A0A5K4EWT0_SCHMA Loading...

DCD domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4EWT0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 397 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.7	Very low	43.4	Very low	250 Å²	250	144.6 Å²	144.6	100%	1.232	79%	0.79	S	S	*	*				0	140.9	0	-80.4	176.2	156.9	0	0	109.1
2	S	36.4	Very low	46.8	Very low	117 Å²	117	142.9 Å²	142.9	82%	0.818	77%	0.769	S	S	*	*			trans	-79.7	133.7	-177.1	-178.8	0	0	0	0	111.9
3	K	36.2	Very low	50.1	Low	194 Å²	194	137.5 Å²	137.5	84%	0.843	74%	0.74	S	S	*	*			trans	-178.7	49.4	148.8	-102.3	171.5	-169	-176.9	0	112.8	A5	K3-A5 PolarHBondContact O-N 2.91Å
4	N	32.1	Very low	52.9	Low	166 Å²	166	133.8 Å²	133.8	89%	0.888	72%	0.715	S	S	*	*			trans	-76.3	70.9	156.7	-88.4	-6.5	0	0	0	108.7	K6	N4-K6 PolarHBondContact O-N 2.94Å
5	A	33.9	Very low	55.2	Low	86 Å²	86	126.3 Å²	126.3	71%	0.711	67%	0.674	S	S	*	*			trans	-60.6	109.1	163.3	0	0	0	0	0	106.5	K3 K7	K3-A5 PolarHBondContact O-N 2.91Å; A5-K7 PolarHBondContact O-N 3.49Å
6	K	35.7	Very low	57.6	Low	199 Å²	199	123.1 Å²	123.1	87%	0.865	65%	0.653	S	S	*	*			trans	-55	107.2	169.2	-80.5	-176.2	175.4	-179.4	0	106.3	N4 V8	N4-K6 PolarHBondContact O-N 2.94Å; K6-V8 VanDerWaalsContact C-N 3.26Å; K6-V8 PolarHBondContact O-N 3.41Å
7	K	36.1	Very low	59.8	Low	192 Å²	192	116.1 Å²	116.1	84%	0.835	62%	0.616	S	S	*	*			trans	-63.5	95.6	173.9	-164.6	178.2	-173	-177	0	105.2	A5 V9	A5-K7 PolarHBondContact O-N 3.49Å; K7-V9 VanDerWaalsContact C-N 3.34Å; K7-V9 PolarHBondContact O-N 2.8Å
8	V	40.9	Very low	61.6	Low	131 Å²	131	113.8 Å²	113.8	79%	0.794	61%	0.607	S	S	*	*			trans	-61.6	105.3	173.4	178.8	0	0	0	0	104.5	K6 G10	K6-V8 VanDerWaalsContact C-N 3.26Å; K6-V8 PolarHBondContact O-N 3.41Å; V8-G10 PolarHBondContact O-N 3.43Å
9	V	50.6	Low	63.2	Low	130 Å²	130	107.8 Å²	107.8	79%	0.788	58%	0.575	S	S	*	*			trans	-71.8	89.3	176.5	-177.5	0	0	0	0	105.2	K7 E11	K7-V9 VanDerWaalsContact C-N 3.34Å; K7-V9 PolarHBondContact O-N 2.8Å; V9-E11 PolarHBondContact O-N 2.85Å
10	G	63.2	Low	64.6	Low	59 Å²	59	106.5 Å²	106.5	61%	0.608	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-59.9	133.5	172.9	0	0	0	0	0	108.6	V8 K12	V8-G10 PolarHBondContact O-N 3.43Å; G10-K12 PolarHBondContact O-N 3.03Å
11	E	75.5	Confident	65.7	Low	67 Å²	67	101.6 Å²	101.6	31%	0.313	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-56.7	138.5	176.9	-76.5	-170.7	-158.1	0	0	110.5	V9 L13 Y59 T61 Y62	V9-E11 PolarHBondContact O-N 2.85Å; E11-L13 PolarHBondContact O-N 2.9Å; E11-Y59 HydrophobicContact CB-CD1 4.2Å; E11-Y59 WeakPolarHBondContact OE2-CB 3.42Å; E11-T61 VanDerWaalsContact CD-OG1 3.24Å; E11-T61 WeakPolarHBondContact OE1-CG2 3.18Å; E11-T61 PolarHBondContact OE1-OG1 2.91Å; E11-T61 PolarHBondContact OE2-N 3.37Å; E11-T61 VanDerWaalsContact OE2-N 3.11Å; E11-T61 PolarHBondContact OE2-OG1 3.39Å; E11-T61 VanDerWaalsContact OE2-OG1 3.06Å; E11-Y62 VanDerWaalsContact OE2-CD1 3.32Å; E11-Y62 WeakPolarHBondContact OE2-CD1 3.27Å; E11-Y62 VanDerWaalsContact OE2-CE1 3.27Å; E11-Y62 WeakPolarHBondContact OE2-CE1 3.32Å
12	K	85	Confident	68.2	Low	124 Å²	124	90.4 Å²	90.4	54%	0.539	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-69.8	123	-178.9	-172.7	-176.8	169.8	-144.7	0	109.5	G10 Q14 E60	G10-K12 PolarHBondContact O-N 3.03Å; K12-Q14 PolarHBondContact O-N 3.44Å; K12-E60 HydrophobicContact CB-CG 4.37Å
13	L	89.7	Confident	70.6	Confident	73 Å²	73	85 Å²	85	38%	0.382	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	122.3	167.6	-176.5	70.8	0	0	0	108.4	E11 K57 Y59	E11-L13 PolarHBondContact O-N 2.9Å; L13-K57 HydrophobicContact CD1-CB 3.77Å; L13-K57 HydrophobicContact CD1-CG 4.04Å; L13-Y59 HydrophobicContact CB-CD1 4.37Å; L13-Y59 HydrophobicContact CB-CE1 4.18Å; L13-Y59 HydrophobicContact CD1-CD1 4.3Å; L13-Y59 HydrophobicContact CD1-CE1 3.94Å; L13-Y59 HydrophobicContact CD1-CE2 4.31Å
14	Q	88.1	Confident	73.1	Confident	85 Å²	85	76.3 Å²	76.3	40%	0.397	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-33.5	179.9	-58.4	-68	1	0	0	112	K12 C58 E60 F129	K12-Q14 PolarHBondContact O-N 3.44Å; Q14-C58 PolarHBondContact N-O 3.11Å; Q14-E60 HydrophobicContact CG-CG 4.26Å; Q14-E60 VanDerWaalsContact NE2-CG 3.25Å; Q14-E60 PolarHBondContact NE2-OE1 2.87Å; Q14-F129 HydrophobicContact CB-CD2 4.35Å; Q14-F129 HydrophobicContact CB-CE2 4.38Å; Q14-F129 HydrophobicContact CG-CE2 4.42Å
15	F	88.4	Confident	75.8	Confident	21 Å²	21	70.2 Å²	70.2	9%	0.092	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	147.1	-174.7	167.3	-89.5	0	0	0	111.8	D17 L56 C58 L117 K122 K125 L126	F15-D17 HydrophobicContact CE1-CB 4.04Å; F15-D17 HydrophobicContact CZ-CB 3.88Å; F15-L56 HydrophobicContact CE1-CD2 3.93Å; F15-L56 HydrophobicContact CE1-CG 4.34Å; F15-C58 HydrophobicContact CB-CB 4.04Å; F15-C58 HydrophobicContact CD1-CB 4.17Å; F15-C58 PolarHBondContact N-O 3.22Å; F15-C58 PolarHBondContact O-N 3.25Å; F15-L117 HydrophobicContact CE1-CD2 4.33Å; F15-L117 HydrophobicContact CZ-CD2 3.93Å; F15-K122 HydrophobicContact CE2-CB 3.84Å; F15-K122 HydrophobicContact CE2-CD 4.08Å; F15-K122 HydrophobicContact CE2-CG 3.84Å; F15-K122 HydrophobicContact CZ-CB 3.87Å; F15-K122 HydrophobicContact CZ-CD 4.2Å; F15-K122 HydrophobicContact CZ-CG 4.23Å; F15-K122 WeakPolarHBondContact CZ-O 3.47Å; F15-K125 HydrophobicContact CD2-CB 3.81Å; F15-K125 HydrophobicContact CD2-CD 4.43Å; F15-K125 HydrophobicContact CE2-CB 3.75Å; F15-L126 HydrophobicContact CE1-CB 4.2Å; F15-L126 HydrophobicContact CE1-CD1 4.5Å; F15-L126 HydrophobicContact CZ-CB 4.3Å
16	E	93.5	Very high	78.4	Confident	75 Å²	75	70.2 Å²	70.2	35%	0.35	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	138.9	175.8	179.4	168.6	-174.6	0	0	111.9	L56 K57 K122	E16-L56 CarbonylContact C-O 3.6Å; E16-L56 VanDerWaalsContact CA-O 3.29Å; E16-L56 WeakPolarHBondContact CA-O 3.4Å; E16-K57 HydrophobicContact CB-CG 4.34Å; E16-K57 HydrophobicContact CG-CG 3.93Å; E16-K57 WeakPolarHBondContact OE1-CE 3.47Å; E16-K57 IonicContact OE1-NZ 3.43Å; E16-K57 PolarHBondContact OE1-NZ 3.2Å; E16-K57 WeakPolarHBondContact OE2-CE 3.46Å; E16-K122 PolarHBondContact O-NZ 3.03Å
17	D	94.4	Very high	80.5	Confident	4 Å²	4	61 Å²	61	2%	0.021	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	163	171.4	-157.1	18.3	0	0	0	113.6	F15 V19 Q55 L56 L117 S118 K122	F15-D17 HydrophobicContact CE1-CB 4.04Å; F15-D17 HydrophobicContact CZ-CB 3.88Å; D17-V19 HydrophobicContact CB-CG1 4.32Å; D17-Q55 CarbonylContact O-C 3.6Å; D17-Q55 WeakPolarHBondContact O-CA 3.31Å; D17-L56 PolarHBondContact N-O 2.85Å; D17-L56 PolarHBondContact O-N 3.13Å; D17-L117 HydrophobicContact CB-CD2 4.45Å; D17-L117 WeakPolarHBondContact OD2-CB 3.49Å; D17-S118 VanDerWaalsContact CG-OG 3.29Å; D17-S118 WeakPolarHBondContact OD1-CB 3.46Å; D17-S118 PolarHBondContact OD1-OG 3.08Å; D17-S118 PolarHBondContact OD2-N 2.87Å; D17-S118 PolarHBondContact OD2-OG 3.29Å; D17-K122 HydrophobicContact CB-CD 3.78Å; D17-K122 WeakPolarHBondContact OD1-CD 3.43Å; D17-K122 WeakPolarHBondContact OD1-CE 3.34Å; D17-K122 IonicContact OD1-NZ 3.9Å; D17-K122 PolarHBondContact OD1-NZ 2.86Å; D17-K122 WeakPolarHBondContact OD2-CD 3.48Å
18	V	92.1	Very high	82.3	Confident	75 Å²	75	60 Å²	60	46%	0.455	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	115	161.5	-179.2	0	0	0	0	107.3
19	V	91.9	Very high	83.3	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	146.3	179.8	-59.4	0	0	0	0	110.5	D17 F21 S53 S54 L56 F65 M115 V116 L117	D17-V19 HydrophobicContact CB-CG1 4.32Å; V19-F21 HydrophobicContact CG2-CD2 4.35Å; V19-F21 HydrophobicContact CG2-CE2 3.62Å; V19-F21 HydrophobicContact CG2-CZ 3.85Å; V19-S53 CarbonylContact O-C 3.1Å; V19-S53 VanDerWaalsContact O-CA 3.27Å; V19-S53 WeakPolarHBondContact O-CA 3.49Å; V19-S54 WeakPolarHBondContact CG2-O 3.41Å; V19-S54 PolarHBondContact N-O 2.83Å; V19-S54 PolarHBondContact O-N 3.37Å; V19-L56 HydrophobicContact CG1-CB 3.78Å; V19-L56 HydrophobicContact CG1-CD2 3.86Å; V19-L56 HydrophobicContact CG2-CB 4.12Å; V19-F65 HydrophobicContact CG2-CD1 4.22Å; V19-F65 HydrophobicContact CG2-CE1 4.22Å; V19-M115 HydrophobicContact CB-CB 4.45Å; V19-V116 WeakPolarHBondContact CA-O 3.28Å; V19-L117 HydrophobicContact CG1-CD2 4.31Å; V19-L117 HydrophobicContact CG1-CG 3.97Å
20	K	91.2	Very high	84.1	Confident	81 Å²	81	56.3 Å²	56.3	35%	0.352	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.1	169.1	-59	-163.6	-178.8	-165.9	0	109.2	V46 E51 L52 M115 V116	K20-V46 HydrophobicContact CB-CG1 3.86Å; K20-V46 HydrophobicContact CB-CG2 4.19Å; K20-V46 HydrophobicContact CD-CG1 3.94Å; K20-E51 IonicContact NZ-OE1 3.29Å; K20-E51 PolarHBondContact NZ-OE1 3.35Å; K20-L52 WeakPolarHBondContact CA-O 3.35Å; K20-M115 CarbonylContact O-C 3.55Å; K20-M115 WeakPolarHBondContact O-CA 3.44Å; K20-V116 PolarHBondContact N-O 3.45Å; K20-V116 PolarHBondContact O-N 3.46Å
