A0A096LZS1_POEFO Loading...

Artemin

Growth factor that supports the survival of sensory and sympathetic peripheral neurons in culture and also supports the survival of dopaminergic neurons of the ventral mid-brain. Acts by binding to its coreceptor, GFRA3, leading to autophosphorylation and activation of the RET receptor. Strong attractant of gut hematopoietic cells thus promoting the formation Peyer's patch-like structures, a major component of the gut-associated lymphoid tissue.

AlphaFold DB , UniProt , Accession A0A096LZS1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 108 aa.

						>A0A096LZS1_POEFO|A0A096LZS1
RTRRSAPDSQCGLRSVLLQVRDLGLGYDSDETVLFKYCGGSCPRARSNYDLTLSNLLLSGRLPQPAPGEPWHSVPCCRPTHYEDMAFLDNSHRWHKVEKLSAAACSCA
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	R	36.8	Very low	57.6	Low	298 Å²	298	135.3 Å²	135.3	100%	1.125	67%	0.671	S	S	*	*				0	78.4	0	-164.8	176.6	-173.4	170.1	1.5	108.6	R3	R1-R3 PolarHBondContact O-N 3.09Å
2	T	40.3	Very low	60.7	Low	132 Å²	132	125.7 Å²	125.7	81%	0.81	63%	0.633	S	S	*	*			trans	-81.7	104.7	-178.3	31.7	0	0	0	0	109.1	R4	T2-R4 VanDerWaalsContact C-N 3.33Å; T2-R4 PolarHBondContact O-N 2.88Å
3	R	47.8	Very low	63.5	Low	237 Å²	237	121.6 Å²	121.6	89%	0.894	61%	0.613	S	S	*	*			trans	-66.1	97.7	166.9	-83.5	-175.5	178.5	-170.4	-0.2	107.1	R1 S5	R1-R3 PolarHBondContact O-N 3.09Å; R3-S5 PolarHBondContact O-N 2.94Å; R3-S5 VanDerWaalsContact O-N 3.08Å
4	R	45.1	Very low	65.9	Low	234 Å²	234	116.7 Å²	116.7	88%	0.883	58%	0.584	S	S	*	*			trans	-60.9	105.8	161	-112.6	176.8	-96.8	-157.8	-5.9	106.1	T2 A6	T2-R4 VanDerWaalsContact C-N 3.33Å; T2-R4 PolarHBondContact O-N 2.88Å; R4-A6 PolarHBondContact O-N 3.43Å; R4-A6 VanDerWaalsContact O-N 3.08Å
5	S	45.8	Very low	68	Low	99 Å²	99	113.9 Å²	113.9	69%	0.692	58%	0.58	S	S	*	*			trans	-56.7	113.1	168.2	-39.7	0	0	0	0	106.7	R3	R3-S5 PolarHBondContact O-N 2.94Å; R3-S5 VanDerWaalsContact O-N 3.08Å
6	A	47.8	Very low	69.8	Low	57 Å²	57	110.4 Å²	110.4	47%	0.471	57%	0.566	S	S	.	*			trans	-59.2	136.2	173.2	0	0	0	0	0	108	R4 D8 S9	R4-A6 PolarHBondContact O-N 3.43Å; R4-A6 VanDerWaalsContact O-N 3.08Å; A6-D8 PolarHBondContact O-N 2.82Å; A6-S9 PolarHBondContact O-N 3.1Å; A6-S9 PolarHBondContact O-OG 3.36Å
7	P	52.2	Low	71.5	Confident	125 Å²	125	110.9 Å²	110.9	81%	0.812	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-56.4	-13.4	176	20.4	-30.2	0	0	0	113.2	S9	P7-S9 VanDerWaalsContact C-N 3.28Å; P7-S9 PolarHBondContact O-N 3.26Å
8	D	56.9	Low	72.9	Confident	110 Å²	110	106.9 Å²	106.9	59%	0.588	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-72.4	-3.3	173.1	-82.6	-22	0	0	0	116.4	A6 R14	A6-D8 PolarHBondContact O-N 2.82Å; D8-R14 PolarHBondContact O-NH2 2.82Å; D8-R14 VanDerWaalsContact O-NH2 3.07Å; D8-R14 IonicContact OD1-CZ 2.79Å; D8-R14 IonicContact OD1-NH1 2.82Å; D8-R14 PolarHBondContact OD1-NH1 3.25Å; D8-R14 IonicContact OD1-NH2 3.26Å
9	S	76.1	Confident	74.3	Confident	60 Å²	60	104.9 Å²	104.9	42%	0.42	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-84	-16	-176.5	64.4	0	0	0	0	115.3	A6 P7 S41	A6-S9 PolarHBondContact O-N 3.1Å; A6-S9 PolarHBondContact O-OG 3.36Å; P7-S9 VanDerWaalsContact C-N 3.28Å; P7-S9 PolarHBondContact O-N 3.26Å; S9-S41 WeakPolarHBondContact O-CB 3.15Å; S9-S41 PolarHBondContact O-N 2.92Å; S9-S41 PolarHBondContact O-OG 2.89Å
10	Q	89.7	Confident	75.4	Confident	109 Å²	109	99.8 Å²	99.8	51%	0.509	51%	0.51	S	S	.	.	B	Isolated β-bridge	trans	-93.7	147.1	-175.3	-166.3	164.4	-2.1	0	0	111.5	G12 R14	Q10-G12 PolarHBondContact O-N 3.23Å; Q10-R14 PolarHBondContact O-NH2 3.38Å; Q10-R14 VanDerWaalsContact O-NH2 3.14Å
11	C	95.3	Very high	76.5	Confident	27 Å²	27	99.7 Å²	99.7	18%	0.182	50%	0.504	C	S	.	.	S	Bend	trans	-53.6	123.8	176.7	178.4	0	0	0	0	111.3	S41 C77	C11-S41 PolarHBondContact N-O 2.82Å; C11-C77 WeakPolarHBondContact CA-SG 3.26Å; C11-C77 HydrophobicContact CB-CB 3.64Å; C11-C77 WeakPolarHBondContact CB-SG 3.47Å; C11-C77 WeakPolarHBondContact SG-CA 3.4Å; C11-C77 WeakPolarHBondContact SG-CB 3.04Å; C11-C77 CovalentContact SG-SG 2.04Å; C11-C77 PolarHBondContact SG-SG 2.02Å
12	G	95	Very high	79.4	Confident	20 Å²	20	90.7 Å²	90.7	21%	0.206	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	172.9	179.9	0	0	0	0	0	112.4	Q10 G39	Q10-G12 PolarHBondContact O-N 3.23Å; G12-G39 PolarHBondContact N-O 3.16Å; G12-G39 VanDerWaalsContact N-O 3.08Å; G12-G39 PolarHBondContact O-N 3.11Å; G12-G39 VanDerWaalsContact O-N 3.11Å
13	L	97.3	Very high	82.1	Confident	73 Å²	73	86.1 Å²	86.1	38%	0.382	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	133.5	176.7	-163.4	66.8	0	0	0	110	K36 A102	L13-K36 HydrophobicContact CD1-CB 4.04Å; L13-K36 HydrophobicContact CD2-CD 3.85Å; L13-K36 HydrophobicContact CG-CB 4.27Å; L13-K36 HydrophobicContact CG-CD 4.44Å; L13-A102 HydrophobicContact CD1-CB 3.7Å; L13-A102 WeakPolarHBondContact CD1-O 3.04Å
14	R	96.4	Very high	84.4	Confident	53 Å²	53	78.1 Å²	78.1	20%	0.2	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	158.5	177.8	-52.1	-59.5	173.5	177.1	1.2	108.4	D8 Q10 K36 Y37	D8-R14 PolarHBondContact O-NH2 2.82Å; D8-R14 VanDerWaalsContact O-NH2 3.07Å; D8-R14 IonicContact OD1-CZ 2.79Å; D8-R14 IonicContact OD1-NH1 2.82Å; D8-R14 PolarHBondContact OD1-NH1 3.25Å; D8-R14 IonicContact OD1-NH2 3.26Å; Q10-R14 PolarHBondContact O-NH2 3.38Å; Q10-R14 VanDerWaalsContact O-NH2 3.14Å; R14-K36 CarbonylContact O-C 3.48Å; R14-K36 WeakPolarHBondContact O-CA 3.19Å; R14-K36 WeakPolarHBondContact O-CB 3.47Å; R14-Y37 HydrophobicContact CB-CD1 3.91Å; R14-Y37 HydrophobicContact CB-CD2 4.05Å; R14-Y37 HydrophobicContact CB-CE1 3.53Å; R14-Y37 HydrophobicContact CB-CE2 3.69Å; R14-Y37 HydrophobicContact CB-CG 4.15Å; R14-Y37 VanDerWaalsContact CB-CZ 3.41Å; R14-Y37 WeakPolarHBondContact CB-O 3.35Å; R14-Y37 HydrophobicContact CG-CD2 4.43Å; R14-Y37 HydrophobicContact CG-CE2 3.99Å; R14-Y37 PolarHBondContact N-O 2.92Å; R14-Y37 PolarHBondContact O-N 2.87Å
15	S	96.9	Very high	86.9	Confident	75 Å²	75	71.1 Å²	71.1	52%	0.524	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	149.6	177.4	58.7	0	0	0	0	111.5	F35	S15-F35 CarbonylContact C-O 3.55Å; S15-F35 VanDerWaalsContact CA-O 3.3Å; S15-F35 WeakPolarHBondContact CA-O 3.44Å
16	V	97.5	Very high	89.3	Confident	58 Å²	58	70.1 Å²	70.1	35%	0.352	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	140.4	177.5	58.7	0	0	0	0	109	L18 F35 Y37	V16-L18 HydrophobicContact CG1-CD2 3.8Å; V16-F35 HydrophobicContact CG1-CB 4.22Å; V16-F35 HydrophobicContact CG1-CD1 4.2Å; V16-F35 PolarHBondContact N-O 3.09Å; V16-F35 PolarHBondContact O-N 2.68Å; V16-Y37 HydrophobicContact CB-CE1 4.37Å; V16-Y37 HydrophobicContact CG1-CD1 4.28Å; V16-Y37 HydrophobicContact CG1-CE1 4.04Å
17	L	98.3	Very high	91.6	Very high	119 Å²	119	70.8 Å²	70.8	62%	0.623	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	128.2	169.6	-70.4	169.6	0	0	0	108.4	T32 V33 L34	L17-T32 HydrophobicContact CB-CG2 3.98Å; L17-T32 HydrophobicContact CD2-CG2 4.17Å; L17-V33 WeakPolarHBondContact CA-O 3.41Å; L17-L34 HydrophobicContact CD2-CB 4.01Å; L17-L34 HydrophobicContact CD2-CD1 3.77Å; L17-L34 HydrophobicContact CG-CD1 4.06Å
