39%	0.392	C	S	.	.	H	α-helix	trans	-69.3	-29.4	-178.4	0	0	0	0	0	114.4	Q102 I103 Q108 L109 P183 Y186	Q102-A106 VanDerWaalsContact O-CB 3.31Å; Q102-A106 WeakPolarHBondContact O-CB 3.35Å; Q102-A106 PolarHBondContact O-N 3.35Å; I103-A106 PolarHBondContact O-N 3.34Å; A106-Q108 PolarHBondContact O-N 3.4Å; A106-L109 WeakPolarHBondContact O-CB 3.03Å; A106-L109 PolarHBondContact O-N 3.4Å; A106-P183 HydrophobicContact CB-CB 4.32Å; A106-P183 HydrophobicContact CB-CG 4.09Å; A106-Y186 HydrophobicContact CB-CD2 4.43Å; A106-Y186 HydrophobicContact CB-CE2 3.46Å; A106-Y186 VanDerWaalsContact CB-CE2 3.46Å
107	D	53	Low	52.2	Low	128 Å²	128	69.5 Å²	69.5	68%	0.684	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-17.2	175.3	-87.7	-12.3	0	0	0	113.3	I103 E105	I103-D107 PolarHBondContact O-N 2.81Å; I103-D107 VanDerWaalsContact O-N 3.15Å; E105-D107 PolarHBondContact O-N 3.07Å
108	Q	56.1	Low	53.3	Low	152 Å²	152	69.3 Å²	69.3	71%	0.71	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-17	174.6	-61.8	178.6	46.5	0	0	112.7	E105 A106	E105-Q108 PolarHBondContact O-N 3.2Å; A106-Q108 PolarHBondContact O-N 3.4Å
109	L	53.3	Low	54.1	Low	36 Å²	36	68.3 Å²	68.3	19%	0.188	37%	0.37	C	S	.	.			trans	-82.3	123.8	-177.6	-64.3	172.6	0	0	0	110.1	A106 D113 F114 P183	A106-L109 WeakPolarHBondContact O-CB 3.03Å; A106-L109 PolarHBondContact O-N 3.4Å; L109-D113 HydrophobicContact CD2-CB 4.24Å; L109-F114 HydrophobicContact CB-CE2 3.98Å; L109-F114 HydrophobicContact CB-CZ 3.96Å; L109-F114 HydrophobicContact CD1-CZ 4.04Å; L109-P183 HydrophobicContact CB-CG 3.58Å; L109-P183 HydrophobicContact CD1-CG 4.01Å; L109-P183 HydrophobicContact CG-CG 4.42Å
110	T	55.7	Low	54.6	Low	63 Å²	63	70 Å²	70	39%	0.387	38%	0.383	S	S	.	.			trans	-101.8	165.8	178.5	67.2	0	0	0	0	110.7	A112 D113 F114	T110-A112 PolarHBondContact O-N 2.55Å; T110-A112 VanDerWaalsContact O-N 3.08Å; T110-A112 PolarHBondContact OG1-N 3.19Å; T110-D113 WeakPolarHBondContact CA-OD2 3.12Å; T110-D113 PolarHBondContact N-OD2 2.98Å; T110-D113 WeakPolarHBondContact O-CB 3.48Å; T110-D113 PolarHBondContact O-N 3.43Å; T110-D113 PolarHBondContact OG1-OD2 2.73Å; T110-F114 WeakPolarHBondContact O-CD2 3.42Å; T110-F114 VanDerWaalsContact O-CE2 3.25Å; T110-F114 WeakPolarHBondContact O-CE2 3.41Å
111	C	51.7	Low	55.2	Low	2 Å²	2	70.3 Å²	70.3	1%	0.014	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-55.7	-25.8	173.2	-172.4	0	0	0	0	113.8	D113 F114 V116 T148 L152 Y184	C111-D113 PolarHBondContact O-N 2.83Å; C111-F114 PolarHBondContact O-N 3.24Å; C111-V116 VanDerWaalsContact SG-CG2 3.57Å; C111-T148 VanDerWaalsContact SG-CB 3.58Å; C111-T148 PolarHBondContact SG-O 3.03Å; C111-T148 VanDerWaalsContact SG-O 3.42Å; C111-L152 HydrophobicContact CB-CD1 3.52Å; C111-L152 WeakPolarHBondContact SG-CD1 3.48Å; C111-Y184 WeakPolarHBondContact CA-OH 3.37Å; C111-Y184 VanDerWaalsContact CB-OH 3.26Å; C111-Y184 WeakPolarHBondContact CB-OH 3.39Å; C111-Y184 PolarHBondContact N-OH 2.8Å
112	A	56.7	Low	55.5	Low	77 Å²	77	68.6 Å²	68.6	64%	0.636	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-64.4	-20.4	176.7	0	0	0	0	0	113.1	T110 F114	T110-A112 PolarHBondContact O-N 2.55Å; T110-A112 VanDerWaalsContact O-N 3.08Å; T110-A112 PolarHBondContact OG1-N 3.19Å; A112-F114 VanDerWaalsContact C-N 3.33Å
113	D	60.8	Low	55.4	Low	66 Å²	66	76.4 Å²	76.4	35%	0.353	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-85.5	-8	-178.1	-54.8	-52.5	0	0	0	112.6	L109 T110 C111 L176	L109-D113 HydrophobicContact CD2-CB 4.24Å; T110-D113 WeakPolarHBondContact CA-OD2 3.12Å; T110-D113 PolarHBondContact N-OD2 2.98Å; T110-D113 WeakPolarHBondContact O-CB 3.48Å; T110-D113 PolarHBondContact O-N 3.43Å; T110-D113 PolarHBondContact OG1-OD2 2.73Å; C111-D113 PolarHBondContact O-N 2.83Å; D113-L176 HydrophobicContact CB-CD2 4.42Å; D113-L176 WeakPolarHBondContact O-CD2 3.39Å
114	F	60.9	Low	55.6	Low	8 Å²	8	77.9 Å²	77.9	4%	0.035	42%	0.42	C	S	.	.	S	Bend	trans	-114.9	141.2	-178.3	-55.7	-87.8	0	0	0	111.5	L109 T110 C111 A112 V116 L171 L176 P183 Y184	L109-F114 HydrophobicContact CB-CE2 3.98Å; L109-F114 HydrophobicContact CB-CZ 3.96Å; L109-F114 HydrophobicContact CD1-CZ 4.04Å; T110-F114 WeakPolarHBondContact O-CD2 3.42Å; T110-F114 VanDerWaalsContact O-CE2 3.25Å; T110-F114 WeakPolarHBondContact O-CE2 3.41Å; C111-F114 PolarHBondContact O-N 3.24Å; A112-F114 VanDerWaalsContact C-N 3.33Å; F114-V116 PolarHBondContact O-N 2.81Å; F114-V116 VanDerWaalsContact O-N 3.16Å; F114-L171 HydrophobicContact CB-CD2 4.37Å; F114-L176 HydrophobicContact CD1-CD1 3.58Å; F114-L176 HydrophobicContact CE1-CD1 3.17Å; F114-L176 HydrophobicContact CZ-CD1 3.82Å; F114-P183 HydrophobicContact CE2-CG 3.99Å; F114-P183 HydrophobicContact CZ-CG 3.66Å; F114-Y184 HydrophobicContact CD2-CD2 4.4Å; F114-Y184 AromaticContact CD2-CE2 3.57Å; F114-Y184 HydrophobicContact CD2-CE2 3.57Å; F114-Y184 HydrophobicContact CE2-CD2 4.4Å; F114-Y184 AromaticContact CE2-CE2 3.72Å; F114-Y184 HydrophobicContact CE2-CE2 3.72Å; F114-Y184 HydrophobicContact CG-CE2 4.11Å; F114-Y184 HydrophobicContact CZ-CE2 4.38Å
115	H	62.5	Low	55.4	Low	87 Å²	87	76.2 Å²	76.2	40%	0.403	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	110.1	165.8	-73.8	-60.6	0	0	0	109.4	Y117 D172 S175	H115-Y117 HydrophobicContact CB-CE2 3.83Å; H115-D172 HydrophobicContact CB-CB 4.21Å; H115-D172 PolarHBondContact N-O 3.15Å; H115-D172 PolarHBondContact O-N 3.47Å; H115-S175 PolarHBondContact CD2-OG 3.28Å
116	V	61.6	Low	54.9	Low	19 Å²	19	72.7 Å²	72.7	12%	0.115	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	118.1	176.6	-168.1	0	0	0	0	109.9	C111 F114 L145 T148 I169 V170 L171	C111-V116 VanDerWaalsContact SG-CG2 3.57Å; F114-V116 PolarHBondContact O-N 2.81Å; F114-V116 VanDerWaalsContact O-N 3.16Å; V116-L145 HydrophobicContact CB-CD1 4.01Å; V116-L145 HydrophobicContact CG1-CD1 4.26Å; V116-L145 WeakPolarHBondContact O-CD1 3.42Å; V116-T148 HydrophobicContact CB-CG2 4.45Å; V116-T148 HydrophobicContact CG2-CG2 4Å; V116-I169 HydrophobicContact CG1-CB 4.03Å; V116-I169 HydrophobicContact CG1-CD1 4.44Å; V116-I169 HydrophobicContact CG1-CG2 4.34Å; V116-V170 CarbonylContact C-O 3.33Å; V116-L171 HydrophobicContact CB-CD2 4.03Å; V116-L171 HydrophobicContact CG1-CD2 3.86Å; V116-L171 HydrophobicContact CG2-CD2 3.48Å; V116-L171 VanDerWaalsContact CG2-CD2 3.48Å
117	Y	64.7	Low	54.8	Low	105 Å²	105	74.7 Å²	74.7	41%	0.412	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	136.4	172.6	-57.1	-83.8	0	0	0	109.9	H115 I169 V170 D172	H115-Y117 HydrophobicContact CB-CE2 3.83Å; Y117-I169 CarbonylContact O-C 3.56Å; Y117-I169 WeakPolarHBondContact O-CA 3.21Å; Y117-V170 PolarHBondContact N-O 3.37Å; Y117-V170 PolarHBondContact O-N 2.82Å; Y117-D172 HydrophobicContact CD2-CB 4.15Å; Y117-D172 HydrophobicContact CE2-CB 3.5Å
118	Q	64.2	Low	54.6	Low	84 Å²	84	73.4 Å²	73.4	39%	0.393	41%	0.413	S	S	.	.			trans	-109.9	109.9	171	-166.3	176.5	46.8	0	0	108.7	T120 K167	Q118-T120 PolarHBondContact O-N 3.37Å; Q118-T120 VanDerWaalsContact O-N 3.14Å; Q118-K167 HydrophobicContact CG-CB 3.98Å; Q118-K167 HydrophobicContact CG-CD 4.08Å
119	P	58.3	Low	54.3	Low	57 Å²	57	75.9 Å²	75.9	37%	0.37	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-58.9	121	179.6	-22.7	33.8	0	0	0	110.8	P168 V170	P119-P168 WeakPolarHBondContact CD-O 3.31Å; P119-V170 HydrophobicContact CG-CG2 3.88Å
120	T	56.6	Low	53.9	Low	79 Å²	79	81 Å²	81	49%	0.485	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-69.8	138.3	171.2	-34	0	0	0	0	108.6	Q118 S122 L124	Q118-T120 PolarHBondContact O-N 3.37Å; Q118-T120 VanDerWaalsContact O-N 3.14Å; T120-S122 PolarHBondContact O-N 3.15Å; T120-L124 HydrophobicContact CG2-CB 3.87Å; T120-L124 HydrophobicContact CG2-CD1 3.77Å; T120-L124 HydrophobicContact CG2-CG 4.48Å
121	A	55.7	Low	53.4	Low	54 Å²	54	85.1 Å²	85.1	45%	0.446	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-53.4	136.2	178.4	0	0	0	0	0	110.4	R123 L124 A125	A121-R123 PolarHBondContact O-N 3.5Å; A121-L124 PolarHBondContact O-N 2.96Å; A121-A125 PolarHBondContact O-N 3.5Å
