A0A087WS68_MOUSE Loading...

RAS protein-specific guanine nucleotide-releasing factor 1

AlphaFold DB , UniProt , Accession A0A087WS68, Species MOUSE (Mus musculus, Mouse), Gene Rasgrf1, Length 153 aa.

						>A0A087WS68_MOUSE|A0A087WS68|Rasgrf1
MQKAIRLNDGHVVTLGLLAQKDGTRKGYLSKRSADNPKWQTKWFALLQNLLFYFESDSSPRPSGLYLLEGSICKRAPSPKRGTSSKESGEKQRHSRSRRRRNVLRRQPTRISKTFRLVAIELTGMTATLEVSFSIIRTEIGTLSLHHSLHTLP
					

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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	31	Very low	61.7	Low	233 Å²	233	125.5 Å²	125.5	100%	1.148	64%	0.635	S	S	*	*				0	100.5	0	-68.8	-150.2	-80.2	0	0	108.9	K3	M1-K3 PolarHBondContact O-N 3.04Å
2	Q	47	Very low	63.6	Low	110 Å²	110	117.3 Å²	117.3	51%	0.514	60%	0.595	S	S	.	*			trans	-78.3	114.4	170	-84.1	167.1	9.4	0	0	108.4	A4 L122	Q2-A4 VanDerWaalsContact C-N 3.27Å; Q2-A4 PolarHBondContact O-N 3.3Å; Q2-L122 VanDerWaalsContact NE2-CA 3.26Å; Q2-L122 VanDerWaalsContact NE2-CB 3.25Å
3	K	41.7	Very low	65.5	Low	190 Å²	190	111.7 Å²	111.7	83%	0.826	57%	0.571	S	S	*	*			trans	-72.3	93.2	164.6	-65.2	-179.3	-178.1	177.7	0	105.8	M1 I5	M1-K3 PolarHBondContact O-N 3.04Å; K3-I5 PolarHBondContact O-N 3.13Å
4	A	45.5	Very low	67.2	Low	88 Å²	88	109.5 Å²	109.5	73%	0.727	57%	0.565	S	S	*	*			trans	-57.8	108.2	169.6	0	0	0	0	0	106.8	Q2 R6	Q2-A4 VanDerWaalsContact C-N 3.27Å; Q2-A4 PolarHBondContact O-N 3.3Å; A4-R6 PolarHBondContact O-N 3.22Å
5	I	56	Low	68.6	Low	90 Å²	90	105.3 Å²	105.3	46%	0.462	54%	0.544	S	S	.	.			trans	-67.9	109.2	178.2	-52.3	-176.5	0	0	0	106	K3 L7 L67	K3-I5 PolarHBondContact O-N 3.13Å; I5-L7 HydrophobicContact CB-CG 4.33Å; I5-L7 HydrophobicContact CG2-CD1 4.16Å; I5-L7 HydrophobicContact CG2-CD2 3.58Å; I5-L7 HydrophobicContact CG2-CG 3.49Å; I5-L7 VanDerWaalsContact CG2-CG 3.49Å; I5-L7 PolarHBondContact O-N 3.4Å; I5-L67 HydrophobicContact CD1-CD1 3.85Å; I5-L67 HydrophobicContact CD1-CD2 3.52Å; I5-L67 HydrophobicContact CD1-CG 4.24Å; I5-L67 HydrophobicContact CG1-CD2 4.03Å
6	R	60.5	Low	69.9	Low	241 Å²	241	98.8 Å²	98.8	91%	0.909	51%	0.51	S	S	*	.			trans	-76.2	80	173.2	-58.4	-178.6	84.2	-167.6	5.8	107.5	A4	A4-R6 PolarHBondContact O-N 3.22Å
7	L	66.3	Low	71	Confident	56 Å²	56	97.6 Å²	97.6	29%	0.293	51%	0.505	S	S	.	.			trans	-86	131.5	171.2	-64.8	178.1	0	0	0	108.9	I5 V12 L15 L65	I5-L7 HydrophobicContact CB-CG 4.33Å; I5-L7 HydrophobicContact CG2-CD1 4.16Å; I5-L7 HydrophobicContact CG2-CD2 3.58Å; I5-L7 HydrophobicContact CG2-CG 3.49Å; I5-L7 VanDerWaalsContact CG2-CG 3.49Å; I5-L7 PolarHBondContact O-N 3.4Å; L7-V12 HydrophobicContact CB-CG2 3.62Å; L7-V12 HydrophobicContact CD1-CG2 4.37Å; L7-L15 HydrophobicContact CD1-CD1 4.34Å; L7-L65 HydrophobicContact CD1-CD2 3.8Å
8	N	79.6	Confident	72.1	Confident	107 Å²	107	96.3 Å²	96.3	57%	0.572	50%	0.498	S	S	*	.			trans	-66.7	146.7	172.3	-168.6	17.5	0	0	0	110	G10 H11 V12	N8-G10 PolarHBondContact O-N 3.19Å; N8-G10 VanDerWaalsContact O-N 3.16Å; N8-H11 WeakPolarHBondContact O-CA 3.43Å; N8-H11 WeakPolarHBondContact O-CB 3.38Å; N8-H11 PolarHBondContact O-N 3.31Å; N8-V12 PolarHBondContact O-N 2.84Å
9	D	81	Confident	72.9	Confident	114 Å²	114	91.2 Å²	91.2	61%	0.61	47%	0.472	S	S	*	.	H	α-helix	trans	-54.1	-39.1	-178.7	-81.2	-35.3	0	0	0	112.1	H11 V12 V13	D9-H11 PolarHBondContact O-N 3.37Å; D9-V12 PolarHBondContact O-N 3.03Å; D9-V13 WeakPolarHBondContact O-CG2 3.34Å; D9-V13 PolarHBondContact O-N 2.87Å
10	G	83.8	Confident	73.6	Confident	39 Å²	39	88.6 Å²	88.6	40%	0.402	46%	0.457	S	S	.	.	H	α-helix	trans	-60.1	-42.9	175	0	0	0	0	0	113	N8 V13 T14	N8-G10 PolarHBondContact O-N 3.19Å; N8-G10 VanDerWaalsContact O-N 3.16Å; G10-V13 PolarHBondContact O-N 2.89Å; G10-T14 PolarHBondContact O-N 2.83Å; G10-T14 PolarHBondContact O-OG1 3.08Å; G10-T14 VanDerWaalsContact O-OG1 3.06Å
11	H	86.1	Confident	74.2	Confident	113 Å²	113	92 Å²	92	52%	0.523	47%	0.468	S	S	.	.	H	α-helix	trans	-68	-38.4	178.1	-64.8	175.4	0	0	0	111.6	N8 D9 V13 T14 L15	N8-H11 WeakPolarHBondContact O-CA 3.43Å; N8-H11 WeakPolarHBondContact O-CB 3.38Å; N8-H11 PolarHBondContact O-N 3.31Å; D9-H11 PolarHBondContact O-N 3.37Å; H11-V13 VanDerWaalsContact C-N 3.3Å; H11-V13 PolarHBondContact O-N 3.23Å; H11-T14 PolarHBondContact O-N 2.88Å; H11-L15 WeakPolarHBondContact O-CB 3.27Å; H11-L15 VanDerWaalsContact O-CG 3.25Å; H11-L15 WeakPolarHBondContact O-CG 3.45Å; H11-L15 PolarHBondContact O-N 2.65Å
12	V	85.4	Confident	76.8	Confident	26 Å²	26	85.5 Å²	85.5	16%	0.158	44%	0.438	C	S	.	.	H	α-helix	trans	-61.8	-42.2	176.3	179.8	0	0	0	0	110.2	L7 N8 D9 G16 F52 P62	L7-V12 HydrophobicContact CB-CG2 3.62Å; L7-V12 HydrophobicContact CD1-CG2 4.37Å; N8-V12 PolarHBondContact O-N 2.84Å; D9-V12 PolarHBondContact O-N 3.03Å; V12-G16 PolarHBondContact O-N 2.81Å; V12-F52 HydrophobicContact CG1-CE1 4.17Å; V12-P62 HydrophobicContact CG1-CG 3.81Å
13	V	88.3	Confident	78.3	Confident	45 Å²	45	80.7 Å²	80.7	27%	0.273	42%	0.419	S	S	.	.	H	α-helix	trans	-63.8	-49.8	175.5	174.1	0	0	0	0	111.3	D9 G10 H11 L15 G16 L17 R61	D9-V13 WeakPolarHBondContact O-CG2 3.34Å; D9-V13 PolarHBondContact O-N 2.87Å; G10-V13 PolarHBondContact O-N 2.89Å; H11-V13 VanDerWaalsContact C-N 3.3Å; H11-V13 PolarHBondContact O-N 3.23Å; V13-L15 PolarHBondContact O-N 2.83Å; V13-G16 PolarHBondContact O-N 3.19Å; V13-G16 VanDerWaalsContact O-N 3.16Å; V13-L17 HydrophobicContact CG1-CD1 4.26Å; V13-L17 WeakPolarHBondContact O-CG 3.48Å; V13-L17 PolarHBondContact O-N 3.01Å; V13-R61 HydrophobicContact CG2-CG 4.27Å
14	T	88.4	Confident	79.8	Confident	81 Å²	81	77 Å²	77	50%	0.497	41%	0.412	S	S	.	.	H	α-helix	trans	-59.6	-46.4	179.3	-57.2	0	0	0	0	112.1	G10 H11 G16 L17 L18	G10-T14 PolarHBondContact O-N 2.83Å; G10-T14 PolarHBondContact O-OG1 3.08Å; G10-T14 VanDerWaalsContact O-OG1 3.06Å; H11-T14 PolarHBondContact O-N 2.88Å; T14-G16 VanDerWaalsContact C-N 3.32Å; T14-G16 PolarHBondContact O-N 3.02Å; T14-L17 PolarHBondContact O-N 3.42Å; T14-L18 HydrophobicContact CG2-CD1 4.31Å; T14-L18 WeakPolarHBondContact O-CG 3.25Å; T14-L18 PolarHBondContact O-N 2.85Å
15	L	89.1	Confident	81.5	Confident	47 Å²	47	80.8 Å²	80.8	25%	0.246	41%	0.408	C	S	.	.	H	α-helix	trans	-66.5	-35.4	176.8	-68.4	172.1	0	0	0	111.8	L7 H11 V13 L18 A19 L47 L50 F52	L7-L15 HydrophobicContact CD1-CD1 4.34Å; H11-L15 WeakPolarHBondContact O-CB 3.27Å; H11-L15 VanDerWaalsContact O-CG 3.25Å; H11-L15 WeakPolarHBondContact O-CG 3.45Å; H11-L15 PolarHBondContact O-N 2.65Å; V13-L15 PolarHBondContact O-N 2.83Å; L15-L18 HydrophobicContact CD2-CD1 4.27Å; L15-L18 WeakPolarHBondContact O-CB 2.97Å; L15-L18 PolarHBondContact O-N 3.18Å; L15-A19 WeakPolarHBondContact O-CB 3.1Å; L15-A19 PolarHBondContact O-N 2.72Å; L15-L47 HydrophobicContact CD2-CD2 4.32Å; L15-L50 HydrophobicContact CD1-CD1 4.12Å; L15-F52 HydrophobicContact CB-CE1 4.14Å; L15-F52 HydrophobicContact CB-CE2 4.19Å; L15-F52 HydrophobicContact CB-CZ 3.46Å; L15-F52 VanDerWaalsContact CB-CZ 3.46Å
16	G	88.9	Confident	82.7	Confident	0 Å²	0	80.4 Å²	80.4	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-61.9	-43.8	173.4	0	0	0	0	0	112.4	V12 V13 T14 A19 Q20 F54	V12-G16 PolarHBondContact O-N 2.81Å; V13-G16 PolarHBondContact O-N 3.19Å; V13-G16 VanDerWaalsContact O-N 3.16Å; T14-G16 VanDerWaalsContact C-N 3.32Å; T14-G16 PolarHBondContact O-N 3.02Å; G16-A19 WeakPolarHBondContact O-CB 3.46Å; G16-A19 PolarHBondContact O-N 2.69Å; G16-Q20 PolarHBondContact O-N 3.2Å; G16-F54 WeakPolarHBondContact O-CZ 3.16Å
17	L	89.4	Confident	83.6	Confident	80 Å²	80	69.8 Å²	69.8	42%	0.419	37%	0.368	S	S	.	.	H	α-helix	trans	-63.7	-42.5	174.8	-69.5	172.2	0	0	0	111.6	V13 T14 A19 Q20 K21 P60	V13-L17 HydrophobicContact CG1-CD1 4.26Å; V13-L17 WeakPolarHBondContact O-CG 3.48Å; V13-L17 PolarHBondContact O-N 3.01Å; T14-L17 PolarHBondContact O-N 3.42Å; L17-A19 VanDerWaalsContact C-N 3.3Å; L17-A19 PolarHBondContact O-N 3.44Å; L17-Q20 PolarHBondContact O-N 3.28Å; L17-Q20 VanDerWaalsContact O-N 3.15Å; L17-K21 PolarHBondContact O-N 2.84Å; L17-P60 HydrophobicContact CD2-CB 4.04Å