18	L	97.5	Very high	93.8	Very high	39 Å²	39	69.6 Å²	69.6	20%	0.204	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	161.4	178.9	54.9	84.8	0	0	0	110.3	V16 L23 T32 V33 F35	V16-L18 HydrophobicContact CG1-CD2 3.8Å; L18-L23 HydrophobicContact CD1-CD2 3.57Å; L18-L23 HydrophobicContact CD1-CG 3.75Å; L18-T32 WeakPolarHBondContact O-CA 3.3Å; L18-V33 HydrophobicContact CD1-CG2 4.1Å; L18-V33 PolarHBondContact N-O 3.25Å; L18-V33 VanDerWaalsContact N-O 3.17Å; L18-V33 PolarHBondContact O-N 3.09Å; L18-F35 HydrophobicContact CD2-CB 3.96Å; L18-F35 HydrophobicContact CD2-CD1 4.48Å; L18-F35 HydrophobicContact CD2-CG 4.43Å; L18-F35 HydrophobicContact CG-CB 4.25Å
19	Q	98.1	Very high	95.7	Very high	69 Å²	69	64.4 Å²	64.4	32%	0.322	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	148.2	175.5	-64.1	177.2	48.3	0	0	110.2	R21 D22 D30 E31	Q19-R21 HydrophobicContact CB-CG 3.9Å; Q19-R21 PolarHBondContact O-N 3.08Å; Q19-D22 PolarHBondContact N-OD2 3.4Å; Q19-D22 WeakPolarHBondContact O-CB 3.24Å; Q19-D22 PolarHBondContact O-N 3.4Å; Q19-D30 PolarHBondContact OE1-OD1 2.74Å; Q19-E31 WeakPolarHBondContact CA-O 3.23Å
20	V	98.1	Very high	96.7	Very high	1 Å²	1	65.2 Å²	65.2	1%	0.006	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-56.5	-37.1	-180	167.1	0	0	0	0	112.4	D22 L23 Y27 E31 V33 F87	V20-D22 PolarHBondContact O-N 3.41Å; V20-L23 HydrophobicContact CG1-CD1 4.38Å; V20-L23 VanDerWaalsContact O-CB 3.24Å; V20-L23 WeakPolarHBondContact O-CB 3.37Å; V20-L23 WeakPolarHBondContact O-CG 3.49Å; V20-L23 PolarHBondContact O-N 3.31Å; V20-L23 VanDerWaalsContact O-N 3.11Å; V20-Y27 HydrophobicContact CG1-CG 4.49Å; V20-E31 HydrophobicContact CG2-CB 4.36Å; V20-E31 WeakPolarHBondContact CG2-O 3.45Å; V20-E31 PolarHBondContact N-O 2.91Å; V20-V33 HydrophobicContact CG2-CG1 3.7Å; V20-V33 HydrophobicContact CG2-CG2 4.01Å; V20-F87 HydrophobicContact CB-CD2 4.39Å; V20-F87 HydrophobicContact CG1-CD1 4.25Å; V20-F87 HydrophobicContact CG1-CD2 3.77Å; V20-F87 HydrophobicContact CG1-CE1 4.01Å; V20-F87 HydrophobicContact CG1-CE2 3.52Å; V20-F87 HydrophobicContact CG1-CG 4.15Å; V20-F87 HydrophobicContact CG1-CZ 3.65Å; V20-F87 HydrophobicContact CG2-CB 3.88Å; V20-F87 HydrophobicContact CG2-CD1 3.89Å; V20-F87 HydrophobicContact CG2-CD2 3.92Å; V20-F87 HydrophobicContact CG2-CE1 4.43Å; V20-F87 HydrophobicContact CG2-CE2 4.47Å; V20-F87 HydrophobicContact CG2-CG 3.61Å
21	R	97.8	Very high	97.1	Very high	99 Å²	99	63.3 Å²	63.3	37%	0.374	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-58.6	-29.6	175.4	61.2	-176.7	55	-170.2	-6.3	114.1	Q19 L23 G24 D28 S29 D30 N90	Q19-R21 HydrophobicContact CB-CG 3.9Å; Q19-R21 PolarHBondContact O-N 3.08Å; R21-L23 PolarHBondContact O-N 2.91Å; R21-G24 PolarHBondContact O-N 3.34Å; R21-D28 IonicContact CZ-OD1 2.9Å; R21-D28 IonicContact NH2-OD1 2.96Å; R21-D28 PolarHBondContact NH2-OD1 2.77Å; R21-S29 PolarHBondContact N-O 3.45Å; R21-S29 PolarHBondContact NE-O 2.96Å; R21-D30 IonicContact CZ-OD1 3.73Å; R21-D30 IonicContact CZ-OD2 3.92Å; R21-D30 IonicContact NE-OD1 2.62Å; R21-D30 PolarHBondContact NE-OD1 3.13Å; R21-D30 IonicContact NH1-OD1 3.46Å; R21-D30 PolarHBondContact NH1-OD1 2.9Å; R21-D30 VanDerWaalsContact NH1-OD1 3.1Å; R21-D30 IonicContact NH2-OD1 3.73Å; R21-D30 PolarHBondContact NH2-OD1 3.23Å; R21-D30 IonicContact NH2-OD2 2.77Å; R21-D30 PolarHBondContact NH2-OD2 2.8Å; R21-N90 PolarHBondContact NH2-ND2 3.1Å
22	D	97.4	Very high	97.2	Very high	109 Å²	109	66 Å²	66	58%	0.583	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-75.6	-12.3	-179.3	-58.5	-34.4	0	0	0	112.4	Q19 V20 G24	Q19-D22 PolarHBondContact N-OD2 3.4Å; Q19-D22 WeakPolarHBondContact O-CB 3.24Å; Q19-D22 PolarHBondContact O-N 3.4Å; V20-D22 PolarHBondContact O-N 3.41Å; D22-G24 PolarHBondContact O-N 3.4Å
23	L	96.3	Very high	97.4	Very high	36 Å²	36	65.5 Å²	65.5	19%	0.188	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-69.2	-15.6	174.8	-65	168.8	0	0	0	112.9	L18 V20 R21 L25 F35 M85 L100	L18-L23 HydrophobicContact CD1-CD2 3.57Å; L18-L23 HydrophobicContact CD1-CG 3.75Å; V20-L23 HydrophobicContact CG1-CD1 4.38Å; V20-L23 VanDerWaalsContact O-CB 3.24Å; V20-L23 WeakPolarHBondContact O-CB 3.37Å; V20-L23 WeakPolarHBondContact O-CG 3.49Å; V20-L23 PolarHBondContact O-N 3.31Å; V20-L23 VanDerWaalsContact O-N 3.11Å; R21-L23 PolarHBondContact O-N 2.91Å; L23-L25 HydrophobicContact CB-CD1 4.22Å; L23-L25 HydrophobicContact CB-CG 4.1Å; L23-L25 HydrophobicContact CD1-CD1 4.45Å; L23-L25 PolarHBondContact O-N 2.9Å; L23-F35 HydrophobicContact CD2-CD2 4.19Å; L23-M85 HydrophobicContact CD1-SD 4.37Å; L23-L100 HydrophobicContact CD1-CD2 3.94Å
24	G	96.7	Very high	97.4	Very high	69 Å²	69	65.9 Å²	65.9	71%	0.711	38%	0.376	S	S	*	.			trans	69.2	18.4	179.3	0	0	0	0	0	114.5	R21 D22	R21-G24 PolarHBondContact O-N 3.34Å; D22-G24 PolarHBondContact O-N 3.4Å
25	L	96.9	Very high	97.5	Very high	86 Å²	86	65.7 Å²	65.7	45%	0.45	38%	0.377	S	S	.	.	S	Bend	trans	-89.5	1.4	-179.1	-64.2	177.9	0	0	0	113.8	L23 Y27 V97 L100	L23-L25 HydrophobicContact CB-CD1 4.22Å; L23-L25 HydrophobicContact CB-CG 4.1Å; L23-L25 HydrophobicContact CD1-CD1 4.45Å; L23-L25 PolarHBondContact O-N 2.9Å; L25-Y27 HydrophobicContact CB-CD2 3.71Å; L25-Y27 HydrophobicContact CB-CE2 3.86Å; L25-Y27 HydrophobicContact CD1-CE2 4.38Å; L25-V97 HydrophobicContact CD1-CG1 4.34Å; L25-L100 HydrophobicContact CD1-CD1 3.93Å; L25-L100 HydrophobicContact CD1-CD2 4.1Å
26	G	97	Very high	97.6	Very high	78 Å²	78	64.6 Å²	64.6	80%	0.804	36%	0.362	S	S	*	.	S	Bend	trans	83.8	7.8	178.2	0	0	0	0	0	115.5
27	Y	97.2	Very high	97.6	Very high	71 Å²	71	66.8 Å²	66.8	28%	0.278	37%	0.365	S	S	.	.			trans	-81.5	129.8	173	-63.5	-75.7	0	0	0	111.2	V20 L25 S29 F87 H95 V97	V20-Y27 HydrophobicContact CG1-CG 4.49Å; L25-Y27 HydrophobicContact CB-CD2 3.71Å; L25-Y27 HydrophobicContact CB-CE2 3.86Å; L25-Y27 HydrophobicContact CD1-CE2 4.38Å; Y27-S29 PolarHBondContact O-N 2.96Å; Y27-F87 AromaticContact CD1-CE2 3.96Å; Y27-F87 HydrophobicContact CD1-CE2 3.96Å; Y27-F87 AromaticContact CD1-CZ 3.88Å; Y27-F87 HydrophobicContact CD1-CZ 3.88Å; Y27-F87 HydrophobicContact CD2-CE1 4.49Å; Y27-F87 HydrophobicContact CD2-CE2 4.27Å; Y27-F87 AromaticContact CD2-CZ 3.56Å; Y27-F87 HydrophobicContact CD2-CZ 3.56Å; Y27-F87 HydrophobicContact CE1-CZ 4.14Å; Y27-F87 AromaticContact CE2-CZ 3.85Å; Y27-F87 HydrophobicContact CE2-CZ 3.85Å; Y27-F87 AromaticContact CG-CE2 3.82Å; Y27-F87 HydrophobicContact CG-CE2 3.82Å; Y27-F87 AromaticContact CG-CZ 3.58Å; Y27-F87 HydrophobicContact CG-CZ 3.58Å; Y27-H95 HydrophobicContact CE1-CB 4.16Å; Y27-H95 AromaticContact CE1-CG 3.77Å; Y27-H95 AromaticContact CE1-ND1 3.51Å; Y27-V97 HydrophobicContact CE2-CG2 3.77Å
28	D	97.3	Very high	97.5	Very high	101 Å²	101	62.1 Å²	62.1	54%	0.54	34%	0.342	S	S	.	.			trans	-89.3	92.8	167.8	-177.9	20.1	0	0	0	109.9	R21 N90	R21-D28 IonicContact CZ-OD1 2.9Å; R21-D28 IonicContact NH2-OD1 2.96Å; R21-D28 PolarHBondContact NH2-OD1 2.77Å; D28-N90 PolarHBondContact O-N 3.22Å; D28-N90 VanDerWaalsContact O-N 3.09Å; D28-N90 PolarHBondContact OD1-ND2 3.11Å; D28-N90 VanDerWaalsContact OD1-ND2 3.09Å