122	S	51.9	Low	52.8	Low	102 Å²	102	90 Å²	90	71%	0.713	49%	0.488	S	S	*	.	H	α-helix	trans	-52	-28.6	-176.5	54.5	0	0	0	0	113.4	T120 A125 A126	T120-S122 PolarHBondContact O-N 3.15Å; S122-A125 PolarHBondContact O-N 2.85Å; S122-A126 VanDerWaalsContact O-CB 3.24Å; S122-A126 WeakPolarHBondContact O-CB 3.44Å; S122-A126 PolarHBondContact O-N 2.93Å
123	R	43	Very low	52.1	Low	214 Å²	214	93.4 Å²	93.4	81%	0.808	50%	0.495	S	S	*	.	H	α-helix	trans	-61.8	-39.7	174.3	-172.1	176.4	178.9	-179.7	-0.1	113.5	A121 A127	A121-R123 PolarHBondContact O-N 3.5Å; R123-A127 WeakPolarHBondContact O-CB 3.36Å; R123-A127 PolarHBondContact O-N 2.8Å
124	L	47.4	Very low	50.8	Low	93 Å²	93	99.4 Å²	99.4	49%	0.487	51%	0.514	S	S	.	.	H	α-helix	trans	-75.5	-37.9	176.9	-71.7	168.7	0	0	0	110.9	T120 A121 A126 A127 N128	T120-L124 HydrophobicContact CG2-CB 3.87Å; T120-L124 HydrophobicContact CG2-CD1 3.77Å; T120-L124 HydrophobicContact CG2-CG 4.48Å; A121-L124 PolarHBondContact O-N 2.96Å; L124-A126 VanDerWaalsContact C-N 3.32Å; L124-A126 PolarHBondContact O-N 2.99Å; L124-A127 PolarHBondContact O-N 2.89Å; L124-N128 WeakPolarHBondContact O-CB 3.34Å; L124-N128 PolarHBondContact O-N 3.3Å; L124-N128 PolarHBondContact O-ND2 2.63Å; L124-N128 PolarHBondContact O-OD1 3.39Å
125	A	46.3	Very low	49.7	Very low	46 Å²	46	107.9 Å²	107.9	38%	0.38	55%	0.553	S	S	.	*	H	α-helix	trans	-63.8	-37.9	173.5	0	0	0	0	0	112.2	A121 S122 R129	A121-A125 PolarHBondContact O-N 3.5Å; S122-A125 PolarHBondContact O-N 2.85Å; A125-R129 WeakPolarHBondContact O-CG 3.31Å; A125-R129 PolarHBondContact O-N 3.35Å; A125-R129 VanDerWaalsContact O-N 3.15Å
126	A	43.9	Very low	48.3	Very low	54 Å²	54	108.1 Å²	108.1	45%	0.446	57%	0.565	S	S	.	*	H	α-helix	trans	-72.1	-38.9	175.7	0	0	0	0	0	112.5	S122 L124 R129 N130	S122-A126 VanDerWaalsContact O-CB 3.24Å; S122-A126 WeakPolarHBondContact O-CB 3.44Å; S122-A126 PolarHBondContact O-N 2.93Å; L124-A126 VanDerWaalsContact C-N 3.32Å; L124-A126 PolarHBondContact O-N 2.99Å; A126-R129 PolarHBondContact O-N 2.8Å; A126-N130 PolarHBondContact O-N 2.78Å
127	A	47.1	Very low	46.7	Very low	42 Å²	42	118 Å²	118	35%	0.347	60%	0.6	S	S	.	*	H	α-helix	trans	-62.5	-46.4	173.8	0	0	0	0	0	111.3	R123 L124 R129 N130 E131	R123-A127 WeakPolarHBondContact O-CB 3.36Å; R123-A127 PolarHBondContact O-N 2.8Å; L124-A127 PolarHBondContact O-N 2.89Å; A127-R129 VanDerWaalsContact C-N 3.25Å; A127-R129 PolarHBondContact O-N 2.86Å; A127-N130 PolarHBondContact O-N 2.73Å; A127-E131 PolarHBondContact O-N 3.22Å
128	N	48.5	Very low	45	Very low	101 Å²	101	120.2 Å²	120.2	54%	0.54	62%	0.619	S	S	.	*	H	α-helix	trans	-66	-26.8	179.1	-66.8	-6.3	0	0	0	113	L124 N130	L124-N128 WeakPolarHBondContact O-CB 3.34Å; L124-N128 PolarHBondContact O-N 3.3Å; L124-N128 PolarHBondContact O-ND2 2.63Å; L124-N128 PolarHBondContact O-OD1 3.39Å; N128-N130 VanDerWaalsContact C-N 3.31Å
129	R	48.9	Very low	43.5	Very low	205 Å²	205	124.8 Å²	124.8	77%	0.774	64%	0.64	S	S	*	*	H	α-helix	trans	-71.9	-23.5	173.6	-84.2	-178.6	172.1	174.2	-1.1	113.4	A125 A126 A127	A125-R129 WeakPolarHBondContact O-CG 3.31Å; A125-R129 PolarHBondContact O-N 3.35Å; A125-R129 VanDerWaalsContact O-N 3.15Å; A126-R129 PolarHBondContact O-N 2.8Å; A127-R129 VanDerWaalsContact C-N 3.25Å; A127-R129 PolarHBondContact O-N 2.86Å
130	N	45.7	Very low	42.2	Very low	143 Å²	143	126 Å²	126	77%	0.765	65%	0.65	S	S	*	*	H	α-helix	trans	-93.4	-15.1	177.9	-72.1	-8.3	0	0	0	113	A126 A127 N128	A126-N130 PolarHBondContact O-N 2.78Å; A127-N130 PolarHBondContact O-N 2.73Å; N128-N130 VanDerWaalsContact C-N 3.31Å
131	E	44.7	Very low	41.2	Very low	150 Å²	150	129 Å²	129	70%	0.701	67%	0.668	S	S	*	*			trans	-94.3	11.9	179.4	-72.9	-172.6	172	0	0	114.1	A127 L133	A127-E131 PolarHBondContact O-N 3.22Å; E131-L133 VanDerWaalsContact C-N 3.33Å; E131-L133 PolarHBondContact O-N 3.35Å
132	T	40.4	Very low	40.2	Very low	103 Å²	103	133.9 Å²	133.9	63%	0.632	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	95.7	166.6	53.8	0	0	0	0	108.7
133	L	41.9	Very low	39.3	Very low	150 Å²	150	134 Å²	134	79%	0.785	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-179	-14.5	143.1	-96.2	157.8	0	0	0	115.7	E131	E131-L133 VanDerWaalsContact C-N 3.33Å; E131-L133 PolarHBondContact O-N 3.35Å
134	Y	32.3	Very low	38.8	Very low	192 Å²	192	126.9 Å²	126.9	75%	0.753	67%	0.67	S	S	*	*	S	Bend	trans	-143.7	122.7	-175.2	-78.3	-82.7	0	0	0	113.2
135	H	37.5	Very low	38.5	Very low	185 Å²	185	125.4 Å²	125.4	86%	0.856	66%	0.662	S	S	*	*			trans	76.7	141	170.9	-54.4	37.2	0	0	0	112.9
136	S	33.7	Very low	38.1	Very low	93 Å²	93	126.6 Å²	126.6	65%	0.65	68%	0.679	S	S	*	*			cis	-167.1	153.8	-15.3	167.5	0	0	0	0	101.6	N138	S136-N138 PolarHBondContact O-N 3.15Å
137	R	29.1	Very low	38.3	Very low	226 Å²	226	128.6 Å²	128.6	85%	0.853	68%	0.682	S	S	*	*	S	Bend	trans	-33.1	132.4	174.4	-65.5	166.3	178.7	174.7	-1.4	112.3
138	N	28.9	Very low	38.4	Very low	151 Å²	151	128 Å²	128	81%	0.807	68%	0.675	S	S	*	*			trans	113.7	26.4	161.3	-49.8	-25.5	0	0	0	119.6	S136 S140	S136-N138 PolarHBondContact O-N 3.15Å; N138-S140 PolarHBondContact O-N 2.98Å
139	H	32.1	Very low	38.4	Very low	181 Å²	181	125.6 Å²	125.6	84%	0.838	66%	0.662	S	S	*	*			trans	-99.9	71.5	160.9	-68.7	-52	0	0	0	111.2	T141	H139-T141 VanDerWaalsContact C-N 3.35Å; H139-T141 PolarHBondContact O-N 2.87Å
140	S	30.8	Very low	38.7	Very low	82 Å²	82	118.7 Å²	118.7	57%	0.573	64%	0.642	S	S	*	*			trans	-54.2	107.1	149.3	177.7	0	0	0	0	107	N138 Y142	N138-S140 PolarHBondContact O-N 2.98Å; S140-Y142 CarbonylContact O-C 3.57Å; S140-Y142 PolarHBondContact O-N 3.27Å; S140-Y142 VanDerWaalsContact OG-CA 3.32Å; S140-Y142 WeakPolarHBondContact OG-CA 3.46Å; S140-Y142 WeakPolarHBondContact OG-CB 3.34Å; S140-Y142 PolarHBondContact OG-N 3.34Å; S140-Y142 PolarHBondContact OG-O 3.4Å
141	T	36.4	Very low	39.2	Very low	142 Å²	142	114.1 Å²	114.1	87%	0.871	62%	0.618	S	S	*	*	S	Bend	trans	-63.9	0.5	166	-22.6	0	0	0	0	111.3	H139	H139-T141 VanDerWaalsContact C-N 3.35Å; H139-T141 PolarHBondContact O-N 2.87Å
142	Y	33.3	Very low	39.8	Very low	157 Å²	157	107 Å²	107	62%	0.616	59%	0.585	S	S	*	*			trans	-91	78.1	164.9	-125.2	-98.1	0	0	0	108.6	S140 G144	S140-Y142 CarbonylContact O-C 3.57Å; S140-Y142 PolarHBondContact O-N 3.27Å; S140-Y142 VanDerWaalsContact OG-CA 3.32Å; S140-Y142 WeakPolarHBondContact OG-CA 3.46Å; S140-Y142 WeakPolarHBondContact OG-CB 3.34Å; S140-Y142 PolarHBondContact OG-N 3.34Å; S140-Y142 PolarHBondContact OG-O 3.4Å; Y142-G144 PolarHBondContact O-N 3.41Å
143	S	33.6	Very low	40.5	Very low	103 Å²	103	107.2 Å²	107.2	72%	0.72	58%	0.576	S	S	*	*			trans	-82.3	103.7	153.4	59.3	0	0	0	0	105.4	L145	S143-L145 PolarHBondContact O-N 3.14Å
144	G	32.5	Very low	41	Very low	65 Å²	65	103.6 Å²	103.6	67%	0.67	56%	0.558	S	S	*	*			trans	-45.1	120.1	171.9	0	0	0	0	0	108.8	Y142 G146	Y142-G144 PolarHBondContact O-N 3.41Å; G144-G146 PolarHBondContact O-N 2.85Å
145	L	41.6	Very low	41.9	Very low	62 Å²	62	97.6 Å²	97.6	33%	0.325	54%	0.537	S	S	.	.			trans	-63.5	83.2	170.7	-89	153.2	0	0	0	107.4	V116 S143 D147 T148 L151	V116-L145 HydrophobicContact CB-CD1 4.01Å; V116-L145 HydrophobicContact CG1-CD1 4.26Å; V116-L145 WeakPolarHBondContact O-CD1 3.42Å; S143-L145 PolarHBondContact O-N 3.14Å; L145-D147 PolarHBondContact O-N 3.22Å; L145-D147 VanDerWaalsContact O-N 3.13Å; L145-T148 HydrophobicContact CB-CG2 3.58Å; L145-T148 HydrophobicContact CD1-CG2 4.34Å; L145-T148 PolarHBondContact O-N 3.15Å; L145-L151 HydrophobicContact CD1-CD1 4.25Å; L145-L151 HydrophobicContact CD2-CD1 3.47Å; L145-L151 VanDerWaalsContact CD2-CD1 3.47Å; L145-L151 HydrophobicContact CD2-CG 4.26Å
146	G	37.7	Very low	42.6	Very low	72 Å²	72	95 Å²	95	74%	0.742	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	113	152.8	0	0	0	0	0	105.8	G144	G144-G146 PolarHBondContact O-N 2.85Å