18	L	89.8	Confident	84.2	Confident	73 Å²	73	72.2 Å²	72.2	38%	0.382	37%	0.374	S	S	.	.	H	α-helix	trans	-60.2	-40.4	172.3	-76.9	162.8	0	0	0	111.5	T14 L15 Q20 K21 D22 G23 L47	T14-L18 HydrophobicContact CG2-CD1 4.31Å; T14-L18 WeakPolarHBondContact O-CG 3.25Å; T14-L18 PolarHBondContact O-N 2.85Å; L15-L18 HydrophobicContact CD2-CD1 4.27Å; L15-L18 WeakPolarHBondContact O-CB 2.97Å; L15-L18 PolarHBondContact O-N 3.18Å; L18-Q20 VanDerWaalsContact C-N 3.31Å; L18-Q20 PolarHBondContact O-N 2.99Å; L18-K21 PolarHBondContact O-N 2.98Å; L18-D22 WeakPolarHBondContact O-CA 3.29Å; L18-D22 PolarHBondContact O-N 3.39Å; L18-G23 PolarHBondContact O-N 3.27Å; L18-L47 HydrophobicContact CB-CD2 3.97Å
19	A	87.3	Confident	84.1	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-64.1	-36.6	175.6	0	0	0	0	0	111.8	L15 G16 L17 G23 K26 A45 L47 F52	L15-A19 WeakPolarHBondContact O-CB 3.1Å; L15-A19 PolarHBondContact O-N 2.72Å; G16-A19 WeakPolarHBondContact O-CB 3.46Å; G16-A19 PolarHBondContact O-N 2.69Å; L17-A19 VanDerWaalsContact C-N 3.3Å; L17-A19 PolarHBondContact O-N 3.44Å; A19-G23 WeakPolarHBondContact O-CA 3.38Å; A19-G23 PolarHBondContact O-N 3.15Å; A19-K26 WeakPolarHBondContact O-CD 3.5Å; A19-K26 WeakPolarHBondContact O-CE 3.49Å; A19-A45 HydrophobicContact CB-CB 3.79Å; A19-L47 HydrophobicContact CB-CB 3.7Å; A19-L47 HydrophobicContact CB-CD2 4.29Å; A19-L47 HydrophobicContact CB-CG 4.5Å; A19-F52 HydrophobicContact CB-CD2 3.54Å; A19-F52 HydrophobicContact CB-CE2 4.08Å; A19-F52 HydrophobicContact CB-CG 4.26Å
20	Q	86.8	Confident	83.8	Confident	39 Å²	39	64.2 Å²	64.2	18%	0.182	33%	0.334	C	S	.	.	H	α-helix	trans	-70.5	-34.6	175.2	-74.1	-170.7	68.7	0	0	113.2	G16 L17 L18 K26 F54 D57 S59	G16-Q20 PolarHBondContact O-N 3.2Å; L17-Q20 PolarHBondContact O-N 3.28Å; L17-Q20 VanDerWaalsContact O-N 3.15Å; L18-Q20 VanDerWaalsContact C-N 3.31Å; L18-Q20 PolarHBondContact O-N 2.99Å; Q20-K26 WeakPolarHBondContact O-CD 3.43Å; Q20-K26 VanDerWaalsContact O-CE 3.29Å; Q20-K26 WeakPolarHBondContact O-CE 3.34Å; Q20-K26 PolarHBondContact O-NZ 3.47Å; Q20-F54 HydrophobicContact CG-CD2 4.46Å; Q20-F54 HydrophobicContact CG-CE1 4.2Å; Q20-F54 HydrophobicContact CG-CE2 3.89Å; Q20-F54 HydrophobicContact CG-CZ 3.77Å; Q20-D57 PolarHBondContact OE1-O 3.42Å; Q20-S59 PolarHBondContact NE2-O 2.81Å
21	K	87.2	Confident	83.3	Confident	159 Å²	159	63.8 Å²	63.8	69%	0.691	32%	0.321	S	S	*	.	H	α-helix	trans	-82.8	-53.4	179.6	-170.8	-174	172.4	-172	0	112.5	L17 L18 K26	L17-K21 PolarHBondContact O-N 2.84Å; L18-K21 PolarHBondContact O-N 2.98Å; K21-K26 PolarHBondContact O-NZ 3.05Å
22	D	85.8	Confident	82.6	Confident	97 Å²	97	62.7 Å²	62.7	52%	0.519	31%	0.313	S	S	.	.	H	α-helix	trans	-116.3	3.6	-167.9	-57.8	-47.3	0	0	0	113.3	L18 T24	L18-D22 WeakPolarHBondContact O-CA 3.29Å; L18-D22 PolarHBondContact O-N 3.39Å; D22-T24 PolarHBondContact O-N 2.73Å
23	G	77.9	Confident	81.6	Confident	10 Å²	10	62.4 Å²	62.4	10%	0.103	31%	0.312	C	S	.	.			trans	-56.4	135.9	178.3	0	0	0	0	0	112.8	L18 A19 R25 K26 L46	L18-G23 PolarHBondContact O-N 3.27Å; A19-G23 WeakPolarHBondContact O-CA 3.38Å; A19-G23 PolarHBondContact O-N 3.15Å; G23-R25 PolarHBondContact O-N 2.95Å; G23-K26 WeakPolarHBondContact O-CE 3.18Å; G23-L46 CarbonylContact C-O 3.47Å; G23-L46 VanDerWaalsContact CA-O 3.27Å; G23-L46 WeakPolarHBondContact CA-O 3.44Å
24	T	73.8	Confident	80.3	Confident	113 Å²	113	63.1 Å²	63.1	69%	0.693	32%	0.322	S	S	*	.	S	Bend	trans	-66.3	-29.5	-175.2	-39.9	0	0	0	0	112	D22 L46	D22-T24 PolarHBondContact O-N 2.73Å; T24-L46 PolarHBondContact N-O 3.49Å
25	R	79.4	Confident	79.4	Confident	166 Å²	166	66.1 Å²	66.1	63%	0.626	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.3	131	178.9	-62.5	-176	-177.9	177.4	3.1	109.9	G23 L46	G23-R25 PolarHBondContact O-N 2.95Å; R25-L46 HydrophobicContact CB-CB 4.36Å; R25-L46 PolarHBondContact O-N 2.99Å
26	K	82.2	Confident	78.2	Confident	82 Å²	82	67.7 Å²	67.7	36%	0.357	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	148.6	-179.1	-45.6	170	-151.8	164.1	0	109.4	A19 Q20 K21 G23 W43 F44 A45	A19-K26 WeakPolarHBondContact O-CD 3.5Å; A19-K26 WeakPolarHBondContact O-CE 3.49Å; Q20-K26 WeakPolarHBondContact O-CD 3.43Å; Q20-K26 VanDerWaalsContact O-CE 3.29Å; Q20-K26 WeakPolarHBondContact O-CE 3.34Å; Q20-K26 PolarHBondContact O-NZ 3.47Å; K21-K26 PolarHBondContact O-NZ 3.05Å; G23-K26 WeakPolarHBondContact O-CE 3.18Å; K26-W43 HydrophobicContact CB-CH2 4.29Å; K26-W43 HydrophobicContact CB-CZ2 3.59Å; K26-F44 CarbonylContact C-O 3.51Å; K26-F44 WeakPolarHBondContact CA-O 3.18Å; K26-A45 HydrophobicContact CB-CB 4.47Å; K26-A45 HydrophobicContact CG-CB 4Å
27	G	79.6	Confident	77.4	Confident	18 Å²	18	72.7 Å²	72.7	19%	0.186	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.5	165	179.4	0	0	0	0	0	114.1	W43 F44	G27-W43 VanDerWaalsContact CA-CZ3 3.4Å; G27-F44 PolarHBondContact N-O 2.85Å; G27-F44 PolarHBondContact O-N 2.82Å
28	Y	79.3	Confident	76.8	Confident	108 Å²	108	76.6 Å²	76.6	42%	0.424	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	125.6	172.1	-73.9	-74.2	0	0	0	110.9	T41 K42 W43 D57	Y28-T41 HydrophobicContact CD1-CG2 3.88Å; Y28-T41 HydrophobicContact CG-CG2 4.24Å; Y28-K42 WeakPolarHBondContact CA-O 3.36Å; Y28-W43 HydrophobicContact CD1-CB 4.24Å; Y28-W43 HydrophobicContact CD1-CE3 4.01Å; Y28-W43 AromaticContact CD2-CE3 3.46Å; Y28-W43 HydrophobicContact CD2-CE3 3.46Å; Y28-W43 VanDerWaalsContact CD2-CE3 3.46Å; Y28-W43 AromaticContact CD2-CZ3 3.56Å; Y28-W43 HydrophobicContact CD2-CZ3 3.56Å; Y28-W43 HydrophobicContact CE1-CB 4Å; Y28-W43 HydrophobicContact CE1-CE3 4.01Å; Y28-W43 AromaticContact CE2-CE3 3.43Å; Y28-W43 HydrophobicContact CE2-CE3 3.43Å; Y28-W43 VanDerWaalsContact CE2-CE3 3.43Å; Y28-W43 AromaticContact CE2-CZ3 3.59Å; Y28-W43 HydrophobicContact CE2-CZ3 3.59Å; Y28-W43 AromaticContact CG-CE3 3.74Å; Y28-W43 HydrophobicContact CG-CE3 3.74Å; Y28-W43 HydrophobicContact CG-CZ3 4.24Å; Y28-W43 AromaticContact CZ-CE3 3.72Å; Y28-D57 PolarHBondContact OH-OD1 2.69Å
29	L	77.6	Confident	76.1	Confident	13 Å²	13	77.7 Å²	77.7	7%	0.068	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	147.8	175.6	-47.5	178.4	0	0	0	110.5	T41 K42 F44 V131 F133	L29-T41 WeakPolarHBondContact O-CA 3.43Å; L29-K42 PolarHBondContact N-O 2.91Å; L29-K42 PolarHBondContact O-N 2.85Å; L29-F44 HydrophobicContact CB-CD2 3.51Å; L29-F44 HydrophobicContact CB-CE2 3.73Å; L29-F44 HydrophobicContact CB-CG 4.33Å; L29-F44 HydrophobicContact CD1-CB 3.76Å; L29-F44 HydrophobicContact CD1-CD1 4.37Å; L29-F44 HydrophobicContact CD1-CD2 3.75Å; L29-F44 HydrophobicContact CD1-CE2 4.43Å; L29-F44 HydrophobicContact CD1-CG 3.71Å; L29-F44 HydrophobicContact CG-CB 4.15Å; L29-F44 HydrophobicContact CG-CD2 3.7Å; L29-F44 HydrophobicContact CG-CE2 4.4Å; L29-F44 HydrophobicContact CG-CG 4.12Å; L29-V131 HydrophobicContact CB-CG1 4.03Å; L29-V131 HydrophobicContact CD1-CG1 3.79Å; L29-F133 HydrophobicContact CD1-CD1 3.27Å; L29-F133 HydrophobicContact CD1-CE1 3.27Å; L29-F133 HydrophobicContact CD1-CG 3.96Å; L29-F133 HydrophobicContact CD1-CZ 3.96Å; L29-F133 HydrophobicContact CD2-CB 4.23Å; L29-F133 HydrophobicContact CD2-CD1 4.02Å; L29-F133 HydrophobicContact CD2-CG 4.35Å; L29-F133 HydrophobicContact CG-CD1 4.28Å
30	S	73.4	Confident	75.5	Confident	39 Å²	39	81.3 Å²	81.3	27%	0.273	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	120.9	174.1	-54.4	0	0	0	0	109.6	Q40 V131 S132	S30-Q40 CarbonylContact C-O 3.24Å; S30-Q40 VanDerWaalsContact CA-O 3.31Å; S30-Q40 WeakPolarHBondContact CA-O 3.4Å; S30-V131 WeakPolarHBondContact O-CA 3.3Å; S30-S132 PolarHBondContact N-O 2.95Å; S30-S132 PolarHBondContact O-N 2.8Å