29	S	97.9	Very high	97.4	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.007	34%	0.341	C	S	.	.			trans	-144.4	135.2	177.3	174	0	0	0	0	109.7	R21 Y27 E31 L88	R21-S29 PolarHBondContact N-O 3.45Å; R21-S29 PolarHBondContact NE-O 2.96Å; Y27-S29 PolarHBondContact O-N 2.96Å; S29-E31 VanDerWaalsContact C-N 3.35Å; S29-E31 WeakPolarHBondContact OG-CB 3.37Å; S29-E31 PolarHBondContact OG-N 3.24Å; S29-E31 VanDerWaalsContact OG-N 3.13Å; S29-L88 PolarHBondContact OG-O 3.27Å
30	D	96.4	Very high	97.1	Very high	77 Å²	77	59.8 Å²	59.8	41%	0.412	35%	0.346	S	S	.	.			trans	-91.1	3.1	171	-69.1	-64.7	0	0	0	112.5	Q19 R21 T32 N90	Q19-D30 PolarHBondContact OE1-OD1 2.74Å; R21-D30 IonicContact CZ-OD1 3.73Å; R21-D30 IonicContact CZ-OD2 3.92Å; R21-D30 IonicContact NE-OD1 2.62Å; R21-D30 PolarHBondContact NE-OD1 3.13Å; R21-D30 IonicContact NH1-OD1 3.46Å; R21-D30 PolarHBondContact NH1-OD1 2.9Å; R21-D30 VanDerWaalsContact NH1-OD1 3.1Å; R21-D30 IonicContact NH2-OD1 3.73Å; R21-D30 PolarHBondContact NH2-OD1 3.23Å; R21-D30 IonicContact NH2-OD2 2.77Å; R21-D30 PolarHBondContact NH2-OD2 2.8Å; D30-T32 PolarHBondContact O-N 2.99Å; D30-N90 PolarHBondContact N-OD1 3.21Å; D30-N90 PolarHBondContact OD2-ND2 2.89Å; D30-N90 PolarHBondContact OD2-OD1 3.17Å
31	E	97.8	Very high	96.8	Very high	68 Å²	68	62.5 Å²	62.5	32%	0.318	37%	0.365	S	S	.	.			trans	-63.9	133.6	178.5	-170.6	169.7	162.3	0	0	110.7	Q19 V20 S29 V33 F87 L88	Q19-E31 WeakPolarHBondContact CA-O 3.23Å; V20-E31 HydrophobicContact CG2-CB 4.36Å; V20-E31 WeakPolarHBondContact CG2-O 3.45Å; V20-E31 PolarHBondContact N-O 2.91Å; S29-E31 VanDerWaalsContact C-N 3.35Å; S29-E31 WeakPolarHBondContact OG-CB 3.37Å; S29-E31 PolarHBondContact OG-N 3.24Å; S29-E31 VanDerWaalsContact OG-N 3.13Å; E31-V33 HydrophobicContact CG-CG1 4.49Å; E31-F87 HydrophobicContact CB-CB 4.49Å; E31-F87 HydrophobicContact CG-CB 4.47Å; E31-F87 WeakPolarHBondContact OE2-CA 3.49Å; E31-L88 WeakPolarHBondContact OE2-CB 3.37Å; E31-L88 PolarHBondContact OE2-N 3.44Å
32	T	98.3	Very high	96.5	Very high	83 Å²	83	58 Å²	58	51%	0.509	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	123.2	175	-59.6	0	0	0	0	109.7	L17 L18 D30	L17-T32 HydrophobicContact CB-CG2 3.98Å; L17-T32 HydrophobicContact CD2-CG2 4.17Å; L18-T32 WeakPolarHBondContact O-CA 3.3Å; D30-T32 PolarHBondContact O-N 2.99Å
33	V	97.8	Very high	95.9	Very high	10 Å²	10	56.4 Å²	56.4	6%	0.061	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	150.3	-178.5	-67.3	0	0	0	0	110.8	L17 L18 V20 E31 F35 M85 F87	L17-V33 WeakPolarHBondContact CA-O 3.41Å; L18-V33 HydrophobicContact CD1-CG2 4.1Å; L18-V33 PolarHBondContact N-O 3.25Å; L18-V33 VanDerWaalsContact N-O 3.17Å; L18-V33 PolarHBondContact O-N 3.09Å; V20-V33 HydrophobicContact CG2-CG1 3.7Å; V20-V33 HydrophobicContact CG2-CG2 4.01Å; E31-V33 HydrophobicContact CG-CG1 4.49Å; V33-F35 PolarHBondContact O-N 3.3Å; V33-M85 HydrophobicContact CB-CE 3.87Å; V33-M85 HydrophobicContact CB-SD 3.67Å; V33-M85 HydrophobicContact CG1-CG 4.4Å; V33-M85 HydrophobicContact CG1-SD 3.94Å; V33-M85 HydrophobicContact CG2-CE 3.94Å; V33-M85 HydrophobicContact CG2-SD 3.56Å; V33-M85 VanDerWaalsContact CG2-SD 3.56Å; V33-F87 HydrophobicContact CG1-CB 4.21Å
34	L	98.1	Very high	95.3	Very high	81 Å²	81	65 Å²	65	42%	0.424	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	106.5	171.4	-173.2	72.5	0	0	0	109.4	L17 M85	L17-L34 HydrophobicContact CD2-CB 4.01Å; L17-L34 HydrophobicContact CD2-CD1 3.77Å; L17-L34 HydrophobicContact CG-CD1 4.06Å; L34-M85 WeakPolarHBondContact O-CE 3.44Å
35	F	98.3	Very high	94.7	Very high	50 Å²	50	63.8 Å²	63.8	22%	0.219	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125	175	-178	-105.4	0	0	0	110.3	S15 V16 L18 L23 V33 Y37 L100	S15-F35 CarbonylContact C-O 3.55Å; S15-F35 VanDerWaalsContact CA-O 3.3Å; S15-F35 WeakPolarHBondContact CA-O 3.44Å; V16-F35 HydrophobicContact CG1-CB 4.22Å; V16-F35 HydrophobicContact CG1-CD1 4.2Å; V16-F35 PolarHBondContact N-O 3.09Å; V16-F35 PolarHBondContact O-N 2.68Å; L18-F35 HydrophobicContact CD2-CB 3.96Å; L18-F35 HydrophobicContact CD2-CD1 4.48Å; L18-F35 HydrophobicContact CD2-CG 4.43Å; L18-F35 HydrophobicContact CG-CB 4.25Å; L23-F35 HydrophobicContact CD2-CD2 4.19Å; V33-F35 PolarHBondContact O-N 3.3Å; F35-Y37 HydrophobicContact CD1-CD1 4.33Å; F35-L100 HydrophobicContact CE2-CD1 4.43Å; F35-L100 HydrophobicContact CE2-CG 4.31Å; F35-L100 VanDerWaalsContact CE2-O 3.26Å; F35-L100 WeakPolarHBondContact CE2-O 3.19Å
36	K	98.3	Very high	94.3	Very high	51 Å²	51	65.4 Å²	65.4	22%	0.222	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	139.7	175.2	-51.8	-179.5	-163.9	141.4	0	110.8	L13 R14 E83 S101 A102	L13-K36 HydrophobicContact CD1-CB 4.04Å; L13-K36 HydrophobicContact CD2-CD 3.85Å; L13-K36 HydrophobicContact CG-CB 4.27Å; L13-K36 HydrophobicContact CG-CD 4.44Å; R14-K36 CarbonylContact O-C 3.48Å; R14-K36 WeakPolarHBondContact O-CA 3.19Å; R14-K36 WeakPolarHBondContact O-CB 3.47Å; K36-E83 VanDerWaalsContact CD-OE1 3.25Å; K36-E83 WeakPolarHBondContact CD-OE1 3.26Å; K36-E83 WeakPolarHBondContact CE-OE1 3.46Å; K36-E83 IonicContact NZ-OE1 2.77Å; K36-E83 PolarHBondContact NZ-OE1 2.94Å; K36-E83 IonicContact NZ-OE2 3.38Å; K36-E83 PolarHBondContact NZ-OE2 3.48Å; K36-S101 VanDerWaalsContact CB-OG 3.29Å; K36-S101 WeakPolarHBondContact CB-OG 3.43Å; K36-S101 PolarHBondContact N-OG 3.16Å; K36-A102 VanDerWaalsContact CB-O 3.22Å; K36-A102 WeakPolarHBondContact CB-O 3.3Å; K36-A102 WeakPolarHBondContact O-CB 3.48Å; K36-A102 PolarHBondContact O-N 2.85Å
37	Y	97.6	Very high	94	Very high	104 Å²	104	64.2 Å²	64.2	41%	0.408	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	162.1	-178.2	66.8	-80.5	0	0	0	111.3	R14 V16 F35	R14-Y37 HydrophobicContact CB-CD1 3.91Å; R14-Y37 HydrophobicContact CB-CD2 4.05Å; R14-Y37 HydrophobicContact CB-CE1 3.53Å; R14-Y37 HydrophobicContact CB-CE2 3.69Å; R14-Y37 HydrophobicContact CB-CG 4.15Å; R14-Y37 VanDerWaalsContact CB-CZ 3.41Å; R14-Y37 WeakPolarHBondContact CB-O 3.35Å; R14-Y37 HydrophobicContact CG-CD2 4.43Å; R14-Y37 HydrophobicContact CG-CE2 3.99Å; R14-Y37 PolarHBondContact N-O 2.92Å; R14-Y37 PolarHBondContact O-N 2.87Å; V16-Y37 HydrophobicContact CB-CE1 4.37Å; V16-Y37 HydrophobicContact CG1-CD1 4.28Å; V16-Y37 HydrophobicContact CG1-CE1 4.04Å; F35-Y37 HydrophobicContact CD1-CD1 4.33Å
38	C	97.1	Very high	93.8	Very high	22 Å²	22	67.2 Å²	67.2	15%	0.149	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.7	177.1	-64.4	0	0	0	0	110.9	P79 C105	C38-P79 HydrophobicContact CB-CG 4.27Å; C38-P79 WeakPolarHBondContact SG-CA 3.26Å; C38-P79 VanDerWaalsContact SG-N 3.39Å; C38-C105 WeakPolarHBondContact CA-SG 3.32Å; C38-C105 HydrophobicContact CB-CB 3.8Å; C38-C105 WeakPolarHBondContact CB-SG 3.3Å; C38-C105 VanDerWaalsContact SG-CA 3.55Å; C38-C105 WeakPolarHBondContact SG-CB 3.45Å; C38-C105 CovalentContact SG-SG 2.03Å; C38-C105 PolarHBondContact SG-SG 3.3Å