147	D	47.6	Very low	43.4	Very low	95 Å²	95	95.1 Å²	95.1	51%	0.508	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	60.2	-171.2	-83.3	-29.2	0	0	0	117.2	L145 D149 T150	L145-D147 PolarHBondContact O-N 3.22Å; L145-D147 VanDerWaalsContact O-N 3.13Å; D147-D149 PolarHBondContact O-N 3.23Å; D147-D149 VanDerWaalsContact O-N 3.17Å; D147-T150 HydrophobicContact CB-CG2 3.42Å; D147-T150 VanDerWaalsContact CB-CG2 3.42Å; D147-T150 VanDerWaalsContact CB-OG1 3.32Å; D147-T150 WeakPolarHBondContact CB-OG1 3.48Å; D147-T150 PolarHBondContact O-N 3.39Å; D147-T150 VanDerWaalsContact O-N 3.11Å; D147-T150 PolarHBondContact O-OG1 3.42Å; D147-T150 VanDerWaalsContact OD2-CG2 3.23Å; D147-T150 WeakPolarHBondContact OD2-CG2 2.99Å
148	T	49.5	Very low	44.7	Very low	31 Å²	31	91.8 Å²	91.8	19%	0.19	53%	0.529	C	S	.	.	H	α-helix	trans	-51.6	-27.6	152.8	53.5	0	0	0	0	112	C111 V116 L145	C111-T148 VanDerWaalsContact SG-CB 3.58Å; C111-T148 PolarHBondContact SG-O 3.03Å; C111-T148 VanDerWaalsContact SG-O 3.42Å; V116-T148 HydrophobicContact CB-CG2 4.45Å; V116-T148 HydrophobicContact CG2-CG2 4Å; L145-T148 HydrophobicContact CB-CG2 3.58Å; L145-T148 HydrophobicContact CD1-CG2 4.34Å; L145-T148 PolarHBondContact O-N 3.15Å
149	D	48.9	Very low	46.1	Very low	50 Å²	50	88 Å²	88	27%	0.267	51%	0.509	S	S	.	.	H	α-helix	trans	-68.9	-35.3	177.6	-141.8	-1	0	0	0	112.3	D147 L152 K153	D147-D149 PolarHBondContact O-N 3.23Å; D147-D149 VanDerWaalsContact O-N 3.17Å; D149-L152 PolarHBondContact O-N 2.97Å; D149-K153 HydrophobicContact CB-CD 4.23Å; D149-K153 VanDerWaalsContact CG-CD 3.47Å; D149-K153 VanDerWaalsContact CG-NZ 3.28Å; D149-K153 WeakPolarHBondContact O-CB 3.47Å; D149-K153 WeakPolarHBondContact O-CG 3.11Å; D149-K153 PolarHBondContact O-N 3.33Å; D149-K153 WeakPolarHBondContact OD1-CD 3.5Å; D149-K153 WeakPolarHBondContact OD1-CE 3.39Å; D149-K153 WeakPolarHBondContact OD1-CG 3.48Å; D149-K153 IonicContact OD1-NZ 3.87Å; D149-K153 PolarHBondContact OD1-NZ 3.41Å; D149-K153 WeakPolarHBondContact OD2-CE 3.48Å; D149-K153 IonicContact OD2-NZ 3.05Å; D149-K153 PolarHBondContact OD2-NZ 2.82Å
150	T	54.6	Low	47.3	Very low	59 Å²	59	83.1 Å²	83.1	36%	0.362	50%	0.495	S	S	.	.	H	α-helix	trans	-71.1	-32.4	178.7	60.7	0	0	0	0	113.4	D147 L152 D154	D147-T150 HydrophobicContact CB-CG2 3.42Å; D147-T150 VanDerWaalsContact CB-CG2 3.42Å; D147-T150 VanDerWaalsContact CB-OG1 3.32Å; D147-T150 WeakPolarHBondContact CB-OG1 3.48Å; D147-T150 PolarHBondContact O-N 3.39Å; D147-T150 VanDerWaalsContact O-N 3.11Å; D147-T150 PolarHBondContact O-OG1 3.42Å; D147-T150 VanDerWaalsContact OD2-CG2 3.23Å; D147-T150 WeakPolarHBondContact OD2-CG2 2.99Å; T150-L152 PolarHBondContact O-N 3.37Å; T150-D154 PolarHBondContact O-N 2.87Å
151	L	55.5	Low	48.6	Very low	48 Å²	48	85.5 Å²	85.5	25%	0.251	50%	0.497	S	S	.	.	H	α-helix	trans	-63.1	-30.1	-179.5	-73.9	-179.1	0	0	0	112.5	L145 I169	L145-L151 HydrophobicContact CD1-CD1 4.25Å; L145-L151 HydrophobicContact CD2-CD1 3.47Å; L145-L151 VanDerWaalsContact CD2-CD1 3.47Å; L145-L151 HydrophobicContact CD2-CG 4.26Å; L151-I169 HydrophobicContact CD1-CG2 4.49Å
152	L	58.7	Low	49.6	Very low	1 Å²	1	84.4 Å²	84.4	1%	0.005	48%	0.48	C	S	.	.	H	α-helix	trans	-106.4	-34	-176.7	-78.1	169.4	0	0	0	113.2	C111 D149 T150 D154 I169 Y184 Y191 L207 L209	C111-L152 HydrophobicContact CB-CD1 3.52Å; C111-L152 WeakPolarHBondContact SG-CD1 3.48Å; D149-L152 PolarHBondContact O-N 2.97Å; T150-L152 PolarHBondContact O-N 3.37Å; L152-D154 PolarHBondContact O-N 3.11Å; L152-I169 HydrophobicContact CD2-CD1 3.96Å; L152-I169 HydrophobicContact CG-CD1 4.34Å; L152-Y184 HydrophobicContact CD1-CE1 3.55Å; L152-Y184 WeakPolarHBondContact CD1-OH 3.29Å; L152-Y184 HydrophobicContact CD2-CE1 3.92Å; L152-Y184 HydrophobicContact CG-CE1 4.42Å; L152-Y191 HydrophobicContact CB-CD1 3.73Å; L152-Y191 HydrophobicContact CB-CD2 4.49Å; L152-Y191 HydrophobicContact CB-CE1 4.39Å; L152-Y191 HydrophobicContact CB-CG 3.76Å; L152-Y191 HydrophobicContact CD1-CG 4.45Å; L152-Y191 HydrophobicContact CD2-CG 4.5Å; L152-Y191 HydrophobicContact CG-CG 4.48Å; L152-Y191 WeakPolarHBondContact O-CD1 2.81Å; L152-L207 HydrophobicContact CD2-CD1 4.5Å; L152-L209 HydrophobicContact CD2-CD1 3.71Å
153	K	55	Low	50.7	Low	106 Å²	106	77.9 Å²	77.9	46%	0.461	46%	0.457	S	S	.	.	H	α-helix	trans	-65.9	-23.4	178.2	-80.9	178.8	164.8	170.4	0	113.7	D149 H155 Y191	D149-K153 HydrophobicContact CB-CD 4.23Å; D149-K153 VanDerWaalsContact CG-CD 3.47Å; D149-K153 VanDerWaalsContact CG-NZ 3.28Å; D149-K153 WeakPolarHBondContact O-CB 3.47Å; D149-K153 WeakPolarHBondContact O-CG 3.11Å; D149-K153 PolarHBondContact O-N 3.33Å; D149-K153 WeakPolarHBondContact OD1-CD 3.5Å; D149-K153 WeakPolarHBondContact OD1-CE 3.39Å; D149-K153 WeakPolarHBondContact OD1-CG 3.48Å; D149-K153 IonicContact OD1-NZ 3.87Å; D149-K153 PolarHBondContact OD1-NZ 3.41Å; D149-K153 WeakPolarHBondContact OD2-CE 3.48Å; D149-K153 IonicContact OD2-NZ 3.05Å; D149-K153 PolarHBondContact OD2-NZ 2.82Å; K153-H155 PolarHBondContact O-N 2.94Å; K153-Y191 HydrophobicContact CG-CE1 3.78Å
154	D	51	Low	51.8	Low	75 Å²	75	82.2 Å²	82.2	40%	0.401	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	22.1	-178.2	-80.5	-4.2	0	0	0	113.8	T150 L152 N156 R166	T150-D154 PolarHBondContact O-N 2.87Å; L152-D154 PolarHBondContact O-N 3.11Å; D154-N156 PolarHBondContact O-N 3.4Å; D154-R166 PolarHBondContact O-NH2 3.34Å
155	H	52.4	Low	53.2	Low	65 Å²	65	88.6 Å²	88.6	30%	0.301	46%	0.462	S	S	.	.			trans	-61.2	0.8	171.5	-156.5	-51.1	0	0	0	113.3	K153 S157 G193 E195 D196	K153-H155 PolarHBondContact O-N 2.94Å; H155-S157 PolarHBondContact O-N 3.34Å; H155-S157 VanDerWaalsContact O-N 3.08Å; H155-G193 PolarHBondContact NE2-N 2.64Å; H155-E195 IonicContact CE1-OE1 3.45Å; H155-D196 IonicContact NE2-OD2 3.87Å
156	N	50.9	Low	54.4	Low	132 Å²	132	87.5 Å²	87.5	71%	0.706	45%	0.453	S	S	*	.			trans	-57.5	116.2	169.9	-90.4	-20.6	0	0	0	111.5	D154 D158	D154-N156 PolarHBondContact O-N 3.4Å; N156-D158 PolarHBondContact O-N 2.69Å
157	S	51.8	Low	55.9	Low	95 Å²	95	88.4 Å²	88.4	66%	0.664	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-8.7	-174	51.6	0	0	0	0	115.4	H155 N159	H155-S157 PolarHBondContact O-N 3.34Å; H155-S157 VanDerWaalsContact O-N 3.08Å; S157-N159 VanDerWaalsContact C-N 3.3Å; S157-N159 PolarHBondContact O-N 3.21Å
158	D	56.1	Low	57.2	Low	156 Å²	156	85.1 Å²	85.1	83%	0.834	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-10.2	-170.5	-90.6	-6.1	0	0	0	114.7	N156	N156-D158 PolarHBondContact O-N 2.69Å
159	N	59.1	Low	58.4	Low	72 Å²	72	83.9 Å²	83.9	39%	0.385	41%	0.413	S	S	.	.			trans	-122	70.8	-176.4	-133.2	-40.3	0	0	0	112.3	S157 E161 K162 C163	S157-N159 VanDerWaalsContact C-N 3.3Å; S157-N159 PolarHBondContact O-N 3.21Å; N159-E161 PolarHBondContact O-N 2.95Å; N159-K162 HydrophobicContact CB-CB 4.14Å; N159-K162 HydrophobicContact CB-CD 3.99Å; N159-K162 HydrophobicContact CB-CG 4.1Å; N159-K162 WeakPolarHBondContact ND2-CE 3.45Å; N159-K162 PolarHBondContact O-N 3.26Å; N159-C163 PolarHBondContact O-N 2.77Å; N159-C163 VanDerWaalsContact O-N 3.11Å
160	S	55.9	Low	59.7	Low	78 Å²	78	82.8 Å²	82.8	55%	0.545	41%	0.408	S	S	.	.	H	α-helix	trans	-55.2	-34	-177.2	66	0	0	0	0	113.6	R164	S160-R164 WeakPolarHBondContact O-CG 3.31Å; S160-R164 PolarHBondContact O-N 2.61Å; S160-R164 VanDerWaalsContact O-N 3.14Å
161	E	58.3	Low	60.6	Low	131 Å²	131	80 Å²	80	61%	0.612	39%	0.391	S	S	*	.	H	α-helix	trans	-68	-39.5	175.5	-73.3	-161.3	149.2	0	0	113	N159 R164 R165	N159-E161 PolarHBondContact O-N 2.95Å; E161-R164 PolarHBondContact O-N 2.9Å; E161-R165 PolarHBondContact O-N 2.73Å
162	K	57.5	Low	61.3	Low	120 Å²	120	79.5 Å²	79.5	52%	0.522	39%	0.389	S	S	.	.	H	α-helix	trans	-66.7	-41.2	176.6	-67.8	-173.5	-179.3	-177.7	0	110.8	N159 R164 R165 R166	N159-K162 HydrophobicContact CB-CB 4.14Å; N159-K162 HydrophobicContact CB-CD 3.99Å; N159-K162 HydrophobicContact CB-CG 4.1Å; N159-K162 WeakPolarHBondContact ND2-CE 3.45Å; N159-K162 PolarHBondContact O-N 3.26Å; K162-R164 PolarHBondContact O-N 3.45Å; K162-R165 PolarHBondContact O-N 2.92Å; K162-R166 PolarHBondContact O-N 2.75Å