21	F	89.2	Confident	84.3	Confident	5 Å²	5	54.7 Å²	54.7	2%	0.022	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	134.4	-178.6	-70.2	-91.2	0	0	0	111.5	V19 L52 F65 I69 V71 L76 G114 M115	V19-F21 HydrophobicContact CG2-CD2 4.35Å; V19-F21 HydrophobicContact CG2-CE2 3.62Å; V19-F21 HydrophobicContact CG2-CZ 3.85Å; F21-L52 HydrophobicContact CB-CB 4.36Å; F21-L52 WeakPolarHBondContact CD2-O 3.47Å; F21-L52 PolarHBondContact N-O 2.84Å; F21-F65 HydrophobicContact CE1-CE1 4.31Å; F21-F65 HydrophobicContact CE2-CD1 4.26Å; F21-F65 AromaticContact CZ-CD1 3.58Å; F21-F65 HydrophobicContact CZ-CD1 3.58Å; F21-F65 AromaticContact CZ-CE1 3.63Å; F21-F65 HydrophobicContact CZ-CE1 3.63Å; F21-F65 HydrophobicContact CZ-CG 4.13Å; F21-F65 HydrophobicContact CZ-CZ 4.26Å; F21-I69 HydrophobicContact CD2-CD1 3.55Å; F21-I69 HydrophobicContact CD2-CG1 4.49Å; F21-I69 HydrophobicContact CE2-CD1 4.06Å; F21-I69 HydrophobicContact CG-CD1 4.34Å; F21-V71 HydrophobicContact CB-CG1 4.37Å; F21-V71 HydrophobicContact CB-CG2 3.86Å; F21-V71 HydrophobicContact CG-CG2 4.24Å; F21-L76 HydrophobicContact CD1-CD1 3.52Å; F21-L76 HydrophobicContact CD1-CD2 4.45Å; F21-L76 HydrophobicContact CD2-CD1 3.54Å; F21-L76 HydrophobicContact CE1-CD1 3.37Å; F21-L76 HydrophobicContact CE1-CD2 4.43Å; F21-L76 HydrophobicContact CE2-CD1 3.37Å; F21-L76 HydrophobicContact CG-CD1 3.59Å; F21-L76 HydrophobicContact CZ-CD1 3.28Å; F21-G114 CarbonylContact C-O 3.54Å; F21-G114 WeakPolarHBondContact CA-O 3.46Å; F21-G114 WeakPolarHBondContact CD1-O 3.22Å; F21-M115 HydrophobicContact CD1-CB 4.05Å; F21-M115 HydrophobicContact CE1-CB 4.14Å; F21-M115 HydrophobicContact CE1-CE 3.9Å
22	T	87.5	Confident	84	Confident	15 Å²	15	56.3 Å²	56.3	9%	0.092	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-22.4	175.9	56.3	0	0	0	0	112.2	L41 T44 V46 G114 V116	T22-L41 WeakPolarHBondContact CB-O 3.29Å; T22-L41 PolarHBondContact OG1-O 3.15Å; T22-T44 WeakPolarHBondContact CG2-O 3.34Å; T22-T44 WeakPolarHBondContact O-CG2 3.09Å; T22-V46 HydrophobicContact CG2-CG2 3.71Å; T22-G114 PolarHBondContact N-O 3.42Å; T22-G114 WeakPolarHBondContact OG1-CA 3.33Å; T22-G114 PolarHBondContact OG1-O 2.92Å; T22-V116 HydrophobicContact CG2-CG2 3.7Å
23	G	88	Confident	83.5	Confident	4 Å²	4	56.3 Å²	56.3	4%	0.041	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.6	172.7	179.2	0	0	0	0	0	112.2	L41 V71 G114	G23-L41 VanDerWaalsContact C-CD2 3.42Å; G23-V71 VanDerWaalsContact CA-CG1 3.41Å; G23-G114 PolarHBondContact O-N 2.78Å
24	S	88.8	Confident	82.9	Confident	11 Å²	11	53.7 Å²	53.7	8%	0.077	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	153.2	168.9	72.2	0	0	0	0	110.9	V71 T72 I74 L112	S24-V71 PolarHBondContact OG-O 3.46Å; S24-T72 PolarHBondContact N-OG1 3.36Å; S24-T72 PolarHBondContact O-OG1 3.09Å; S24-T72 PolarHBondContact OG-OG1 3.1Å; S24-I74 WeakPolarHBondContact OG-CB 3.42Å; S24-I74 VanDerWaalsContact OG-CD1 3.31Å; S24-I74 WeakPolarHBondContact OG-CD1 3.12Å; S24-L112 CarbonylContact C-O 3.59Å; S24-L112 VanDerWaalsContact CA-O 3.26Å; S24-L112 WeakPolarHBondContact CA-O 3.4Å
25	S	87.9	Confident	82.3	Confident	37 Å²	37	50.3 Å²	50.3	26%	0.259	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	150.7	179.3	-163.9	0	0	0	0	111.2	T111 L112	S25-T111 WeakPolarHBondContact O-CA 3.4Å; S25-L112 PolarHBondContact N-O 3.16Å; S25-L112 PolarHBondContact O-N 3.29Å
26	I	87.8	Confident	81.8	Confident	87 Å²	87	54 Å²	54	45%	0.446	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	125.6	176	-63.4	169.9	0	0	0	107.4	I74 D109 T111	I26-I74 HydrophobicContact CD1-CD1 3.87Å; I26-I74 HydrophobicContact CD1-CG1 4.14Å; I26-I74 HydrophobicContact CG1-CD1 3.83Å; I26-D109 HydrophobicContact CG2-CB 3.36Å; I26-T111 HydrophobicContact CG1-CG2 4.33Å
27	C	80.7	Confident	81.3	Confident	6 Å²	6	51.5 Å²	51.5	4%	0.041	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	119.4	-171.4	-157.9	0	0	0	0	113.2	S29 V110 L112	C27-S29 PolarHBondContact O-N 2.96Å; C27-V110 PolarHBondContact N-O 2.97Å; C27-V110 PolarHBondContact O-N 3.23Å; C27-L112 HydrophobicContact CB-CD1 3.98Å
28	K	74.3	Confident	80.8	Confident	170 Å²	170	51.3 Å²	51.3	74%	0.739	27%	0.265	S	S	*	.	S	Bend	trans	-67.8	-8.3	173.3	-73.8	-175.9	175.1	-169.8	0	115.2	D109	K28-D109 WeakPolarHBondContact CE-OD1 3.1Å; K28-D109 WeakPolarHBondContact CE-OD2 3.38Å; K28-D109 HydrophobicContact CG-CB 4.44Å; K28-D109 VanDerWaalsContact CG-OD1 3.24Å; K28-D109 WeakPolarHBondContact CG-OD1 3.3Å; K28-D109 WeakPolarHBondContact CG-OD2 3.44Å; K28-D109 IonicContact NZ-OD2 3.35Å
29	S	61.3	Low	80.2	Confident	48 Å²	48	47.9 Å²	47.9	34%	0.336	25%	0.245	S	C	.	.			trans	-121	103.2	-162.7	179.5	0	0	0	0	110.9	C27 L34	C27-S29 PolarHBondContact O-N 2.96Å; S29-L34 VanDerWaalsContact O-CB 3.27Å; S29-L34 WeakPolarHBondContact O-CB 3.36Å
30	H	67	Low	79.7	Confident	135 Å²	135	51.2 Å²	51.2	63%	0.625	27%	0.266	S	S	*	.			trans	-69.5	126.5	164.5	-51	-82.9	0	0	0	109.1	V110	H30-V110 VanDerWaalsContact CE1-CG2 3.4Å; H30-V110 WeakPolarHBondContact CE1-CG2 3.44Å
31	G	67.6	Low	79.5	Confident	25 Å²	25	48 Å²	48	26%	0.258	25%	0.252	S	S	.	.	S	Bend	trans	131.7	-146.8	179.9	0	0	0	0	0	113.4	K33 L34 K35	G31-K33 PolarHBondContact O-N 2.95Å; G31-L34 PolarHBondContact O-N 3.06Å; G31-K35 PolarHBondContact O-N 3.33Å
32	D	69.2	Low	79.2	Confident	101 Å²	101	48.4 Å²	48.4	54%	0.54	26%	0.255	S	S	.	.	H	α-helix	trans	-66	-34.4	-169.5	-61.8	-48.7	0	0	0	113.8	L34 K35 E36	D32-L34 VanDerWaalsContact C-N 3.25Å; D32-L34 PolarHBondContact O-N 3.39Å; D32-K35 WeakPolarHBondContact O-CA 3.28Å; D32-K35 WeakPolarHBondContact O-CB 3.34Å; D32-K35 PolarHBondContact O-N 3.44Å; D32-K35 WeakPolarHBondContact OD1-CE 3.42Å; D32-K35 IonicContact OD1-NZ 3.16Å; D32-K35 PolarHBondContact OD1-NZ 2.98Å; D32-E36 PolarHBondContact O-N 3.4Å
33	K	75.1	Confident	78.8	Confident	125 Å²	125	51.2 Å²	51.2	54%	0.543	27%	0.268	S	S	.	.	H	α-helix	trans	-58.7	-37.4	174.4	-173.3	175.3	-177.3	176.8	0	112.6	G31 E36 T37	G31-K33 PolarHBondContact O-N 2.95Å; K33-E36 PolarHBondContact O-N 3.11Å; K33-T37 WeakPolarHBondContact O-CB 3.4Å; K33-T37 PolarHBondContact O-N 3.06Å; K33-T37 PolarHBondContact O-OG1 2.68Å
34	L	77.9	Confident	78.5	Confident	17 Å²	17	53.7 Å²	53.7	9%	0.089	28%	0.283	C	S	.	.	H	α-helix	trans	-72.1	-33.2	177.5	169.3	159	0	0	0	111.1	S29 G31 D32 A38 F89 L101 V110 L112	S29-L34 VanDerWaalsContact O-CB 3.27Å; S29-L34 WeakPolarHBondContact O-CB 3.36Å; G31-L34 PolarHBondContact O-N 3.06Å; D32-L34 VanDerWaalsContact C-N 3.25Å; D32-L34 PolarHBondContact O-N 3.39Å; L34-A38 WeakPolarHBondContact O-CB 3.1Å; L34-A38 PolarHBondContact O-N 3.13Å; L34-F89 HydrophobicContact CD2-CE2 3.61Å; L34-F89 HydrophobicContact CD2-CZ 3.63Å; L34-L101 HydrophobicContact CD1-CD2 3.64Å; L34-L101 HydrophobicContact CD2-CD2 3.59Å; L34-L101 HydrophobicContact CG-CD2 3.64Å; L34-V110 HydrophobicContact CD1-CB 4.38Å; L34-V110 HydrophobicContact CD1-CG1 4.22Å; L34-L112 HydrophobicContact CG-CD2 4.38Å
35	K	75.6	Confident	77.8	Confident	14 Å²	14	62.4 Å²	62.4	6%	0.061	32%	0.319	C	S	.	.	H	α-helix	trans	-66.7	-44.6	169.3	-56.3	175.6	-170	160.7	0	112.1	G31 D32 T37 A38 A39 F89 T374	G31-K35 PolarHBondContact O-N 3.33Å; D32-K35 WeakPolarHBondContact O-CA 3.28Å; D32-K35 WeakPolarHBondContact O-CB 3.34Å; D32-K35 PolarHBondContact O-N 3.44Å; D32-K35 WeakPolarHBondContact OD1-CE 3.42Å; D32-K35 IonicContact OD1-NZ 3.16Å; D32-K35 PolarHBondContact OD1-NZ 2.98Å; K35-T37 VanDerWaalsContact C-N 3.34Å; K35-A38 PolarHBondContact O-N 3.21Å; K35-A39 WeakPolarHBondContact O-CB 3.4Å; K35-A39 PolarHBondContact O-N 3.14Å; K35-F89 HydrophobicContact CB-CE1 4.34Å; K35-F89 HydrophobicContact CB-CZ 4.33Å; K35-F89 HydrophobicContact CG-CE1 4.03Å; K35-F89 HydrophobicContact CG-CZ 3.98Å; K35-T374 PolarHBondContact NZ-OG1 3.11Å
36	E	76.7	Confident	76.9	Confident	99 Å²	99	62.8 Å²	62.8	46%	0.463	32%	0.32	S	S	.	.	H	α-helix	trans	-64.3	-40.2	179.3	-176	-179.4	-162.1	0	0	111.4	D32 K33 A39 T40	D32-E36 PolarHBondContact O-N 3.4Å; K33-E36 PolarHBondContact O-N 3.11Å; E36-A39 WeakPolarHBondContact O-CB 2.92Å; E36-A39 PolarHBondContact O-N 2.77Å; E36-T40 WeakPolarHBondContact O-CB 2.82Å; E36-T40 PolarHBondContact O-N 3.43Å; E36-T40 PolarHBondContact O-OG1 3.42Å
37	T	84	Confident	75.7	Confident	22 Å²	22	62.6 Å²	62.6	14%	0.135	32%	0.32	C	S	.	.	H	α-helix	trans	-61.7	-46.8	172.3	-53.8	0	0	0	0	110.9	K33 K35 T40 L41 L112	K33-T37 WeakPolarHBondContact O-CB 3.4Å; K33-T37 PolarHBondContact O-N 3.06Å; K33-T37 PolarHBondContact O-OG1 2.68Å; K35-T37 VanDerWaalsContact C-N 3.34Å; T37-T40 WeakPolarHBondContact O-CB 3.37Å; T37-T40 PolarHBondContact O-N 3.31Å; T37-L41 HydrophobicContact CG2-CD1 4.36Å; T37-L41 WeakPolarHBondContact O-CG 3.4Å; T37-L41 PolarHBondContact O-N 2.87Å; T37-L112 HydrophobicContact CG2-CD2 4.1Å
38	A	82.6	Confident	74.4	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-64.4	-39.8	176.2	0	0	0	0	0	112.9	L34 K35 T40 L41 I42 F89 V99 L112	L34-A38 WeakPolarHBondContact O-CB 3.1Å; L34-A38 PolarHBondContact O-N 3.13Å; K35-A38 PolarHBondContact O-N 3.21Å; A38-T40 VanDerWaalsContact C-N 3.31Å; A38-T40 PolarHBondContact O-N 3.26Å; A38-L41 PolarHBondContact O-N 2.86Å; A38-I42 WeakPolarHBondContact O-CG1 3.43Å; A38-I42 PolarHBondContact O-N 3.49Å; A38-F89 HydrophobicContact CB-CB 4.09Å; A38-F89 HydrophobicContact CB-CD1 4.3Å; A38-F89 HydrophobicContact CB-CD2 3.16Å; A38-F89 HydrophobicContact CB-CE2 3.51Å; A38-F89 HydrophobicContact CB-CG 3.62Å; A38-F89 HydrophobicContact CB-CZ 4.21Å; A38-V99 HydrophobicContact CB-CB 4.33Å; A38-V99 HydrophobicContact CB-CG1 4.2Å; A38-V99 HydrophobicContact CB-CG2 4.28Å; A38-L112 HydrophobicContact CB-CD2 4.11Å