39	G	94.7	Very high	93.6	Very high	18 Å²	18	70.1 Å²	70.1	19%	0.186	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	151.2	179.9	0	0	0	0	0	112.8	G12	G12-G39 PolarHBondContact N-O 3.16Å; G12-G39 VanDerWaalsContact N-O 3.08Å; G12-G39 PolarHBondContact O-N 3.11Å; G12-G39 VanDerWaalsContact O-N 3.11Å
40	G	92.4	Very high	93.2	Very high	41 Å²	41	71 Å²	71	42%	0.423	37%	0.367	S	S	.	.	S	Bend	trans	122.3	-179.2	-179.3	0	0	0	0	0	112.7
41	S	90.6	Very high	93	Very high	57 Å²	57	70.8 Å²	70.8	40%	0.399	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-104.9	157.1	-176.7	69.2	0	0	0	0	112.7	S9 C11 P43	S9-S41 WeakPolarHBondContact O-CB 3.15Å; S9-S41 PolarHBondContact O-N 2.92Å; S9-S41 PolarHBondContact O-OG 2.89Å; C11-S41 PolarHBondContact N-O 2.82Å; S41-P43 WeakPolarHBondContact O-CD 3.3Å; S41-P43 WeakPolarHBondContact OG-CD 3.29Å
42	C	92.4	Very high	92.8	Very high	4 Å²	4	71.1 Å²	71.1	3%	0.027	37%	0.372	C	S	.	.			trans	-119.5	52.8	-178.2	-71.2	0	0	0	0	113.3	R44 A45 P75 C107	C42-R44 PolarHBondContact O-N 2.89Å; C42-A45 HydrophobicContact CB-CB 4.31Å; C42-A45 PolarHBondContact O-N 2.91Å; C42-P75 HydrophobicContact CB-CB 4.31Å; C42-P75 VanDerWaalsContact CB-O 3.26Å; C42-P75 WeakPolarHBondContact CB-O 3.2Å; C42-C107 VanDerWaalsContact CA-SG 3.59Å; C42-C107 HydrophobicContact CB-CB 3.64Å; C42-C107 WeakPolarHBondContact CB-SG 3.49Å; C42-C107 WeakPolarHBondContact SG-CA 3.22Å; C42-C107 WeakPolarHBondContact SG-CB 3.48Å; C42-C107 CovalentContact SG-SG 2.02Å; C42-C107 PolarHBondContact SG-SG 3.06Å
43	P	84.1	Confident	92.5	Very high	77 Å²	77	68.7 Å²	68.7	50%	0.5	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-24.3	-173.5	27.6	-35.1	0	0	0	113.4	S41	S41-P43 WeakPolarHBondContact O-CD 3.3Å; S41-P43 WeakPolarHBondContact OG-CD 3.29Å
44	R	83.9	Confident	92.2	Very high	216 Å²	216	68.8 Å²	68.8	82%	0.815	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-4.6	-175.9	-60.5	-177.2	-171.8	166.3	3.8	114.3	C42	C42-R44 PolarHBondContact O-N 2.89Å
45	A	84	Confident	92	Very high	43 Å²	43	69.8 Å²	69.8	36%	0.355	36%	0.363	S	S	.	.			trans	-100.3	13.2	-175.8	0	0	0	0	0	113.3	C42 S47 P75 C107	C42-A45 HydrophobicContact CB-CB 4.31Å; C42-A45 PolarHBondContact O-N 2.91Å; A45-S47 PolarHBondContact O-N 2.99Å; A45-P75 HydrophobicContact CB-CG 4.2Å; A45-P75 WeakPolarHBondContact O-CG 3.27Å; A45-C107 HydrophobicContact CB-CB 3.46Å; A45-C107 VanDerWaalsContact CB-CB 3.46Å
46	R	88.4	Confident	91.7	Very high	121 Å²	121	70.1 Å²	70.1	46%	0.457	37%	0.367	S	S	.	.			trans	-65.1	124.5	-177.8	-66.8	-177.4	178	-171.3	-6.8	111.1	D50 L51 V74	R46-D50 HydrophobicContact CB-CB 4.25Å; R46-L51 HydrophobicContact CB-CD2 4.33Å; R46-L51 HydrophobicContact CB-CG 4.43Å; R46-V74 HydrophobicContact CG-CG1 4.02Å
47	S	91	Very high	91.4	Very high	52 Å²	52	68.7 Å²	68.7	36%	0.364	36%	0.361	S	S	.	.			trans	-82.1	169.2	170.9	68.8	0	0	0	0	112	A45 Y49 D50 L51	A45-S47 PolarHBondContact O-N 2.99Å; S47-Y49 PolarHBondContact O-N 2.78Å; S47-Y49 PolarHBondContact OG-N 3.07Å; S47-D50 WeakPolarHBondContact CB-OD2 3.2Å; S47-D50 PolarHBondContact N-OD2 3.08Å; S47-D50 WeakPolarHBondContact O-CB 3.39Å; S47-D50 PolarHBondContact O-N 3.07Å; S47-D50 PolarHBondContact OG-N 2.62Å; S47-D50 VanDerWaalsContact OG-N 3.14Å; S47-D50 PolarHBondContact OG-OD2 3.08Å; S47-L51 WeakPolarHBondContact O-CG 3.25Å; S47-L51 PolarHBondContact O-N 2.96Å
48	N	93.6	Very high	91	Very high	135 Å²	135	70.9 Å²	70.9	72%	0.722	38%	0.379	S	S	*	.	H	α-helix	trans	-60.1	-32.3	170.9	-73.4	-17.2	0	0	0	112.1	T52	N48-T52 VanDerWaalsContact O-CB 3.3Å; N48-T52 WeakPolarHBondContact O-CB 3.45Å; N48-T52 PolarHBondContact O-N 3.29Å; N48-T52 PolarHBondContact O-OG1 3.15Å
49	Y	91.8	Very high	90.9	Very high	161 Å²	161	72.5 Å²	72.5	63%	0.631	39%	0.391	S	S	*	.	H	α-helix	trans	-62.2	-50.2	173.8	173.4	-94.9	0	0	0	110.7	S47 L51 T52 L53	S47-Y49 PolarHBondContact O-N 2.78Å; S47-Y49 PolarHBondContact OG-N 3.07Å; Y49-L51 VanDerWaalsContact C-N 3.33Å; Y49-L51 PolarHBondContact O-N 3.35Å; Y49-T52 PolarHBondContact O-N 3.16Å; Y49-T52 VanDerWaalsContact O-N 3.16Å; Y49-L53 HydrophobicContact CE1-CD2 3.92Å; Y49-L53 VanDerWaalsContact O-CB 3.29Å; Y49-L53 WeakPolarHBondContact O-CB 3.17Å; Y49-L53 PolarHBondContact O-N 3.15Å
50	D	91.5	Very high	90.8	Very high	20 Å²	20	74.2 Å²	74.2	11%	0.107	41%	0.408	C	S	.	.	H	α-helix	trans	-58	-44.5	179.1	-64.6	-32.9	0	0	0	112.4	R46 S47 S54 S73	R46-D50 HydrophobicContact CB-CB 4.25Å; S47-D50 WeakPolarHBondContact CB-OD2 3.2Å; S47-D50 PolarHBondContact N-OD2 3.08Å; S47-D50 WeakPolarHBondContact O-CB 3.39Å; S47-D50 PolarHBondContact O-N 3.07Å; S47-D50 PolarHBondContact OG-N 2.62Å; S47-D50 VanDerWaalsContact OG-N 3.14Å; S47-D50 PolarHBondContact OG-OD2 3.08Å; D50-S54 VanDerWaalsContact O-CB 3.32Å; D50-S54 WeakPolarHBondContact O-CB 3.46Å; D50-S54 PolarHBondContact O-N 2.84Å; D50-S54 PolarHBondContact O-OG 3.35Å; D50-S73 WeakPolarHBondContact CB-O 3.47Å
51	L	92.1	Very high	90.9	Very high	73 Å²	73	81.1 Å²	81.1	38%	0.382	42%	0.422	S	S	.	.	H	α-helix	trans	-64	-45.9	176.4	-66.4	174.2	0	0	0	111.5	R46 S47 Y49 S54 N55	R46-L51 HydrophobicContact CB-CD2 4.33Å; R46-L51 HydrophobicContact CB-CG 4.43Å; S47-L51 WeakPolarHBondContact O-CG 3.25Å; S47-L51 PolarHBondContact O-N 2.96Å; Y49-L51 VanDerWaalsContact C-N 3.33Å; Y49-L51 PolarHBondContact O-N 3.35Å; L51-S54 WeakPolarHBondContact O-CB 2.92Å; L51-S54 PolarHBondContact O-N 2.91Å; L51-N55 VanDerWaalsContact O-CG 3.26Å; L51-N55 PolarHBondContact O-N 2.67Å; L51-N55 PolarHBondContact O-ND2 2.92Å
52	T	93.6	Very high	90.9	Very high	75 Å²	75	81.3 Å²	81.3	46%	0.46	42%	0.418	S	S	.	.	H	α-helix	trans	-64.4	-47.9	179.6	-58.7	0	0	0	0	110.9	N48 Y49 S54 N55 L56	N48-T52 VanDerWaalsContact O-CB 3.3Å; N48-T52 WeakPolarHBondContact O-CB 3.45Å; N48-T52 PolarHBondContact O-N 3.29Å; N48-T52 PolarHBondContact O-OG1 3.15Å; Y49-T52 PolarHBondContact O-N 3.16Å; Y49-T52 VanDerWaalsContact O-N 3.16Å; T52-S54 VanDerWaalsContact C-N 3.34Å; T52-S54 PolarHBondContact O-N 2.71Å; T52-N55 PolarHBondContact O-N 2.81Å; T52-N55 VanDerWaalsContact O-N 3.13Å; T52-L56 HydrophobicContact CG2-CD1 3.88Å; T52-L56 HydrophobicContact CG2-CG 4.18Å; T52-L56 WeakPolarHBondContact O-CG 3.48Å; T52-L56 PolarHBondContact O-N 2.03Å
53	L	91.8	Very high	90.8	Very high	31 Å²	31	86.5 Å²	86.5	16%	0.162	45%	0.452	C	S	.	.	H	α-helix	trans	-59.8	-45.4	178.8	-175.8	67.5	0	0	0	111.1	Y49 N55 L56 L57 L62 W71	Y49-L53 HydrophobicContact CE1-CD2 3.92Å; Y49-L53 VanDerWaalsContact O-CB 3.29Å; Y49-L53 WeakPolarHBondContact O-CB 3.17Å; Y49-L53 PolarHBondContact O-N 3.15Å; L53-N55 VanDerWaalsContact C-N 3.33Å; L53-N55 PolarHBondContact O-N 3.08Å; L53-L56 PolarHBondContact O-N 2.04Å; L53-L57 HydrophobicContact CD1-CD1 4.2Å; L53-L57 HydrophobicContact CG-CD1 4.12Å; L53-L57 PolarHBondContact O-N 3.11Å; L53-L62 HydrophobicContact CD1-CD1 3.55Å; L53-W71 HydrophobicContact CD2-CZ2 3.79Å; L53-W71 HydrophobicContact CG-CZ2 3.82Å