163	C	56.9	Low	61.7	Low	19 Å²	19	80.8 Å²	80.8	13%	0.128	39%	0.394	C	S	.	.	H	α-helix	trans	-61.5	-41.1	177.1	-67.3	0	0	0	0	112.2	N159 R165 R166 R210	N159-C163 PolarHBondContact O-N 2.77Å; N159-C163 VanDerWaalsContact O-N 3.11Å; C163-R165 VanDerWaalsContact C-N 3.27Å; C163-R165 PolarHBondContact O-N 2.78Å; C163-R166 PolarHBondContact O-N 3.47Å; C163-R210 WeakPolarHBondContact O-CG 3.44Å
164	R	57.1	Low	62.2	Low	195 Å²	195	77.6 Å²	77.6	74%	0.736	39%	0.391	S	S	*	.	H	α-helix	trans	-63	-29.1	178.2	-75.7	178.5	179.1	-173.3	0.9	113.9	S160 E161 K162 R210	S160-R164 WeakPolarHBondContact O-CG 3.31Å; S160-R164 PolarHBondContact O-N 2.61Å; S160-R164 VanDerWaalsContact O-N 3.14Å; E161-R164 PolarHBondContact O-N 2.9Å; K162-R164 PolarHBondContact O-N 3.45Å; R164-R210 PolarHBondContact O-NE 3.46Å
165	R	60.8	Low	62.6	Low	198 Å²	198	76.9 Å²	76.9	75%	0.747	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-2.8	-177.7	-66.6	-175.4	-175.4	177.8	5.6	113.9	E161 K162 C163 K167	E161-R165 PolarHBondContact O-N 2.73Å; K162-R165 PolarHBondContact O-N 2.92Å; C163-R165 VanDerWaalsContact C-N 3.27Å; C163-R165 PolarHBondContact O-N 2.78Å; R165-K167 PolarHBondContact O-N 2.97Å
166	R	67.2	Low	62.7	Low	39 Å²	39	76 Å²	76	15%	0.147	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-58.7	135.8	178.2	-71.2	-171.4	173.2	155.7	6.3	110	D154 K162 C163 R210	D154-R166 PolarHBondContact O-NH2 3.34Å; K162-R166 PolarHBondContact O-N 2.75Å; C163-R166 PolarHBondContact O-N 3.47Å; R166-R210 HydrophobicContact CB-CG 4.22Å; R166-R210 PolarHBondContact O-NE 3.41Å; R166-R210 PolarHBondContact O-NH2 3.29Å
167	K	69.6	Low	62.8	Low	91 Å²	91	73.7 Å²	73.7	40%	0.396	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-88.3	152	169.4	-65.3	177.3	-177.8	169.5	0	107.6	Q118 R165	Q118-K167 HydrophobicContact CG-CB 3.98Å; Q118-K167 HydrophobicContact CG-CD 4.08Å; R165-K167 PolarHBondContact O-N 2.97Å
168	P	74.2	Confident	62.8	Low	27 Å²	27	72.3 Å²	72.3	18%	0.175	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-54.2	145.7	165.8	25.6	-33.7	0	0	0	109.1	P119 M206 L207	P119-P168 WeakPolarHBondContact CD-O 3.31Å; P168-M206 HydrophobicContact CB-CG 4.19Å; P168-M206 HydrophobicContact CB-SD 4.33Å; P168-L207 CarbonylContact C-O 3.51Å; P168-L207 WeakPolarHBondContact CA-O 3.49Å
169	I	75.3	Confident	62.6	Low	4 Å²	4	70 Å²	70	2%	0.021	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	145.2	173.5	59.1	177.2	0	0	0	107.9	V116 Y117 L151 L152 L171 M206 L207 L209	V116-I169 HydrophobicContact CG1-CB 4.03Å; V116-I169 HydrophobicContact CG1-CD1 4.44Å; V116-I169 HydrophobicContact CG1-CG2 4.34Å; Y117-I169 CarbonylContact O-C 3.56Å; Y117-I169 WeakPolarHBondContact O-CA 3.21Å; L151-I169 HydrophobicContact CD1-CG2 4.49Å; L152-I169 HydrophobicContact CD2-CD1 3.96Å; L152-I169 HydrophobicContact CG-CD1 4.34Å; I169-L171 HydrophobicContact CD1-CD2 4.49Å; I169-M206 CarbonylContact O-C 3.52Å; I169-M206 VanDerWaalsContact O-CA 3.29Å; I169-M206 WeakPolarHBondContact O-CA 3.17Å; I169-L207 HydrophobicContact CD1-CB 4.39Å; I169-L207 HydrophobicContact CD1-CD1 4.12Å; I169-L207 HydrophobicContact CG1-CB 3.81Å; I169-L207 HydrophobicContact CG1-CD1 4.32Å; I169-L207 HydrophobicContact CG1-CG 4.47Å; I169-L207 PolarHBondContact N-O 3.42Å; I169-L207 PolarHBondContact O-N 3.06Å; I169-L209 HydrophobicContact CD1-CD1 4.08Å
170	V	76.4	Confident	62.3	Low	27 Å²	27	67.2 Å²	67.2	16%	0.164	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.3	176.6	175.9	0	0	0	0	106.6	V116 Y117 P119 F204 V205 M206	V116-V170 CarbonylContact C-O 3.33Å; Y117-V170 PolarHBondContact N-O 3.37Å; Y117-V170 PolarHBondContact O-N 2.82Å; P119-V170 HydrophobicContact CG-CG2 3.88Å; V170-F204 HydrophobicContact CG1-CB 3.92Å; V170-F204 HydrophobicContact CG1-CD2 3.94Å; V170-F204 HydrophobicContact CG1-CG 4.19Å; V170-V205 CarbonylContact C-O 3.56Å; V170-V205 WeakPolarHBondContact CA-O 3.43Å; V170-M206 HydrophobicContact CG2-CB 4.06Å; V170-M206 HydrophobicContact CG2-CG 3.88Å; V170-M206 HydrophobicContact CG2-SD 4.26Å
171	L	72.3	Confident	62.4	Low	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	114.5	179.4	-62	171.1	0	0	0	107.7	F114 V116 I169 Y184 F204 V205 L207	F114-L171 HydrophobicContact CB-CD2 4.37Å; V116-L171 HydrophobicContact CB-CD2 4.03Å; V116-L171 HydrophobicContact CG1-CD2 3.86Å; V116-L171 HydrophobicContact CG2-CD2 3.48Å; V116-L171 VanDerWaalsContact CG2-CD2 3.48Å; I169-L171 HydrophobicContact CD1-CD2 4.49Å; L171-Y184 HydrophobicContact CD1-CD1 3.51Å; L171-Y184 HydrophobicContact CD1-CD2 3.29Å; L171-Y184 HydrophobicContact CD1-CE1 3.89Å; L171-Y184 HydrophobicContact CD1-CE2 3.67Å; L171-Y184 HydrophobicContact CD1-CG 3.16Å; L171-F204 CarbonylContact O-C 3.6Å; L171-F204 WeakPolarHBondContact O-CA 3.27Å; L171-V205 PolarHBondContact N-O 3.32Å; L171-V205 PolarHBondContact O-N 2.87Å; L171-L207 HydrophobicContact CD1-CD1 3.34Å; L171-L207 HydrophobicContact CD1-CG 3.97Å; L171-L207 HydrophobicContact CG-CD1 4.33Å
172	D	69.9	Low	62.6	Low	39 Å²	39	59.4 Å²	59.4	21%	0.209	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	118.1	172.8	177.9	-14	0	0	0	109	H115 Y117 G174 S175 E203	H115-D172 HydrophobicContact CB-CB 4.21Å; H115-D172 PolarHBondContact N-O 3.15Å; H115-D172 PolarHBondContact O-N 3.47Å; Y117-D172 HydrophobicContact CD2-CB 4.15Å; Y117-D172 HydrophobicContact CE2-CB 3.5Å; D172-G174 WeakPolarHBondContact OD1-CA 3.33Å; D172-G174 PolarHBondContact OD1-N 2.96Å; D172-S175 PolarHBondContact O-OG 3.22Å; D172-S175 PolarHBondContact OD1-N 3.37Å; D172-S175 VanDerWaalsContact OD1-N 3.14Å; D172-E203 WeakPolarHBondContact CA-O 3.45Å
173	Y	69	Low	62.8	Low	28 Å²	28	53.7 Å²	53.7	11%	0.11	30%	0.3	C	S	.	.			trans	-110.5	-4.7	175.5	63.2	-95.3	0	0	0	111.9	S175 L176 S182 M185 G201 S202 E203 F204 V205	Y173-S175 PolarHBondContact O-N 3.34Å; Y173-L176 WeakPolarHBondContact O-CB 3.2Å; Y173-L176 PolarHBondContact O-N 3.4Å; Y173-S182 VanDerWaalsContact CD1-CB 3.49Å; Y173-M185 HydrophobicContact CE1-CE 3.58Å; Y173-M185 HydrophobicContact CE2-CE 4.06Å; Y173-M185 WeakPolarHBondContact OH-CE 3.38Å; Y173-G201 PolarHBondContact OH-O 3.42Å; Y173-S202 PolarHBondContact OH-O 2.92Å; Y173-E203 WeakPolarHBondContact CD1-O 3.29Å; Y173-E203 PolarHBondContact N-O 3.23Å; Y173-E203 PolarHBondContact OH-N 3.39Å; Y173-F204 VanDerWaalsContact CE1-CA 3.45Å; Y173-V205 HydrophobicContact CD1-CG2 3.99Å; Y173-V205 HydrophobicContact CE1-CG2 3.67Å
174	G	64	Low	63.1	Low	39 Å²	39	52.8 Å²	52.8	40%	0.402	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-64	-27.8	171.2	0	0	0	0	0	112	D172 L176 E203	D172-G174 WeakPolarHBondContact OD1-CA 3.33Å; D172-G174 PolarHBondContact OD1-N 2.96Å; G174-L176 PolarHBondContact O-N 3.41Å; G174-E203 PolarHBondContact N-O 3.16Å; G174-E203 VanDerWaalsContact N-O 3.15Å
175	S	60.2	Low	63.4	Low	59 Å²	59	45.1 Å²	45.1	41%	0.413	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-62.3	-16.9	173.8	60.8	0	0	0	0	115.6	H115 D172 Y173 G177	H115-S175 PolarHBondContact CD2-OG 3.28Å; D172-S175 PolarHBondContact O-OG 3.22Å; D172-S175 PolarHBondContact OD1-N 3.37Å; D172-S175 VanDerWaalsContact OD1-N 3.14Å; Y173-S175 PolarHBondContact O-N 3.34Å; S175-G177 VanDerWaalsContact C-N 3.27Å; S175-G177 PolarHBondContact O-N 3.04Å
176	L	55	Low	63.6	Low	46 Å²	46	37 Å²	37	24%	0.241	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-77.9	-3.7	-172.7	-81.5	160.1	0	0	0	114.9	D113 F114 Y173 G174 S178	D113-L176 HydrophobicContact CB-CD2 4.42Å; D113-L176 WeakPolarHBondContact O-CD2 3.39Å; F114-L176 HydrophobicContact CD1-CD1 3.58Å; F114-L176 HydrophobicContact CE1-CD1 3.17Å; F114-L176 HydrophobicContact CZ-CD1 3.82Å; Y173-L176 WeakPolarHBondContact O-CB 3.2Å; Y173-L176 PolarHBondContact O-N 3.4Å; G174-L176 PolarHBondContact O-N 3.41Å; L176-S178 PolarHBondContact O-N 2.81Å; L176-S178 PolarHBondContact O-OG 3.01Å