39	A	79.4	Confident	73.4	Confident	4 Å²	4	67.8 Å²	67.8	3%	0.033	35%	0.354	C	S	.	.	H	α-helix	trans	-58.7	-45.9	174.3	0	0	0	0	0	111.2	K35 E36 I42 L43 V381	K35-A39 WeakPolarHBondContact O-CB 3.4Å; K35-A39 PolarHBondContact O-N 3.14Å; E36-A39 WeakPolarHBondContact O-CB 2.92Å; E36-A39 PolarHBondContact O-N 2.77Å; A39-I42 PolarHBondContact O-N 2.87Å; A39-L43 WeakPolarHBondContact O-CB 3.44Å; A39-L43 VanDerWaalsContact O-CG 3.26Å; A39-L43 WeakPolarHBondContact O-CG 3.41Å; A39-L43 PolarHBondContact O-N 3.35Å; A39-V381 HydrophobicContact CB-CG2 3.51Å
40	T	83.1	Confident	73.3	Confident	70 Å²	70	70.8 Å²	70.8	43%	0.429	37%	0.366	S	S	.	.	H	α-helix	trans	-60.3	-48.7	176.8	-54.2	0	0	0	0	109.9	E36 T37 A38 I42 L43 T44	E36-T40 WeakPolarHBondContact O-CB 2.82Å; E36-T40 PolarHBondContact O-N 3.43Å; E36-T40 PolarHBondContact O-OG1 3.42Å; T37-T40 WeakPolarHBondContact O-CB 3.37Å; T37-T40 PolarHBondContact O-N 3.31Å; A38-T40 VanDerWaalsContact C-N 3.31Å; A38-T40 PolarHBondContact O-N 3.26Å; T40-I42 VanDerWaalsContact C-N 3.32Å; T40-I42 PolarHBondContact O-N 2.96Å; T40-L43 PolarHBondContact O-N 2.99Å; T40-L43 VanDerWaalsContact O-N 3.15Å; T40-T44 PolarHBondContact O-N 2.98Å; T40-T44 PolarHBondContact O-OG1 3.04Å
41	L	85.7	Confident	73	Confident	13 Å²	13	69.8 Å²	69.8	7%	0.068	36%	0.362	C	S	.	.	H	α-helix	trans	-60.8	-34.1	176.5	-71.7	173.1	0	0	0	113.9	T22 G23 T37 A38 V99 L112	T22-L41 WeakPolarHBondContact CB-O 3.29Å; T22-L41 PolarHBondContact OG1-O 3.15Å; G23-L41 VanDerWaalsContact C-CD2 3.42Å; T37-L41 HydrophobicContact CG2-CD1 4.36Å; T37-L41 WeakPolarHBondContact O-CG 3.4Å; T37-L41 PolarHBondContact O-N 2.87Å; A38-L41 PolarHBondContact O-N 2.86Å; L41-V99 HydrophobicContact CB-CG2 3.84Å; L41-V99 HydrophobicContact CD1-CG1 4.06Å; L41-L112 HydrophobicContact CD1-CB 3.79Å; L41-L112 HydrophobicContact CD1-CD2 4.48Å
42	I	82.9	Confident	73.5	Confident	14 Å²	14	70.6 Å²	70.6	7%	0.072	36%	0.36	C	S	.	.	H	α-helix	trans	-70.8	-38.2	174.9	-72.9	171.2	0	0	0	111.6	A38 A39 T40 F89 H94 A97 V99	A38-I42 WeakPolarHBondContact O-CG1 3.43Å; A38-I42 PolarHBondContact O-N 3.49Å; A39-I42 PolarHBondContact O-N 2.87Å; T40-I42 VanDerWaalsContact C-N 3.32Å; T40-I42 PolarHBondContact O-N 2.96Å; I42-F89 HydrophobicContact CD1-CB 4.1Å; I42-H94 HydrophobicContact CG2-CB 3.9Å; I42-A97 HydrophobicContact CG2-CB 4.08Å; I42-V99 HydrophobicContact CD1-CG2 4.21Å; I42-V99 HydrophobicContact CG1-CG2 3.66Å
43	L	80.1	Confident	74.2	Confident	73 Å²	73	67.8 Å²	67.8	38%	0.382	35%	0.348	S	S	.	.	H	α-helix	trans	-84.8	-20.2	-176.5	-68.2	168.6	0	0	0	113.4	A39 T40 K45 H94 N378	A39-L43 WeakPolarHBondContact O-CB 3.44Å; A39-L43 VanDerWaalsContact O-CG 3.26Å; A39-L43 WeakPolarHBondContact O-CG 3.41Å; A39-L43 PolarHBondContact O-N 3.35Å; T40-L43 PolarHBondContact O-N 2.99Å; T40-L43 VanDerWaalsContact O-N 3.15Å; L43-K45 PolarHBondContact O-N 3.47Å; L43-K45 VanDerWaalsContact O-N 3.12Å; L43-H94 VanDerWaalsContact CD2-NE2 3.34Å; L43-H94 WeakPolarHBondContact CD2-NE2 3.43Å; L43-N378 HydrophobicContact CD1-CB 3.58Å
44	T	81.3	Confident	74.9	Confident	57 Å²	57	62 Å²	62	35%	0.35	32%	0.323	S	S	.	.	S	Bend	trans	-59.7	115.7	175	-64.8	0	0	0	0	109.8	T22 T40 V46	T22-T44 WeakPolarHBondContact CG2-O 3.34Å; T22-T44 WeakPolarHBondContact O-CG2 3.09Å; T40-T44 PolarHBondContact O-N 2.98Å; T40-T44 PolarHBondContact O-OG1 3.04Å; T44-V46 PolarHBondContact O-N 2.75Å
45	K	72.8	Confident	75.5	Confident	193 Å²	193	64.8 Å²	64.8	84%	0.839	34%	0.336	S	S	*	.			trans	-61.9	131.9	172.4	-66.4	-176.7	179.9	179.4	0	108.9	L43 D47	L43-K45 PolarHBondContact O-N 3.47Å; L43-K45 VanDerWaalsContact O-N 3.12Å; K45-D47 PolarHBondContact O-N 3.33Å; K45-D47 VanDerWaalsContact O-N 3.11Å
46	V	70.2	Confident	76.4	Confident	45 Å²	45	64.1 Å²	64.1	27%	0.273	33%	0.333	S	S	.	.			trans	-61	113.8	168.9	-180	0	0	0	0	107.6	K20 T22 T44 S48 V116	K20-V46 HydrophobicContact CB-CG1 3.86Å; K20-V46 HydrophobicContact CB-CG2 4.19Å; K20-V46 HydrophobicContact CD-CG1 3.94Å; T22-V46 HydrophobicContact CG2-CG2 3.71Å; T44-V46 PolarHBondContact O-N 2.75Å; V46-S48 PolarHBondContact O-N 2.89Å; V46-V116 HydrophobicContact CG2-CB 4.21Å; V46-V116 HydrophobicContact CG2-CG2 3.94Å
47	D	62.1	Low	77.2	Confident	83 Å²	83	61.9 Å²	61.9	44%	0.444	32%	0.321	S	S	.	.			trans	-71.2	115.3	177.8	-170.8	-14.8	0	0	0	109.2	K45 K49 L50	K45-D47 PolarHBondContact O-N 3.33Å; K45-D47 VanDerWaalsContact O-N 3.11Å; D47-K49 PolarHBondContact O-N 3.34Å; D47-K49 VanDerWaalsContact O-N 3.13Å; D47-K49 WeakPolarHBondContact OD1-CB 3.09Å; D47-K49 PolarHBondContact OD1-N 3.29Å; D47-L50 CarbonylContact O-C 3.39Å; D47-L50 PolarHBondContact O-N 3.23Å; D47-L50 VanDerWaalsContact O-N 3.1Å
48	S	54.2	Low	77.6	Confident	97 Å²	97	60.8 Å²	60.8	68%	0.678	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-13.4	-178	54.7	0	0	0	0	113.6	V46	V46-S48 PolarHBondContact O-N 2.89Å
49	K	52.4	Low	78	Confident	188 Å²	188	63 Å²	63	82%	0.817	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-20.6	175.3	-63	179.5	-180	177.7	0	113.2	D47	D47-K49 PolarHBondContact O-N 3.34Å; D47-K49 VanDerWaalsContact O-N 3.13Å; D47-K49 WeakPolarHBondContact OD1-CB 3.09Å; D47-K49 PolarHBondContact OD1-N 3.29Å
50	L	59.6	Low	78.4	Confident	111 Å²	111	66.3 Å²	66.3	58%	0.581	34%	0.338	S	S	*	.	S	Bend	trans	-117	72.9	177.4	-75.8	160.1	0	0	0	107.6	D47 L52	D47-L50 CarbonylContact O-C 3.39Å; D47-L50 PolarHBondContact O-N 3.23Å; D47-L50 VanDerWaalsContact O-N 3.1Å; L50-L52 PolarHBondContact O-N 3.28Å
51	E	60	Low	78.5	Confident	115 Å²	115	64.5 Å²	64.5	54%	0.537	33%	0.327	S	S	.	.			trans	-69.1	73.7	179.8	-69.8	-137	111	0	0	112.2	K20 S53	K20-E51 IonicContact NZ-OE1 3.29Å; K20-E51 PolarHBondContact NZ-OE1 3.35Å; E51-S53 PolarHBondContact O-N 3.12Å
52	L	77.9	Confident	78.8	Confident	41 Å²	41	65.5 Å²	65.5	22%	0.215	33%	0.33	C	S	.	.			trans	-74.3	65.5	172.4	-68.6	166.7	0	0	0	109	K20 F21 L50 I69 L70 V71	K20-L52 WeakPolarHBondContact CA-O 3.35Å; F21-L52 HydrophobicContact CB-CB 4.36Å; F21-L52 WeakPolarHBondContact CD2-O 3.47Å; F21-L52 PolarHBondContact N-O 2.84Å; L50-L52 PolarHBondContact O-N 3.28Å; L52-I69 VanDerWaalsContact C-CD1 3.48Å; L52-I69 HydrophobicContact CB-CD1 3.71Å; L52-I69 HydrophobicContact CD2-CB 4.27Å; L52-I69 HydrophobicContact CD2-CD1 4Å; L52-I69 HydrophobicContact CD2-CG1 4.46Å; L52-I69 HydrophobicContact CG-CD1 4.48Å; L52-L70 VanDerWaalsContact CD2-O 3.26Å; L52-L70 WeakPolarHBondContact CD2-O 3.36Å; L52-V71 HydrophobicContact CB-CG2 4.44Å; L52-V71 HydrophobicContact CD1-CG1 4.36Å; L52-V71 HydrophobicContact CD1-CG2 4.15Å; L52-V71 HydrophobicContact CD2-CG2 4.25Å
53	S	85.6	Confident	79.2	Confident	42 Å²	42	64.8 Å²	64.8	29%	0.294	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	146.1	178.6	69.3	0	0	0	0	111.9	V19 E51	V19-S53 CarbonylContact O-C 3.1Å; V19-S53 VanDerWaalsContact O-CA 3.27Å; V19-S53 WeakPolarHBondContact O-CA 3.49Å; E51-S53 PolarHBondContact O-N 3.12Å
54	S	88.2	Confident	79.8	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.021	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	150.7	179.3	-162.5	0	0	0	0	110.7	V19 L56 Y66 P67	V19-S54 WeakPolarHBondContact CG2-O 3.41Å; V19-S54 PolarHBondContact N-O 2.83Å; V19-S54 PolarHBondContact O-N 3.37Å; S54-L56 PolarHBondContact O-N 3.28Å; S54-Y66 WeakPolarHBondContact OG-CA 3.43Å; S54-Y66 PolarHBondContact OG-N 2.9Å; S54-Y66 PolarHBondContact OG-O 2.87Å; S54-P67 PolarHBondContact OG-O 3.29Å
55	Q	92	Very high	80.3	Confident	76 Å²	76	59.7 Å²	59.7	36%	0.355	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	114.5	167.6	-68.6	-174.2	-11.7	0	0	109.2	D17 F65 Y66	D17-Q55 CarbonylContact O-C 3.6Å; D17-Q55 WeakPolarHBondContact O-CA 3.31Å; Q55-F65 CarbonylContact O-C 3.56Å; Q55-F65 VanDerWaalsContact O-CA 3.32Å; Q55-F65 WeakPolarHBondContact O-CA 3.48Å; Q55-Y66 WeakPolarHBondContact CB-O 3.4Å; Q55-Y66 PolarHBondContact N-O 3.21Å; Q55-Y66 PolarHBondContact O-N 2.79Å
56	L	93.7	Very high	81	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	124.1	165.1	167.5	58.5	0	0	0	109	F15 E16 D17 V19 S54 I63 S64 F65 L117 L126	F15-L56 HydrophobicContact CE1-CD2 3.93Å; F15-L56 HydrophobicContact CE1-CG 4.34Å; E16-L56 CarbonylContact C-O 3.6Å; E16-L56 VanDerWaalsContact CA-O 3.29Å; E16-L56 WeakPolarHBondContact CA-O 3.4Å; D17-L56 PolarHBondContact N-O 2.85Å; D17-L56 PolarHBondContact O-N 3.13Å; V19-L56 HydrophobicContact CG1-CB 3.78Å; V19-L56 HydrophobicContact CG1-CD2 3.86Å; V19-L56 HydrophobicContact CG2-CB 4.12Å; S54-L56 PolarHBondContact O-N 3.28Å; L56-I63 HydrophobicContact CD1-CB 4.05Å; L56-S64 CarbonylContact C-O 3.45Å; L56-S64 WeakPolarHBondContact CA-O 3.11Å; L56-F65 HydrophobicContact CB-CD1 4.15Å; L56-F65 HydrophobicContact CB-CE1 4.07Å; L56-F65 HydrophobicContact CD1-CD1 4.12Å; L56-F65 HydrophobicContact CD1-CE1 3.61Å; L56-F65 HydrophobicContact CD1-CZ 4.01Å; L56-F65 HydrophobicContact CD2-CE1 4.46Å; L56-F65 HydrophobicContact CG-CE1 4.24Å; L56-L117 HydrophobicContact CD2-CD2 4.49Å; L56-L126 HydrophobicContact CD2-CD1 4.12Å; L56-L126 HydrophobicContact CD2-CD2 3.76Å