31	K	72.7	Confident	75.1	Confident	30 Å²	30	83.6 Å²	83.6	13%	0.13	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	134.5	177.4	-179.4	-165.7	176.1	-157.3	0	109.3	S33 Q40 F44 Y66 L129 E130 V131	K31-S33 WeakPolarHBondContact CE-OG 3.33Å; K31-S33 PolarHBondContact NZ-OG 3.07Å; K31-Q40 PolarHBondContact N-O 3.34Å; K31-Q40 PolarHBondContact O-N 2.99Å; K31-F44 HydrophobicContact CB-CZ 4.07Å; K31-F44 HydrophobicContact CD-CZ 4.29Å; K31-Y66 WeakPolarHBondContact CE-OH 3.42Å; K31-Y66 PolarHBondContact NZ-OH 3.14Å; K31-L129 HydrophobicContact CG-CD2 4.41Å; K31-E130 CarbonylContact C-O 3.59Å; K31-E130 WeakPolarHBondContact CA-O 3.1Å; K31-V131 HydrophobicContact CG-CG2 4.49Å
32	R	71.8	Confident	75	Confident	91 Å²	91	77.8 Å²	77.8	34%	0.343	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.5	163.3	-173.6	173.1	63	158.9	-1.9	108.3	P37 W39 L129 E130	R32-P37 WeakPolarHBondContact CD-O 3.4Å; R32-W39 HydrophobicContact CB-CD2 3.94Å; R32-W39 HydrophobicContact CB-CE3 3.9Å; R32-W39 HydrophobicContact CB-CH2 4.46Å; R32-W39 HydrophobicContact CB-CZ2 4.43Å; R32-W39 HydrophobicContact CB-CZ3 4.17Å; R32-L129 WeakPolarHBondContact O-CA 3.11Å; R32-E130 HydrophobicContact CB-CB 4.37Å; R32-E130 IonicContact CZ-OE2 3.88Å; R32-E130 PolarHBondContact N-O 3.49Å; R32-E130 IonicContact NE-OE2 2.83Å; R32-E130 IonicContact NH2-OE2 2.79Å; R32-E130 PolarHBondContact NH2-OE2 2.92Å; R32-E130 PolarHBondContact O-N 3.38Å
33	S	64.6	Low	74.9	Confident	19 Å²	19	75.2 Å²	75.2	13%	0.133	38%	0.381	C	S	.	.			trans	-109.9	161.7	179.7	-44.6	0	0	0	0	109.8	K31 D35 N36	K31-S33 WeakPolarHBondContact CE-OG 3.33Å; K31-S33 PolarHBondContact NZ-OG 3.07Å; S33-D35 PolarHBondContact O-N 2.84Å; S33-N36 PolarHBondContact N-O 3.43Å; S33-N36 CarbonylContact O-C 3.57Å; S33-N36 VanDerWaalsContact O-C 3.24Å; S33-N36 PolarHBondContact O-N 2.82Å
34	A	61.5	Low	75.2	Confident	60 Å²	60	75 Å²	75	50%	0.496	38%	0.377	S	S	.	.	S	Bend	trans	-60.3	-38.1	173.2	0	0	0	0	0	111.1	N36	A34-N36 VanDerWaalsContact C-N 3.29Å; A34-N36 PolarHBondContact O-N 2.93Å
35	D	68.4	Low	75.7	Confident	144 Å²	144	69.6 Å²	69.6	77%	0.77	34%	0.344	S	S	*	.	S	Bend	trans	-74.2	-19.6	179.8	-39.7	-67.2	0	0	0	113.1	S33	S33-D35 PolarHBondContact O-N 2.84Å
36	N	64.8	Low	75.8	Confident	80 Å²	80	63.4 Å²	63.4	43%	0.428	32%	0.323	S	S	.	.			trans	-136.8	100.3	-175.1	-91.9	-68.5	0	0	0	110.2	S33 A34 K38	S33-N36 PolarHBondContact N-O 3.43Å; S33-N36 CarbonylContact O-C 3.57Å; S33-N36 VanDerWaalsContact O-C 3.24Å; S33-N36 PolarHBondContact O-N 2.82Å; A34-N36 VanDerWaalsContact C-N 3.29Å; A34-N36 PolarHBondContact O-N 2.93Å; N36-K38 PolarHBondContact O-N 2.83Å
37	P	72.3	Confident	75.7	Confident	106 Å²	106	60.7 Å²	60.7	69%	0.688	31%	0.313	S	S	*	.			trans	-71.3	-14.9	-178	28.7	-34.8	0	0	0	112.9	R32	R32-P37 WeakPolarHBondContact CD-O 3.4Å
38	K	76.6	Confident	76	Confident	161 Å²	161	67.4 Å²	67.4	70%	0.7	34%	0.339	S	S	*	.	S	Bend	trans	-76.9	129.8	176.2	-169.7	174.9	-179.3	179	0	110.3	N36 Q40	N36-K38 PolarHBondContact O-N 2.83Å; K38-Q40 PolarHBondContact O-N 2.94Å
39	W	75.6	Confident	75.9	Confident	96 Å²	96	65.1 Å²	65.1	36%	0.364	33%	0.334	S	S	.	.			trans	-63.9	124.5	170.1	-69.3	92.7	0	0	0	110	R32 E130 S132	R32-W39 HydrophobicContact CB-CD2 3.94Å; R32-W39 HydrophobicContact CB-CE3 3.9Å; R32-W39 HydrophobicContact CB-CH2 4.46Å; R32-W39 HydrophobicContact CB-CZ2 4.43Å; R32-W39 HydrophobicContact CB-CZ3 4.17Å; W39-E130 HydrophobicContact CH2-CB 3.45Å; W39-E130 VanDerWaalsContact CH2-CB 3.45Å; W39-E130 HydrophobicContact CH2-CG 4.3Å; W39-E130 WeakPolarHBondContact CH2-OE2 3.42Å; W39-E130 HydrophobicContact CZ2-CB 4.2Å; W39-E130 VanDerWaalsContact CZ2-OE2 3.3Å; W39-E130 WeakPolarHBondContact CZ2-OE2 3.41Å; W39-E130 HydrophobicContact CZ3-CB 3.92Å; W39-E130 VanDerWaalsContact CZ3-O 3.31Å; W39-E130 WeakPolarHBondContact CZ3-O 3.44Å; W39-S132 WeakPolarHBondContact CZ3-OG 3.5Å
40	Q	73.5	Confident	76	Confident	76 Å²	76	65.3 Å²	65.3	36%	0.355	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.5	176.3	-62.4	-172.2	31.8	0	0	109.9	S30 K31 K38	S30-Q40 CarbonylContact C-O 3.24Å; S30-Q40 VanDerWaalsContact CA-O 3.31Å; S30-Q40 WeakPolarHBondContact CA-O 3.4Å; K31-Q40 PolarHBondContact N-O 3.34Å; K31-Q40 PolarHBondContact O-N 2.99Å; K38-Q40 PolarHBondContact O-N 2.94Å
41	T	79.5	Confident	76.5	Confident	88 Å²	88	64 Å²	64	54%	0.54	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	122.8	171.9	-58.7	0	0	0	0	108.7	Y28 L29	Y28-T41 HydrophobicContact CD1-CG2 3.88Å; Y28-T41 HydrophobicContact CG-CG2 4.24Å; L29-T41 WeakPolarHBondContact O-CA 3.43Å
42	K	83.9	Confident	77.1	Confident	36 Å²	36	62.5 Å²	62.5	16%	0.157	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	155.4	177.3	-68.1	-68.9	-179.5	179.9	0	109.2	Y28 L29 F44 E55	Y28-K42 WeakPolarHBondContact CA-O 3.36Å; L29-K42 PolarHBondContact N-O 2.91Å; L29-K42 PolarHBondContact O-N 2.85Å; K42-F44 HydrophobicContact CB-CD2 4.44Å; K42-F44 HydrophobicContact CB-CE2 3.79Å; K42-F44 HydrophobicContact CB-CZ 4.41Å; K42-F44 VanDerWaalsContact O-CD2 3.26Å; K42-F44 WeakPolarHBondContact O-CD2 3.26Å; K42-E55 IonicContact NZ-OE1 3.62Å; K42-E55 PolarHBondContact NZ-OE1 2.91Å
43	W	83.6	Confident	77.7	Confident	43 Å²	43	60.4 Å²	60.4	16%	0.163	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	130.5	176.7	179.6	-104.2	0	0	0	109.6	K26 G27 Y28 Y53 F54 D57	K26-W43 HydrophobicContact CB-CH2 4.29Å; K26-W43 HydrophobicContact CB-CZ2 3.59Å; G27-W43 VanDerWaalsContact CA-CZ3 3.4Å; Y28-W43 HydrophobicContact CD1-CB 4.24Å; Y28-W43 HydrophobicContact CD1-CE3 4.01Å; Y28-W43 AromaticContact CD2-CE3 3.46Å; Y28-W43 HydrophobicContact CD2-CE3 3.46Å; Y28-W43 VanDerWaalsContact CD2-CE3 3.46Å; Y28-W43 AromaticContact CD2-CZ3 3.56Å; Y28-W43 HydrophobicContact CD2-CZ3 3.56Å; Y28-W43 HydrophobicContact CE1-CB 4Å; Y28-W43 HydrophobicContact CE1-CE3 4.01Å; Y28-W43 AromaticContact CE2-CE3 3.43Å; Y28-W43 HydrophobicContact CE2-CE3 3.43Å; Y28-W43 VanDerWaalsContact CE2-CE3 3.43Å; Y28-W43 AromaticContact CE2-CZ3 3.59Å; Y28-W43 HydrophobicContact CE2-CZ3 3.59Å; Y28-W43 AromaticContact CG-CE3 3.74Å; Y28-W43 HydrophobicContact CG-CE3 3.74Å; Y28-W43 HydrophobicContact CG-CZ3 4.24Å; Y28-W43 AromaticContact CZ-CE3 3.72Å; W43-Y53 CarbonylContact O-C 3.53Å; W43-Y53 VanDerWaalsContact O-CA 3.27Å; W43-Y53 WeakPolarHBondContact O-CA 3.43Å; W43-F54 HydrophobicContact CB-CB 4.14Å; W43-F54 AromaticContact CD1-CD2 3.82Å; W43-F54 PolarHBondContact N-O 2.91Å; W43-F54 PolarHBondContact O-N 3.45Å; W43-D57 HydrophobicContact CD2-CB 3.74Å; W43-D57 HydrophobicContact CE3-CB 4.02Å; W43-D57 HydrophobicContact CG-CB 4.1Å; W43-D57 HydrophobicContact CH2-CB 4.35Å; W43-D57 HydrophobicContact CZ2-CB 4.1Å; W43-D57 HydrophobicContact CZ3-CB 4.3Å
44	F	84.5	Confident	78.9	Confident	5 Å²	5	59.5 Å²	59.5	2%	0.022	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	142.5	179	-72	-101.3	0	0	0	110.3	K26 G27 L29 K31 K42 L51 F52 Y53 Y66	K26-F44 CarbonylContact C-O 3.51Å; K26-F44 WeakPolarHBondContact CA-O 3.18Å; G27-F44 PolarHBondContact N-O 2.85Å; G27-F44 PolarHBondContact O-N 2.82Å; L29-F44 HydrophobicContact CB-CD2 3.51Å; L29-F44 HydrophobicContact CB-CE2 3.73Å; L29-F44 HydrophobicContact CB-CG 4.33Å; L29-F44 HydrophobicContact CD1-CB 3.76Å; L29-F44 HydrophobicContact CD1-CD1 4.37Å; L29-F44 HydrophobicContact CD1-CD2 3.75Å; L29-F44 HydrophobicContact CD1-CE2 4.43Å; L29-F44 HydrophobicContact CD1-CG 3.71Å; L29-F44 HydrophobicContact CG-CB 4.15Å; L29-F44 HydrophobicContact CG-CD2 3.7Å; L29-F44 HydrophobicContact CG-CE2 4.4Å; L29-F44 HydrophobicContact CG-CG 4.12Å; K31-F44 HydrophobicContact CB-CZ 4.07Å; K31-F44 HydrophobicContact CD-CZ 4.29Å; K42-F44 HydrophobicContact CB-CD2 4.44Å; K42-F44 HydrophobicContact CB-CE2 3.79Å; K42-F44 HydrophobicContact CB-CZ 4.41Å; K42-F44 VanDerWaalsContact O-CD2 3.26Å; K42-F44 WeakPolarHBondContact O-CD2 3.26Å; F44-L51 HydrophobicContact CB-CD1 4.24Å; F44-L51 HydrophobicContact CD1-CD1 4.21Å; F44-L51 HydrophobicContact CD1-CD2 4.12Å; F44-L51 HydrophobicContact CD1-CG 4.05Å; F44-F52 CarbonylContact C-O 3.58Å; F44-F52 VanDerWaalsContact CA-O 3.3Å; F44-F52 WeakPolarHBondContact CA-O 3.3Å; F44-Y53 VanDerWaalsContact CE1-CB 3.49Å; F44-Y53 HydrophobicContact CE1-CG 4.29Å; F44-Y66 HydrophobicContact CE1-CE2 4.5Å