54	S	90.9	Very high	90.9	Very high	12 Å²	12	90.4 Å²	90.4	8%	0.084	46%	0.463	C	S	.	.	H	α-helix	trans	-53.3	-49.2	172.5	-57.6	0	0	0	0	112	D50 L51 T52 L58 S73	D50-S54 VanDerWaalsContact O-CB 3.32Å; D50-S54 WeakPolarHBondContact O-CB 3.46Å; D50-S54 PolarHBondContact O-N 2.84Å; D50-S54 PolarHBondContact O-OG 3.35Å; L51-S54 WeakPolarHBondContact O-CB 2.92Å; L51-S54 PolarHBondContact O-N 2.91Å; T52-S54 VanDerWaalsContact C-N 3.34Å; T52-S54 PolarHBondContact O-N 2.71Å; S54-L58 WeakPolarHBondContact O-CB 3.4Å; S54-L58 VanDerWaalsContact O-CG 3.25Å; S54-L58 WeakPolarHBondContact O-CG 3.03Å; S54-L58 PolarHBondContact O-N 2.8Å; S54-S73 WeakPolarHBondContact OG-CB 3.48Å; S54-S73 PolarHBondContact OG-OG 3.34Å
55	N	93	Very high	90.9	Very high	103 Å²	103	82.4 Å²	82.4	55%	0.551	44%	0.439	S	S	*	.	H	α-helix	trans	-68	-40.1	-178.2	-71.6	-21.9	0	0	0	112.7	L51 T52 L53 S59	L51-N55 VanDerWaalsContact O-CG 3.26Å; L51-N55 PolarHBondContact O-N 2.67Å; L51-N55 PolarHBondContact O-ND2 2.92Å; T52-N55 PolarHBondContact O-N 2.81Å; T52-N55 VanDerWaalsContact O-N 3.13Å; L53-N55 VanDerWaalsContact C-N 3.33Å; L53-N55 PolarHBondContact O-N 3.08Å; N55-S59 VanDerWaalsContact O-CB 3.3Å; N55-S59 WeakPolarHBondContact O-CB 3.02Å; N55-S59 PolarHBondContact O-N 3.24Å; N55-S59 PolarHBondContact O-OG 3.14Å
56	L	93.4	Very high	90.9	Very high	57 Å²	57	83 Å²	83	30%	0.298	44%	0.444	S	S	.	.	H	α-helix	trans	-66.8	-37.7	-180	-69.9	178	0	0	0	111.9	T52 L53 S59 G60 R61 L62	T52-L56 HydrophobicContact CG2-CD1 3.88Å; T52-L56 HydrophobicContact CG2-CG 4.18Å; T52-L56 WeakPolarHBondContact O-CG 3.48Å; T52-L56 PolarHBondContact O-N 2.03Å; L53-L56 PolarHBondContact O-N 2.04Å; L56-S59 WeakPolarHBondContact CA-OG 3.38Å; L56-S59 PolarHBondContact O-OG 3.23Å; L56-G60 PolarHBondContact O-N 2.77Å; L56-R61 HydrophobicContact CB-CB 4.48Å; L56-R61 HydrophobicContact CD2-CB 4.02Å; L56-R61 PolarHBondContact O-N 3.4Å; L56-L62 HydrophobicContact CB-CD1 3.62Å; L56-L62 HydrophobicContact CB-CG 3.87Å; L56-L62 HydrophobicContact CD1-CD1 4.09Å; L56-L62 HydrophobicContact CD1-CG 4.47Å; L56-L62 PolarHBondContact O-N 3.32Å
57	L	90.8	Very high	90.7	Very high	20 Å²	20	84 Å²	84	11%	0.105	47%	0.466	C	S	.	.	H	α-helix	trans	-70.7	-45.2	174.5	-78.1	160.9	0	0	0	112.6	L53 S59 G60 L62 P63 W71	L53-L57 HydrophobicContact CD1-CD1 4.2Å; L53-L57 HydrophobicContact CG-CD1 4.12Å; L53-L57 PolarHBondContact O-N 3.11Å; L57-S59 PolarHBondContact O-N 2.78Å; L57-G60 PolarHBondContact O-N 2.84Å; L57-L62 HydrophobicContact CD2-CB 3.76Å; L57-L62 HydrophobicContact CG-CB 4.06Å; L57-L62 HydrophobicContact CG-CD1 4.21Å; L57-P63 VanDerWaalsContact CD2-O 3.27Å; L57-P63 WeakPolarHBondContact CD2-O 3.05Å; L57-W71 HydrophobicContact CB-CH2 4.45Å; L57-W71 HydrophobicContact CD1-CD2 3.88Å; L57-W71 HydrophobicContact CD1-CE3 4.25Å; L57-W71 HydrophobicContact CD1-CH2 3.26Å; L57-W71 HydrophobicContact CD1-CZ2 2.94Å; L57-W71 HydrophobicContact CD1-CZ3 3.95Å; L57-W71 HydrophobicContact CG-CH2 4.48Å; L57-W71 HydrophobicContact CG-CZ2 4.39Å
58	L	90	Very high	90.1	Very high	150 Å²	150	85.6 Å²	85.6	79%	0.785	49%	0.491	S	S	*	.	H	α-helix	trans	-61.2	-34.3	175.7	-73.4	171.5	0	0	0	112.2	S54 G60	S54-L58 WeakPolarHBondContact O-CB 3.4Å; S54-L58 VanDerWaalsContact O-CG 3.25Å; S54-L58 WeakPolarHBondContact O-CG 3.03Å; S54-L58 PolarHBondContact O-N 2.8Å; L58-G60 VanDerWaalsContact C-N 3.29Å
59	S	94.4	Very high	89.5	Confident	56 Å²	56	85 Å²	85	39%	0.392	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	1.1	176	60.7	0	0	0	0	114.3	N55 L56 L57 R61	N55-S59 VanDerWaalsContact O-CB 3.3Å; N55-S59 WeakPolarHBondContact O-CB 3.02Å; N55-S59 PolarHBondContact O-N 3.24Å; N55-S59 PolarHBondContact O-OG 3.14Å; L56-S59 WeakPolarHBondContact CA-OG 3.38Å; L56-S59 PolarHBondContact O-OG 3.23Å; L57-S59 PolarHBondContact O-N 2.78Å; S59-R61 PolarHBondContact O-N 3.02Å; S59-R61 PolarHBondContact OG-NH1 2.81Å
60	G	92.5	Very high	88.6	Confident	54 Å²	54	82.2 Å²	82.2	56%	0.557	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	17.2	179.2	0	0	0	0	0	114.4	L56 L57 L58 L62	L56-G60 PolarHBondContact O-N 2.77Å; L57-G60 PolarHBondContact O-N 2.84Å; L58-G60 VanDerWaalsContact C-N 3.29Å; G60-L62 VanDerWaalsContact C-N 3.3Å
61	R	95.4	Very high	87.7	Confident	186 Å²	186	86.1 Å²	86.1	70%	0.702	50%	0.499	S	S	*	.	S	Bend	trans	-80.3	-14	176.7	-69	-170.8	177.7	97.7	-5.9	113.1	L56 S59	L56-R61 HydrophobicContact CB-CB 4.48Å; L56-R61 HydrophobicContact CD2-CB 4.02Å; L56-R61 PolarHBondContact O-N 3.4Å; S59-R61 PolarHBondContact O-N 3.02Å; S59-R61 PolarHBondContact OG-NH1 2.81Å
62	L	91.3	Very high	86.9	Confident	62 Å²	62	88.4 Å²	88.4	33%	0.325	51%	0.508	S	S	.	.	S	Bend	trans	-116.7	150.2	171.1	-69.3	173.7	0	0	0	109.6	L53 L56 L57 G60 Q64	L53-L62 HydrophobicContact CD1-CD1 3.55Å; L56-L62 HydrophobicContact CB-CD1 3.62Å; L56-L62 HydrophobicContact CB-CG 3.87Å; L56-L62 HydrophobicContact CD1-CD1 4.09Å; L56-L62 HydrophobicContact CD1-CG 4.47Å; L56-L62 PolarHBondContact O-N 3.32Å; L57-L62 HydrophobicContact CD2-CB 3.76Å; L57-L62 HydrophobicContact CG-CB 4.06Å; L57-L62 HydrophobicContact CG-CD1 4.21Å; G60-L62 VanDerWaalsContact C-N 3.3Å; L62-Q64 PolarHBondContact O-N 2.79Å
63	P	90	Very high	86.3	Confident	113 Å²	113	85.7 Å²	85.7	73%	0.734	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-54	135	172.2	-22.9	33.2	0	0	0	110.5	L57	L57-P63 VanDerWaalsContact CD2-O 3.27Å; L57-P63 WeakPolarHBondContact CD2-O 3.05Å
64	Q	84.7	Confident	85.9	Confident	158 Å²	158	86.2 Å²	86.2	74%	0.738	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-70.7	144.1	174.2	-70	-168.5	-4.8	0	0	110	L62	L62-Q64 PolarHBondContact O-N 2.79Å
65	P	83.9	Confident	85.9	Confident	48 Å²	48	86.4 Å²	86.4	31%	0.312	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-54	150.5	169.8	-19.2	29.1	0	0	0	110.6	E69 W71	P65-E69 HydrophobicContact CB-CB 4.25Å; P65-W71 HydrophobicContact CB-CB 4.08Å; P65-W71 HydrophobicContact CG-CB 3.48Å; P65-W71 VanDerWaalsContact CG-CB 3.48Å; P65-W71 HydrophobicContact CG-CD2 4.39Å; P65-W71 HydrophobicContact CG-CG 3.59Å
66	A	84.8	Confident	85.9	Confident	56 Å²	56	84 Å²	84	46%	0.463	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-59.8	149.7	177.1	0	0	0	0	0	110.6	G68 E69	A66-G68 PolarHBondContact O-N 3.01Å; A66-G68 VanDerWaalsContact O-N 3.11Å; A66-E69 HydrophobicContact CB-CB 4.31Å; A66-E69 PolarHBondContact N-OE2 2.85Å; A66-E69 VanDerWaalsContact O-CB 3.3Å; A66-E69 WeakPolarHBondContact O-CB 3.32Å; A66-E69 PolarHBondContact O-N 3.33Å
67	P	83.3	Confident	86	Confident	141 Å²	141	82.1 Å²	82.1	92%	0.916	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	121.9	174.1	-24.1	33.2	0	0	0	110.9
68	G	79	Confident	86.2	Confident	86 Å²	86	88.6 Å²	88.6	89%	0.887	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.9	-4.7	-178.1	0	0	0	0	0	115.1	A66 P70	A66-G68 PolarHBondContact O-N 3.01Å; A66-G68 VanDerWaalsContact O-N 3.11Å; G68-P70 WeakPolarHBondContact O-CD 3.03Å
69	E	81.4	Confident	86.6	Confident	123 Å²	123	83 Å²	83	58%	0.575	48%	0.475	S	S	*	.			trans	-80.3	119.9	174.4	-163.8	175.5	179.6	0	0	110.2	P65 A66 W71	P65-E69 HydrophobicContact CB-CB 4.25Å; A66-E69 HydrophobicContact CB-CB 4.31Å; A66-E69 PolarHBondContact N-OE2 2.85Å; A66-E69 VanDerWaalsContact O-CB 3.3Å; A66-E69 WeakPolarHBondContact O-CB 3.32Å; A66-E69 PolarHBondContact O-N 3.33Å; E69-W71 PolarHBondContact O-N 2.92Å; E69-W71 VanDerWaalsContact O-N 3.16Å