177	G	53.2	Low	63.4	Low	84 Å²	84	41.4 Å²	41.4	87%	0.866	26%	0.262	S	S	*	.	S	Bend	trans	58.3	-0.3	176.8	0	0	0	0	0	115.4	S175	S175-G177 VanDerWaalsContact C-N 3.27Å; S175-G177 PolarHBondContact O-N 3.04Å
178	S	51.5	Low	63.2	Low	67 Å²	67	42 Å²	42	47%	0.469	27%	0.27	S	S	.	.	S	Bend	trans	-129.9	138.6	-172.9	50.6	0	0	0	0	107.8	L176 S180	L176-S178 PolarHBondContact O-N 2.81Å; L176-S178 PolarHBondContact O-OG 3.01Å; S178-S180 PolarHBondContact O-N 3.44Å
179	S	50.5	Low	62.9	Low	107 Å²	107	42 Å²	42	75%	0.748	27%	0.267	S	S	*	.			trans	-67.8	14.6	-174.5	178.3	0	0	0	0	114	L181	S179-L181 PolarHBondContact O-N 2.88Å; S179-L181 VanDerWaalsContact O-N 3.14Å
180	S	53.7	Low	62.5	Low	13 Å²	13	51.3 Å²	51.3	9%	0.091	30%	0.302	C	S	.	.			trans	-68.4	114.6	-178.7	56.6	0	0	0	0	109	S178 S182	S178-S180 PolarHBondContact O-N 3.44Å; S180-S182 PolarHBondContact O-N 3.41Å
181	L	58.4	Low	62	Low	46 Å²	46	50.9 Å²	50.9	24%	0.241	30%	0.298	C	S	.	.			trans	-47.4	132.8	166.9	-100.9	88.8	0	0	0	108.9	M99 S179 M185	M99-L181 HydrophobicContact CE-CD2 3.46Å; M99-L181 VanDerWaalsContact CE-CD2 3.46Å; M99-L181 HydrophobicContact CG-CD2 4.36Å; M99-L181 HydrophobicContact SD-CD2 4.02Å; S179-L181 PolarHBondContact O-N 2.88Å; S179-L181 VanDerWaalsContact O-N 3.14Å; L181-M185 HydrophobicContact CB-SD 3.79Å; L181-M185 HydrophobicContact CD2-CB 4.38Å; L181-M185 HydrophobicContact CD2-SD 3.41Å; L181-M185 WeakPolarHBondContact CD2-SD 3.46Å; L181-M185 HydrophobicContact CG-SD 3.44Å; L181-M185 WeakPolarHBondContact CG-SD 3.48Å
182	S	62.3	Low	61.9	Low	0 Å²	0	51 Å²	51	0%	0	30%	0.299	C	S	.	.			trans	-55.5	131	177.5	-176.2	0	0	0	0	109.6	Y173 S180 Y184 M185	Y173-S182 VanDerWaalsContact CD1-CB 3.49Å; S180-S182 PolarHBondContact O-N 3.41Å; S182-Y184 PolarHBondContact O-N 3.45Å; S182-Y184 WeakPolarHBondContact OG-CD2 3.29Å; S182-M185 WeakPolarHBondContact O-CB 3.46Å; S182-M185 WeakPolarHBondContact O-CG 3.25Å; S182-M185 PolarHBondContact O-N 3.41Å
183	P	61.8	Low	61.8	Low	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-54.3	-21.9	177.8	-22.1	29.5	0	0	0	113.3	A106 L109 F114 M185 Y186 H189	A106-P183 HydrophobicContact CB-CB 4.32Å; A106-P183 HydrophobicContact CB-CG 4.09Å; L109-P183 HydrophobicContact CB-CG 3.58Å; L109-P183 HydrophobicContact CD1-CG 4.01Å; L109-P183 HydrophobicContact CG-CG 4.42Å; F114-P183 HydrophobicContact CE2-CG 3.99Å; F114-P183 HydrophobicContact CZ-CG 3.66Å; P183-M185 PolarHBondContact O-N 3.23Å; P183-Y186 HydrophobicContact CB-CD2 4.49Å; P183-Y186 WeakPolarHBondContact O-CD2 3.24Å; P183-Y186 PolarHBondContact O-N 2.65Å; P183-H189 VanDerWaalsContact CB-NE2 3.29Å; P183-H189 WeakPolarHBondContact CB-NE2 3.34Å; P183-H189 PolarHBondContact O-CD2 3.31Å
184	Y	62.7	Low	61.9	Low	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-77.9	-7.8	178.3	-57.7	-82.9	0	0	0	113.9	C111 F114 L152 L171 S182 Y186 Y191 V192 L207	C111-Y184 WeakPolarHBondContact CA-OH 3.37Å; C111-Y184 VanDerWaalsContact CB-OH 3.26Å; C111-Y184 WeakPolarHBondContact CB-OH 3.39Å; C111-Y184 PolarHBondContact N-OH 2.8Å; F114-Y184 HydrophobicContact CD2-CD2 4.4Å; F114-Y184 AromaticContact CD2-CE2 3.57Å; F114-Y184 HydrophobicContact CD2-CE2 3.57Å; F114-Y184 HydrophobicContact CE2-CD2 4.4Å; F114-Y184 AromaticContact CE2-CE2 3.72Å; F114-Y184 HydrophobicContact CE2-CE2 3.72Å; F114-Y184 HydrophobicContact CG-CE2 4.11Å; F114-Y184 HydrophobicContact CZ-CE2 4.38Å; L152-Y184 HydrophobicContact CD1-CE1 3.55Å; L152-Y184 WeakPolarHBondContact CD1-OH 3.29Å; L152-Y184 HydrophobicContact CD2-CE1 3.92Å; L152-Y184 HydrophobicContact CG-CE1 4.42Å; L171-Y184 HydrophobicContact CD1-CD1 3.51Å; L171-Y184 HydrophobicContact CD1-CD2 3.29Å; L171-Y184 HydrophobicContact CD1-CE1 3.89Å; L171-Y184 HydrophobicContact CD1-CE2 3.67Å; L171-Y184 HydrophobicContact CD1-CG 3.16Å; S182-Y184 PolarHBondContact O-N 3.45Å; S182-Y184 WeakPolarHBondContact OG-CD2 3.29Å; Y184-Y186 VanDerWaalsContact C-N 3.34Å; Y184-Y191 HydrophobicContact CE1-CD2 4.38Å; Y184-V192 HydrophobicContact CD1-CG2 3.68Å; Y184-V192 HydrophobicContact CE1-CG2 4.42Å; Y184-L207 HydrophobicContact CD1-CD1 3.53Å; Y184-L207 HydrophobicContact CE1-CD1 4.3Å; Y184-L207 HydrophobicContact CG-CD1 4.01Å
185	M	63.8	Low	62.3	Low	34 Å²	34	57.9 Å²	57.9	17%	0.167	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-73.5	-26	169.1	-66.3	179.3	158.4	0	0	112.1	Y173 L181 S182 P183 M200 V205	Y173-M185 HydrophobicContact CE1-CE 3.58Å; Y173-M185 HydrophobicContact CE2-CE 4.06Å; Y173-M185 WeakPolarHBondContact OH-CE 3.38Å; L181-M185 HydrophobicContact CB-SD 3.79Å; L181-M185 HydrophobicContact CD2-CB 4.38Å; L181-M185 HydrophobicContact CD2-SD 3.41Å; L181-M185 WeakPolarHBondContact CD2-SD 3.46Å; L181-M185 HydrophobicContact CG-SD 3.44Å; L181-M185 WeakPolarHBondContact CG-SD 3.48Å; S182-M185 WeakPolarHBondContact O-CB 3.46Å; S182-M185 WeakPolarHBondContact O-CG 3.25Å; S182-M185 PolarHBondContact O-N 3.41Å; P183-M185 PolarHBondContact O-N 3.23Å; M185-M200 HydrophobicContact CB-SD 3.98Å; M185-M200 HydrophobicContact CG-CG 4.49Å; M185-M200 HydrophobicContact CG-SD 3.78Å; M185-V205 HydrophobicContact CE-CG2 4.12Å; M185-V205 HydrophobicContact CG-CG2 3.82Å
186	Y	65.7	Low	63	Low	27 Å²	27	55.7 Å²	55.7	11%	0.106	30%	0.304	C	S	.	.	S	Bend	trans	-74.8	130.8	-174	-60.4	-60.7	0	0	0	112.6	M99 I103 A106 P183 Y184 N188 R198	M99-Y186 HydrophobicContact CB-CE1 4.29Å; M99-Y186 HydrophobicContact SD-CE1 4.17Å; I103-Y186 HydrophobicContact CD1-CD1 4.35Å; I103-Y186 HydrophobicContact CD1-CE1 3.97Å; I103-Y186 HydrophobicContact CG1-CD1 3.96Å; I103-Y186 HydrophobicContact CG1-CE1 3.31Å; I103-Y186 HydrophobicContact CG1-CE2 4.34Å; A106-Y186 HydrophobicContact CB-CD2 4.43Å; A106-Y186 HydrophobicContact CB-CE2 3.46Å; A106-Y186 VanDerWaalsContact CB-CE2 3.46Å; P183-Y186 HydrophobicContact CB-CD2 4.49Å; P183-Y186 WeakPolarHBondContact O-CD2 3.24Å; P183-Y186 PolarHBondContact O-N 2.65Å; Y184-Y186 VanDerWaalsContact C-N 3.34Å; Y186-N188 CarbonylContact O-C 3.55Å; Y186-N188 PolarHBondContact O-N 2.82Å; Y186-R198 PolarHBondContact O-NH1 2.71Å
187	L	61.8	Low	63.9	Low	131 Å²	131	54.6 Å²	54.6	69%	0.686	30%	0.3	S	S	*	.	S	Bend	trans	-47.6	-38.2	-177.3	-84.8	164.2	0	0	0	113.5	R198	L187-R198 PolarHBondContact O-NH2 3.47Å
188	N	65.7	Low	65.1	Low	104 Å²	104	52.7 Å²	52.7	56%	0.556	27%	0.267	S	S	*	.	S	Bend	trans	-119.1	117.2	171.9	-53	-49.8	0	0	0	108.5	Y186 K194	Y186-N188 CarbonylContact O-C 3.55Å; Y186-N188 PolarHBondContact O-N 2.82Å; N188-K194 WeakPolarHBondContact OD1-CE 3.11Å; N188-K194 WeakPolarHBondContact OD1-CG 3.11Å
189	H	67.8	Low	66.3	Low	27 Å²	27	51.9 Å²	51.9	13%	0.125	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-133.4	154	171.2	-172.9	-109.2	0	0	0	108.4	P183 Y191 V192	P183-H189 VanDerWaalsContact CB-NE2 3.29Å; P183-H189 WeakPolarHBondContact CB-NE2 3.34Å; P183-H189 PolarHBondContact O-CD2 3.31Å; H189-Y191 AromaticContact CE1-CD2 3.53Å; H189-Y191 AromaticContact ND1-CD2 3.75Å; H189-Y191 PolarHBondContact O-N 3.05Å; H189-V192 HydrophobicContact CB-CB 4.2Å; H189-V192 HydrophobicContact CB-CG2 4.47Å; H189-V192 PolarHBondContact N-O 2.89Å; H189-V192 CarbonylContact O-C 3.48Å; H189-V192 PolarHBondContact O-N 3.22Å
190	R	67.2	Low	67.5	Low	199 Å²	199	52.5 Å²	52.5	75%	0.751	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-29.3	-177	-178.5	177.5	-179.9	176.3	2.1	113.7
191	Y	65.3	Low	68.2	Low	19 Å²	19	52.9 Å²	52.9	8%	0.075	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-1.4	-176.7	-52.6	-67.1	0	0	0	114.7	L152 K153 Y184 H189	L152-Y191 HydrophobicContact CB-CD1 3.73Å; L152-Y191 HydrophobicContact CB-CD2 4.49Å; L152-Y191 HydrophobicContact CB-CE1 4.39Å; L152-Y191 HydrophobicContact CB-CG 3.76Å; L152-Y191 HydrophobicContact CD1-CG 4.45Å; L152-Y191 HydrophobicContact CD2-CG 4.5Å; L152-Y191 HydrophobicContact CG-CG 4.48Å; L152-Y191 WeakPolarHBondContact O-CD1 2.81Å; K153-Y191 HydrophobicContact CG-CE1 3.78Å; Y184-Y191 HydrophobicContact CE1-CD2 4.38Å; H189-Y191 AromaticContact CE1-CD2 3.53Å; H189-Y191 AromaticContact ND1-CD2 3.75Å; H189-Y191 PolarHBondContact O-N 3.05Å