45	A	85.3	Confident	80.2	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	125.4	173.5	0	0	0	0	0	109.9	A19 K26 F52 F54	A19-A45 HydrophobicContact CB-CB 3.79Å; K26-A45 HydrophobicContact CB-CB 4.47Å; K26-A45 HydrophobicContact CG-CB 4Å; A45-F52 PolarHBondContact N-O 2.94Å; A45-F52 PolarHBondContact O-N 2.96Å; A45-F54 HydrophobicContact CB-CE2 4.04Å
46	L	80.2	Confident	81	Confident	37 Å²	37	57.6 Å²	57.6	19%	0.194	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	121.3	176.9	-178.6	67.9	0	0	0	109.5	G23 T24 R25 L51 L68	G23-L46 CarbonylContact C-O 3.47Å; G23-L46 VanDerWaalsContact CA-O 3.27Å; G23-L46 WeakPolarHBondContact CA-O 3.44Å; T24-L46 PolarHBondContact N-O 3.49Å; R25-L46 HydrophobicContact CB-CB 4.36Å; R25-L46 PolarHBondContact O-N 2.99Å; L46-L51 HydrophobicContact CB-CD1 4.07Å; L46-L51 HydrophobicContact CD1-CB 4.14Å; L46-L51 HydrophobicContact CD1-CD1 4.23Å; L46-L68 HydrophobicContact CD1-CD1 3.72Å
47	L	81.9	Confident	81.9	Confident	25 Å²	25	57.7 Å²	57.7	13%	0.131	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	109.8	172.3	-176.3	67.8	0	0	0	108.3	L15 L18 A19 N49 L50 F52	L15-L47 HydrophobicContact CD2-CD2 4.32Å; L18-L47 HydrophobicContact CB-CD2 3.97Å; A19-L47 HydrophobicContact CB-CB 3.7Å; A19-L47 HydrophobicContact CB-CD2 4.29Å; A19-L47 HydrophobicContact CB-CG 4.5Å; L47-N49 PolarHBondContact O-N 2.86Å; L47-L50 PolarHBondContact N-O 3.16Å; L47-L50 WeakPolarHBondContact O-CA 3.33Å; L47-L50 WeakPolarHBondContact O-CB 3.27Å; L47-L50 PolarHBondContact O-N 3.35Å; L47-F52 HydrophobicContact CB-CD2 4.49Å; L47-F52 HydrophobicContact CB-CE2 4.21Å; L47-F52 HydrophobicContact CD2-CE2 4.43Å
48	Q	85	Confident	82.4	Confident	159 Å²	159	57.1 Å²	57.1	74%	0.743	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	-106.3	-175.8	-58.5	174.4	-26.8	0	0	112.3
49	N	76.5	Confident	82.8	Confident	60 Å²	60	50.6 Å²	50.6	32%	0.321	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	7.1	177	62.6	-26.4	0	0	0	113	L47 L68	L47-N49 PolarHBondContact O-N 2.86Å; N49-L68 PolarHBondContact O-N 3.5Å
50	L	81.3	Confident	83	Confident	17 Å²	17	50 Å²	50	9%	0.089	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118.1	-177.9	-62.5	175.7	0	0	0	109.9	L15 L47 F52 L65 L67	L15-L50 HydrophobicContact CD1-CD1 4.12Å; L47-L50 PolarHBondContact N-O 3.16Å; L47-L50 WeakPolarHBondContact O-CA 3.33Å; L47-L50 WeakPolarHBondContact O-CB 3.27Å; L47-L50 PolarHBondContact O-N 3.35Å; L50-F52 HydrophobicContact CB-CD2 4.34Å; L50-F52 HydrophobicContact CB-CE2 3.6Å; L50-F52 HydrophobicContact CB-CZ 4.11Å; L50-F52 HydrophobicContact CD1-CE2 4.31Å; L50-F52 HydrophobicContact CD1-CZ 4.21Å; L50-L65 HydrophobicContact CB-CD1 3.69Å; L50-L65 HydrophobicContact CD2-CD1 4.01Å; L50-L65 HydrophobicContact CD2-CD2 4.19Å; L50-L65 HydrophobicContact CG-CD1 4.38Å; L50-L67 HydrophobicContact CD2-CD1 3.57Å
51	L	82.5	Confident	83.6	Confident	10 Å²	10	54.5 Å²	54.5	5%	0.052	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	103.8	177.3	-178.8	68.7	0	0	0	110	F44 L46 Y66 L68 F133	F44-L51 HydrophobicContact CB-CD1 4.24Å; F44-L51 HydrophobicContact CD1-CD1 4.21Å; F44-L51 HydrophobicContact CD1-CD2 4.12Å; F44-L51 HydrophobicContact CD1-CG 4.05Å; L46-L51 HydrophobicContact CB-CD1 4.07Å; L46-L51 HydrophobicContact CD1-CB 4.14Å; L46-L51 HydrophobicContact CD1-CD1 4.23Å; L51-Y66 PolarHBondContact N-O 3.44Å; L51-Y66 PolarHBondContact O-N 3.22Å; L51-L68 HydrophobicContact CB-CD1 3.96Å; L51-L68 HydrophobicContact CB-CD2 4.34Å; L51-L68 HydrophobicContact CB-CG 4.04Å; L51-L68 HydrophobicContact CD2-CD1 4.4Å; L51-L68 HydrophobicContact CD2-CD2 4.39Å; L51-F133 HydrophobicContact CD2-CZ 4.45Å
52	F	86.3	Confident	84	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	146.2	175.9	-63.7	-89.5	0	0	0	110.5	V12 L15 A19 F44 A45 L47 L50 F54 P62 L65	V12-F52 HydrophobicContact CG1-CE1 4.17Å; L15-F52 HydrophobicContact CB-CE1 4.14Å; L15-F52 HydrophobicContact CB-CE2 4.19Å; L15-F52 HydrophobicContact CB-CZ 3.46Å; L15-F52 VanDerWaalsContact CB-CZ 3.46Å; A19-F52 HydrophobicContact CB-CD2 3.54Å; A19-F52 HydrophobicContact CB-CE2 4.08Å; A19-F52 HydrophobicContact CB-CG 4.26Å; F44-F52 CarbonylContact C-O 3.58Å; F44-F52 VanDerWaalsContact CA-O 3.3Å; F44-F52 WeakPolarHBondContact CA-O 3.3Å; A45-F52 PolarHBondContact N-O 2.94Å; A45-F52 PolarHBondContact O-N 2.96Å; L47-F52 HydrophobicContact CB-CD2 4.49Å; L47-F52 HydrophobicContact CB-CE2 4.21Å; L47-F52 HydrophobicContact CD2-CE2 4.43Å; L50-F52 HydrophobicContact CB-CD2 4.34Å; L50-F52 HydrophobicContact CB-CE2 3.6Å; L50-F52 HydrophobicContact CB-CZ 4.11Å; L50-F52 HydrophobicContact CD1-CE2 4.31Å; L50-F52 HydrophobicContact CD1-CZ 4.21Å; F52-F54 HydrophobicContact CB-CD2 4.42Å; F52-F54 HydrophobicContact CB-CE2 3.54Å; F52-F54 HydrophobicContact CB-CZ 3.93Å; F52-P62 HydrophobicContact CD1-CB 4.02Å; F52-P62 HydrophobicContact CD1-CG 4.32Å; F52-L65 HydrophobicContact CD1-CB 4.12Å; F52-L65 HydrophobicContact CD1-CD1 3.87Å; F52-L65 HydrophobicContact CD1-CG 4.43Å; F52-L65 HydrophobicContact CD2-CD1 4.12Å; F52-L65 HydrophobicContact CE1-CB 4.16Å; F52-L65 HydrophobicContact CE1-CD1 3.71Å; F52-L65 HydrophobicContact CE1-CD2 3.97Å; F52-L65 HydrophobicContact CE1-CG 4.15Å; F52-L65 HydrophobicContact CE2-CD1 3.96Å; F52-L65 HydrophobicContact CG-CD1 4.07Å; F52-L65 HydrophobicContact CZ-CD1 3.74Å; F52-L65 HydrophobicContact CZ-CD2 4.19Å; F52-L65 HydrophobicContact CZ-CG 4.48Å
53	Y	84.8	Confident	84.2	Confident	47 Å²	47	52 Å²	52	18%	0.184	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	145.9	168.2	70.8	-90.1	0	0	0	111.6	W43 F44 P62 S63 G64 Y66	W43-Y53 CarbonylContact O-C 3.53Å; W43-Y53 VanDerWaalsContact O-CA 3.27Å; W43-Y53 WeakPolarHBondContact O-CA 3.43Å; F44-Y53 VanDerWaalsContact CE1-CB 3.49Å; F44-Y53 HydrophobicContact CE1-CG 4.29Å; Y53-P62 CarbonylContact O-C 3.51Å; Y53-S63 VanDerWaalsContact CE2-C 3.43Å; Y53-S63 VanDerWaalsContact CZ-C 3.47Å; Y53-S63 PolarHBondContact O-N 2.84Å; Y53-S63 PolarHBondContact OH-O 3.03Å; Y53-G64 VanDerWaalsContact CD1-C 3.47Å; Y53-G64 WeakPolarHBondContact CD1-O 3.31Å; Y53-G64 VanDerWaalsContact CZ-CA 3.4Å; Y53-G64 PolarHBondContact N-O 2.9Å; Y53-G64 PolarHBondContact O-N 3.29Å; Y53-Y66 AromaticContact CD1-CD2 3.96Å; Y53-Y66 HydrophobicContact CD1-CD2 3.96Å; Y53-Y66 AromaticContact CD1-CE2 3.4Å; Y53-Y66 HydrophobicContact CD1-CE2 3.4Å; Y53-Y66 HydrophobicContact CE1-CD2 4.29Å; Y53-Y66 AromaticContact CE1-CE2 3.51Å; Y53-Y66 HydrophobicContact CE1-CE2 3.51Å; Y53-Y66 AromaticContact CE1-CZ 3.83Å; Y53-Y66 HydrophobicContact CG-CE2 4.46Å
54	F	88.4	Confident	84.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	155.3	-172	-62.3	-91	0	0	0	108.7	G16 Q20 W43 A45 F52 S56 S59 P62	G16-F54 WeakPolarHBondContact O-CZ 3.16Å; Q20-F54 HydrophobicContact CG-CD2 4.46Å; Q20-F54 HydrophobicContact CG-CE1 4.2Å; Q20-F54 HydrophobicContact CG-CE2 3.89Å; Q20-F54 HydrophobicContact CG-CZ 3.77Å; W43-F54 HydrophobicContact CB-CB 4.14Å; W43-F54 AromaticContact CD1-CD2 3.82Å; W43-F54 PolarHBondContact N-O 2.91Å; W43-F54 PolarHBondContact O-N 3.45Å; A45-F54 HydrophobicContact CB-CE2 4.04Å; F52-F54 HydrophobicContact CB-CD2 4.42Å; F52-F54 HydrophobicContact CB-CE2 3.54Å; F52-F54 HydrophobicContact CB-CZ 3.93Å; F54-S56 VanDerWaalsContact C-N 3.35Å; F54-S56 WeakPolarHBondContact CB-O 3.42Å; F54-S59 WeakPolarHBondContact CB-OG 3.39Å; F54-S59 WeakPolarHBondContact CD1-O 3.35Å; F54-P62 VanDerWaalsContact CD1-CA 3.47Å; F54-P62 HydrophobicContact CD1-CB 4.11Å; F54-P62 HydrophobicContact CE1-CB 3.57Å; F54-P62 HydrophobicContact CE1-CG 4.26Å; F54-P62 HydrophobicContact CZ-CB 3.84Å