70	P	72.3	Confident	86.8	Confident	103 Å²	103	83.4 Å²	83.4	67%	0.669	48%	0.475	S	S	*	.			trans	-67.9	116.9	179.1	26.8	-31.7	0	0	0	109.2	G68	G68-P70 WeakPolarHBondContact O-CD 3.03Å
71	W	72.8	Confident	87	Confident	102 Å²	102	86.6 Å²	86.6	39%	0.386	48%	0.475	S	S	.	.			trans	-113.5	130	177.1	-177.5	80.3	0	0	0	111.2	L53 L57 P65 E69 S73	L53-W71 HydrophobicContact CD2-CZ2 3.79Å; L53-W71 HydrophobicContact CG-CZ2 3.82Å; L57-W71 HydrophobicContact CB-CH2 4.45Å; L57-W71 HydrophobicContact CD1-CD2 3.88Å; L57-W71 HydrophobicContact CD1-CE3 4.25Å; L57-W71 HydrophobicContact CD1-CH2 3.26Å; L57-W71 HydrophobicContact CD1-CZ2 2.94Å; L57-W71 HydrophobicContact CD1-CZ3 3.95Å; L57-W71 HydrophobicContact CG-CH2 4.48Å; L57-W71 HydrophobicContact CG-CZ2 4.39Å; P65-W71 HydrophobicContact CB-CB 4.08Å; P65-W71 HydrophobicContact CG-CB 3.48Å; P65-W71 VanDerWaalsContact CG-CB 3.48Å; P65-W71 HydrophobicContact CG-CD2 4.39Å; P65-W71 HydrophobicContact CG-CG 3.59Å; E69-W71 PolarHBondContact O-N 2.92Å; E69-W71 VanDerWaalsContact O-N 3.16Å; W71-S73 VanDerWaalsContact CZ3-CB 3.42Å
72	H	75.3	Confident	87.2	Confident	121 Å²	121	83.1 Å²	83.1	56%	0.56	46%	0.463	S	S	*	.			trans	-122.7	118.8	-177.8	-60.7	-60.9	0	0	0	110.3	V74	H72-V74 VanDerWaalsContact C-N 3.3Å
73	S	80.6	Confident	87.5	Confident	18 Å²	18	83 Å²	83	13%	0.126	46%	0.461	C	S	.	.	S	Bend	trans	-90	-1.4	173.9	94.1	0	0	0	0	113.4	D50 S54 W71	D50-S73 WeakPolarHBondContact CB-O 3.47Å; S54-S73 WeakPolarHBondContact OG-CB 3.48Å; S54-S73 PolarHBondContact OG-OG 3.34Å; W71-S73 VanDerWaalsContact CZ3-CB 3.42Å
74	V	84.6	Confident	87.9	Confident	41 Å²	41	81.1 Å²	81.1	25%	0.248	44%	0.444	C	S	.	.	S	Bend	trans	-121.9	148.6	-175.6	-64.1	0	0	0	0	108.6	R46 H72	R46-V74 HydrophobicContact CG-CG1 4.02Å; H72-V74 VanDerWaalsContact C-N 3.3Å
75	P	91.1	Very high	88.5	Confident	16 Å²	16	74.4 Å²	74.4	10%	0.104	41%	0.413	C	S	.	.			trans	-54	147.3	173.8	-26.9	35.2	0	0	0	111.8	C42 A45 C107	C42-P75 HydrophobicContact CB-CB 4.31Å; C42-P75 VanDerWaalsContact CB-O 3.26Å; C42-P75 WeakPolarHBondContact CB-O 3.2Å; A45-P75 HydrophobicContact CB-CG 4.2Å; A45-P75 WeakPolarHBondContact O-CG 3.27Å; P75-C107 HydrophobicContact CB-CB 4.19Å
76	C	91.9	Very high	89.2	Confident	53 Å²	53	75 Å²	75	36%	0.358	42%	0.421	S	S	.	.			trans	-87.1	152.2	176.4	-68.5	0	0	0	0	110	R78 C107 A108	C76-R78 HydrophobicContact CB-CG 4.06Å; C76-R78 PolarHBondContact O-N 3.19Å; C76-C107 WeakPolarHBondContact O-CA 3.25Å; C76-A108 PolarHBondContact N-O 3.32Å; C76-A108 PolarHBondContact O-N 3.01Å; C76-A108 VanDerWaalsContact O-O 3.11Å
77	C	95	Very high	89.8	Confident	17 Å²	17	72.3 Å²	72.3	12%	0.115	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	108.9	168.9	-170.2	0	0	0	0	109	C11	C11-C77 WeakPolarHBondContact CA-SG 3.26Å; C11-C77 HydrophobicContact CB-CB 3.64Å; C11-C77 WeakPolarHBondContact CB-SG 3.47Å; C11-C77 WeakPolarHBondContact SG-CA 3.4Å; C11-C77 WeakPolarHBondContact SG-CB 3.04Å; C11-C77 CovalentContact SG-SG 2.04Å; C11-C77 PolarHBondContact SG-SG 2.02Å
78	R	96.3	Very high	90.6	Very high	156 Å²	156	68 Å²	68	59%	0.589	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.1	154	-174.1	-69.6	-62.5	-141.8	121.2	3.6	111.9	C76 C105 S106	C76-R78 HydrophobicContact CB-CG 4.06Å; C76-R78 PolarHBondContact O-N 3.19Å; R78-C105 WeakPolarHBondContact O-CA 3.35Å; R78-S106 PolarHBondContact N-O 2.97Å; R78-S106 PolarHBondContact O-N 3.41Å
79	P	98	Very high	91.4	Very high	33 Å²	33	64.4 Å²	64.4	21%	0.214	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	137.8	172.4	-14.6	27.8	0	0	0	111.9	C38 Y82 A102 A104	C38-P79 HydrophobicContact CB-CG 4.27Å; C38-P79 WeakPolarHBondContact SG-CA 3.26Å; C38-P79 VanDerWaalsContact SG-N 3.39Å; P79-Y82 HydrophobicContact CB-CD1 4.44Å; P79-Y82 HydrophobicContact CB-CE1 3.74Å; P79-Y82 HydrophobicContact CB-CE2 4.29Å; P79-Y82 HydrophobicContact CG-CE1 3.99Å; P79-A102 HydrophobicContact CB-CB 4.01Å; P79-A102 HydrophobicContact CG-CB 4.15Å; P79-A104 CarbonylContact C-O 3.59Å; P79-A104 VanDerWaalsContact CA-O 3.26Å; P79-A104 WeakPolarHBondContact CA-O 3.41Å
80	T	97.7	Very high	92.2	Very high	64 Å²	64	61.7 Å²	61.7	39%	0.393	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	-25.9	171.6	51.4	0	0	0	0	112.5	A104 S106	T80-A104 PolarHBondContact N-O 3.14Å; T80-A104 WeakPolarHBondContact OG1-CB 2.93Å; T80-A104 PolarHBondContact OG1-O 3.37Å; T80-S106 WeakPolarHBondContact CG2-OG 3.4Å
81	H	98.3	Very high	93.4	Very high	121 Å²	121	60.6 Å²	60.6	56%	0.56	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.8	156	177.7	-65.5	-81.7	0	0	0	109.9	A103 A104	H81-A103 HydrophobicContact CB-CB 3.96Å; H81-A103 PolarHBondContact O-N 3.18Å; H81-A104 HydrophobicContact CB-CB 4.17Å
82	Y	98.6	Very high	94.6	Very high	114 Å²	114	63.1 Å²	63.1	45%	0.447	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	151.7	-179.6	-58.2	-94.7	0	0	0	110.1	P79 K99 S101	P79-Y82 HydrophobicContact CB-CD1 4.44Å; P79-Y82 HydrophobicContact CB-CE1 3.74Å; P79-Y82 HydrophobicContact CB-CE2 4.29Å; P79-Y82 HydrophobicContact CG-CE1 3.99Å; Y82-K99 WeakPolarHBondContact CD1-O 3.29Å; Y82-K99 HydrophobicContact CG-CB 4.08Å; Y82-S101 CarbonylContact C-O 3.5Å; Y82-S101 WeakPolarHBondContact CA-O 3.42Å
83	E	98.4	Very high	95.7	Very high	60 Å²	60	64.3 Å²	64.3	28%	0.28	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	150.8	171.7	67.9	-168.4	170.4	0	0	109.8	K36 L100 S101 A103	K36-E83 VanDerWaalsContact CD-OE1 3.25Å; K36-E83 WeakPolarHBondContact CD-OE1 3.26Å; K36-E83 WeakPolarHBondContact CE-OE1 3.46Å; K36-E83 IonicContact NZ-OE1 2.77Å; K36-E83 PolarHBondContact NZ-OE1 2.94Å; K36-E83 IonicContact NZ-OE2 3.38Å; K36-E83 PolarHBondContact NZ-OE2 3.48Å; E83-L100 PolarHBondContact O-N 2.78Å; E83-L100 VanDerWaalsContact O-N 3.15Å; E83-S101 PolarHBondContact N-O 2.74Å; E83-S101 PolarHBondContact O-N 2.79Å; E83-S101 VanDerWaalsContact O-N 3.16Å; E83-S101 WeakPolarHBondContact OE1-CB 3.44Å; E83-S101 PolarHBondContact OE1-OG 2.95Å; E83-A103 HydrophobicContact CB-CB 4.43Å
84	D	98.5	Very high	96.5	Very high	73 Å²	73	72.3 Å²	72.3	39%	0.39	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	155.2	175.6	-57.8	-17.7	0	0	0	110.1	K96 V97 E98 K99	D84-K96 WeakPolarHBondContact OD2-CE 3.3Å; D84-K96 IonicContact OD2-NZ 3.1Å; D84-K96 PolarHBondContact OD2-NZ 2.97Å; D84-V97 WeakPolarHBondContact CA-O 3.5Å; D84-E98 WeakPolarHBondContact OD1-CA 3.32Å; D84-E98 WeakPolarHBondContact OD1-CB 3.33Å; D84-K99 PolarHBondContact OD1-N 2.76Å
85	M	97.9	Very high	97.2	Very high	17 Å²	17	72.4 Å²	72.4	8%	0.084	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.7	176	-176.4	173.2	-77.3	0	0	109.7	L23 V33 L34 F87 K96 V97 L100	L23-M85 HydrophobicContact CD1-SD 4.37Å; V33-M85 HydrophobicContact CB-CE 3.87Å; V33-M85 HydrophobicContact CB-SD 3.67Å; V33-M85 HydrophobicContact CG1-CG 4.4Å; V33-M85 HydrophobicContact CG1-SD 3.94Å; V33-M85 HydrophobicContact CG2-CE 3.94Å; V33-M85 HydrophobicContact CG2-SD 3.56Å; V33-M85 VanDerWaalsContact CG2-SD 3.56Å; L34-M85 WeakPolarHBondContact O-CE 3.44Å; M85-F87 HydrophobicContact CG-CD1 4.34Å; M85-K96 CarbonylContact O-C 3.58Å; M85-K96 WeakPolarHBondContact O-CA 3.46Å; M85-V97 PolarHBondContact N-O 3.48Å; M85-V97 PolarHBondContact O-N 3.44Å; M85-L100 HydrophobicContact CB-CB 4.3Å; M85-L100 HydrophobicContact CB-CD2 3.99Å; M85-L100 HydrophobicContact CG-CD2 4.4Å; M85-L100 HydrophobicContact SD-CD2 3.71Å