192	V	71.1	Confident	68.6	Low	3 Å²	3	54 Å²	54	2%	0.018	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-132.4	118.3	-176.4	-173.3	0	0	0	0	109.4	Y184 H189 D196 L207 L209	Y184-V192 HydrophobicContact CD1-CG2 3.68Å; Y184-V192 HydrophobicContact CE1-CG2 4.42Å; H189-V192 HydrophobicContact CB-CB 4.2Å; H189-V192 HydrophobicContact CB-CG2 4.47Å; H189-V192 PolarHBondContact N-O 2.89Å; H189-V192 CarbonylContact O-C 3.48Å; H189-V192 PolarHBondContact O-N 3.22Å; V192-D196 HydrophobicContact CG1-CB 3.85Å; V192-L207 HydrophobicContact CG1-CD2 4.48Å; V192-L207 HydrophobicContact CG2-CD1 3.86Å; V192-L207 HydrophobicContact CG2-CD2 4.34Å; V192-L209 HydrophobicContact CG2-CD2 4.39Å
193	G	67.7	Low	68.9	Low	11 Å²	11	58.3 Å²	58.3	11%	0.113	29%	0.287	C	S	.	.			trans	-78.7	170.1	177.2	0	0	0	0	0	112.9	H155 E195 D196 R198	H155-G193 PolarHBondContact NE2-N 2.64Å; G193-E195 PolarHBondContact O-N 3.02Å; G193-D196 PolarHBondContact N-OD2 3.18Å; G193-D196 PolarHBondContact O-N 2.91Å; G193-R198 PolarHBondContact O-NH2 3.43Å
194	K	70.8	Confident	69.4	Low	157 Å²	157	62.4 Å²	62.4	68%	0.683	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-25.5	172.4	-69	-174.9	179.3	-178.5	0	111.9	N188 D196	N188-K194 WeakPolarHBondContact OD1-CE 3.11Å; N188-K194 WeakPolarHBondContact OD1-CG 3.11Å; K194-D196 VanDerWaalsContact C-N 3.34Å
195	E	72.4	Confident	70	Confident	82 Å²	82	62.4 Å²	62.4	38%	0.383	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-12.4	178.6	64.6	-92.2	-139.7	0	0	114	H155 G193 K211	H155-E195 IonicContact CE1-OE1 3.45Å; G193-E195 PolarHBondContact O-N 3.02Å; E195-K211 HydrophobicContact CG-CG 4.42Å
196	D	73.9	Confident	70.8	Confident	12 Å²	12	62.5 Å²	62.5	6%	0.064	31%	0.305	C	S	.	.	S	Bend	trans	-79.9	136.1	-178.6	-68.1	-30.6	0	0	0	110.8	H155 V192 G193 K194 L209	H155-D196 IonicContact NE2-OD2 3.87Å; V192-D196 HydrophobicContact CG1-CB 3.85Å; G193-D196 PolarHBondContact N-OD2 3.18Å; G193-D196 PolarHBondContact O-N 2.91Å; K194-D196 VanDerWaalsContact C-N 3.34Å; D196-L209 HydrophobicContact CB-CD2 4.34Å; D196-L209 WeakPolarHBondContact OD1-CA 3.18Å; D196-L209 WeakPolarHBondContact OD2-CD2 3.24Å
197	S	74.9	Confident	71.4	Confident	23 Å²	23	61.2 Å²	61.2	16%	0.161	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	143.2	178.7	-63.7	0	0	0	0	111.2	N208	S197-N208 PolarHBondContact N-O 2.83Å; S197-N208 PolarHBondContact O-N 2.92Å
198	R	77.4	Confident	72.2	Confident	44 Å²	44	55 Å²	55	17%	0.166	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	141	-173.7	-55.8	175.9	-110.9	-160.6	-13	111.1	Y186 L187 G193 M206 L207	Y186-R198 PolarHBondContact O-NH1 2.71Å; L187-R198 PolarHBondContact O-NH2 3.47Å; G193-R198 PolarHBondContact O-NH2 3.43Å; R198-M206 CarbonylContact C-O 3.59Å; R198-M206 WeakPolarHBondContact CA-O 3.39Å; R198-L207 HydrophobicContact CB-CD2 4.32Å; R198-L207 HydrophobicContact CG-CD2 3.59Å
199	I	76.8	Confident	72.6	Confident	51 Å²	51	50.6 Å²	50.6	26%	0.262	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	116.2	167.9	-60.4	-172.5	0	0	0	107.2	M206 F215 L216 V219	I199-M206 HydrophobicContact CB-CB 4.3Å; I199-M206 HydrophobicContact CB-CE 3.9Å; I199-M206 HydrophobicContact CD1-CE 3.54Å; I199-M206 HydrophobicContact CG1-CE 3.97Å; I199-M206 HydrophobicContact CG2-CE 4.48Å; I199-M206 PolarHBondContact N-O 2.96Å; I199-M206 PolarHBondContact O-N 3.08Å; I199-F215 HydrophobicContact CD1-CE1 3.84Å; I199-F215 HydrophobicContact CD1-CZ 4.33Å; I199-F215 HydrophobicContact CG1-CE1 4.03Å; I199-L216 HydrophobicContact CD1-CD2 4.41Å; I199-L216 HydrophobicContact CG1-CD2 4.16Å; I199-V219 HydrophobicContact CD1-CG1 4.17Å; I199-V219 HydrophobicContact CD1-CG2 4.11Å
200	M	75.6	Confident	72.8	Confident	120 Å²	120	52.6 Å²	52.6	59%	0.591	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	120.6	-179.8	-61.3	-176.9	-66.6	0	0	108.9	M185 V205	M185-M200 HydrophobicContact CB-SD 3.98Å; M185-M200 HydrophobicContact CG-CG 4.49Å; M185-M200 HydrophobicContact CG-SD 3.78Å; M200-V205 HydrophobicContact CG-CG1 4.39Å; M200-V205 HydrophobicContact CG-CG2 4.43Å
201	G	68.6	Low	72.8	Confident	20 Å²	20	49 Å²	49	21%	0.206	24%	0.241	C	C	.	.			trans	-96.8	179.4	162.4	0	0	0	0	0	110.4	Y173 E203 F204	Y173-G201 PolarHBondContact OH-O 3.42Å; G201-E203 VanDerWaalsContact C-N 3.27Å; G201-E203 PolarHBondContact O-N 3.25Å; G201-F204 WeakPolarHBondContact CA-O 3.03Å; G201-F204 PolarHBondContact N-O 3.14Å
202	S	67.8	Low	73	Confident	69 Å²	69	54.4 Å²	54.4	48%	0.483	27%	0.27	S	S	.	.	S	Bend	trans	-68.7	-22.3	179.1	53	0	0	0	0	114.6	Y173	Y173-S202 PolarHBondContact OH-O 2.92Å
203	E	68.4	Low	73.1	Confident	91 Å²	91	55.3 Å²	55.3	43%	0.425	28%	0.275	S	S	.	.	S	Bend	trans	-135.5	-1.2	-176.1	-64.4	176.7	164.1	0	0	112.2	D172 Y173 G174 G201	D172-E203 WeakPolarHBondContact CA-O 3.45Å; Y173-E203 WeakPolarHBondContact CD1-O 3.29Å; Y173-E203 PolarHBondContact N-O 3.23Å; Y173-E203 PolarHBondContact OH-N 3.39Å; G174-E203 PolarHBondContact N-O 3.16Å; G174-E203 VanDerWaalsContact N-O 3.15Å; G201-E203 VanDerWaalsContact C-N 3.27Å; G201-E203 PolarHBondContact O-N 3.25Å
204	F	72.9	Confident	73.4	Confident	86 Å²	86	60.4 Å²	60.4	38%	0.377	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	153.1	-179.3	71.9	-90.2	0	0	0	112.8	V170 L171 Y173 G201	V170-F204 HydrophobicContact CG1-CB 3.92Å; V170-F204 HydrophobicContact CG1-CD2 3.94Å; V170-F204 HydrophobicContact CG1-CG 4.19Å; L171-F204 CarbonylContact O-C 3.6Å; L171-F204 WeakPolarHBondContact O-CA 3.27Å; Y173-F204 VanDerWaalsContact CE1-CA 3.45Å; G201-F204 WeakPolarHBondContact CA-O 3.03Å; G201-F204 PolarHBondContact N-O 3.14Å
205	V	74.6	Confident	73.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	119.1	167.2	-176.5	0	0	0	0	108.2	V170 L171 Y173 M185 M200 L207	V170-V205 CarbonylContact C-O 3.56Å; V170-V205 WeakPolarHBondContact CA-O 3.43Å; L171-V205 PolarHBondContact N-O 3.32Å; L171-V205 PolarHBondContact O-N 2.87Å; Y173-V205 HydrophobicContact CD1-CG2 3.99Å; Y173-V205 HydrophobicContact CE1-CG2 3.67Å; M185-V205 HydrophobicContact CE-CG2 4.12Å; M185-V205 HydrophobicContact CG-CG2 3.82Å; M200-V205 HydrophobicContact CG-CG1 4.39Å; M200-V205 HydrophobicContact CG-CG2 4.43Å; V205-L207 HydrophobicContact CG1-CD2 3.55Å; V205-L207 HydrophobicContact CG1-CG 4.07Å
206	M	81	Confident	74	Confident	37 Å²	37	54.1 Å²	54.1	18%	0.182	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	116.9	167.5	-175.1	172.2	53.5	0	0	109.4	P168 I169 V170 R198 I199 F215	P168-M206 HydrophobicContact CB-CG 4.19Å; P168-M206 HydrophobicContact CB-SD 4.33Å; I169-M206 CarbonylContact O-C 3.52Å; I169-M206 VanDerWaalsContact O-CA 3.29Å; I169-M206 WeakPolarHBondContact O-CA 3.17Å; V170-M206 HydrophobicContact CG2-CB 4.06Å; V170-M206 HydrophobicContact CG2-CG 3.88Å; V170-M206 HydrophobicContact CG2-SD 4.26Å; R198-M206 CarbonylContact C-O 3.59Å; R198-M206 WeakPolarHBondContact CA-O 3.39Å; I199-M206 HydrophobicContact CB-CB 4.3Å; I199-M206 HydrophobicContact CB-CE 3.9Å; I199-M206 HydrophobicContact CD1-CE 3.54Å; I199-M206 HydrophobicContact CG1-CE 3.97Å; I199-M206 HydrophobicContact CG2-CE 4.48Å; I199-M206 PolarHBondContact N-O 2.96Å; I199-M206 PolarHBondContact O-N 3.08Å; M206-F215 HydrophobicContact CE-CE1 3.99Å; M206-F215 HydrophobicContact CE-CZ 3.56Å; M206-F215 HydrophobicContact SD-CZ 4.12Å