55	E	88.8	Confident	84.1	Confident	129 Å²	129	52.9 Å²	52.9	60%	0.603	28%	0.283	S	S	*	.	S	Bend	trans	-68	-39.9	172.4	-177.4	139.1	-118.7	0	0	111.6	K42 S63	K42-E55 IonicContact NZ-OE1 3.62Å; K42-E55 PolarHBondContact NZ-OE1 2.91Å; E55-S63 PolarHBondContact N-OG 3.33Å
56	S	86.3	Confident	83.8	Confident	35 Å²	35	55.1 Å²	55.1	25%	0.245	29%	0.291	C	S	.	.	S	Bend	trans	-143.5	160.4	-179.1	-175.9	0	0	0	0	110.4	F54 S58 S59	F54-S56 VanDerWaalsContact C-N 3.35Å; F54-S56 WeakPolarHBondContact CB-O 3.42Å; S56-S58 PolarHBondContact O-N 3.44Å; S56-S58 PolarHBondContact OG-OG 3.32Å; S56-S59 PolarHBondContact N-OG 2.97Å; S56-S59 PolarHBondContact O-N 3.37Å; S56-S59 PolarHBondContact O-OG 2.87Å
57	D	82.8	Confident	83.5	Confident	82 Å²	82	56.2 Å²	56.2	44%	0.439	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-18.5	173.2	69.8	-62.8	0	0	0	113.3	Q20 Y28 W43	Q20-D57 PolarHBondContact OE1-O 3.42Å; Y28-D57 PolarHBondContact OH-OD1 2.69Å; W43-D57 HydrophobicContact CD2-CB 3.74Å; W43-D57 HydrophobicContact CE3-CB 4.02Å; W43-D57 HydrophobicContact CG-CB 4.1Å; W43-D57 HydrophobicContact CH2-CB 4.35Å; W43-D57 HydrophobicContact CZ2-CB 4.1Å; W43-D57 HydrophobicContact CZ3-CB 4.3Å
58	S	83.6	Confident	83.2	Confident	94 Å²	94	57.2 Å²	57.2	66%	0.657	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-8.5	175.8	57	0	0	0	0	114	S56 P60	S56-S58 PolarHBondContact O-N 3.44Å; S56-S58 PolarHBondContact OG-OG 3.32Å; S58-P60 WeakPolarHBondContact O-CD 3.46Å
59	S	84.6	Confident	82.5	Confident	24 Å²	24	56.4 Å²	56.4	17%	0.168	30%	0.299	C	S	.	.			trans	-79.2	123.2	-173	64	0	0	0	0	111.1	Q20 F54 S56 R61	Q20-S59 PolarHBondContact NE2-O 2.81Å; F54-S59 WeakPolarHBondContact CB-OG 3.39Å; F54-S59 WeakPolarHBondContact CD1-O 3.35Å; S56-S59 PolarHBondContact N-OG 2.97Å; S56-S59 PolarHBondContact O-N 3.37Å; S56-S59 PolarHBondContact O-OG 2.87Å; S59-R61 VanDerWaalsContact C-N 3.3Å; S59-R61 PolarHBondContact O-N 2.91Å
60	P	78.8	Confident	81.7	Confident	84 Å²	84	57.2 Å²	57.2	55%	0.545	32%	0.321	S	S	.	.	S	Bend	trans	-75.8	-22.7	-176.4	29.3	-35	0	0	0	112.5	L17 S58	L17-P60 HydrophobicContact CD2-CB 4.04Å; S58-P60 WeakPolarHBondContact O-CD 3.46Å
61	R	86.1	Confident	80.8	Confident	170 Å²	170	58.2 Å²	58.2	64%	0.642	33%	0.329	S	S	*	.	S	Bend	trans	-99.4	120.2	-177.1	-171	172.4	-177.7	175.2	1.5	110.2	V13 S59 S63	V13-R61 HydrophobicContact CG2-CG 4.27Å; S59-R61 VanDerWaalsContact C-N 3.3Å; S59-R61 PolarHBondContact O-N 2.91Å; R61-S63 PolarHBondContact O-N 3.47Å
62	P	89.8	Confident	79.3	Confident	12 Å²	12	63.5 Å²	63.5	8%	0.078	36%	0.357	C	S	.	.			trans	-64.3	134.2	171.2	26.9	-32.7	0	0	0	109.9	V12 F52 Y53 F54 G64	V12-P62 HydrophobicContact CG1-CG 3.81Å; F52-P62 HydrophobicContact CD1-CB 4.02Å; F52-P62 HydrophobicContact CD1-CG 4.32Å; Y53-P62 CarbonylContact O-C 3.51Å; F54-P62 VanDerWaalsContact CD1-CA 3.47Å; F54-P62 HydrophobicContact CD1-CB 4.11Å; F54-P62 HydrophobicContact CE1-CB 3.57Å; F54-P62 HydrophobicContact CE1-CG 4.26Å; F54-P62 HydrophobicContact CZ-CB 3.84Å; P62-G64 PolarHBondContact O-N 3.06Å
63	S	87.2	Confident	78	Confident	60 Å²	60	68.3 Å²	68.3	42%	0.42	39%	0.389	S	S	.	.	S	Bend	trans	-74.5	-16.2	173.3	-53.6	0	0	0	0	111.8	Y53 E55 R61	Y53-S63 VanDerWaalsContact CE2-C 3.43Å; Y53-S63 VanDerWaalsContact CZ-C 3.47Å; Y53-S63 PolarHBondContact O-N 2.84Å; Y53-S63 PolarHBondContact OH-O 3.03Å; E55-S63 PolarHBondContact N-OG 3.33Å; R61-S63 PolarHBondContact O-N 3.47Å
64	G	84.3	Confident	76.7	Confident	16 Å²	16	73.1 Å²	73.1	17%	0.165	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.8	-177.6	167.9	0	0	0	0	0	113	Y53 P62	Y53-G64 VanDerWaalsContact CD1-C 3.47Å; Y53-G64 WeakPolarHBondContact CD1-O 3.31Å; Y53-G64 VanDerWaalsContact CZ-CA 3.4Å; Y53-G64 PolarHBondContact N-O 2.9Å; Y53-G64 PolarHBondContact O-N 3.29Å; P62-G64 PolarHBondContact O-N 3.06Å
65	L	81.3	Confident	74.9	Confident	50 Å²	50	81.5 Å²	81.5	26%	0.262	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141	-171.1	166.9	64.4	0	0	0	110.8	L7 L50 F52	L7-L65 HydrophobicContact CD1-CD2 3.8Å; L50-L65 HydrophobicContact CB-CD1 3.69Å; L50-L65 HydrophobicContact CD2-CD1 4.01Å; L50-L65 HydrophobicContact CD2-CD2 4.19Å; L50-L65 HydrophobicContact CG-CD1 4.38Å; F52-L65 HydrophobicContact CD1-CB 4.12Å; F52-L65 HydrophobicContact CD1-CD1 3.87Å; F52-L65 HydrophobicContact CD1-CG 4.43Å; F52-L65 HydrophobicContact CD2-CD1 4.12Å; F52-L65 HydrophobicContact CE1-CB 4.16Å; F52-L65 HydrophobicContact CE1-CD1 3.71Å; F52-L65 HydrophobicContact CE1-CD2 3.97Å; F52-L65 HydrophobicContact CE1-CG 4.15Å; F52-L65 HydrophobicContact CE2-CD1 3.96Å; F52-L65 HydrophobicContact CG-CD1 4.07Å; F52-L65 HydrophobicContact CZ-CD1 3.74Å; F52-L65 HydrophobicContact CZ-CD2 4.19Å; F52-L65 HydrophobicContact CZ-CG 4.48Å
66	Y	79.6	Confident	73.2	Confident	47 Å²	47	76.1 Å²	76.1	18%	0.184	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.8	169.8	-60.3	-71.5	0	0	0	110.5	K31 F44 L51 Y53 L129	K31-Y66 WeakPolarHBondContact CE-OH 3.42Å; K31-Y66 PolarHBondContact NZ-OH 3.14Å; F44-Y66 HydrophobicContact CE1-CE2 4.5Å; L51-Y66 PolarHBondContact N-O 3.44Å; L51-Y66 PolarHBondContact O-N 3.22Å; Y53-Y66 AromaticContact CD1-CD2 3.96Å; Y53-Y66 HydrophobicContact CD1-CD2 3.96Å; Y53-Y66 AromaticContact CD1-CE2 3.4Å; Y53-Y66 HydrophobicContact CD1-CE2 3.4Å; Y53-Y66 HydrophobicContact CE1-CD2 4.29Å; Y53-Y66 AromaticContact CE1-CE2 3.51Å; Y53-Y66 HydrophobicContact CE1-CE2 3.51Å; Y53-Y66 AromaticContact CE1-CZ 3.83Å; Y53-Y66 HydrophobicContact CG-CE2 4.46Å; Y66-L129 HydrophobicContact CD1-CD1 4.16Å; Y66-L129 HydrophobicContact CE1-CD1 3.44Å; Y66-L129 VanDerWaalsContact CE1-CD1 3.44Å
67	L	74.1	Confident	71.5	Confident	59 Å²	59	80.1 Å²	80.1	31%	0.309	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	119.7	169.8	-178.7	68	0	0	0	108.9	I5 L50 E69	I5-L67 HydrophobicContact CD1-CD1 3.85Å; I5-L67 HydrophobicContact CD1-CD2 3.52Å; I5-L67 HydrophobicContact CD1-CG 4.24Å; I5-L67 HydrophobicContact CG1-CD2 4.03Å; L50-L67 HydrophobicContact CD2-CD1 3.57Å; L67-E69 VanDerWaalsContact C-N 3.32Å; L67-E69 HydrophobicContact CD1-CB 4.13Å; L67-E69 HydrophobicContact CD2-CB 4.04Å; L67-E69 HydrophobicContact CG-CB 3.83Å
68	L	74.1	Confident	69.7	Low	47 Å²	47	80.2 Å²	80.2	25%	0.246	45%	0.453	C	S	.	.			trans	-91.5	9.9	-179.3	-58.5	-174.4	0	0	0	113.3	L46 N49 L51 G70 S71 I120	L46-L68 HydrophobicContact CD1-CD1 3.72Å; N49-L68 PolarHBondContact O-N 3.5Å; L51-L68 HydrophobicContact CB-CD1 3.96Å; L51-L68 HydrophobicContact CB-CD2 4.34Å; L51-L68 HydrophobicContact CB-CG 4.04Å; L51-L68 HydrophobicContact CD2-CD1 4.4Å; L51-L68 HydrophobicContact CD2-CD2 4.39Å; L68-G70 PolarHBondContact O-N 3.36Å; L68-S71 WeakPolarHBondContact CA-OG 3.45Å; L68-S71 WeakPolarHBondContact O-CB 3.45Å; L68-S71 PolarHBondContact O-N 3.46Å; L68-I120 HydrophobicContact CD2-CD1 4.46Å
69	E	71.3	Confident	68.1	Low	142 Å²	142	80.1 Å²	80.1	66%	0.664	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	118.1	176.1	-166.5	178.1	151.2	0	0	110	L67 S71	L67-E69 VanDerWaalsContact C-N 3.32Å; L67-E69 HydrophobicContact CD1-CB 4.13Å; L67-E69 HydrophobicContact CD2-CB 4.04Å; L67-E69 HydrophobicContact CG-CB 3.83Å; E69-S71 PolarHBondContact O-N 2.91Å
70	G	58.9	Low	66.2	Low	77 Å²	77	88.4 Å²	88.4	79%	0.794	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	6.8	-175.1	0	0	0	0	0	115.2	L68	L68-G70 PolarHBondContact O-N 3.36Å