86	A	97.9	Very high	97.5	Very high	59 Å²	59	77.1 Å²	77.1	49%	0.488	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142.7	172.9	0	0	0	0	0	110	H95	A86-H95 WeakPolarHBondContact CA-O 3.34Å
87	F	98.1	Very high	97.8	Very high	0 Å²	0	75.9 Å²	75.9	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	163	-179.3	57.1	-94.5	0	0	0	109.8	V20 Y27 E31 V33 M85 H95 V97	V20-F87 HydrophobicContact CB-CD2 4.39Å; V20-F87 HydrophobicContact CG1-CD1 4.25Å; V20-F87 HydrophobicContact CG1-CD2 3.77Å; V20-F87 HydrophobicContact CG1-CE1 4.01Å; V20-F87 HydrophobicContact CG1-CE2 3.52Å; V20-F87 HydrophobicContact CG1-CG 4.15Å; V20-F87 HydrophobicContact CG1-CZ 3.65Å; V20-F87 HydrophobicContact CG2-CB 3.88Å; V20-F87 HydrophobicContact CG2-CD1 3.89Å; V20-F87 HydrophobicContact CG2-CD2 3.92Å; V20-F87 HydrophobicContact CG2-CE1 4.43Å; V20-F87 HydrophobicContact CG2-CE2 4.47Å; V20-F87 HydrophobicContact CG2-CG 3.61Å; Y27-F87 AromaticContact CD1-CE2 3.96Å; Y27-F87 HydrophobicContact CD1-CE2 3.96Å; Y27-F87 AromaticContact CD1-CZ 3.88Å; Y27-F87 HydrophobicContact CD1-CZ 3.88Å; Y27-F87 HydrophobicContact CD2-CE1 4.49Å; Y27-F87 HydrophobicContact CD2-CE2 4.27Å; Y27-F87 AromaticContact CD2-CZ 3.56Å; Y27-F87 HydrophobicContact CD2-CZ 3.56Å; Y27-F87 HydrophobicContact CE1-CZ 4.14Å; Y27-F87 AromaticContact CE2-CZ 3.85Å; Y27-F87 HydrophobicContact CE2-CZ 3.85Å; Y27-F87 AromaticContact CG-CE2 3.82Å; Y27-F87 HydrophobicContact CG-CE2 3.82Å; Y27-F87 AromaticContact CG-CZ 3.58Å; Y27-F87 HydrophobicContact CG-CZ 3.58Å; E31-F87 HydrophobicContact CB-CB 4.49Å; E31-F87 HydrophobicContact CG-CB 4.47Å; E31-F87 WeakPolarHBondContact OE2-CA 3.49Å; V33-F87 HydrophobicContact CG1-CB 4.21Å; M85-F87 HydrophobicContact CG-CD1 4.34Å; F87-H95 HydrophobicContact CD2-CB 4.21Å; F87-H95 HydrophobicContact CE1-CB 4.32Å; F87-H95 HydrophobicContact CE2-CB 3.64Å; F87-H95 AromaticContact CE2-CD2 3.93Å; F87-H95 HydrophobicContact CZ-CB 3.7Å; F87-H95 PolarHBondContact N-O 3.04Å; F87-H95 VanDerWaalsContact N-O 3.09Å; F87-H95 PolarHBondContact O-N 3.44Å; F87-V97 HydrophobicContact CE1-CG2 3.92Å; F87-V97 HydrophobicContact CZ-CG2 4.29Å
88	L	98.1	Very high	98	Very high	51 Å²	51	81.1 Å²	81.1	27%	0.267	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	132.3	175.1	-164.9	72.8	0	0	0	109.4	S29 E31 W94	S29-L88 PolarHBondContact OG-O 3.27Å; E31-L88 WeakPolarHBondContact OE2-CB 3.37Å; E31-L88 PolarHBondContact OE2-N 3.44Å; L88-W94 HydrophobicContact CB-CE3 4.41Å; L88-W94 HydrophobicContact CB-CH2 4.48Å; L88-W94 HydrophobicContact CB-CZ3 4.34Å; L88-W94 HydrophobicContact CD1-CD2 3.86Å; L88-W94 HydrophobicContact CD1-CE3 4.45Å; L88-W94 HydrophobicContact CD1-CG 3.98Å; L88-W94 HydrophobicContact CD1-CZ2 4.3Å
89	D	97.8	Very high	98	Very high	10 Å²	10	80.6 Å²	80.6	5%	0.053	39%	0.388	C	S	.	.			trans	-83	170	172.7	76	10.3	0	0	0	112.8	S91 H92 R93 H95	D89-S91 PolarHBondContact O-N 3.03Å; D89-S91 VanDerWaalsContact O-N 3.1Å; D89-S91 VanDerWaalsContact OD1-CA 3.23Å; D89-S91 WeakPolarHBondContact OD1-CA 3.5Å; D89-S91 VanDerWaalsContact OD1-CB 3.3Å; D89-S91 WeakPolarHBondContact OD1-CB 2.96Å; D89-S91 PolarHBondContact OD1-N 2.75Å; D89-H92 PolarHBondContact O-N 2.91Å; D89-H92 PolarHBondContact OD1-N 3.06Å; D89-H92 VanDerWaalsContact OD1-N 3.08Å; D89-R93 PolarHBondContact N-O 3.34Å; D89-R93 WeakPolarHBondContact OD1-CB 3.44Å; D89-R93 PolarHBondContact OD1-N 3.03Å; D89-R93 IonicContact OD1-NE 2.88Å; D89-R93 IonicContact OD2-CZ 3.82Å; D89-R93 IonicContact OD2-NE 3.7Å; D89-R93 PolarHBondContact OD2-NE 3.4Å; D89-R93 IonicContact OD2-NH2 2.94Å; D89-R93 PolarHBondContact OD2-NH2 3.13Å; D89-H95 VanDerWaalsContact CG-NE2 3.32Å; D89-H95 IonicContact OD2-CD2 3.8Å; D89-H95 IonicContact OD2-CE1 2.71Å; D89-H95 IonicContact OD2-NE2 2.91Å; D89-H95 PolarHBondContact OD2-NE2 2.89Å
90	N	98	Very high	98	Very high	66 Å²	66	80.8 Å²	80.8	35%	0.353	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-10.7	178.4	-72.4	-10.7	0	0	0	113.3	R21 D28 D30 H92	R21-N90 PolarHBondContact NH2-ND2 3.1Å; D28-N90 PolarHBondContact O-N 3.22Å; D28-N90 VanDerWaalsContact O-N 3.09Å; D28-N90 PolarHBondContact OD1-ND2 3.11Å; D28-N90 VanDerWaalsContact OD1-ND2 3.09Å; D30-N90 PolarHBondContact N-OD1 3.21Å; D30-N90 PolarHBondContact OD2-ND2 2.89Å; D30-N90 PolarHBondContact OD2-OD1 3.17Å; N90-H92 VanDerWaalsContact C-N 3.34Å
91	S	97.7	Very high	98.1	Very high	80 Å²	80	77.8 Å²	77.8	56%	0.559	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	12.3	171.3	-58.9	0	0	0	0	112.7	D89 R93	D89-S91 PolarHBondContact O-N 3.03Å; D89-S91 VanDerWaalsContact O-N 3.1Å; D89-S91 VanDerWaalsContact OD1-CA 3.23Å; D89-S91 WeakPolarHBondContact OD1-CA 3.5Å; D89-S91 VanDerWaalsContact OD1-CB 3.3Å; D89-S91 WeakPolarHBondContact OD1-CB 2.96Å; D89-S91 PolarHBondContact OD1-N 2.75Å; S91-R93 VanDerWaalsContact C-N 3.29Å; S91-R93 PolarHBondContact O-N 3.22Å
92	H	97	Very high	98.1	Very high	155 Å²	155	72.2 Å²	72.2	72%	0.718	34%	0.343	S	S	*	.	S	Bend	trans	60.3	32.2	-178.1	-52	91.2	0	0	0	114.2	D89 N90	D89-H92 PolarHBondContact O-N 2.91Å; D89-H92 PolarHBondContact OD1-N 3.06Å; D89-H92 VanDerWaalsContact OD1-N 3.08Å; N90-H92 VanDerWaalsContact C-N 3.34Å
93	R	98.2	Very high	98.1	Very high	147 Å²	147	68.8 Å²	68.8	56%	0.555	34%	0.339	S	S	*	.			trans	-105.8	134.3	174.6	-57.5	178.5	-60.7	-175.8	0.8	110.4	D89 S91 H95	D89-R93 PolarHBondContact N-O 3.34Å; D89-R93 WeakPolarHBondContact OD1-CB 3.44Å; D89-R93 PolarHBondContact OD1-N 3.03Å; D89-R93 IonicContact OD1-NE 2.88Å; D89-R93 IonicContact OD2-CZ 3.82Å; D89-R93 IonicContact OD2-NE 3.7Å; D89-R93 PolarHBondContact OD2-NE 3.4Å; D89-R93 IonicContact OD2-NH2 2.94Å; D89-R93 PolarHBondContact OD2-NH2 3.13Å; S91-R93 VanDerWaalsContact C-N 3.29Å; S91-R93 PolarHBondContact O-N 3.22Å; R93-H95 PolarHBondContact O-CD2 2.86Å; R93-H95 VanDerWaalsContact O-CD2 3.23Å
94	W	98	Very high	98	Very high	186 Å²	186	67.4 Å²	67.4	71%	0.705	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	134.5	173.6	-75.6	102.8	0	0	0	110.9	L88	L88-W94 HydrophobicContact CB-CE3 4.41Å; L88-W94 HydrophobicContact CB-CH2 4.48Å; L88-W94 HydrophobicContact CB-CZ3 4.34Å; L88-W94 HydrophobicContact CD1-CD2 3.86Å; L88-W94 HydrophobicContact CD1-CE3 4.45Å; L88-W94 HydrophobicContact CD1-CG 3.98Å; L88-W94 HydrophobicContact CD1-CZ2 4.3Å