207	L	76.8	Confident	74.1	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	134.6	177.2	-59	178.5	0	0	0	110.7	L152 P168 I169 L171 Y184 V192 R198 V205 L209	L152-L207 HydrophobicContact CD2-CD1 4.5Å; P168-L207 CarbonylContact C-O 3.51Å; P168-L207 WeakPolarHBondContact CA-O 3.49Å; I169-L207 HydrophobicContact CD1-CB 4.39Å; I169-L207 HydrophobicContact CD1-CD1 4.12Å; I169-L207 HydrophobicContact CG1-CB 3.81Å; I169-L207 HydrophobicContact CG1-CD1 4.32Å; I169-L207 HydrophobicContact CG1-CG 4.47Å; I169-L207 PolarHBondContact N-O 3.42Å; I169-L207 PolarHBondContact O-N 3.06Å; L171-L207 HydrophobicContact CD1-CD1 3.34Å; L171-L207 HydrophobicContact CD1-CG 3.97Å; L171-L207 HydrophobicContact CG-CD1 4.33Å; Y184-L207 HydrophobicContact CD1-CD1 3.53Å; Y184-L207 HydrophobicContact CE1-CD1 4.3Å; Y184-L207 HydrophobicContact CG-CD1 4.01Å; V192-L207 HydrophobicContact CG1-CD2 4.48Å; V192-L207 HydrophobicContact CG2-CD1 3.86Å; V192-L207 HydrophobicContact CG2-CD2 4.34Å; R198-L207 HydrophobicContact CB-CD2 4.32Å; R198-L207 HydrophobicContact CG-CD2 3.59Å; V205-L207 HydrophobicContact CG1-CD2 3.55Å; V205-L207 HydrophobicContact CG1-CG 4.07Å; L207-L209 HydrophobicContact CB-CD2 4.22Å; L207-L209 HydrophobicContact CB-CG 4.49Å; L207-L209 HydrophobicContact CD1-CD2 4.44Å
208	N	79.8	Confident	74.4	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	104.7	164.4	-170.5	-2.6	0	0	0	109.9	S197 R210 D213 F215	S197-N208 PolarHBondContact N-O 2.83Å; S197-N208 PolarHBondContact O-N 2.92Å; N208-R210 PolarHBondContact O-N 3.21Å; N208-R210 WeakPolarHBondContact OD1-CB 3.25Å; N208-R210 WeakPolarHBondContact OD1-CD 3.39Å; N208-R210 VanDerWaalsContact OD1-CG 3.27Å; N208-R210 WeakPolarHBondContact OD1-CG 3.18Å; N208-R210 PolarHBondContact OD1-N 3.01Å; N208-D213 PolarHBondContact ND2-OD2 3.02Å; N208-F215 HydrophobicContact CB-CB 4.31Å; N208-F215 HydrophobicContact CB-CD1 3.96Å; N208-F215 HydrophobicContact CB-CD2 4.22Å; N208-F215 HydrophobicContact CB-CE1 4.32Å; N208-F215 HydrophobicContact CB-CG 3.88Å; N208-F215 WeakPolarHBondContact ND2-CB 3.19Å; N208-F215 WeakPolarHBondContact ND2-CD2 3.15Å; N208-F215 WeakPolarHBondContact ND2-CG 3.26Å
209	L	73.4	Confident	74.4	Confident	11 Å²	11	59.2 Å²	59.2	6%	0.058	31%	0.308	C	S	.	.			trans	-88.2	22.9	-177.1	-52.4	176	0	0	0	113.1	L152 I169 V192 D196 L207	L152-L209 HydrophobicContact CD2-CD1 3.71Å; I169-L209 HydrophobicContact CD1-CD1 4.08Å; V192-L209 HydrophobicContact CG2-CD2 4.39Å; D196-L209 HydrophobicContact CB-CD2 4.34Å; D196-L209 WeakPolarHBondContact OD1-CA 3.18Å; D196-L209 WeakPolarHBondContact OD2-CD2 3.24Å; L207-L209 HydrophobicContact CB-CD2 4.22Å; L207-L209 HydrophobicContact CB-CG 4.49Å; L207-L209 HydrophobicContact CD1-CD2 4.44Å
210	R	72.5	Confident	74.5	Confident	69 Å²	69	61.7 Å²	61.7	26%	0.26	32%	0.322	S	S	.	.			trans	-89.2	112.2	175.8	-71.8	172	180	165.9	10.4	108.8	C163 R164 R166 N208 N212 D213	C163-R210 WeakPolarHBondContact O-CG 3.44Å; R164-R210 PolarHBondContact O-NE 3.46Å; R166-R210 HydrophobicContact CB-CG 4.22Å; R166-R210 PolarHBondContact O-NE 3.41Å; R166-R210 PolarHBondContact O-NH2 3.29Å; N208-R210 PolarHBondContact O-N 3.21Å; N208-R210 WeakPolarHBondContact OD1-CB 3.25Å; N208-R210 WeakPolarHBondContact OD1-CD 3.39Å; N208-R210 VanDerWaalsContact OD1-CG 3.27Å; N208-R210 WeakPolarHBondContact OD1-CG 3.18Å; N208-R210 PolarHBondContact OD1-N 3.01Å; R210-N212 PolarHBondContact O-N 3.38Å; R210-D213 HydrophobicContact CB-CB 3.53Å; R210-D213 WeakPolarHBondContact CD-OD2 3.16Å; R210-D213 IonicContact CZ-OD2 2.64Å; R210-D213 IonicContact NE-OD2 3.88Å; R210-D213 IonicContact NH1-OD2 3.85Å; R210-D213 PolarHBondContact NH1-OD2 2.84Å; R210-D213 PolarHBondContact O-N 3.2Å
211	K	67.8	Low	74.7	Confident	124 Å²	124	60.1 Å²	60.1	54%	0.539	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	127.5	172.7	-173.5	166	-174.7	166.6	0	111.1	E195 D213	E195-K211 HydrophobicContact CG-CG 4.42Å; K211-D213 VanDerWaalsContact C-N 3.27Å; K211-D213 PolarHBondContact O-N 2.89Å
212	N	68.3	Low	75.2	Confident	131 Å²	131	63.6 Å²	63.6	70%	0.701	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	30	179.2	-49.3	-26.8	0	0	0	114.1	R210	R210-N212 PolarHBondContact O-N 3.38Å
213	D	72.7	Confident	75.6	Confident	23 Å²	23	64.3 Å²	64.3	12%	0.123	33%	0.328	C	S	.	.			trans	-84.3	129.1	170.1	-167.8	14.1	0	0	0	110	N208 R210 K211 F215 K218	N208-D213 PolarHBondContact ND2-OD2 3.02Å; R210-D213 HydrophobicContact CB-CB 3.53Å; R210-D213 WeakPolarHBondContact CD-OD2 3.16Å; R210-D213 IonicContact CZ-OD2 2.64Å; R210-D213 IonicContact NE-OD2 3.88Å; R210-D213 IonicContact NH1-OD2 3.85Å; R210-D213 PolarHBondContact NH1-OD2 2.84Å; R210-D213 PolarHBondContact O-N 3.2Å; K211-D213 VanDerWaalsContact C-N 3.27Å; K211-D213 PolarHBondContact O-N 2.89Å; D213-F215 PolarHBondContact O-N 2.98Å; D213-K218 IonicContact OD1-NZ 2.61Å; D213-K218 PolarHBondContact OD1-NZ 3.45Å
214	D	74.7	Confident	76	Confident	118 Å²	118	64.9 Å²	64.9	63%	0.631	33%	0.332	S	S	*	.			trans	-75.7	47.7	173.8	-58.3	-39.7	0	0	0	110.9	L216 A217 K218	D214-L216 PolarHBondContact O-N 3.29Å; D214-A217 HydrophobicContact CB-CB 4.08Å; D214-A217 PolarHBondContact O-N 2.92Å; D214-K218 WeakPolarHBondContact O-CG 3.37Å; D214-K218 PolarHBondContact O-N 3.25Å
215	F	78.1	Confident	76.4	Confident	24 Å²	24	65.7 Å²	65.7	11%	0.105	34%	0.336	C	S	.	.	H	α-helix	trans	-58.5	-47.4	-170.6	177.9	-115.1	0	0	0	112.4	I199 M206 N208 D213 A217 K218 V219	I199-F215 HydrophobicContact CD1-CE1 3.84Å; I199-F215 HydrophobicContact CD1-CZ 4.33Å; I199-F215 HydrophobicContact CG1-CE1 4.03Å; M206-F215 HydrophobicContact CE-CE1 3.99Å; M206-F215 HydrophobicContact CE-CZ 3.56Å; M206-F215 HydrophobicContact SD-CZ 4.12Å; N208-F215 HydrophobicContact CB-CB 4.31Å; N208-F215 HydrophobicContact CB-CD1 3.96Å; N208-F215 HydrophobicContact CB-CD2 4.22Å; N208-F215 HydrophobicContact CB-CE1 4.32Å; N208-F215 HydrophobicContact CB-CG 3.88Å; N208-F215 WeakPolarHBondContact ND2-CB 3.19Å; N208-F215 WeakPolarHBondContact ND2-CD2 3.15Å; N208-F215 WeakPolarHBondContact ND2-CG 3.26Å; D213-F215 PolarHBondContact O-N 2.98Å; F215-A217 VanDerWaalsContact C-N 3.34Å; F215-K218 WeakPolarHBondContact O-CB 3.33Å; F215-K218 PolarHBondContact O-N 3.23Å; F215-V219 HydrophobicContact CD2-CG2 4.43Å; F215-V219 HydrophobicContact CE1-CG2 4.13Å; F215-V219 HydrophobicContact CE2-CG2 4.02Å; F215-V219 HydrophobicContact CZ-CG2 3.86Å; F215-V219 WeakPolarHBondContact O-CG2 3.34Å; F215-V219 PolarHBondContact O-N 3.39Å
216	L	77.1	Confident	76.4	Confident	83 Å²	83	67.6 Å²	67.6	44%	0.435	35%	0.352	S	S	.	.	H	α-helix	trans	-63.5	-42.5	179.2	-62.6	179.3	0	0	0	110.9	I199 D214 K218 V219 D220	I199-L216 HydrophobicContact CD1-CD2 4.41Å; I199-L216 HydrophobicContact CG1-CD2 4.16Å; D214-L216 PolarHBondContact O-N 3.29Å; L216-K218 VanDerWaalsContact C-N 3.3Å; L216-K218 PolarHBondContact O-N 3.46Å; L216-V219 WeakPolarHBondContact O-CB 3.4Å; L216-V219 PolarHBondContact O-N 3.17Å; L216-V219 VanDerWaalsContact O-N 3.11Å; L216-D220 PolarHBondContact O-N 3.43Å
217	A	77.8	Confident	75.9	Confident	56 Å²	56	75 Å²	75	46%	0.463	38%	0.378	S	S	.	.	H	α-helix	trans	-61	-38.5	175.3	0	0	0	0	0	112.2	D214 F215 D220 E221	D214-A217 HydrophobicContact CB-CB 4.08Å; D214-A217 PolarHBondContact O-N 2.92Å; F215-A217 VanDerWaalsContact C-N 3.34Å; A217-D220 PolarHBondContact O-N 2.68Å; A217-E221 VanDerWaalsContact O-CB 3.31Å; A217-E221 WeakPolarHBondContact O-CB 2.87Å; A217-E221 PolarHBondContact O-N 3.48Å
218	K	80.8	Confident	75.9	Confident	93 Å²	93	81.5 Å²	81.5	40%	0.404	41%	0.408	S	S	.	.	H	α-helix	trans	-67.2	-37.4	174.8	-70.5	168.6	-175.6	170.8	0	112.4	D213 D214 F215 L216 T222	D213-K218 IonicContact OD1-NZ 2.61Å; D213-K218 PolarHBondContact OD1-NZ 3.45Å; D214-K218 WeakPolarHBondContact O-CG 3.37Å; D214-K218 PolarHBondContact O-N 3.25Å; F215-K218 WeakPolarHBondContact O-CB 3.33Å; F215-K218 PolarHBondContact O-N 3.23Å; L216-K218 VanDerWaalsContact C-N 3.3Å; L216-K218 PolarHBondContact O-N 3.46Å; K218-T222 VanDerWaalsContact O-CB 3.29Å; K218-T222 WeakPolarHBondContact O-CB 3.32Å; K218-T222 PolarHBondContact O-N 2.76Å; K218-T222 PolarHBondContact O-OG1 3.49Å