71	S	62.8	Low	64.6	Low	37 Å²	37	95.5 Å²	95.5	26%	0.259	50%	0.499	S	S	.	.			trans	-74.7	137.5	176.3	-68.5	0	0	0	0	111.8	L68 E69	L68-S71 WeakPolarHBondContact CA-OG 3.45Å; L68-S71 WeakPolarHBondContact O-CB 3.45Å; L68-S71 PolarHBondContact O-N 3.46Å; E69-S71 PolarHBondContact O-N 2.91Å
72	I	52	Low	62.3	Low	122 Å²	122	91 Å²	91	63%	0.626	50%	0.504	S	S	*	.			trans	-108.7	122.9	-178.7	-58.2	174.4	0	0	0	109.9	K74	I72-K74 HydrophobicContact CG2-CG 4.4Å; I72-K74 PolarHBondContact O-N 2.84Å
73	C	58.6	Low	59.9	Low	101 Å²	101	96.7 Å²	96.7	68%	0.682	54%	0.539	S	S	*	.			trans	-89.2	106.4	175.5	-62.3	0	0	0	0	110.6	L117	C73-L117 HydrophobicContact CB-CD1 3.73Å; C73-L117 WeakPolarHBondContact SG-CD1 3.45Å
74	K	57.1	Low	57.7	Low	148 Å²	148	99.1 Å²	99.1	64%	0.643	56%	0.556	S	S	*	*			trans	-91.2	135.2	168.8	-69.1	-176.4	-178.9	172.8	0	110.4	I72 A76	I72-K74 HydrophobicContact CG2-CG 4.4Å; I72-K74 PolarHBondContact O-N 2.84Å; K74-A76 PolarHBondContact O-N 3.05Å
75	R	51.2	Low	55.2	Low	175 Å²	175	104.1 Å²	104.1	66%	0.66	59%	0.589	S	S	*	*			trans	-80.9	113.9	172.1	-176.4	177	-179.5	-168.2	-3.2	108.5	F115	R75-F115 HydrophobicContact CG-CD1 4.41Å
76	A	52.1	Low	53.1	Low	16 Å²	16	111.3 Å²	111.3	13%	0.132	62%	0.618	C	S	.	*	P	Polyproline II helix	trans	-62.9	144.8	170	0	0	0	0	0	111.2	K74 S78 R116	K74-A76 PolarHBondContact O-N 3.05Å; A76-S78 PolarHBondContact O-N 3.33Å; A76-R116 HydrophobicContact CB-CB 3.57Å; A76-R116 HydrophobicContact CB-CG 3.93Å
77	P	50.5	Low	50.5	Low	120 Å²	120	117.8 Å²	117.8	78%	0.779	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-57.1	127	170.8	24.2	-31.7	0	0	0	108.4
78	S	45.6	Very low	48.4	Very low	84 Å²	84	120.4 Å²	120.4	59%	0.587	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-54.9	137.1	173.4	54.4	0	0	0	0	108.5	A76 K80	A76-S78 PolarHBondContact O-N 3.33Å; S78-K80 PolarHBondContact O-N 3.48Å
79	P	50.9	Low	46.3	Very low	92 Å²	92	121.4 Å²	121.4	60%	0.597	70%	0.695	S	S	*	*			trans	-52.1	114	170.1	-20.7	30.5	0	0	0	107.4	R81	P79-R81 PolarHBondContact O-N 3Å
80	K	43.3	Very low	44.2	Very low	197 Å²	197	122.4 Å²	122.4	86%	0.857	70%	0.699	S	S	*	*			trans	-60.4	113.9	173.8	-70.5	-174.2	178.4	-179.2	0	104.9	S78 G82	S78-K80 PolarHBondContact O-N 3.48Å; K80-G82 PolarHBondContact O-N 2.88Å
81	R	45.7	Very low	42.8	Very low	234 Å²	234	126.3 Å²	126.3	88%	0.883	69%	0.694	S	S	*	*			trans	-56.1	112.8	165.7	-73.4	-171.8	-68.9	-148.8	0.1	105.3	P79 T83	P79-R81 PolarHBondContact O-N 3Å; R81-T83 PolarHBondContact O-N 2.86Å
82	G	38.7	Very low	41.3	Very low	74 Å²	74	131 Å²	131	76%	0.763	71%	0.712	S	S	*	*			trans	-58.7	105.3	179.6	0	0	0	0	0	108.6	K80 S84	K80-G82 PolarHBondContact O-N 2.88Å; G82-S84 VanDerWaalsContact C-N 3.34Å; G82-S84 PolarHBondContact O-N 2.83Å
83	T	38.2	Very low	40.2	Very low	133 Å²	133	135 Å²	135	82%	0.816	72%	0.72	S	S	*	*			trans	-76.9	97.8	154.1	48.1	0	0	0	0	105.1	R81 S85	R81-T83 PolarHBondContact O-N 2.86Å; T83-S85 PolarHBondContact O-N 3Å; T83-S85 VanDerWaalsContact O-N 3.08Å
84	S	40.7	Very low	38.5	Very low	110 Å²	110	138 Å²	138	77%	0.769	72%	0.723	S	S	*	*			trans	-56.4	107.2	158.5	50.7	0	0	0	0	108	G82	G82-S84 VanDerWaalsContact C-N 3.34Å; G82-S84 PolarHBondContact O-N 2.83Å
85	S	33.3	Very low	37.4	Very low	121 Å²	121	134.9 Å²	134.9	85%	0.846	72%	0.72	S	S	*	*			trans	-179.5	142.9	138	-79	0	0	0	0	110.5	T83	T83-S85 PolarHBondContact O-N 3Å; T83-S85 VanDerWaalsContact O-N 3.08Å
86	K	35.8	Very low	36.4	Very low	201 Å²	201	137 Å²	137	87%	0.874	73%	0.728	S	S	*	*			trans	-49.1	148	-179.1	-74.7	164.7	162.6	173.6	0	114.4
87	E	26.7	Very low	35.5	Very low	183 Å²	183	141.2 Å²	141.2	86%	0.855	76%	0.756	S	S	*	*				139.1	124.7	119.3	-161.7	162.9	175	0	0	115.4
88	S	28.6	Very low	34.8	Very low	114 Å²	114	146.6 Å²	146.6	80%	0.797	76%	0.761	S	S	*	*			trans	23.1	130.7	150.2	-149.8	0	0	0	0	122.9
89	G	29.8	Very low	34.7	Very low	68 Å²	68	154.1 Å²	154.1	70%	0.701	78%	0.777	S	S	*	*				86.7	105.9	122.5	0	0	0	0	0	121.7
90	E	28.6	Very low	33.9	Very low	163 Å²	163	161.4 Å²	161.4	76%	0.762	79%	0.792	S	S	*	*			trans	70.6	144.6	134.4	-163.9	167	116	0	0	123.5
91	K	29.1	Very low	33.7	Very low	159 Å²	159	163.3 Å²	163.3	69%	0.691	79%	0.794	S	S	*	*			trans	80.7	107.4	161.6	-90.7	154.6	-177	140.3	0	117.9
92	Q	30.2	Very low	32.9	Very low	137 Å²	137	159.3 Å²	159.3	64%	0.64	79%	0.79	S	S	*	*				89.2	119.6	89.2	-90.9	-158.4	157.3	0	0	114.8
93	R	29.4	Very low	32.9	Very low	205 Å²	205	162.9 Å²	162.9	77%	0.774	80%	0.797	S	S	*	*			trans	77.1	139.3	132.5	-64.2	175.7	-176.6	-107.5	-1.3	119.9
94	H	24.1	Very low	32.5	Very low	164 Å²	164	163.6 Å²	163.6	76%	0.759	80%	0.795	S	S	*	*			trans	107.2	124.6	132.6	-144.8	70.2	0	0	0	117.6
95	S	32.3	Very low	32.2	Very low	83 Å²	83	169.4 Å²	169.4	58%	0.58	80%	0.8	S	S	*	*			trans	-70.1	170.6	172.8	42.7	0	0	0	0	112.1
96	R	31.5	Very low	32	Very low	219 Å²	219	175.5 Å²	175.5	83%	0.826	80%	0.804	S	S	*	*			trans	97	104.7	157.6	-60.5	-177.9	160.8	158	-3.8	118.4
97	S	31.7	Very low	31.5	Very low	104 Å²	104	172.8 Å²	172.8	73%	0.727	80%	0.795	S	S	*	*				70.4	116	116.8	-140.3	0	0	0	0	119.1
98	R	37.3	Very low	31.5	Very low	234 Å²	234	169.9 Å²	169.9	88%	0.883	79%	0.792	S	S	*	*				164	135	105.8	-87.9	176.9	-179.8	-174.5	0.7	112.5
99	R	42.3	Very low	31.5	Very low	242 Å²	242	169.4 Å²	169.4	91%	0.913	78%	0.784	S	S	*	*			trans	-7.4	124.2	157.2	-70.8	171.1	168.4	155.8	-3.6	117.1
100	R	34.4	Very low	31.5	Very low	244 Å²	244	176.8 Å²	176.8	92%	0.921	79%	0.791	S	S	*	*			trans	-137.8	115.7	137.4	-98	-178.3	158.1	149.4	-5.3	109.6	N102	R100-N102 PolarHBondContact O-N 2.98Å
101	R	39.1	Very low	31.6	Very low	237 Å²	237	173.2 Å²	173.2	89%	0.894	78%	0.776	S	S	*	*			trans	-61.7	118.1	164.4	-91.1	174.8	-91.4	158.6	-5.7	107
102	N	28.7	Very low	31.6	Very low	151 Å²	151	168.5 Å²	168.5	81%	0.807	76%	0.764	S	S	*	*			trans	-124.9	107.7	155.5	-96.9	-10.8	0	0	0	106.8	R100 L104	R100-N102 PolarHBondContact O-N 2.98Å; N102-L104 PolarHBondContact O-N 2.76Å
103	V	39.3	Very low	31.8	Very low	149 Å²	149	166.9 Å²	166.9	90%	0.903	75%	0.754	S	S	*	*			trans	-70.8	87.1	163.4	177.1	0	0	0	0	105.5
104	L	30.5	Very low	31.9	Very low	147 Å²	147	160.5 Å²	160.5	77%	0.77	74%	0.738	S	S	*	*			trans	-114.7	118.9	167	-153.4	76.8	0	0	0	106.1	N102 R106	N102-L104 PolarHBondContact O-N 2.76Å; L104-R106 PolarHBondContact O-N 2.8Å
105	R	33.4	Very low	32.3	Very low	233 Å²	233	156 Å²	156	88%	0.879	72%	0.717	S	S	*	*			trans	-15	105.2	164	-84.9	170.6	137.3	-150.4	-2.3	110.9	Q107	R105-Q107 PolarHBondContact O-N 3.34Å
106	R	30.2	Very low	32.5	Very low	248 Å²	248	156.7 Å²	156.7	94%	0.936	71%	0.707	S	S	*	*			trans	-70.3	88.7	172.5	-72.6	-174.1	172.3	-176.3	0.2	107.2	L104	L104-R106 PolarHBondContact O-N 2.8Å
107	Q	23.5	Very low	32.7	Very low	145 Å²	145	147.3 Å²	147.3	68%	0.678	67%	0.673	S	S	*	*			trans	-45	132.8	151.9	-70.7	-77.9	66.3	0	0	106.6	R105 T109	R105-Q107 PolarHBondContact O-N 3.34Å; Q107-T109 PolarHBondContact O-N 2.87Å
108	P	27.8	Very low	32.8	Very low	121 Å²	121	145.3 Å²	145.3	79%	0.786	66%	0.656	S	S	*	*			trans	-64.4	86.1	173	25.3	-29.8	0	0	0	106.7	R110	P108-R110 VanDerWaalsContact C-N 3.34Å; P108-R110 PolarHBondContact O-N 3.21Å
109	T	28.2	Very low	32.6	Very low	104 Å²	104	136.3 Å²	136.3	64%	0.638	63%	0.632	S	S	*	*			trans	-67.8	106.5	174.8	43.6	0	0	0	0	104.4	Q107 I111	Q107-T109 PolarHBondContact O-N 2.87Å; T109-I111 WeakPolarHBondContact O-CG1 3.41Å; T109-I111 PolarHBondContact O-N 2.75Å
110	R	30.5	Very low	32.4	Very low	223 Å²	223	126.3 Å²	126.3	84%	0.842	60%	0.596	S	S	*	*			trans	-54.3	81.7	166.9	-136.3	-177	-167.2	-162.4	4.2	106.7	P108 S112	P108-R110 VanDerWaalsContact C-N 3.34Å; P108-R110 PolarHBondContact O-N 3.21Å; R110-S112 PolarHBondContact O-N 3.32Å