95	H	98.3	Very high	98	Very high	42 Å²	42	65.4 Å²	65.4	19%	0.194	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	148.2	171.9	-62.9	-82.3	0	0	0	109.7	Y27 A86 F87 D89 R93	Y27-H95 HydrophobicContact CE1-CB 4.16Å; Y27-H95 AromaticContact CE1-CG 3.77Å; Y27-H95 AromaticContact CE1-ND1 3.51Å; A86-H95 WeakPolarHBondContact CA-O 3.34Å; F87-H95 HydrophobicContact CD2-CB 4.21Å; F87-H95 HydrophobicContact CE1-CB 4.32Å; F87-H95 HydrophobicContact CE2-CB 3.64Å; F87-H95 AromaticContact CE2-CD2 3.93Å; F87-H95 HydrophobicContact CZ-CB 3.7Å; F87-H95 PolarHBondContact N-O 3.04Å; F87-H95 VanDerWaalsContact N-O 3.09Å; F87-H95 PolarHBondContact O-N 3.44Å; D89-H95 VanDerWaalsContact CG-NE2 3.32Å; D89-H95 IonicContact OD2-CD2 3.8Å; D89-H95 IonicContact OD2-CE1 2.71Å; D89-H95 IonicContact OD2-NE2 2.91Å; D89-H95 PolarHBondContact OD2-NE2 2.89Å; R93-H95 PolarHBondContact O-CD2 2.86Å; R93-H95 VanDerWaalsContact O-CD2 3.23Å
96	K	98	Very high	97.9	Very high	115 Å²	115	66.7 Å²	66.7	50%	0.5	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	125.5	170.8	-176	-166.6	176.6	-149.8	0	108.1	D84 M85 E98	D84-K96 WeakPolarHBondContact OD2-CE 3.3Å; D84-K96 IonicContact OD2-NZ 3.1Å; D84-K96 PolarHBondContact OD2-NZ 2.97Å; M85-K96 CarbonylContact O-C 3.58Å; M85-K96 WeakPolarHBondContact O-CA 3.46Å; K96-E98 IonicContact NZ-OE1 2.81Å; K96-E98 PolarHBondContact NZ-OE1 2.66Å
97	V	98.2	Very high	97.7	Very high	27 Å²	27	66.1 Å²	66.1	16%	0.164	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	118.5	173.8	-173.1	0	0	0	0	108.1	L25 Y27 D84 M85 F87 L100	L25-V97 HydrophobicContact CD1-CG1 4.34Å; Y27-V97 HydrophobicContact CE2-CG2 3.77Å; D84-V97 WeakPolarHBondContact CA-O 3.5Å; M85-V97 PolarHBondContact N-O 3.48Å; M85-V97 PolarHBondContact O-N 3.44Å; F87-V97 HydrophobicContact CE1-CG2 3.92Å; F87-V97 HydrophobicContact CZ-CG2 4.29Å; V97-L100 HydrophobicContact CB-CB 4.36Å; V97-L100 HydrophobicContact CB-CD2 4.14Å; V97-L100 HydrophobicContact CG1-CB 4.07Å; V97-L100 HydrophobicContact CG1-CD1 4.48Å; V97-L100 HydrophobicContact CG1-CD2 4.19Å; V97-L100 HydrophobicContact CG1-CG 4.48Å
98	E	98.3	Very high	97.2	Very high	127 Å²	127	71 Å²	71	59%	0.593	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.6	144.7	-176.9	-58.8	-163.3	150.3	0	0	112	D84 K96 L100	D84-E98 WeakPolarHBondContact OD1-CA 3.32Å; D84-E98 WeakPolarHBondContact OD1-CB 3.33Å; K96-E98 IonicContact NZ-OE1 2.81Å; K96-E98 PolarHBondContact NZ-OE1 2.66Å; E98-L100 PolarHBondContact O-N 3.31Å; E98-L100 VanDerWaalsContact O-N 3.15Å
99	K	97.9	Very high	97.2	Very high	146 Å²	146	72 Å²	72	64%	0.635	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.4	35	175.5	-57.2	179.1	-178.8	173.3	0	114.4	Y82 D84	Y82-K99 WeakPolarHBondContact CD1-O 3.29Å; Y82-K99 HydrophobicContact CG-CB 4.08Å; D84-K99 PolarHBondContact OD1-N 2.76Å
100	L	97.8	Very high	97.1	Very high	37 Å²	37	75.2 Å²	75.2	19%	0.194	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-42	-177.6	-178.6	59.1	0	0	0	112.2	L23 L25 F35 E83 M85 V97 E98	L23-L100 HydrophobicContact CD1-CD2 3.94Å; L25-L100 HydrophobicContact CD1-CD1 3.93Å; L25-L100 HydrophobicContact CD1-CD2 4.1Å; F35-L100 HydrophobicContact CE2-CD1 4.43Å; F35-L100 HydrophobicContact CE2-CG 4.31Å; F35-L100 VanDerWaalsContact CE2-O 3.26Å; F35-L100 WeakPolarHBondContact CE2-O 3.19Å; E83-L100 PolarHBondContact O-N 2.78Å; E83-L100 VanDerWaalsContact O-N 3.15Å; M85-L100 HydrophobicContact CB-CB 4.3Å; M85-L100 HydrophobicContact CB-CD2 3.99Å; M85-L100 HydrophobicContact CG-CD2 4.4Å; M85-L100 HydrophobicContact SD-CD2 3.71Å; V97-L100 HydrophobicContact CB-CB 4.36Å; V97-L100 HydrophobicContact CB-CD2 4.14Å; V97-L100 HydrophobicContact CG1-CB 4.07Å; V97-L100 HydrophobicContact CG1-CD1 4.48Å; V97-L100 HydrophobicContact CG1-CD2 4.19Å; V97-L100 HydrophobicContact CG1-CG 4.48Å; E98-L100 PolarHBondContact O-N 3.31Å; E98-L100 VanDerWaalsContact O-N 3.15Å
101	S	98.3	Very high	97.1	Very high	1 Å²	1	75.7 Å²	75.7	1%	0.007	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	144.4	-173.4	175.9	0	0	0	0	110.8	K36 Y82 E83	K36-S101 VanDerWaalsContact CB-OG 3.29Å; K36-S101 WeakPolarHBondContact CB-OG 3.43Å; K36-S101 PolarHBondContact N-OG 3.16Å; Y82-S101 CarbonylContact C-O 3.5Å; Y82-S101 WeakPolarHBondContact CA-O 3.42Å; E83-S101 PolarHBondContact N-O 2.74Å; E83-S101 PolarHBondContact O-N 2.79Å; E83-S101 VanDerWaalsContact O-N 3.16Å; E83-S101 WeakPolarHBondContact OE1-CB 3.44Å; E83-S101 PolarHBondContact OE1-OG 2.95Å
102	A	98.5	Very high	97.1	Very high	3 Å²	3	75.5 Å²	75.5	3%	0.025	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	137.8	177.5	0	0	0	0	0	111.2	L13 K36 P79	L13-A102 HydrophobicContact CD1-CB 3.7Å; L13-A102 WeakPolarHBondContact CD1-O 3.04Å; K36-A102 VanDerWaalsContact CB-O 3.22Å; K36-A102 WeakPolarHBondContact CB-O 3.3Å; K36-A102 WeakPolarHBondContact O-CB 3.48Å; K36-A102 PolarHBondContact O-N 2.85Å; P79-A102 HydrophobicContact CB-CB 4.01Å; P79-A102 HydrophobicContact CG-CB 4.15Å
103	A	98.2	Very high	97.1	Very high	43 Å²	43	70.5 Å²	70.5	36%	0.355	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	-23.3	175.5	0	0	0	0	0	112.9	H81 E83	H81-A103 HydrophobicContact CB-CB 3.96Å; H81-A103 PolarHBondContact O-N 3.18Å; E83-A103 HydrophobicContact CB-CB 4.43Å
104	A	97.9	Very high	97	Very high	31 Å²	31	65.4 Å²	65.4	26%	0.256	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	155.9	177.5	0	0	0	0	0	110.7	P79 T80 H81	P79-A104 CarbonylContact C-O 3.59Å; P79-A104 VanDerWaalsContact CA-O 3.26Å; P79-A104 WeakPolarHBondContact CA-O 3.41Å; T80-A104 PolarHBondContact N-O 3.14Å; T80-A104 WeakPolarHBondContact OG1-CB 2.93Å; T80-A104 PolarHBondContact OG1-O 3.37Å; H81-A104 HydrophobicContact CB-CB 4.17Å
105	C	97.6	Very high	96.9	Very high	31 Å²	31	56.8 Å²	56.8	21%	0.209	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	146.5	-177.8	-54.8	0	0	0	0	111.3	C38 R78	C38-C105 WeakPolarHBondContact CA-SG 3.32Å; C38-C105 HydrophobicContact CB-CB 3.8Å; C38-C105 WeakPolarHBondContact CB-SG 3.3Å; C38-C105 VanDerWaalsContact SG-CA 3.55Å; C38-C105 WeakPolarHBondContact SG-CB 3.45Å; C38-C105 CovalentContact SG-SG 2.03Å; C38-C105 PolarHBondContact SG-SG 3.3Å; R78-C105 WeakPolarHBondContact O-CA 3.35Å
106	S	95.8	Very high	96.8	Very high	43 Å²	43	57.9 Å²	57.9	30%	0.301	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	166.2	168.7	74.6	0	0	0	0	111.6	R78 T80	R78-S106 PolarHBondContact N-O 2.97Å; R78-S106 PolarHBondContact O-N 3.41Å; T80-S106 WeakPolarHBondContact CG2-OG 3.4Å
107	C	94.9	Very high	96.7	Very high	48 Å²	48	53.2 Å²	53.2	32%	0.324	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	116.6	168	-66.1	0	0	0	0	108.9	C42 A45 P75 C76	C42-C107 VanDerWaalsContact CA-SG 3.59Å; C42-C107 HydrophobicContact CB-CB 3.64Å; C42-C107 WeakPolarHBondContact CB-SG 3.49Å; C42-C107 WeakPolarHBondContact SG-CA 3.22Å; C42-C107 WeakPolarHBondContact SG-CB 3.48Å; C42-C107 CovalentContact SG-SG 2.02Å; C42-C107 PolarHBondContact SG-SG 3.06Å; A45-C107 HydrophobicContact CB-CB 3.46Å; A45-C107 VanDerWaalsContact CB-CB 3.46Å; P75-C107 HydrophobicContact CB-CB 4.19Å; C76-C107 WeakPolarHBondContact O-CA 3.25Å
108	A	87.3	Confident	96.6	Very high	101 Å²	101	55.5 Å²	55.5	84%	0.835	34%	0.34	S	S	*	.			trans	-144.2	0	180	0	0	0	0	0	111.7	C76	C76-A108 PolarHBondContact N-O 3.32Å; C76-A108 PolarHBondContact O-N 3.01Å; C76-A108 VanDerWaalsContact O-O 3.11Å

Retrieved 108 of 108 residues in 71.5 ms (Link to these results)

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