57	K	93.9	Very high	81.7	Confident	52 Å²	52	59.3 Å²	59.3	23%	0.226	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129.6	169.8	-73.8	170.1	178.8	158.6	0	109.9	L13 E16 Y59 I63 S64	L13-K57 HydrophobicContact CD1-CB 3.77Å; L13-K57 HydrophobicContact CD1-CG 4.04Å; E16-K57 HydrophobicContact CB-CG 4.34Å; E16-K57 HydrophobicContact CG-CG 3.93Å; E16-K57 WeakPolarHBondContact OE1-CE 3.47Å; E16-K57 IonicContact OE1-NZ 3.43Å; E16-K57 PolarHBondContact OE1-NZ 3.2Å; E16-K57 WeakPolarHBondContact OE2-CE 3.46Å; K57-Y59 HydrophobicContact CB-CD2 4.49Å; K57-Y59 HydrophobicContact CB-CE2 3.7Å; K57-I63 CarbonylContact O-C 3.57Å; K57-I63 WeakPolarHBondContact O-CA 3.19Å; K57-S64 PolarHBondContact N-O 2.81Å; K57-S64 PolarHBondContact O-N 3.23Å; K57-S64 PolarHBondContact O-OG 2.9Å
58	C	91.7	Very high	82.6	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	120.4	-179.6	-67.1	0	0	0	0	110.4	Q14 F15 I63 F129	Q14-C58 PolarHBondContact N-O 3.11Å; F15-C58 HydrophobicContact CB-CB 4.04Å; F15-C58 HydrophobicContact CD1-CB 4.17Å; F15-C58 PolarHBondContact N-O 3.22Å; F15-C58 PolarHBondContact O-N 3.25Å; C58-I63 HydrophobicContact CB-CG2 4.31Å; C58-I63 VanDerWaalsContact SG-CG2 3.53Å; C58-F129 HydrophobicContact CB-CD1 4.06Å; C58-F129 HydrophobicContact CB-CD2 4.47Å; C58-F129 HydrophobicContact CB-CE1 3.62Å; C58-F129 HydrophobicContact CB-CE2 4.07Å; C58-F129 HydrophobicContact CB-CG 4.46Å; C58-F129 HydrophobicContact CB-CZ 3.64Å
59	Y	91.6	Very high	83.7	Confident	47 Å²	47	56.1 Å²	56.1	18%	0.184	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	168.6	177.5	-58.6	-91.9	0	0	0	109.9	E11 L13 K57 T61 Y62 S64 F129	E11-Y59 HydrophobicContact CB-CD1 4.2Å; E11-Y59 WeakPolarHBondContact OE2-CB 3.42Å; L13-Y59 HydrophobicContact CB-CD1 4.37Å; L13-Y59 HydrophobicContact CB-CE1 4.18Å; L13-Y59 HydrophobicContact CD1-CD1 4.3Å; L13-Y59 HydrophobicContact CD1-CE1 3.94Å; L13-Y59 HydrophobicContact CD1-CE2 4.31Å; K57-Y59 HydrophobicContact CB-CD2 4.49Å; K57-Y59 HydrophobicContact CB-CE2 3.7Å; Y59-T61 PolarHBondContact O-N 2.86Å; Y59-T61 VanDerWaalsContact O-N 3.13Å; Y59-Y62 HydrophobicContact CD2-CD1 4.45Å; Y59-Y62 AromaticContact CD2-CD2 3.8Å; Y59-Y62 HydrophobicContact CD2-CD2 3.8Å; Y59-Y62 AromaticContact CD2-CE1 3.96Å; Y59-Y62 HydrophobicContact CD2-CE1 3.96Å; Y59-Y62 AromaticContact CD2-CE2 3.21Å; Y59-Y62 HydrophobicContact CD2-CE2 3.21Å; Y59-Y62 HydrophobicContact CD2-CG 4.41Å; Y59-Y62 AromaticContact CD2-CZ 3.32Å; Y59-Y62 HydrophobicContact CE2-CD2 4.46Å; Y59-Y62 AromaticContact CE2-CE2 3.56Å; Y59-Y62 HydrophobicContact CE2-CE2 3.56Å; Y59-Y62 AromaticContact CE2-CZ 3.74Å; Y59-Y62 HydrophobicContact CG-CD1 4.44Å; Y59-Y62 AromaticContact CG-CE1 3.86Å; Y59-Y62 HydrophobicContact CG-CE1 3.86Å; Y59-Y62 AromaticContact CG-CE2 3.99Å; Y59-Y62 HydrophobicContact CG-CE2 3.99Å; Y59-Y62 AromaticContact CG-CZ 3.61Å; Y59-Y62 PolarHBondContact N-O 3.24Å; Y59-Y62 PolarHBondContact O-N 3.43Å; Y59-S64 WeakPolarHBondContact CE2-OG 3.48Å; Y59-F129 WeakPolarHBondContact O-CE2 3.49Å; Y59-F129 WeakPolarHBondContact O-CZ 3.27Å
60	E	87.2	Confident	84.9	Confident	72 Å²	72	52.2 Å²	52.2	34%	0.336	26%	0.257	S	S	.	.	S	Bend	trans	-59	-26	-176.1	-70	178.9	174.1	0	0	115	K12 Q14 L82	K12-E60 HydrophobicContact CB-CG 4.37Å; Q14-E60 HydrophobicContact CG-CG 4.26Å; Q14-E60 VanDerWaalsContact NE2-CG 3.25Å; Q14-E60 PolarHBondContact NE2-OE1 2.87Å; E60-L82 WeakPolarHBondContact O-CD1 3.16Å
61	T	85.7	Confident	85.6	Confident	32 Å²	32	47 Å²	47	20%	0.196	23%	0.229	C	C	.	.	S	Bend	trans	-116.8	-10.7	179.1	78.6	0	0	0	0	115.3	E11 Y59 L82	E11-T61 VanDerWaalsContact CD-OG1 3.24Å; E11-T61 WeakPolarHBondContact OE1-CG2 3.18Å; E11-T61 PolarHBondContact OE1-OG1 2.91Å; E11-T61 PolarHBondContact OE2-N 3.37Å; E11-T61 VanDerWaalsContact OE2-N 3.11Å; E11-T61 PolarHBondContact OE2-OG1 3.39Å; E11-T61 VanDerWaalsContact OE2-OG1 3.06Å; Y59-T61 PolarHBondContact O-N 2.86Å; Y59-T61 VanDerWaalsContact O-N 3.13Å; T61-L82 PolarHBondContact O-N 3.38Å
62	Y	90.9	Very high	86.3	Confident	34 Å²	34	46.3 Å²	46.3	13%	0.133	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	159.4	-175.3	68.1	-82.8	0	0	0	113.8	E11 Y59 R79 I80	E11-Y62 VanDerWaalsContact OE2-CD1 3.32Å; E11-Y62 WeakPolarHBondContact OE2-CD1 3.27Å; E11-Y62 VanDerWaalsContact OE2-CE1 3.27Å; E11-Y62 WeakPolarHBondContact OE2-CE1 3.32Å; Y59-Y62 HydrophobicContact CD2-CD1 4.45Å; Y59-Y62 AromaticContact CD2-CD2 3.8Å; Y59-Y62 HydrophobicContact CD2-CD2 3.8Å; Y59-Y62 AromaticContact CD2-CE1 3.96Å; Y59-Y62 HydrophobicContact CD2-CE1 3.96Å; Y59-Y62 AromaticContact CD2-CE2 3.21Å; Y59-Y62 HydrophobicContact CD2-CE2 3.21Å; Y59-Y62 HydrophobicContact CD2-CG 4.41Å; Y59-Y62 AromaticContact CD2-CZ 3.32Å; Y59-Y62 HydrophobicContact CE2-CD2 4.46Å; Y59-Y62 AromaticContact CE2-CE2 3.56Å; Y59-Y62 HydrophobicContact CE2-CE2 3.56Å; Y59-Y62 AromaticContact CE2-CZ 3.74Å; Y59-Y62 HydrophobicContact CG-CD1 4.44Å; Y59-Y62 AromaticContact CG-CE1 3.86Å; Y59-Y62 HydrophobicContact CG-CE1 3.86Å; Y59-Y62 AromaticContact CG-CE2 3.99Å; Y59-Y62 HydrophobicContact CG-CE2 3.99Å; Y59-Y62 AromaticContact CG-CZ 3.61Å; Y59-Y62 PolarHBondContact N-O 3.24Å; Y59-Y62 PolarHBondContact O-N 3.43Å; Y62-R79 HydrophobicContact CD2-CG 3.59Å; Y62-R79 VanDerWaalsContact CD2-NE 3.28Å; Y62-R79 VanDerWaalsContact CE1-CZ 3.42Å; Y62-R79 HydrophobicContact CE2-CG 4.19Å; Y62-R79 HydrophobicContact CG-CG 4.11Å; Y62-R79 VanDerWaalsContact CG-NE 3.27Å; Y62-I80 WeakPolarHBondContact CA-O 3.1Å; Y62-I80 WeakPolarHBondContact CB-O 3.15Å
63	I	92.2	Very high	85.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	151.1	161.9	65.8	177.9	0	0	0	110.1	L56 K57 C58 F65 R79 I80 L82 I85 I100 F129	L56-I63 HydrophobicContact CD1-CB 4.05Å; K57-I63 CarbonylContact O-C 3.57Å; K57-I63 WeakPolarHBondContact O-CA 3.19Å; C58-I63 HydrophobicContact CB-CG2 4.31Å; C58-I63 VanDerWaalsContact SG-CG2 3.53Å; I63-F65 HydrophobicContact CD1-CE2 3.88Å; I63-F65 HydrophobicContact CD1-CZ 3.84Å; I63-F65 HydrophobicContact CG1-CE2 4.2Å; I63-R79 CarbonylContact O-C 3.56Å; I63-R79 WeakPolarHBondContact O-CA 3.32Å; I63-I80 HydrophobicContact CD1-CB 4.45Å; I63-I80 HydrophobicContact CD1-CD1 4.44Å; I63-I80 HydrophobicContact CG1-CB 3.92Å; I63-I80 PolarHBondContact N-O 2.92Å; I63-I80 PolarHBondContact O-N 2.83Å; I63-L82 HydrophobicContact CG2-CD2 4.06Å; I63-I85 HydrophobicContact CD1-CD1 3.79Å; I63-I85 HydrophobicContact CG1-CD1 4.21Å; I63-I100 HydrophobicContact CD1-CD1 3.58Å; I63-F129 HydrophobicContact CG2-CE1 3.68Å; I63-F129 HydrophobicContact CG2-CZ 4.34Å
64	S	92.5	Very high	85.2	Confident	19 Å²	19	47.2 Å²	47.2	13%	0.133	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	147.1	176.2	60.1	0	0	0	0	112	L56 K57 Y59 G78	L56-S64 CarbonylContact C-O 3.45Å; L56-S64 WeakPolarHBondContact CA-O 3.11Å; K57-S64 PolarHBondContact N-O 2.81Å; K57-S64 PolarHBondContact O-N 3.23Å; K57-S64 PolarHBondContact O-OG 2.9Å; Y59-S64 WeakPolarHBondContact CE2-OG 3.48Å; S64-G78 CarbonylContact C-O 3.6Å; S64-G78 WeakPolarHBondContact CA-O 3.41Å; S64-G78 WeakPolarHBondContact CB-O 3.41Å
65	F	91.1	Very high	84.6	Confident	3 Å²	3	55.1 Å²	55.1	1%	0.013	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.7	178.9	-59	-77	0	0	0	109.2	V19 F21 Q55 L56 I63 G78 I80 I100 M115	V19-F65 HydrophobicContact CG2-CD1 4.22Å; V19-F65 HydrophobicContact CG2-CE1 4.22Å; F21-F65 HydrophobicContact CE1-CE1 4.31Å; F21-F65 HydrophobicContact CE2-CD1 4.26Å; F21-F65 AromaticContact CZ-CD1 3.58Å; F21-F65 HydrophobicContact CZ-CD1 3.58Å; F21-F65 AromaticContact CZ-CE1 3.63Å; F21-F65 HydrophobicContact CZ-CE1 3.63Å; F21-F65 HydrophobicContact CZ-CG 4.13Å; F21-F65 HydrophobicContact CZ-CZ 4.26Å; Q55-F65 CarbonylContact O-C 3.56Å; Q55-F65 VanDerWaalsContact O-CA 3.32Å; Q55-F65 WeakPolarHBondContact O-CA 3.48Å; L56-F65 HydrophobicContact CB-CD1 4.15Å; L56-F65 HydrophobicContact CB-CE1 4.07Å; L56-F65 HydrophobicContact CD1-CD1 4.12Å; L56-F65 HydrophobicContact CD1-CE1 3.61Å; L56-F65 HydrophobicContact CD1-CZ 4.01Å; L56-F65 HydrophobicContact CD2-CE1 4.46Å; L56-F65 HydrophobicContact CG-CE1 4.24Å; I63-F65 HydrophobicContact CD1-CE2 3.88Å; I63-F65 HydrophobicContact CD1-CZ 3.84Å; I63-F65 HydrophobicContact CG1-CE2 4.2Å; F65-G78 PolarHBondContact N-O 2.87Å; F65-G78 WeakPolarHBondContact O-CA 3.45Å; F65-I80 HydrophobicContact CE2-CD1 3.93Å; F65-I100 HydrophobicContact CZ-CD1 4.48Å; F65-M115 HydrophobicContact CE1-CE 4.38Å; F65-M115 HydrophobicContact CE1-SD 4.35Å; F65-M115 HydrophobicContact CZ-CE 4.07Å; F65-M115 HydrophobicContact CZ-SD 4.49Å
66	Y	87.8	Confident	83.8	Confident	168 Å²	168	51.5 Å²	51.5	66%	0.659	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.7	126.6	175.4	-172	-93	0	0	0	113	S54 Q55	S54-Y66 WeakPolarHBondContact OG-CA 3.43Å; S54-Y66 PolarHBondContact OG-N 2.9Å; S54-Y66 PolarHBondContact OG-O 2.87Å; Q55-Y66 WeakPolarHBondContact CB-O 3.4Å; Q55-Y66 PolarHBondContact N-O 3.21Å; Q55-Y66 PolarHBondContact O-N 2.79Å
67	P	85.6	Confident	82.7	Confident	62 Å²	62	53.1 Å²	53.1	40%	0.403	27%	0.269	S	S	.	.	S	Bend	cis	-69.6	159	1.2	29.4	-35.9	0	0	0	113	S54 I69	S54-P67 PolarHBondContact OG-O 3.29Å; P67-I69 HydrophobicContact CB-CG2 4.48Å; P67-I69 HydrophobicContact CG-CG2 3.98Å