111	I	29.6	Very low	32.1	Very low	88 Å²	88	122.9 Å²	122.9	45%	0.451	59%	0.59	S	S	.	*			trans	-76.8	73.4	174.2	-66.2	162.8	0	0	0	104.8	T109 K113	T109-I111 WeakPolarHBondContact O-CG1 3.41Å; T109-I111 PolarHBondContact O-N 2.75Å; I111-K113 HydrophobicContact CG2-CD 3.69Å; I111-K113 HydrophobicContact CG2-CG 3.58Å; I111-K113 PolarHBondContact O-N 3Å
112	S	29.8	Very low	31.9	Very low	61 Å²	61	115.8 Å²	115.8	43%	0.427	57%	0.569	S	S	.	*			trans	-66.2	82.9	162.6	-76.4	0	0	0	0	106.6	R110 T114	R110-S112 PolarHBondContact O-N 3.32Å; S112-T114 PolarHBondContact O-N 2.78Å; S112-T114 VanDerWaalsContact O-N 3.14Å
113	K	33.2	Very low	31.9	Very low	103 Å²	103	114.5 Å²	114.5	45%	0.448	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.4	99.7	166.6	-83.4	162.6	-179.7	172.5	0	106.1	I111 F115 F133	I111-K113 HydrophobicContact CG2-CD 3.69Å; I111-K113 HydrophobicContact CG2-CG 3.58Å; I111-K113 PolarHBondContact O-N 3Å; K113-F115 HydrophobicContact CB-CD2 3.88Å; K113-F115 HydrophobicContact CB-CE2 3.33Å; K113-F115 HydrophobicContact CB-CZ 3.88Å; K113-F115 HydrophobicContact CD-CE2 4.13Å; K113-F115 HydrophobicContact CD-CZ 3.96Å; K113-F115 HydrophobicContact CG-CE2 4.29Å; K113-F115 HydrophobicContact CG-CZ 4.41Å; K113-F115 WeakPolarHBondContact O-CD2 3.31Å; K113-F115 PolarHBondContact O-N 3.16Å; K113-F133 VanDerWaalsContact O-O 3.13Å
114	T	31.9	Very low	31.5	Very low	71 Å²	71	111.3 Å²	111.3	44%	0.436	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-65.9	99.1	166.2	-44.5	0	0	0	0	107.5	S112 R116	S112-T114 PolarHBondContact O-N 2.78Å; S112-T114 VanDerWaalsContact O-N 3.14Å; T114-R116 HydrophobicContact CG2-CG 4.37Å
115	F	33.6	Very low	31.3	Very low	69 Å²	69	112 Å²	112	30%	0.303	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.2	105.9	166	-61.3	-94.8	0	0	0	106	R75 K113 L117 F133 I135	R75-F115 HydrophobicContact CG-CD1 4.41Å; K113-F115 HydrophobicContact CB-CD2 3.88Å; K113-F115 HydrophobicContact CB-CE2 3.33Å; K113-F115 HydrophobicContact CB-CZ 3.88Å; K113-F115 HydrophobicContact CD-CE2 4.13Å; K113-F115 HydrophobicContact CD-CZ 3.96Å; K113-F115 HydrophobicContact CG-CE2 4.29Å; K113-F115 HydrophobicContact CG-CZ 4.41Å; K113-F115 WeakPolarHBondContact O-CD2 3.31Å; K113-F115 PolarHBondContact O-N 3.16Å; F115-L117 PolarHBondContact O-N 3.08Å; F115-F133 HydrophobicContact CB-CB 4.18Å; F115-F133 PolarHBondContact N-O 3.3Å; F115-F133 PolarHBondContact O-N 3.45Å; F115-I135 HydrophobicContact CD2-CD1 4.31Å; F115-I135 HydrophobicContact CE2-CD1 4.21Å
116	R	35.1	Very low	31.1	Very low	98 Å²	98	107.1 Å²	107.1	37%	0.37	56%	0.562	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.5	116.7	164.9	-54	-175.7	174.8	177.6	-1.2	107	A76 T114 V118	A76-R116 HydrophobicContact CB-CB 3.57Å; A76-R116 HydrophobicContact CB-CG 3.93Å; T114-R116 HydrophobicContact CG2-CG 4.37Å; R116-V118 HydrophobicContact CB-CG2 4.48Å; R116-V118 PolarHBondContact O-N 2.92Å
117	L	37.3	Very low	31.2	Very low	22 Å²	22	97.3 Å²	97.3	12%	0.115	53%	0.534	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	114.8	168	-168.2	79.3	0	0	0	106.9	C73 F115 V131 F133	C73-L117 HydrophobicContact CB-CD1 3.73Å; C73-L117 WeakPolarHBondContact SG-CD1 3.45Å; F115-L117 PolarHBondContact O-N 3.08Å; L117-V131 HydrophobicContact CB-CB 4.35Å; L117-V131 PolarHBondContact N-O 2.85Å; L117-F133 HydrophobicContact CB-CD2 4.05Å; L117-F133 HydrophobicContact CB-CE2 3.62Å; L117-F133 HydrophobicContact CD1-CE2 4.48Å; L117-F133 HydrophobicContact CD2-CE2 3.89Å; L117-F133 HydrophobicContact CD2-CZ 4.37Å; L117-F133 HydrophobicContact CG-CE2 4.21Å
118	V	34	Very low	31.7	Very low	62 Å²	62	94.6 Å²	94.6	38%	0.376	53%	0.528	S	S	.	.			trans	-109.4	121	175	179.2	0	0	0	0	108.3	R116	R116-V118 HydrophobicContact CB-CG2 4.48Å; R116-V118 PolarHBondContact O-N 2.92Å
119	A	31.4	Very low	32.2	Very low	45 Å²	45	90 Å²	90	37%	0.372	50%	0.496	S	S	.	.			trans	73.8	109.4	167.3	0	0	0	0	0	117.3
120	I	38.2	Very low	32.7	Very low	32 Å²	32	86.1 Å²	86.1	16%	0.164	47%	0.471	C	S	.	.			trans	-92.5	99.6	143.5	-55.2	176.4	0	0	0	104.5	L68 L122	L68-I120 HydrophobicContact CD2-CD1 4.46Å; I120-L122 HydrophobicContact CG2-CD2 3.61Å; I120-L122 HydrophobicContact CG2-CG 3.77Å; I120-L122 PolarHBondContact O-N 2.98Å; I120-L122 VanDerWaalsContact O-N 3.1Å
121	E	29.5	Very low	33.1	Very low	172 Å²	172	75.9 Å²	75.9	80%	0.804	43%	0.433	S	S	*	.			trans	-71.6	100	166	-102.7	-154.9	124.2	0	0	107.7
122	L	33.2	Very low	33.4	Very low	87 Å²	87	72.7 Å²	72.7	46%	0.455	42%	0.419	S	S	.	.	B	Isolated β-bridge	trans	-88.1	107.7	162.5	-60.2	174.2	0	0	0	105.8	Q2 I120 G124 M125	Q2-L122 VanDerWaalsContact NE2-CA 3.26Å; Q2-L122 VanDerWaalsContact NE2-CB 3.25Å; I120-L122 HydrophobicContact CG2-CD2 3.61Å; I120-L122 HydrophobicContact CG2-CG 3.77Å; I120-L122 PolarHBondContact O-N 2.98Å; I120-L122 VanDerWaalsContact O-N 3.1Å; L122-G124 PolarHBondContact O-N 2.91Å; L122-M125 PolarHBondContact O-N 2.99Å
123	T	28.8	Very low	33.8	Very low	124 Å²	124	72 Å²	72	76%	0.761	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.5	106.1	174.1	30.8	0	0	0	0	110.8
124	G	32.4	Very low	33.7	Very low	82 Å²	82	69.6 Å²	69.6	85%	0.845	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	125.3	-20.1	171.6	0	0	0	0	0	116.9	L122	L122-G124 PolarHBondContact O-N 2.91Å
125	M	26.1	Very low	33.7	Very low	162 Å²	162	69.5 Å²	69.5	80%	0.798	40%	0.4	S	S	*	.	B	Isolated β-bridge	trans	-147.8	116.1	173.5	-78.2	-179.6	157.7	0	0	109.7	L122 A127	L122-M125 PolarHBondContact O-N 2.99Å; M125-A127 VanDerWaalsContact C-N 3.28Å; M125-A127 PolarHBondContact O-N 2.85Å
126	T	28.8	Very low	33.5	Very low	130 Å²	130	72.2 Å²	72.2	80%	0.798	42%	0.416	S	S	*	.			trans	-73.2	77.5	179.4	48.4	0	0	0	0	111	T128	T126-T128 PolarHBondContact O-N 3.3Å
127	A	31.5	Very low	33.3	Very low	43 Å²	43	77 Å²	77	36%	0.355	44%	0.435	S	S	.	.			trans	-88.8	95.8	168.4	0	0	0	0	0	109.6	M125 L129	M125-A127 VanDerWaalsContact C-N 3.28Å; M125-A127 PolarHBondContact O-N 2.85Å; A127-L129 PolarHBondContact O-N 3.1Å
128	T	35.4	Very low	33.1	Very low	88 Å²	88	81.7 Å²	81.7	54%	0.54	46%	0.464	S	S	.	.			trans	-74	91.2	169.9	42.6	0	0	0	0	109.9	T126 E130	T126-T128 PolarHBondContact O-N 3.3Å; T128-E130 PolarHBondContact O-N 3.18Å
129	L	38.4	Very low	32.8	Very low	23 Å²	23	86.9 Å²	86.9	12%	0.12	48%	0.484	C	S	.	.			trans	-79.9	103.6	166.1	-68.7	170.7	0	0	0	108.4	K31 R32 Y66 A127 V131	K31-L129 HydrophobicContact CG-CD2 4.41Å; R32-L129 WeakPolarHBondContact O-CA 3.11Å; Y66-L129 HydrophobicContact CD1-CD1 4.16Å; Y66-L129 HydrophobicContact CE1-CD1 3.44Å; Y66-L129 VanDerWaalsContact CE1-CD1 3.44Å; A127-L129 PolarHBondContact O-N 3.1Å; L129-V131 PolarHBondContact O-N 3Å
130	E	37.2	Very low	32.9	Very low	24 Å²	24	92.4 Å²	92.4	11%	0.112	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	110.4	165.3	-81.4	-144.6	107.9	0	0	108.7	K31 R32 W39 T128	K31-E130 CarbonylContact C-O 3.59Å; K31-E130 WeakPolarHBondContact CA-O 3.1Å; R32-E130 HydrophobicContact CB-CB 4.37Å; R32-E130 IonicContact CZ-OE2 3.88Å; R32-E130 PolarHBondContact N-O 3.49Å; R32-E130 IonicContact NE-OE2 2.83Å; R32-E130 IonicContact NH2-OE2 2.79Å; R32-E130 PolarHBondContact NH2-OE2 2.92Å; R32-E130 PolarHBondContact O-N 3.38Å; W39-E130 HydrophobicContact CH2-CB 3.45Å; W39-E130 VanDerWaalsContact CH2-CB 3.45Å; W39-E130 HydrophobicContact CH2-CG 4.3Å; W39-E130 WeakPolarHBondContact CH2-OE2 3.42Å; W39-E130 HydrophobicContact CZ2-CB 4.2Å; W39-E130 VanDerWaalsContact CZ2-OE2 3.3Å; W39-E130 WeakPolarHBondContact CZ2-OE2 3.41Å; W39-E130 HydrophobicContact CZ3-CB 3.92Å; W39-E130 VanDerWaalsContact CZ3-O 3.31Å; W39-E130 WeakPolarHBondContact CZ3-O 3.44Å; T128-E130 PolarHBondContact O-N 3.18Å