219	V	76.7	Confident	75.8	Confident	36 Å²	36	87.2 Å²	87.2	22%	0.218	44%	0.443	C	S	.	.	H	α-helix	trans	-64.9	-47.4	174.2	170.5	0	0	0	0	109.7	I199 F215 L216 E221 T222 L223	I199-V219 HydrophobicContact CD1-CG1 4.17Å; I199-V219 HydrophobicContact CD1-CG2 4.11Å; F215-V219 HydrophobicContact CD2-CG2 4.43Å; F215-V219 HydrophobicContact CE1-CG2 4.13Å; F215-V219 HydrophobicContact CE2-CG2 4.02Å; F215-V219 HydrophobicContact CZ-CG2 3.86Å; F215-V219 WeakPolarHBondContact O-CG2 3.34Å; F215-V219 PolarHBondContact O-N 3.39Å; L216-V219 WeakPolarHBondContact O-CB 3.4Å; L216-V219 PolarHBondContact O-N 3.17Å; L216-V219 VanDerWaalsContact O-N 3.11Å; V219-E221 PolarHBondContact O-N 2.89Å; V219-T222 CarbonylContact O-C 3.58Å; V219-T222 WeakPolarHBondContact O-CB 3.4Å; V219-T222 PolarHBondContact O-N 3.13Å; V219-T222 VanDerWaalsContact O-N 3.15Å; V219-L223 HydrophobicContact CG1-CD1 3.95Å; V219-L223 HydrophobicContact CG1-CG 4.34Å; V219-L223 WeakPolarHBondContact O-CG 3.39Å; V219-L223 PolarHBondContact O-N 2.96Å
220	D	79.9	Confident	75.1	Confident	104 Å²	104	90.6 Å²	90.6	56%	0.556	46%	0.461	S	S	*	.	H	α-helix	trans	-60.9	-46	177.3	-70.8	-23	0	0	0	111.9	L216 A217 T222 L223 M224	L216-D220 PolarHBondContact O-N 3.43Å; A217-D220 PolarHBondContact O-N 2.68Å; D220-T222 VanDerWaalsContact C-N 3.28Å; D220-T222 PolarHBondContact O-N 3.08Å; D220-L223 PolarHBondContact O-N 3.31Å; D220-M224 VanDerWaalsContact O-CB 3.31Å; D220-M224 WeakPolarHBondContact O-CB 3.45Å; D220-M224 PolarHBondContact O-N 3.29Å
221	E	79.5	Confident	74.2	Confident	87 Å²	87	91.6 Å²	91.6	41%	0.407	48%	0.478	S	S	.	.	H	α-helix	trans	-59	-41.5	174.6	-171.6	-168.7	165.5	0	0	111.3	A217 V219 M224 K225	A217-E221 VanDerWaalsContact O-CB 3.31Å; A217-E221 WeakPolarHBondContact O-CB 2.87Å; A217-E221 PolarHBondContact O-N 3.48Å; V219-E221 PolarHBondContact O-N 2.89Å; E221-M224 PolarHBondContact O-N 3.11Å; E221-K225 HydrophobicContact CG-CD 4.31Å; E221-K225 WeakPolarHBondContact O-CB 2.98Å; E221-K225 WeakPolarHBondContact O-CG 3.45Å; E221-K225 PolarHBondContact O-N 3.44Å; E221-K225 WeakPolarHBondContact OE1-CE 3.19Å; E221-K225 IonicContact OE1-NZ 2.61Å; E221-K225 PolarHBondContact OE1-NZ 3.45Å
222	T	78.4	Confident	73.6	Confident	92 Å²	92	95.6 Å²	95.6	56%	0.564	49%	0.49	S	S	*	.	H	α-helix	trans	-67.6	-41.6	178	-59.1	0	0	0	0	111.5	K218 V219 D220 K225 A226	K218-T222 VanDerWaalsContact O-CB 3.29Å; K218-T222 WeakPolarHBondContact O-CB 3.32Å; K218-T222 PolarHBondContact O-N 2.76Å; K218-T222 PolarHBondContact O-OG1 3.49Å; V219-T222 CarbonylContact O-C 3.58Å; V219-T222 WeakPolarHBondContact O-CB 3.4Å; V219-T222 PolarHBondContact O-N 3.13Å; V219-T222 VanDerWaalsContact O-N 3.15Å; D220-T222 VanDerWaalsContact C-N 3.28Å; D220-T222 PolarHBondContact O-N 3.08Å; T222-K225 PolarHBondContact O-N 3.45Å; T222-A226 VanDerWaalsContact O-CB 3.23Å; T222-A226 WeakPolarHBondContact O-CB 3.08Å; T222-A226 PolarHBondContact O-N 2.84Å
223	L	75.9	Confident	72.7	Confident	84 Å²	84	97.4 Å²	97.4	44%	0.44	50%	0.5	S	S	.	.	H	α-helix	trans	-66.8	-39	176.7	-72.6	174.2	0	0	0	111.4	V219 D220 A226 R227	V219-L223 HydrophobicContact CG1-CD1 3.95Å; V219-L223 HydrophobicContact CG1-CG 4.34Å; V219-L223 WeakPolarHBondContact O-CG 3.39Å; V219-L223 PolarHBondContact O-N 2.96Å; D220-L223 PolarHBondContact O-N 3.31Å; L223-A226 PolarHBondContact O-N 3.46Å; L223-R227 WeakPolarHBondContact O-CB 3.46Å; L223-R227 VanDerWaalsContact O-CG 3.23Å; L223-R227 WeakPolarHBondContact O-CG 3.23Å; L223-R227 PolarHBondContact O-N 2.68Å
224	M	77.5	Confident	71.1	Confident	103 Å²	103	104.7 Å²	104.7	51%	0.507	55%	0.552	S	S	.	*	H	α-helix	trans	-62.1	-51.7	174.1	-176.7	176.7	63.4	0	0	110.9	D220 E221 A226 R227 E228	D220-M224 VanDerWaalsContact O-CB 3.31Å; D220-M224 WeakPolarHBondContact O-CB 3.45Å; D220-M224 PolarHBondContact O-N 3.29Å; E221-M224 PolarHBondContact O-N 3.11Å; M224-A226 VanDerWaalsContact C-N 3.28Å; M224-A226 PolarHBondContact O-N 3.26Å; M224-R227 WeakPolarHBondContact O-CB 3.32Å; M224-R227 PolarHBondContact O-N 3.44Å; M224-R227 VanDerWaalsContact O-N 3.09Å; M224-E228 WeakPolarHBondContact O-CG 3.17Å; M224-E228 PolarHBondContact O-N 2.89Å
225	K	81.9	Confident	70.9	Confident	103 Å²	103	104 Å²	104	45%	0.448	55%	0.549	S	S	.	.	H	α-helix	trans	-59.5	-39	174.4	-75.4	172.8	172.7	171.5	0	112.4	E221 T222 E228 V229	E221-K225 HydrophobicContact CG-CD 4.31Å; E221-K225 WeakPolarHBondContact O-CB 2.98Å; E221-K225 WeakPolarHBondContact O-CG 3.45Å; E221-K225 PolarHBondContact O-N 3.44Å; E221-K225 WeakPolarHBondContact OE1-CE 3.19Å; E221-K225 IonicContact OE1-NZ 2.61Å; E221-K225 PolarHBondContact OE1-NZ 3.45Å; T222-K225 PolarHBondContact O-N 3.45Å; K225-E228 PolarHBondContact O-N 3.02Å; K225-V229 WeakPolarHBondContact O-CG2 3.21Å; K225-V229 PolarHBondContact O-N 2.61Å; K225-V229 VanDerWaalsContact O-N 3.07Å
226	A	73.9	Confident	70.5	Confident	41 Å²	41	108.2 Å²	108.2	34%	0.339	57%	0.572	S	S	.	*	H	α-helix	trans	-60.8	-46.6	174.9	0	0	0	0	0	110.2	T222 L223 M224 E228 V229 N230	T222-A226 VanDerWaalsContact O-CB 3.23Å; T222-A226 WeakPolarHBondContact O-CB 3.08Å; T222-A226 PolarHBondContact O-N 2.84Å; L223-A226 PolarHBondContact O-N 3.46Å; M224-A226 VanDerWaalsContact C-N 3.28Å; M224-A226 PolarHBondContact O-N 3.26Å; A226-E228 VanDerWaalsContact C-N 3.3Å; A226-E228 PolarHBondContact O-N 3.34Å; A226-V229 PolarHBondContact O-N 3.11Å; A226-N230 WeakPolarHBondContact O-CB 3.43Å; A226-N230 PolarHBondContact O-N 3.14Å
227	R	71.6	Confident	70.2	Confident	192 Å²	192	109.6 Å²	109.6	73%	0.725	58%	0.579	S	S	*	*	H	α-helix	trans	-63.4	-29.9	176	-70.9	167.6	178.9	179.3	0.4	113.6	L223 M224 N230	L223-R227 WeakPolarHBondContact O-CB 3.46Å; L223-R227 VanDerWaalsContact O-CG 3.23Å; L223-R227 WeakPolarHBondContact O-CG 3.23Å; L223-R227 PolarHBondContact O-N 2.68Å; M224-R227 WeakPolarHBondContact O-CB 3.32Å; M224-R227 PolarHBondContact O-N 3.44Å; M224-R227 VanDerWaalsContact O-N 3.09Å; R227-N230 CarbonylContact C-O 3.48Å; R227-N230 CarbonylContact O-C 3.59Å
228	E	76.2	Confident	69.7	Low	136 Å²	136	112.8 Å²	112.8	64%	0.636	59%	0.586	S	S	*	*	H	α-helix	trans	-70.7	-45.2	174.6	-71.8	172.4	-177.3	0	0	112	M224 K225 A226	M224-E228 WeakPolarHBondContact O-CG 3.17Å; M224-E228 PolarHBondContact O-N 2.89Å; K225-E228 PolarHBondContact O-N 3.02Å; A226-E228 VanDerWaalsContact C-N 3.3Å; A226-E228 PolarHBondContact O-N 3.34Å
229	V	77.7	Confident	69	Low	122 Å²	122	114 Å²	114	74%	0.739	60%	0.598	S	S	*	*	H	α-helix	trans	-72.5	-39.2	-179.9	175.4	0	0	0	0	111.2	K225 A226	K225-V229 WeakPolarHBondContact O-CG2 3.21Å; K225-V229 PolarHBondContact O-N 2.61Å; K225-V229 VanDerWaalsContact O-N 3.07Å; A226-V229 PolarHBondContact O-N 3.11Å
230	N	58	Low	68.5	Low	82 Å²	82	119.2 Å²	119.2	44%	0.439	62%	0.623	S	S	.	*	S	Bend	trans	-102.1	89.8	178.1	-78	-37.8	0	0	0	107	A226 R227 W232	A226-N230 WeakPolarHBondContact O-CB 3.43Å; A226-N230 PolarHBondContact O-N 3.14Å; R227-N230 CarbonylContact C-O 3.48Å; R227-N230 CarbonylContact O-C 3.59Å; N230-W232 VanDerWaalsContact C-CD1 3.48Å; N230-W232 HydrophobicContact CB-CG 4.21Å; N230-W232 VanDerWaalsContact CB-NE1 3.34Å; N230-W232 PolarHBondContact O-N 3.01Å
231	S	53.1	Low	67.7	Low	90 Å²	90	120.3 Å²	120.3	63%	0.629	63%	0.628	S	S	*	*			trans	-64.1	55.4	172.4	58.8	0	0	0	0	112.7	N233	S231-N233 VanDerWaalsContact C-N 3.29Å; S231-N233 PolarHBondContact O-N 3.19Å
232	W	57	Low	66.8	Low	208 Å²	208	122.8 Å²	122.8	79%	0.788	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	89.1	174.3	-67	39	0	0	0	103.8	N230	N230-W232 VanDerWaalsContact C-CD1 3.48Å; N230-W232 HydrophobicContact CB-CG 4.21Å; N230-W232 VanDerWaalsContact CB-NE1 3.34Å; N230-W232 PolarHBondContact O-N 3.01Å
233	N	48.8	Very low	65.8	Low	168 Å²	168	125.4 Å²	125.4	90%	0.898	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	123.4	52.9	177.5	-58.3	-18.4	0	0	0	113.9	S231	S231-N233 VanDerWaalsContact C-N 3.29Å; S231-N233 PolarHBondContact O-N 3.19Å
234	S	38.7	Very low	64.9	Low	176 Å²	176	129.2 Å²	129.2	100%	1.231	67%	0.671	S	S	*	*			trans	-93	0	145	-55.7	0	0	0	0	109.3

Retrieved 234 of 234 residues in 454.4 ms (Link to these results)

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