68	E	80.6	Confident	82.1	Confident	85 Å²	85	51.3 Å²	51.3	40%	0.397	27%	0.265	S	S	.	.			trans	-66	129.8	160.1	-68.2	-170	172.8	0	0	108.7	R75 G78	E68-R75 IonicContact OE2-CZ 2.72Å; E68-R75 IonicContact OE2-NE 2.79Å; E68-R75 PolarHBondContact OE2-NE 2.98Å; E68-R75 IonicContact OE2-NH2 3.09Å; E68-R75 PolarHBondContact OE2-NH2 2.9Å; E68-G78 WeakPolarHBondContact OE1-CA 3.45Å; E68-G78 PolarHBondContact OE1-N 3.22Å
69	I	78.5	Confident	82	Confident	28 Å²	28	57.8 Å²	57.8	14%	0.144	29%	0.289	C	S	.	.			trans	-127.6	157.7	-177	60.2	173.7	0	0	0	110.5	F21 L52 P67 V71 L76	F21-I69 HydrophobicContact CD2-CD1 3.55Å; F21-I69 HydrophobicContact CD2-CG1 4.49Å; F21-I69 HydrophobicContact CE2-CD1 4.06Å; F21-I69 HydrophobicContact CG-CD1 4.34Å; L52-I69 VanDerWaalsContact C-CD1 3.48Å; L52-I69 HydrophobicContact CB-CD1 3.71Å; L52-I69 HydrophobicContact CD2-CB 4.27Å; L52-I69 HydrophobicContact CD2-CD1 4Å; L52-I69 HydrophobicContact CD2-CG1 4.46Å; L52-I69 HydrophobicContact CG-CD1 4.48Å; P67-I69 HydrophobicContact CB-CG2 4.48Å; P67-I69 HydrophobicContact CG-CG2 3.98Å; I69-V71 HydrophobicContact CD1-CG2 3.96Å; I69-V71 HydrophobicContact CG1-CG2 4.02Å; I69-L76 HydrophobicContact CD1-CD1 3.91Å; I69-L76 HydrophobicContact CG1-CB 4.38Å; I69-L76 HydrophobicContact CG1-CD1 3.53Å; I69-L76 HydrophobicContact CG1-CG 4.04Å; I69-L76 WeakPolarHBondContact O-CB 3.4Å; I69-L76 PolarHBondContact O-N 2.94Å
70	L	77.2	Confident	81.9	Confident	107 Å²	107	55.6 Å²	55.6	56%	0.56	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.5	115.1	176.6	-149.1	94.3	0	0	0	109.4	L52 R75	L52-L70 VanDerWaalsContact CD2-O 3.26Å; L52-L70 WeakPolarHBondContact CD2-O 3.36Å; L70-R75 HydrophobicContact CD1-CB 3.86Å
71	V	74.7	Confident	81.9	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	122.3	179.9	-178.3	0	0	0	0	108.4	F21 G23 S24 L52 I69 G73 I74 L76	F21-V71 HydrophobicContact CB-CG1 4.37Å; F21-V71 HydrophobicContact CB-CG2 3.86Å; F21-V71 HydrophobicContact CG-CG2 4.24Å; G23-V71 VanDerWaalsContact CA-CG1 3.41Å; S24-V71 PolarHBondContact OG-O 3.46Å; L52-V71 HydrophobicContact CB-CG2 4.44Å; L52-V71 HydrophobicContact CD1-CG1 4.36Å; L52-V71 HydrophobicContact CD1-CG2 4.15Å; L52-V71 HydrophobicContact CD2-CG2 4.25Å; I69-V71 HydrophobicContact CD1-CG2 3.96Å; I69-V71 HydrophobicContact CG1-CG2 4.02Å; V71-G73 PolarHBondContact O-N 2.93Å; V71-G73 VanDerWaalsContact O-N 3.07Å; V71-I74 PolarHBondContact N-O 3.45Å; V71-I74 PolarHBondContact O-N 3.45Å; V71-I74 VanDerWaalsContact O-O 3.08Å; V71-L76 HydrophobicContact CB-CD2 4.16Å; V71-L76 HydrophobicContact CB-CG 4.27Å; V71-L76 HydrophobicContact CG2-CD1 3.66Å; V71-L76 HydrophobicContact CG2-CD2 3.99Å; V71-L76 HydrophobicContact CG2-CG 3.66Å
72	T	73.7	Confident	81.9	Confident	100 Å²	100	54 Å²	54	61%	0.613	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	35.2	179.3	44	0	0	0	0	114.2	S24 I74	S24-T72 PolarHBondContact N-OG1 3.36Å; S24-T72 PolarHBondContact O-OG1 3.09Å; S24-T72 PolarHBondContact OG-OG1 3.1Å; T72-I74 VanDerWaalsContact C-N 3.29Å; T72-I74 PolarHBondContact O-N 3.48Å
73	G	69.1	Low	81.4	Confident	61 Å²	61	59.9 Å²	59.9	63%	0.629	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	-9.7	-179.6	0	0	0	0	0	115.3	V71	V71-G73 PolarHBondContact O-N 2.93Å; V71-G73 VanDerWaalsContact O-N 3.07Å
74	I	70.6	Confident	81	Confident	41 Å²	41	62.2 Å²	62.2	21%	0.21	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	130.4	176	-61.4	157.7	0	0	0	108.2	S24 I26 V71 T72 L76	S24-I74 WeakPolarHBondContact OG-CB 3.42Å; S24-I74 VanDerWaalsContact OG-CD1 3.31Å; S24-I74 WeakPolarHBondContact OG-CD1 3.12Å; I26-I74 HydrophobicContact CD1-CD1 3.87Å; I26-I74 HydrophobicContact CD1-CG1 4.14Å; I26-I74 HydrophobicContact CG1-CD1 3.83Å; V71-I74 PolarHBondContact N-O 3.45Å; V71-I74 PolarHBondContact O-N 3.45Å; V71-I74 VanDerWaalsContact O-O 3.08Å; T72-I74 VanDerWaalsContact C-N 3.29Å; T72-I74 PolarHBondContact O-N 3.48Å; I74-L76 PolarHBondContact O-N 2.78Å
75	R	75.9	Confident	80.7	Confident	169 Å²	169	62 Å²	62	64%	0.638	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.2	172.2	-177.6	172.7	173	174.8	-4.4	108.7	E68 L70 E77 Y113	E68-R75 IonicContact OE2-CZ 2.72Å; E68-R75 IonicContact OE2-NE 2.79Å; E68-R75 PolarHBondContact OE2-NE 2.98Å; E68-R75 IonicContact OE2-NH2 3.09Å; E68-R75 PolarHBondContact OE2-NH2 2.9Å; L70-R75 HydrophobicContact CD1-CB 3.86Å; R75-E77 PolarHBondContact O-N 2.73Å; R75-Y113 PolarHBondContact O-OH 2.63Å
76	L	74.7	Confident	80.2	Confident	1 Å²	1	64 Å²	64	1%	0.005	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-67.3	130.2	170	-64.6	-168.9	0	0	0	109.6	F21 I69 V71 I74 G78 Y113	F21-L76 HydrophobicContact CD1-CD1 3.52Å; F21-L76 HydrophobicContact CD1-CD2 4.45Å; F21-L76 HydrophobicContact CD2-CD1 3.54Å; F21-L76 HydrophobicContact CE1-CD1 3.37Å; F21-L76 HydrophobicContact CE1-CD2 4.43Å; F21-L76 HydrophobicContact CE2-CD1 3.37Å; F21-L76 HydrophobicContact CG-CD1 3.59Å; F21-L76 HydrophobicContact CZ-CD1 3.28Å; I69-L76 HydrophobicContact CD1-CD1 3.91Å; I69-L76 HydrophobicContact CG1-CB 4.38Å; I69-L76 HydrophobicContact CG1-CD1 3.53Å; I69-L76 HydrophobicContact CG1-CG 4.04Å; I69-L76 WeakPolarHBondContact O-CB 3.4Å; I69-L76 PolarHBondContact O-N 2.94Å; V71-L76 HydrophobicContact CB-CD2 4.16Å; V71-L76 HydrophobicContact CB-CG 4.27Å; V71-L76 HydrophobicContact CG2-CD1 3.66Å; V71-L76 HydrophobicContact CG2-CD2 3.99Å; V71-L76 HydrophobicContact CG2-CG 3.66Å; I74-L76 PolarHBondContact O-N 2.78Å; L76-G78 PolarHBondContact O-N 3.47Å; L76-Y113 WeakPolarHBondContact CA-OH 3.4Å; L76-Y113 HydrophobicContact CB-CE2 4.38Å; L76-Y113 HydrophobicContact CD2-CD1 3.58Å; L76-Y113 HydrophobicContact CD2-CD2 3.82Å; L76-Y113 HydrophobicContact CD2-CE1 3.37Å; L76-Y113 HydrophobicContact CD2-CE2 3.6Å; L76-Y113 HydrophobicContact CD2-CG 3.81Å
77	E	72.2	Confident	79.9	Confident	33 Å²	33	56.1 Å²	56.1	15%	0.154	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-71.2	124.7	177.2	-61.6	-179.3	-166.4	0	0	110	R75 R79 I80 R104 Y113	R75-E77 PolarHBondContact O-N 2.73Å; E77-R79 PolarHBondContact O-N 3.25Å; E77-R79 VanDerWaalsContact O-N 3.13Å; E77-I80 HydrophobicContact CB-CG1 4.24Å; E77-R104 IonicContact OE1-CZ 3.04Å; E77-R104 IonicContact OE1-NE 2.76Å; E77-R104 PolarHBondContact OE1-NE 2.64Å; E77-R104 IonicContact OE1-NH1 3.19Å; E77-R104 IonicContact OE1-NH2 2.64Å; E77-R104 PolarHBondContact OE1-NH2 3.19Å; E77-R104 IonicContact OE2-CZ 3.06Å; E77-R104 IonicContact OE2-NE 3.17Å; E77-R104 PolarHBondContact OE2-NE 3.13Å; E77-R104 IonicContact OE2-NH2 2.65Å; E77-R104 PolarHBondContact OE2-NH2 2.81Å; E77-Y113 PolarHBondContact N-OH 2.87Å; E77-Y113 VanDerWaalsContact N-OH 3.17Å
78	G	80.8	Confident	80	Confident	14 Å²	14	53.1 Å²	53.1	14%	0.144	27%	0.274	C	S	.	.	S	Bend	trans	-67.5	-11.5	-178.9	0	0	0	0	0	114.1	S64 F65 E68 L76	S64-G78 CarbonylContact C-O 3.6Å; S64-G78 WeakPolarHBondContact CA-O 3.41Å; S64-G78 WeakPolarHBondContact CB-O 3.41Å; F65-G78 PolarHBondContact N-O 2.87Å; F65-G78 WeakPolarHBondContact O-CA 3.45Å; E68-G78 WeakPolarHBondContact OE1-CA 3.45Å; E68-G78 PolarHBondContact OE1-N 3.22Å; L76-G78 PolarHBondContact O-N 3.47Å
79	R	89.6	Confident	80.2	Confident	137 Å²	137	49.1 Å²	49.1	52%	0.517	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	130.9	178	179.7	165.9	-179.4	174.3	-0.6	110.6	Y62 I63 E77	Y62-R79 HydrophobicContact CD2-CG 3.59Å; Y62-R79 VanDerWaalsContact CD2-NE 3.28Å; Y62-R79 VanDerWaalsContact CE1-CZ 3.42Å; Y62-R79 HydrophobicContact CE2-CG 4.19Å; Y62-R79 HydrophobicContact CG-CG 4.11Å; Y62-R79 VanDerWaalsContact CG-NE 3.27Å; I63-R79 CarbonylContact O-C 3.56Å; I63-R79 WeakPolarHBondContact O-CA 3.32Å; E77-R79 PolarHBondContact O-N 3.25Å; E77-R79 VanDerWaalsContact O-N 3.13Å
80	I	89.5	Confident	80.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	126.3	176.5	-50	178	0	0	0	107.9	Y62 I63 F65 E77 E84 I85 F102 Y113	Y62-I80 WeakPolarHBondContact CA-O 3.1Å; Y62-I80 WeakPolarHBondContact CB-O 3.15Å; I63-I80 HydrophobicContact CD1-CB 4.45Å; I63-I80 HydrophobicContact CD1-CD1 4.44Å; I63-I80 HydrophobicContact CG1-CB 3.92Å; I63-I80 PolarHBondContact N-O 2.92Å; I63-I80 PolarHBondContact O-N 2.83Å; F65-I80 HydrophobicContact CE2-CD1 3.93Å; E77-I80 HydrophobicContact CB-CG1 4.24Å; I80-E84 HydrophobicContact CG2-CB 4.21Å; I80-I85 HydrophobicContact CG2-CG1 3.97Å; I80-F102 HydrophobicContact CD1-CD1 3.87Å; I80-F102 HydrophobicContact CD1-CD2 4.24Å; I80-F102 HydrophobicContact CD1-CE1 3.83Å; I80-F102 HydrophobicContact CD1-CE2 4.21Å; I80-F102 HydrophobicContact CD1-CG 4.09Å; I80-F102 HydrophobicContact CD1-CZ 4.01Å; I80-F102 HydrophobicContact CG2-CB 3.94Å; I80-F102 HydrophobicContact CG2-CD2 3.9Å; I80-F102 HydrophobicContact CG2-CG 3.91Å; I80-Y113 HydrophobicContact CD1-CD2 4.08Å; I80-Y113 HydrophobicContact CD1-CE2 3.82Å
81	S	87.7	Confident	80.3	Confident	34 Å²	34	43.5 Å²	43.5	24%	0.238	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	142.7	175.3	178.8	0	0	0	0	110.7	Q83 E84 I85	S81-Q83 PolarHBondContact O-N 2.98Å; S81-Q83 VanDerWaalsContact O-N 3.12Å; S81-Q83 PolarHBondContact OG-N 3.03Å; S81-E84 VanDerWaalsContact CB-OE2 3.28Å; S81-E84 WeakPolarHBondContact CB-OE2 3.35Å; S81-E84 PolarHBondContact N-OE2 3.45Å; S81-E84 WeakPolarHBondContact O-CB 3.36Å; S81-E84 PolarHBondContact O-N 3.3Å; S81-I85 PolarHBondContact O-N 3.39Å