131	V	40.7	Very low	32.5	Very low	8 Å²	8	93.3 Å²	93.3	5%	0.048	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	111.5	172.6	-174.2	0	0	0	0	107.6	L29 S30 K31 L117 L129 F133	L29-V131 HydrophobicContact CB-CG1 4.03Å; L29-V131 HydrophobicContact CD1-CG1 3.79Å; S30-V131 WeakPolarHBondContact O-CA 3.3Å; K31-V131 HydrophobicContact CG-CG2 4.49Å; L117-V131 HydrophobicContact CB-CB 4.35Å; L117-V131 PolarHBondContact N-O 2.85Å; L129-V131 PolarHBondContact O-N 3Å; V131-F133 HydrophobicContact CB-CD2 4.31Å; V131-F133 HydrophobicContact CB-CE2 3.78Å; V131-F133 HydrophobicContact CB-CZ 4.41Å; V131-F133 HydrophobicContact CG1-CD2 3.93Å; V131-F133 HydrophobicContact CG1-CE1 4.47Å; V131-F133 HydrophobicContact CG1-CE2 3.52Å; V131-F133 HydrophobicContact CG1-CZ 3.83Å; V131-F133 PolarHBondContact O-N 2.9Å
132	S	34.8	Very low	32.8	Very low	21 Å²	21	91.6 Å²	91.6	15%	0.147	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	102.2	171.5	-70.3	0	0	0	0	108.4	S30 W39 S134	S30-S132 PolarHBondContact N-O 2.95Å; S30-S132 PolarHBondContact O-N 2.8Å; W39-S132 WeakPolarHBondContact CZ3-OG 3.5Å; S132-S134 PolarHBondContact O-N 2.9Å
133	F	37.9	Very low	32.6	Very low	46 Å²	46	95.4 Å²	95.4	20%	0.202	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	109.4	170.4	-65.3	-100.7	0	0	0	108.5	L29 L51 K113 F115 L117 V131 I135	L29-F133 HydrophobicContact CD1-CD1 3.27Å; L29-F133 HydrophobicContact CD1-CE1 3.27Å; L29-F133 HydrophobicContact CD1-CG 3.96Å; L29-F133 HydrophobicContact CD1-CZ 3.96Å; L29-F133 HydrophobicContact CD2-CB 4.23Å; L29-F133 HydrophobicContact CD2-CD1 4.02Å; L29-F133 HydrophobicContact CD2-CG 4.35Å; L29-F133 HydrophobicContact CG-CD1 4.28Å; L51-F133 HydrophobicContact CD2-CZ 4.45Å; K113-F133 VanDerWaalsContact O-O 3.13Å; F115-F133 HydrophobicContact CB-CB 4.18Å; F115-F133 PolarHBondContact N-O 3.3Å; F115-F133 PolarHBondContact O-N 3.45Å; L117-F133 HydrophobicContact CB-CD2 4.05Å; L117-F133 HydrophobicContact CB-CE2 3.62Å; L117-F133 HydrophobicContact CD1-CE2 4.48Å; L117-F133 HydrophobicContact CD2-CE2 3.89Å; L117-F133 HydrophobicContact CD2-CZ 4.37Å; L117-F133 HydrophobicContact CG-CE2 4.21Å; V131-F133 HydrophobicContact CB-CD2 4.31Å; V131-F133 HydrophobicContact CB-CE2 3.78Å; V131-F133 HydrophobicContact CB-CZ 4.41Å; V131-F133 HydrophobicContact CG1-CD2 3.93Å; V131-F133 HydrophobicContact CG1-CE1 4.47Å; V131-F133 HydrophobicContact CG1-CE2 3.52Å; V131-F133 HydrophobicContact CG1-CZ 3.83Å; V131-F133 PolarHBondContact O-N 2.9Å; F133-I135 HydrophobicContact CB-CG1 4.43Å
134	S	31.3	Very low	32.6	Very low	52 Å²	52	94.5 Å²	94.5	36%	0.364	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	85.4	162.6	-151.9	0	0	0	0	106.6	S132 I136	S132-S134 PolarHBondContact O-N 2.9Å; S134-I136 VanDerWaalsContact C-N 3.31Å; S134-I136 PolarHBondContact O-N 2.97Å
135	I	32.5	Very low	32.4	Very low	69 Å²	69	98.7 Å²	98.7	35%	0.354	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	97.7	173	-60.1	176.1	0	0	0	106.1	F115 F133 R137	F115-I135 HydrophobicContact CD2-CD1 4.31Å; F115-I135 HydrophobicContact CE2-CD1 4.21Å; F133-I135 HydrophobicContact CB-CG1 4.43Å; I135-R137 PolarHBondContact O-N 3.02Å
136	I	29.3	Very low	32.7	Very low	126 Å²	126	98.1 Å²	98.1	65%	0.646	54%	0.54	S	S	*	.			trans	-62.8	108.2	155.7	-59.2	174.1	0	0	0	103.7	S134 T138	S134-I136 VanDerWaalsContact C-N 3.31Å; S134-I136 PolarHBondContact O-N 2.97Å; I136-T138 PolarHBondContact O-N 3.48Å
137	R	30.6	Very low	32.9	Very low	200 Å²	200	99.4 Å²	99.4	76%	0.755	54%	0.537	S	S	*	.			trans	-59.6	94.5	162.9	-110	-174.1	168	-164.2	-5.1	105.4	I135 E139	I135-R137 PolarHBondContact O-N 3.02Å; R137-E139 PolarHBondContact O-N 3.43Å
138	T	32.2	Very low	32.9	Very low	119 Å²	119	101.4 Å²	101.4	73%	0.73	55%	0.549	S	S	*	.			trans	-63.9	112	152.4	-38.3	0	0	0	0	103.3	I136 I140	I136-T138 PolarHBondContact O-N 3.48Å; T138-I140 VanDerWaalsContact C-N 3.31Å; T138-I140 PolarHBondContact O-N 3.45Å
139	E	28.7	Very low	32.9	Very low	171 Å²	171	103.9 Å²	103.9	80%	0.799	56%	0.558	S	S	*	*			trans	-56.1	104.4	171.8	-67.3	-150.3	137.1	0	0	106.9	R137 G141	R137-E139 PolarHBondContact O-N 3.43Å; E139-G141 PolarHBondContact O-N 3.42Å
140	I	32.8	Very low	32.6	Very low	162 Å²	162	110 Å²	110	83%	0.831	59%	0.586	S	S	*	*			trans	-65.6	95	156.8	-61.9	171.7	0	0	0	102.7	T138 T142	T138-I140 VanDerWaalsContact C-N 3.31Å; T138-I140 PolarHBondContact O-N 3.45Å; I140-T142 PolarHBondContact O-N 3.16Å
141	G	30.8	Very low	32.8	Very low	51 Å²	51	115.4 Å²	115.4	53%	0.526	62%	0.62	S	S	.	*			trans	-47	126.7	163.4	0	0	0	0	0	107.1	E139 L143	E139-G141 PolarHBondContact O-N 3.42Å; G141-L143 VanDerWaalsContact C-N 3.28Å; G141-L143 PolarHBondContact O-N 3.3Å
142	T	35.1	Very low	32.7	Very low	135 Å²	135	121.3 Å²	121.3	83%	0.828	65%	0.651	S	S	*	*			trans	-50.3	96	161.3	40.3	0	0	0	0	108.6	I140 S144	I140-T142 PolarHBondContact O-N 3.16Å; T142-S144 PolarHBondContact O-N 3.46Å
143	L	29.3	Very low	33.3	Very low	168 Å²	168	129.7 Å²	129.7	88%	0.88	71%	0.705	S	S	*	*			trans	-85	84	152.5	-71.8	175.3	0	0	0	105.8	G141 L145	G141-L143 VanDerWaalsContact C-N 3.28Å; G141-L143 PolarHBondContact O-N 3.3Å; L143-L145 PolarHBondContact O-N 2.79Å; L143-L145 VanDerWaalsContact O-N 3.08Å
144	S	28.8	Very low	33	Very low	105 Å²	105	133.9 Å²	133.9	73%	0.734	73%	0.73	S	S	*	*			trans	-53.5	109.7	150.1	-87.3	0	0	0	0	106.4	T142 H146	T142-S144 PolarHBondContact O-N 3.46Å; S144-H146 PolarHBondContact O-N 3.21Å
145	L	28.9	Very low	33.1	Very low	169 Å²	169	138.2 Å²	138.2	89%	0.885	75%	0.749	S	S	*	*			trans	-66.4	86.1	157.2	-91.9	153.2	0	0	0	106.5	L143 H147	L143-L145 PolarHBondContact O-N 2.79Å; L143-L145 VanDerWaalsContact O-N 3.08Å; L145-H147 PolarHBondContact O-N 2.9Å
146	H	31.4	Very low	33.1	Very low	150 Å²	150	142 Å²	142	69%	0.694	77%	0.771	S	S	*	*			trans	-70.7	106.5	162.6	-170.5	-102.7	0	0	0	106.4	S144 S148	S144-H146 PolarHBondContact O-N 3.21Å; H146-S148 PolarHBondContact CE1-OG 3.24Å; H146-S148 PolarHBondContact ND1-OG 3.39Å; H146-S148 PolarHBondContact O-N 3.25Å
147	H	32.3	Very low	33.4	Very low	157 Å²	157	142.9 Å²	142.9	73%	0.727	78%	0.778	S	S	*	*			trans	-70.1	81.2	171.1	-140.6	-94	0	0	0	107.7	L145 L149	L145-H147 PolarHBondContact O-N 2.9Å; H147-L149 VanDerWaalsContact C-N 3.32Å; H147-L149 PolarHBondContact O-N 2.83Å; H147-L149 VanDerWaalsContact O-N 3.13Å
148	S	33.3	Very low	33.5	Very low	86 Å²	86	139.4 Å²	139.4	60%	0.601	78%	0.78	S	S	*	*			trans	-77.8	90.1	164.7	-100.5	0	0	0	0	107.5	H146 H150	H146-S148 PolarHBondContact CE1-OG 3.24Å; H146-S148 PolarHBondContact ND1-OG 3.39Å; H146-S148 PolarHBondContact O-N 3.25Å; S148-H150 VanDerWaalsContact C-N 3.33Å; S148-H150 PolarHBondContact O-N 3.41Å
149	L	33.6	Very low	33.6	Very low	140 Å²	140	140.7 Å²	140.7	73%	0.733	78%	0.783	S	S	*	*			trans	-62.3	101.9	156.8	-94.2	138.6	0	0	0	107	H147 T151	H147-L149 VanDerWaalsContact C-N 3.32Å; H147-L149 PolarHBondContact O-N 2.83Å; H147-L149 VanDerWaalsContact O-N 3.13Å; L149-T151 PolarHBondContact O-N 3.34Å
150	H	34.2	Very low	34	Very low	152 Å²	152	138.6 Å²	138.6	70%	0.704	78%	0.782	S	S	*	*			trans	-65.9	112.1	163.5	-119.2	-105.8	0	0	0	107.2	S148 L152	S148-H150 VanDerWaalsContact C-N 3.33Å; S148-H150 PolarHBondContact O-N 3.41Å; H150-L152 VanDerWaalsContact ND1-CD1 3.34Å; H150-L152 WeakPolarHBondContact ND1-CD1 3.16Å
151	T	41.1	Very low	34.1	Very low	136 Å²	136	136.8 Å²	136.8	83%	0.834	78%	0.778	S	S	*	*			trans	-96.8	115.1	156.5	-35.3	0	0	0	0	106	L149	L149-T151 PolarHBondContact O-N 3.34Å
152	L	38.8	Very low	34.4	Very low	132 Å²	132	143.9 Å²	143.9	69%	0.691	80%	0.799	S	S	*	*			trans	-138.5	158.7	166.4	-74.4	176.4	0	0	0	107	H150	H150-L152 VanDerWaalsContact ND1-CD1 3.34Å; H150-L152 WeakPolarHBondContact ND1-CD1 3.16Å
153	P	45.5	Very low	34.3	Very low	197 Å²	197	144.7 Å²	144.7	100%	1.279	80%	0.797	S	S	*	*			cis	-98.2	0	-35.5	30.9	-18.8	0	0	0	112.4

Retrieved 153 of 153 residues in 172.4 ms (Link to these results)

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