82	L	84.6	Confident	80.2	Confident	38 Å²	38	45.6 Å²	45.6	20%	0.199	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-22.2	173.5	-63.8	-178.1	0	0	0	112.5	E60 T61 I63 E84 I85 F129 L130	E60-L82 WeakPolarHBondContact O-CD1 3.16Å; T61-L82 PolarHBondContact O-N 3.38Å; I63-L82 HydrophobicContact CG2-CD2 4.06Å; L82-E84 VanDerWaalsContact C-N 3.34Å; L82-I85 HydrophobicContact CD2-CD1 3.92Å; L82-F129 HydrophobicContact CD1-CE1 4.43Å; L82-F129 HydrophobicContact CD1-CE2 4.42Å; L82-F129 HydrophobicContact CD1-CZ 3.84Å; L82-F129 HydrophobicContact CD2-CE1 3.74Å; L82-F129 HydrophobicContact CD2-CZ 3.9Å; L82-F129 HydrophobicContact CG-CZ 4.41Å; L82-L130 HydrophobicContact CD2-CD2 4.05Å
83	Q	81.4	Confident	80.2	Confident	157 Å²	157	49.1 Å²	49.1	73%	0.734	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-22.8	175.3	-61.5	-179.6	-2.6	0	0	113.3	S81	S81-Q83 PolarHBondContact O-N 2.98Å; S81-Q83 VanDerWaalsContact O-N 3.12Å; S81-Q83 PolarHBondContact OG-N 3.03Å
84	E	83.8	Confident	80.7	Confident	49 Å²	49	49.7 Å²	49.7	23%	0.229	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-19.7	177.1	-63.7	166.4	143.3	0	0	111.3	I80 S81 L82 L86 F102 Q103	I80-E84 HydrophobicContact CG2-CB 4.21Å; S81-E84 VanDerWaalsContact CB-OE2 3.28Å; S81-E84 WeakPolarHBondContact CB-OE2 3.35Å; S81-E84 PolarHBondContact N-OE2 3.45Å; S81-E84 WeakPolarHBondContact O-CB 3.36Å; S81-E84 PolarHBondContact O-N 3.3Å; L82-E84 VanDerWaalsContact C-N 3.34Å; E84-L86 PolarHBondContact O-N 2.88Å; E84-F102 CarbonylContact O-C 3.59Å; E84-F102 WeakPolarHBondContact O-CA 3.4Å; E84-F102 VanDerWaalsContact O-CB 3.3Å; E84-F102 WeakPolarHBondContact O-CB 3.32Å; E84-Q103 PolarHBondContact O-N 2.86Å
85	I	84.7	Confident	81.4	Confident	14 Å²	14	49.8 Å²	49.8	7%	0.072	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	116.7	178.9	-61.6	177.5	0	0	0	109.7	I63 I80 S81 L82 I100 L101 F102 L130	I63-I85 HydrophobicContact CD1-CD1 3.79Å; I63-I85 HydrophobicContact CG1-CD1 4.21Å; I80-I85 HydrophobicContact CG2-CG1 3.97Å; S81-I85 PolarHBondContact O-N 3.39Å; L82-I85 HydrophobicContact CD2-CD1 3.92Å; I85-I100 HydrophobicContact CD1-CG2 4.16Å; I85-I100 HydrophobicContact CG1-CG2 4.15Å; I85-I100 HydrophobicContact CG2-CG2 3.92Å; I85-L101 CarbonylContact C-O 3.48Å; I85-L101 WeakPolarHBondContact CA-O 3.38Å; I85-F102 HydrophobicContact CG1-CB 4.27Å; I85-L130 HydrophobicContact CD1-CD2 3.68Å; I85-L130 HydrophobicContact CG2-CD2 4.47Å
86	L	81.3	Confident	82.1	Confident	44 Å²	44	46.4 Å²	46.4	23%	0.23	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-20.9	179.3	-58.6	-177.6	0	0	0	113	E84 L101 Q103 V110	E84-L86 PolarHBondContact O-N 2.88Å; L86-L101 HydrophobicContact CB-CB 4.48Å; L86-L101 PolarHBondContact N-O 3.22Å; L86-Q103 HydrophobicContact CD1-CB 3.75Å; L86-Q103 HydrophobicContact CD2-CB 4.36Å; L86-Q103 HydrophobicContact CG-CB 4.09Å; L86-V110 HydrophobicContact CD1-CG1 4.05Å; L86-V110 HydrophobicContact CD1-CG2 3.78Å
87	G	82.6	Confident	82.6	Confident	3 Å²	3	46.6 Å²	46.6	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.1	-171.5	-175.1	0	0	0	0	0	113	L101	G87-L101 WeakPolarHBondContact O-CD1 3.36Å; G87-L101 PolarHBondContact O-N 2.88Å
88	F	87.5	Confident	83.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	159.3	178.8	58.9	-91.1	0	0	0	112.6	V90 L98 V99 A127 L130 T131 Y384 A386	F88-V90 HydrophobicContact CD2-CG1 4.08Å; F88-V90 HydrophobicContact CE2-CG1 4.35Å; F88-L98 HydrophobicContact CB-CD2 4.14Å; F88-L98 HydrophobicContact CB-CG 4.47Å; F88-L98 HydrophobicContact CD2-CD1 4.29Å; F88-V99 CarbonylContact C-O 3.49Å; F88-V99 WeakPolarHBondContact CA-O 3.28Å; F88-V99 VanDerWaalsContact CB-O 3.3Å; F88-V99 WeakPolarHBondContact CB-O 3.41Å; F88-A127 HydrophobicContact CE2-CB 3.72Å; F88-A127 HydrophobicContact CZ-CB 3.86Å; F88-L130 HydrophobicContact CB-CD1 4.4Å; F88-L130 HydrophobicContact CD1-CB 3.74Å; F88-L130 HydrophobicContact CD1-CD1 3.86Å; F88-L130 HydrophobicContact CD1-CG 4.47Å; F88-L130 HydrophobicContact CE1-CB 3.65Å; F88-L130 HydrophobicContact CE1-CD1 4.49Å; F88-L130 HydrophobicContact CG-CD1 4.26Å; F88-T131 HydrophobicContact CE1-CG2 3.77Å; F88-T131 HydrophobicContact CZ-CG2 3.68Å; F88-Y384 HydrophobicContact CE2-CG 4.47Å; F88-Y384 PolarHBondContact N-O 2.87Å; F88-Y384 PolarHBondContact O-N 3.46Å; F88-A386 HydrophobicContact CD1-CB 4.42Å; F88-A386 HydrophobicContact CE1-CB 4.41Å
89	F	83.1	Confident	83.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	144.1	165.8	-66.6	-88.6	0	0	0	110.1	L34 K35 A38 I42 L98 V99 L101 V381 Y382 L383	L34-F89 HydrophobicContact CD2-CE2 3.61Å; L34-F89 HydrophobicContact CD2-CZ 3.63Å; K35-F89 HydrophobicContact CB-CE1 4.34Å; K35-F89 HydrophobicContact CB-CZ 4.33Å; K35-F89 HydrophobicContact CG-CE1 4.03Å; K35-F89 HydrophobicContact CG-CZ 3.98Å; A38-F89 HydrophobicContact CB-CB 4.09Å; A38-F89 HydrophobicContact CB-CD1 4.3Å; A38-F89 HydrophobicContact CB-CD2 3.16Å; A38-F89 HydrophobicContact CB-CE2 3.51Å; A38-F89 HydrophobicContact CB-CG 3.62Å; A38-F89 HydrophobicContact CB-CZ 4.21Å; I42-F89 HydrophobicContact CD1-CB 4.1Å; F89-L98 CarbonylContact O-C 3.58Å; F89-L98 WeakPolarHBondContact O-CA 3.38Å; F89-V99 HydrophobicContact CB-CB 4.25Å; F89-V99 PolarHBondContact N-O 3.44Å; F89-V99 PolarHBondContact O-N 3.06Å; F89-L101 HydrophobicContact CD2-CD1 3.64Å; F89-L101 HydrophobicContact CE2-CD1 3.72Å; F89-L101 HydrophobicContact CE2-CD2 4.06Å; F89-L101 HydrophobicContact CE2-CG 4.43Å; F89-V381 HydrophobicContact CD1-CG1 3.79Å; F89-V381 HydrophobicContact CE1-CG1 4.09Å; F89-Y382 WeakPolarHBondContact CD1-O 3.45Å; F89-L383 HydrophobicContact CD1-CB 4.33Å; F89-L383 HydrophobicContact CD1-CD1 4.26Å; F89-L383 HydrophobicContact CE1-CB 3.7Å; F89-L383 HydrophobicContact CE1-CD1 3.6Å; F89-L383 HydrophobicContact CE1-CG 4.23Å; F89-L383 HydrophobicContact CE2-CD1 4.17Å; F89-L383 HydrophobicContact CZ-CB 4.41Å; F89-L383 HydrophobicContact CZ-CD1 3.54Å
90	V	82.4	Confident	83.9	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.006	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	160.9	167.3	-67.2	0	0	0	0	108.6	F88 L98 W358 Y384	F88-V90 HydrophobicContact CD2-CG1 4.08Å; F88-V90 HydrophobicContact CE2-CG1 4.35Å; V90-L98 HydrophobicContact CG1-CB 4.1Å; V90-L98 HydrophobicContact CG1-CD1 3.62Å; V90-L98 HydrophobicContact CG1-CG 3.74Å; V90-W358 HydrophobicContact CB-CH2 3.78Å; V90-W358 HydrophobicContact CB-CZ2 3.92Å; V90-W358 HydrophobicContact CB-CZ3 4.16Å; V90-W358 HydrophobicContact CG1-CH2 3.61Å; V90-W358 HydrophobicContact CG1-CZ2 4.18Å; V90-W358 HydrophobicContact CG1-CZ3 4.06Å; V90-W358 HydrophobicContact CG2-CD2 4.14Å; V90-W358 HydrophobicContact CG2-CE3 3.84Å; V90-W358 HydrophobicContact CG2-CH2 3.85Å; V90-W358 HydrophobicContact CG2-CZ2 4.12Å; V90-W358 HydrophobicContact CG2-CZ3 3.7Å; V90-Y384 HydrophobicContact CG2-CD2 3.51Å; V90-Y384 HydrophobicContact CG2-CE2 3.34Å
91	S	77	Confident	83.9	Confident	16 Å²	16	38.3 Å²	38.3	11%	0.112	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	127.2	175.1	177	0	0	0	0	110.5	K93 H94	S91-K93 PolarHBondContact O-N 3.4Å; S91-K93 PolarHBondContact OG-N 3.43Å; S91-H94 CarbonylContact O-C 3.59Å; S91-H94 PolarHBondContact O-N 3.08Å
92	P	71.7	Confident	83.8	Confident	46 Å²	46	36.8 Å²	36.8	30%	0.299	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-31.6	171.8	-26.4	35.4	0	0	0	113.2	H94 Y382	P92-H94 VanDerWaalsContact C-N 3.32Å; P92-Y382 HydrophobicContact CG-CD2 4.18Å; P92-Y382 HydrophobicContact CG-CE2 4.17Å
93	K	74.5	Confident	83.8	Confident	174 Å²	174	36.5 Å²	36.5	76%	0.757	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-20.7	176.2	-66	-170.2	175.9	-171.8	0	113.6	S91	S91-K93 PolarHBondContact O-N 3.4Å; S91-K93 PolarHBondContact OG-N 3.43Å
94	H	80.1	Confident	83.6	Confident	72 Å²	72	35.5 Å²	35.5	33%	0.333	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	68	-180	-54.7	-71.7	0	0	0	109.3	I42 L43 S91 P92 K96 A97	I42-H94 HydrophobicContact CG2-CB 3.9Å; L43-H94 VanDerWaalsContact CD2-NE2 3.34Å; L43-H94 WeakPolarHBondContact CD2-NE2 3.43Å; S91-H94 CarbonylContact O-C 3.59Å; S91-H94 PolarHBondContact O-N 3.08Å; P92-H94 VanDerWaalsContact C-N 3.32Å; H94-K96 PolarHBondContact O-N 3.45Å; H94-A97 HydrophobicContact CB-CB 3.85Å; H94-A97 WeakPolarHBondContact O-CB 3.38Å; H94-A97 PolarHBondContact O-N 3.32Å
95	P	83.8	Confident	83.3	Confident	44 Å²	44	35 Å²	35	29%	0.286	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	-4.9	-167.7	29.6	-37.8	0	0	0	114.4	S120 A123	P95-S120 WeakPolarHBondContact O-CA 3.42Å; P95-A123 VanDerWaalsContact O-CB 3.28Å; P95-A123 WeakPolarHBondContact O-CB 3.38Å
96	K	90.3	Very high	82.6	Confident	98 Å²	98	40 Å²	40	43%	0.426	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	-15.2	169.2	-58.9	-163.7	-178.3	-165.2	0	113.5	H94 V116 L117 S118	H94-K96 PolarHBondContact O-N 3.45Å; K96-V116 HydrophobicContact CB-CG1 4.02Å; K96-V116 WeakPolarHBondContact O-CA 3.42Å; K96-L117 PolarHBondContact O-N 3.05Å; K96-S118 PolarHBondContact NZ-O 3.44Å
97	A	86.4	Confident	82.1	Confident	5 Å²	5	45.8 Å²	45.8	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	133.7	-173.9	0	0	0	0	0	111.1	I42 H94 M115 V116	I42-A97 HydrophobicContact CG2-CB 4.08Å; H94-A97 HydrophobicContact CB-CB 3.85Å; H94-A97 WeakPolarHBondContact O-CB 3.38Å; H94-A97 PolarHBondContact O-N 3.32Å; A97-M115 WeakPolarHBondContact CA-O 3.5Å; A97-V116 HydrophobicContact CB-CG2 4.2Å
98	L	89.5	Confident	81.9	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	145.3	-179.6	-172.2	148.4	0	0	0	108.8	F88 F89 V90 I100 M115 L117 L126 A127	F88-L98 HydrophobicContact CB-CD2 4.14Å; F88-L98 HydrophobicContact CB-CG 4.47Å; F88-L98 HydrophobicContact CD2-CD1 4.29Å; F89-L98 CarbonylContact O-C 3.58Å; F89-L98 WeakPolarHBondContact O-CA 3.38Å; V90-L98 HydrophobicContact CG1-CB 4.1Å; V90-L98 HydrophobicContact CG1-CD1 3.62Å; V90-L98 HydrophobicContact CG1-CG 3.74Å; L98-I100 HydrophobicContact CD2-CD1 4.25Å; L98-I100 HydrophobicContact CD2-CG1 3.38Å; L98-M115 PolarHBondContact N-O 3.03Å; L98-M115 WeakPolarHBondContact O-CG 3.5Å; L98-M115 PolarHBondContact O-N 3.13Å; L98-M115 VanDerWaalsContact O-O 3.06Å; L98-L117 HydrophobicContact CB-CD1 3.98Å; L98-L126 HydrophobicContact CD1-CD2 4.13Å; L98-L126 HydrophobicContact CD1-CG 4.34Å; L98-L126 HydrophobicContact CD2-CD2 4.14Å; L98-A127 HydrophobicContact CD1-CB 4.32Å
99	V	89.5	Confident	81.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	118	172.3	-179.9	0	0	0	0	108.3	A38 L41 I42 F88 F89 L112 Y113	A38-V99 HydrophobicContact CB-CB 4.33Å; A38-V99 HydrophobicContact CB-CG1 4.2Å; A38-V99 HydrophobicContact CB-CG2 4.28Å; L41-V99 HydrophobicContact CB-CG2 3.84Å; L41-V99 HydrophobicContact CD1-CG1 4.06Å; I42-V99 HydrophobicContact CD1-CG2 4.21Å; I42-V99 HydrophobicContact CG1-CG2 3.66Å; F88-V99 CarbonylContact C-O 3.49Å; F88-V99 WeakPolarHBondContact CA-O 3.28Å; F88-V99 VanDerWaalsContact CB-O 3.3Å; F88-V99 WeakPolarHBondContact CB-O 3.41Å; F89-V99 HydrophobicContact CB-CB 4.25Å; F89-V99 PolarHBondContact N-O 3.44Å; F89-V99 PolarHBondContact O-N 3.06Å; V99-L112 HydrophobicContact CG1-CB 3.99Å; V99-L112 HydrophobicContact CG1-CD2 4.13Å; V99-L112 HydrophobicContact CG1-CG 4.45Å; V99-Y113 CarbonylContact C-O 3.56Å; V99-Y113 VanDerWaalsContact CA-O 3.28Å; V99-Y113 WeakPolarHBondContact CA-O 3.28Å
100	I	90.2	Very high	81.9	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	138.8	173.3	-56.2	-179.6	0	0	0	108.5	I63 F65 I85 L98 L112 Y113 M115 L126 L130	I63-I100 HydrophobicContact CD1-CD1 3.58Å; F65-I100 HydrophobicContact CZ-CD1 4.48Å; I85-I100 HydrophobicContact CD1-CG2 4.16Å; I85-I100 HydrophobicContact CG1-CG2 4.15Å; I85-I100 HydrophobicContact CG2-CG2 3.92Å; L98-I100 HydrophobicContact CD2-CD1 4.25Å; L98-I100 HydrophobicContact CD2-CG1 3.38Å; I100-L112 WeakPolarHBondContact O-CA 3.3Å; I100-Y113 PolarHBondContact N-O 3.5Å; I100-Y113 PolarHBondContact O-N 3.14Å; I100-M115 HydrophobicContact CB-CE 4.24Å; I100-M115 HydrophobicContact CD1-CE 3.58Å; I100-M115 HydrophobicContact CD1-SD 4.03Å; I100-M115 HydrophobicContact CG1-CE 3.68Å; I100-M115 HydrophobicContact CG1-SD 4.35Å; I100-L126 HydrophobicContact CD1-CD2 4.49Å; I100-L130 HydrophobicContact CD1-CD1 4.23Å; I100-L130 HydrophobicContact CG1-CD1 4.24Å
101	L	88.9	Confident	82.3	Confident	8 Å²	8	54.1 Å²	54.1	4%	0.042	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	132.8	169.4	-57.6	97.9	0	0	0	110.1	L34 I85 L86 G87 F89 V110 T111 L112	L34-L101 HydrophobicContact CD1-CD2 3.64Å; L34-L101 HydrophobicContact CD2-CD2 3.59Å; L34-L101 HydrophobicContact CG-CD2 3.64Å; I85-L101 CarbonylContact C-O 3.48Å; I85-L101 WeakPolarHBondContact CA-O 3.38Å; L86-L101 HydrophobicContact CB-CB 4.48Å; L86-L101 PolarHBondContact N-O 3.22Å; G87-L101 WeakPolarHBondContact O-CD1 3.36Å; G87-L101 PolarHBondContact O-N 2.88Å; F89-L101 HydrophobicContact CD2-CD1 3.64Å; F89-L101 HydrophobicContact CE2-CD1 3.72Å; F89-L101 HydrophobicContact CE2-CD2 4.06Å; F89-L101 HydrophobicContact CE2-CG 4.43Å; L101-V110 HydrophobicContact CB-CG1 3.99Å; L101-V110 HydrophobicContact CD2-CG1 3.92Å; L101-T111 WeakPolarHBondContact CA-O 3.19Å; L101-L112 HydrophobicContact CD2-CD1 4.39Å; L101-L112 HydrophobicContact CD2-CD2 4Å; L101-L112 HydrophobicContact CD2-CG 3.85Å; L101-L112 HydrophobicContact CG-CD2 4.4Å; L101-L112 HydrophobicContact CG-CG 4.07Å
102	F	87.2	Confident	82.8	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.009	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	159.4	176.1	69.2	-78	0	0	0	111.4	I80 E84 I85 T111 Y113	I80-F102 HydrophobicContact CD1-CD1 3.87Å; I80-F102 HydrophobicContact CD1-CD2 4.24Å; I80-F102 HydrophobicContact CD1-CE1 3.83Å; I80-F102 HydrophobicContact CD1-CE2 4.21Å; I80-F102 HydrophobicContact CD1-CG 4.09Å; I80-F102 HydrophobicContact CD1-CZ 4.01Å; I80-F102 HydrophobicContact CG2-CB 3.94Å; I80-F102 HydrophobicContact CG2-CD2 3.9Å; I80-F102 HydrophobicContact CG2-CG 3.91Å; E84-F102 CarbonylContact O-C 3.59Å; E84-F102 WeakPolarHBondContact O-CA 3.4Å; E84-F102 VanDerWaalsContact O-CB 3.3Å; E84-F102 WeakPolarHBondContact O-CB 3.32Å; I85-F102 HydrophobicContact CG1-CB 4.27Å; F102-T111 HydrophobicContact CE1-CG2 3.59Å; F102-T111 HydrophobicContact CE2-CG2 4.42Å; F102-T111 HydrophobicContact CZ-CG2 3.49Å; F102-T111 VanDerWaalsContact CZ-CG2 3.49Å; F102-T111 PolarHBondContact N-O 3.19Å; F102-T111 PolarHBondContact O-N 3.18Å; F102-Y113 AromaticContact CE1-CD1 3.95Å; F102-Y113 HydrophobicContact CE1-CD1 3.95Å; F102-Y113 AromaticContact CE1-CD2 3.62Å; F102-Y113 HydrophobicContact CE1-CD2 3.62Å; F102-Y113 AromaticContact CE1-CE1 3.8Å; F102-Y113 HydrophobicContact CE1-CE1 3.8Å; F102-Y113 AromaticContact CE1-CE2 3.47Å; F102-Y113 HydrophobicContact CE1-CE2 3.47Å; F102-Y113 VanDerWaalsContact CE1-CE2 3.47Å; F102-Y113 AromaticContact CE1-CG 3.86Å; F102-Y113 HydrophobicContact CE1-CG 3.86Å; F102-Y113 AromaticContact CE1-CZ 3.56Å; F102-Y113 HydrophobicContact CZ-CD1 4.48Å; F102-Y113 HydrophobicContact CZ-CD2 4.23Å; F102-Y113 AromaticContact CZ-CE1 3.87Å; F102-Y113 HydrophobicContact CZ-CE1 3.87Å; F102-Y113 AromaticContact CZ-CE2 3.59Å; F102-Y113 HydrophobicContact CZ-CE2 3.59Å; F102-Y113 AromaticContact CZ-CZ 3.37Å
103	Q	83.2	Confident	83.7	Confident	32 Å²	32	51.2 Å²	51.2	15%	0.15	26%	0.256	C	S	.	.			trans	-151.4	113.1	-175.7	-175.9	-172	17.2	0	0	107.8	E84 L86 S105 P106 E108	E84-Q103 PolarHBondContact O-N 2.86Å; L86-Q103 HydrophobicContact CD1-CB 3.75Å; L86-Q103 HydrophobicContact CD2-CB 4.36Å; L86-Q103 HydrophobicContact CG-CB 4.09Å; Q103-S105 WeakPolarHBondContact CG-O 3.4Å; Q103-S105 PolarHBondContact NE2-O 3.24Å; Q103-P106 PolarHBondContact NE2-O 2.96Å; Q103-E108 PolarHBondContact NE2-O 2.8Å
104	R	78.3	Confident	84.5	Confident	137 Å²	137	43 Å²	43	52%	0.517	22%	0.22	S	C	.	.	S	Bend	trans	-69.4	-33.1	-176.8	-69	174	162.4	-172.6	-7.6	113.4	E77	E77-R104 IonicContact OE1-CZ 3.04Å; E77-R104 IonicContact OE1-NE 2.76Å; E77-R104 PolarHBondContact OE1-NE 2.64Å; E77-R104 IonicContact OE1-NH1 3.19Å; E77-R104 IonicContact OE1-NH2 2.64Å; E77-R104 PolarHBondContact OE1-NH2 3.19Å; E77-R104 IonicContact OE2-CZ 3.06Å; E77-R104 IonicContact OE2-NE 3.17Å; E77-R104 PolarHBondContact OE2-NE 3.13Å; E77-R104 IonicContact OE2-NH2 2.65Å; E77-R104 PolarHBondContact OE2-NH2 2.81Å
105	S	76.2	Confident	85	Confident	37 Å²	37	39.6 Å²	39.6	26%	0.259	21%	0.205	S	C	.	.	S	Bend	trans	-135.7	137.1	-179.3	172.6	0	0	0	0	109.6	Q103 L107 E108	Q103-S105 WeakPolarHBondContact CG-O 3.4Å; Q103-S105 PolarHBondContact NE2-O 3.24Å; S105-L107 PolarHBondContact O-N 3.06Å; S105-L107 PolarHBondContact OG-N 3.17Å; S105-E108 PolarHBondContact O-N 2.75Å
106	P	71.1	Confident	85.4	Confident	120 Å²	120	39.4 Å²	39.4	78%	0.779	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-11.5	176.3	-25.9	34.9	0	0	0	115.3	Q103	Q103-P106 PolarHBondContact NE2-O 2.96Å
107	L	71.2	Confident	85.5	Confident	165 Å²	165	34.9 Å²	34.9	86%	0.864	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-9.5	177.5	-59.3	175.6	0	0	0	113.7	S105	S105-L107 PolarHBondContact O-N 3.06Å; S105-L107 PolarHBondContact OG-N 3.17Å
108	E	77.9	Confident	85.8	Confident	101 Å²	101	37.4 Å²	37.4	47%	0.472	20%	0.2	S	C	.	.	S	Bend	trans	-90.2	161.7	178.7	-75	176.1	-166	0	0	112.1	Q103 S105	Q103-E108 PolarHBondContact NE2-O 2.8Å; S105-E108 PolarHBondContact O-N 2.75Å
109	D	85	Confident	85.8	Confident	59 Å²	59	39.2 Å²	39.2	32%	0.316	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-71.9	149.2	174.8	-63.9	-9.6	0	0	0	110.7	I26 K28 T111	I26-D109 HydrophobicContact CG2-CB 3.36Å; K28-D109 WeakPolarHBondContact CE-OD1 3.1Å; K28-D109 WeakPolarHBondContact CE-OD2 3.38Å; K28-D109 HydrophobicContact CG-CB 4.44Å; K28-D109 VanDerWaalsContact CG-OD1 3.24Å; K28-D109 WeakPolarHBondContact CG-OD1 3.3Å; K28-D109 WeakPolarHBondContact CG-OD2 3.44Å; K28-D109 IonicContact NZ-OD2 3.35Å; D109-T111 PolarHBondContact O-N 2.76Å
110	V	86	Confident	85.8	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	128.6	177.9	-178.3	0	0	0	0	109.8	C27 H30 L34 L86 L101 L112	C27-V110 PolarHBondContact N-O 2.97Å; C27-V110 PolarHBondContact O-N 3.23Å; H30-V110 VanDerWaalsContact CE1-CG2 3.4Å; H30-V110 WeakPolarHBondContact CE1-CG2 3.44Å; L34-V110 HydrophobicContact CD1-CB 4.38Å; L34-V110 HydrophobicContact CD1-CG1 4.22Å; L86-V110 HydrophobicContact CD1-CG1 4.05Å; L86-V110 HydrophobicContact CD1-CG2 3.78Å; L101-V110 HydrophobicContact CB-CG1 3.99Å; L101-V110 HydrophobicContact CD2-CG1 3.92Å; V110-L112 HydrophobicContact CG1-CD1 4.4Å
111	T	89.5	Confident	85.7	Confident	19 Å²	19	44 Å²	44	12%	0.117	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	134.4	175.3	-58.4	0	0	0	0	110.2	S25 I26 L101 F102 D109 Y113	S25-T111 WeakPolarHBondContact O-CA 3.4Å; I26-T111 HydrophobicContact CG1-CG2 4.33Å; L101-T111 WeakPolarHBondContact CA-O 3.19Å; F102-T111 HydrophobicContact CE1-CG2 3.59Å; F102-T111 HydrophobicContact CE2-CG2 4.42Å; F102-T111 HydrophobicContact CZ-CG2 3.49Å; F102-T111 VanDerWaalsContact CZ-CG2 3.49Å; F102-T111 PolarHBondContact N-O 3.19Å; F102-T111 PolarHBondContact O-N 3.18Å; D109-T111 PolarHBondContact O-N 2.76Å; T111-Y113 HydrophobicContact CG2-CD1 3.88Å; T111-Y113 HydrophobicContact CG2-CE1 3.42Å; T111-Y113 VanDerWaalsContact CG2-CE1 3.42Å
112	L	89.2	Confident	85.8	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.2	179.2	-66.8	86.6	0	0	0	109.5	S24 S25 C27 L34 T37 A38 L41 V99 I100 L101 V110	S24-L112 CarbonylContact C-O 3.59Å; S24-L112 VanDerWaalsContact CA-O 3.26Å; S24-L112 WeakPolarHBondContact CA-O 3.4Å; S25-L112 PolarHBondContact N-O 3.16Å; S25-L112 PolarHBondContact O-N 3.29Å; C27-L112 HydrophobicContact CB-CD1 3.98Å; L34-L112 HydrophobicContact CG-CD2 4.38Å; T37-L112 HydrophobicContact CG2-CD2 4.1Å; A38-L112 HydrophobicContact CB-CD2 4.11Å; L41-L112 HydrophobicContact CD1-CB 3.79Å; L41-L112 HydrophobicContact CD1-CD2 4.48Å; V99-L112 HydrophobicContact CG1-CB 3.99Å; V99-L112 HydrophobicContact CG1-CD2 4.13Å; V99-L112 HydrophobicContact CG1-CG 4.45Å; I100-L112 WeakPolarHBondContact O-CA 3.3Å; L101-L112 HydrophobicContact CD2-CD1 4.39Å; L101-L112 HydrophobicContact CD2-CD2 4Å; L101-L112 HydrophobicContact CD2-CG 3.85Å; L101-L112 HydrophobicContact CG-CD2 4.4Å; L101-L112 HydrophobicContact CG-CG 4.07Å; V110-L112 HydrophobicContact CG1-CD1 4.4Å
113	Y	90.5	Very high	85.8	Confident	1 Å²	1	46.6 Å²	46.6	0%	0.004	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	112.8	172.6	-69.5	-10.7	0	0	0	110	R75 L76 E77 I80 V99 I100 F102 T111	R75-Y113 PolarHBondContact O-OH 2.63Å; L76-Y113 WeakPolarHBondContact CA-OH 3.4Å; L76-Y113 HydrophobicContact CB-CE2 4.38Å; L76-Y113 HydrophobicContact CD2-CD1 3.58Å; L76-Y113 HydrophobicContact CD2-CD2 3.82Å; L76-Y113 HydrophobicContact CD2-CE1 3.37Å; L76-Y113 HydrophobicContact CD2-CE2 3.6Å; L76-Y113 HydrophobicContact CD2-CG 3.81Å; E77-Y113 PolarHBondContact N-OH 2.87Å; E77-Y113 VanDerWaalsContact N-OH 3.17Å; I80-Y113 HydrophobicContact CD1-CD2 4.08Å; I80-Y113 HydrophobicContact CD1-CE2 3.82Å; V99-Y113 CarbonylContact C-O 3.56Å; V99-Y113 VanDerWaalsContact CA-O 3.28Å; V99-Y113 WeakPolarHBondContact CA-O 3.28Å; I100-Y113 PolarHBondContact N-O 3.5Å; I100-Y113 PolarHBondContact O-N 3.14Å; F102-Y113 AromaticContact CE1-CD1 3.95Å; F102-Y113 HydrophobicContact CE1-CD1 3.95Å; F102-Y113 AromaticContact CE1-CD2 3.62Å; F102-Y113 HydrophobicContact CE1-CD2 3.62Å; F102-Y113 AromaticContact CE1-CE1 3.8Å; F102-Y113 HydrophobicContact CE1-CE1 3.8Å; F102-Y113 AromaticContact CE1-CE2 3.47Å; F102-Y113 HydrophobicContact CE1-CE2 3.47Å; F102-Y113 VanDerWaalsContact CE1-CE2 3.47Å; F102-Y113 AromaticContact CE1-CG 3.86Å; F102-Y113 HydrophobicContact CE1-CG 3.86Å; F102-Y113 AromaticContact CE1-CZ 3.56Å; F102-Y113 HydrophobicContact CZ-CD1 4.48Å; F102-Y113 HydrophobicContact CZ-CD2 4.23Å; F102-Y113 AromaticContact CZ-CE1 3.87Å; F102-Y113 HydrophobicContact CZ-CE1 3.87Å; F102-Y113 AromaticContact CZ-CE2 3.59Å; F102-Y113 HydrophobicContact CZ-CE2 3.59Å; F102-Y113 AromaticContact CZ-CZ 3.37Å; T111-Y113 HydrophobicContact CG2-CD1 3.88Å; T111-Y113 HydrophobicContact CG2-CE1 3.42Å; T111-Y113 VanDerWaalsContact CG2-CE1 3.42Å
114	G	90.2	Very high	85.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	129.2	172.8	0	0	0	0	0	111.3	F21 T22 G23	F21-G114 CarbonylContact C-O 3.54Å; F21-G114 WeakPolarHBondContact CA-O 3.46Å; F21-G114 WeakPolarHBondContact CD1-O 3.22Å; T22-G114 PolarHBondContact N-O 3.42Å; T22-G114 WeakPolarHBondContact OG1-CA 3.33Å; T22-G114 PolarHBondContact OG1-O 2.92Å; G23-G114 PolarHBondContact O-N 2.78Å
115	M	91.3	Very high	86.3	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	150.5	-178.1	65.8	-165.9	74.5	0	0	112.6	V19 K20 F21 F65 A97 L98 I100 L117 L126	V19-M115 HydrophobicContact CB-CB 4.45Å; K20-M115 CarbonylContact O-C 3.55Å; K20-M115 WeakPolarHBondContact O-CA 3.44Å; F21-M115 HydrophobicContact CD1-CB 4.05Å; F21-M115 HydrophobicContact CE1-CB 4.14Å; F21-M115 HydrophobicContact CE1-CE 3.9Å; F65-M115 HydrophobicContact CE1-CE 4.38Å; F65-M115 HydrophobicContact CE1-SD 4.35Å; F65-M115 HydrophobicContact CZ-CE 4.07Å; F65-M115 HydrophobicContact CZ-SD 4.49Å; A97-M115 WeakPolarHBondContact CA-O 3.5Å; L98-M115 PolarHBondContact N-O 3.03Å; L98-M115 WeakPolarHBondContact O-CG 3.5Å; L98-M115 PolarHBondContact O-N 3.13Å; L98-M115 VanDerWaalsContact O-O 3.06Å; I100-M115 HydrophobicContact CB-CE 4.24Å; I100-M115 HydrophobicContact CD1-CE 3.58Å; I100-M115 HydrophobicContact CD1-SD 4.03Å; I100-M115 HydrophobicContact CG1-CE 3.68Å; I100-M115 HydrophobicContact CG1-SD 4.35Å; M115-L117 HydrophobicContact CG-CD1 4.36Å; M115-L126 HydrophobicContact SD-CD2 4.4Å
116	V	91.9	Very high	86.8	Confident	40 Å²	40	44.1 Å²	44.1	24%	0.242	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	121.3	171.5	173.4	0	0	0	0	107.9	V19 K20 T22 V46 K96 A97	V19-V116 WeakPolarHBondContact CA-O 3.28Å; K20-V116 PolarHBondContact N-O 3.45Å; K20-V116 PolarHBondContact O-N 3.46Å; T22-V116 HydrophobicContact CG2-CG2 3.7Å; V46-V116 HydrophobicContact CG2-CB 4.21Å; V46-V116 HydrophobicContact CG2-CG2 3.94Å; K96-V116 HydrophobicContact CB-CG1 4.02Å; K96-V116 WeakPolarHBondContact O-CA 3.42Å; A97-V116 HydrophobicContact CB-CG2 4.2Å
117	L	92.2	Very high	87.4	Confident	3 Å²	3	38.6 Å²	38.6	2%	0.016	21%	0.211	C	C	.	.			trans	-81.6	160.3	174.8	-69.8	100.2	0	0	0	111	F15 D17 V19 L56 K96 L98 M115 S119 K122 A123 L126	F15-L117 HydrophobicContact CE1-CD2 4.33Å; F15-L117 HydrophobicContact CZ-CD2 3.93Å; D17-L117 HydrophobicContact CB-CD2 4.45Å; D17-L117 WeakPolarHBondContact OD2-CB 3.49Å; V19-L117 HydrophobicContact CG1-CD2 4.31Å; V19-L117 HydrophobicContact CG1-CG 3.97Å; L56-L117 HydrophobicContact CD2-CD2 4.49Å; K96-L117 PolarHBondContact O-N 3.05Å; L98-L117 HydrophobicContact CB-CD1 3.98Å; M115-L117 HydrophobicContact CG-CD1 4.36Å; L117-S119 PolarHBondContact O-N 3.31Å; L117-K122 HydrophobicContact CD2-CB 4.31Å; L117-A123 HydrophobicContact CB-CB 4.29Å; L117-A123 HydrophobicContact CD1-CB 3.88Å; L117-A123 HydrophobicContact CG-CB 4.46Å; L117-L126 HydrophobicContact CD1-CD2 4.2Å; L117-L126 HydrophobicContact CD2-CB 4.15Å; L117-L126 HydrophobicContact CD2-CD2 3.93Å
118	S	92.1	Very high	87.9	Confident	58 Å²	58	37 Å²	37	41%	0.406	19%	0.193	S	C	.	.	S	Bend	trans	-63.4	-30.9	-177.1	63.5	0	0	0	0	112.7	D17 K96	D17-S118 VanDerWaalsContact CG-OG 3.29Å; D17-S118 WeakPolarHBondContact OD1-CB 3.46Å; D17-S118 PolarHBondContact OD1-OG 3.08Å; D17-S118 PolarHBondContact OD2-N 2.87Å; D17-S118 PolarHBondContact OD2-OG 3.29Å; K96-S118 PolarHBondContact NZ-O 3.44Å
119	S	91	Very high	88.2	Confident	39 Å²	39	33.3 Å²	33.3	27%	0.273	18%	0.175	S	C	.	.			trans	-145.6	161	178.3	65.1	0	0	0	0	112.8	L117 K122 A123	L117-S119 PolarHBondContact O-N 3.31Å; S119-K122 PolarHBondContact O-N 3.29Å; S119-K122 WeakPolarHBondContact OG-CB 3.4Å; S119-K122 WeakPolarHBondContact OG-CG 3.43Å; S119-K122 PolarHBondContact OG-N 2.92Å; S119-A123 PolarHBondContact O-N 2.85Å; S119-A123 VanDerWaalsContact O-N 3.08Å
120	S	88.6	Confident	88	Confident	45 Å²	45	31.2 Å²	31.2	32%	0.315	16%	0.164	S	C	.	.	H	α-helix	trans	-65.2	-42.4	175.8	43.2	0	0	0	0	112.3	P95 K122 A123 Q124	P95-S120 WeakPolarHBondContact O-CA 3.42Å; S120-K122 PolarHBondContact O-N 3.04Å; S120-A123 WeakPolarHBondContact O-CB 3.39Å; S120-A123 PolarHBondContact O-N 3.34Å; S120-Q124 VanDerWaalsContact O-CD 3.32Å; S120-Q124 WeakPolarHBondContact O-CG 3.45Å; S120-Q124 PolarHBondContact O-N 3.38Å; S120-Q124 PolarHBondContact O-NE2 2.72Å
121	S	87.9	Confident	87.4	Confident	56 Å²	56	33.5 Å²	33.5	39%	0.392	18%	0.178	S	C	.	.	H	α-helix	trans	-55.4	-40.2	173.1	-179.3	0	0	0	0	111.8	Q124 K125	S121-Q124 PolarHBondContact O-N 2.79Å; S121-K125 WeakPolarHBondContact O-CG 3.28Å; S121-K125 PolarHBondContact O-N 3.03Å
122	K	91.9	Very high	86.1	Confident	64 Å²	64	39.1 Å²	39.1	28%	0.278	20%	0.203	S	C	.	.	H	α-helix	trans	-69.9	-37.6	174.6	-76.6	-159.8	-173	-167.4	0	113.4	F15 E16 D17 L117 S119 S120 Q124 K125 L126	F15-K122 HydrophobicContact CE2-CB 3.84Å; F15-K122 HydrophobicContact CE2-CD 4.08Å; F15-K122 HydrophobicContact CE2-CG 3.84Å; F15-K122 HydrophobicContact CZ-CB 3.87Å; F15-K122 HydrophobicContact CZ-CD 4.2Å; F15-K122 HydrophobicContact CZ-CG 4.23Å; F15-K122 WeakPolarHBondContact CZ-O 3.47Å; E16-K122 PolarHBondContact O-NZ 3.03Å; D17-K122 HydrophobicContact CB-CD 3.78Å; D17-K122 WeakPolarHBondContact OD1-CD 3.43Å; D17-K122 WeakPolarHBondContact OD1-CE 3.34Å; D17-K122 IonicContact OD1-NZ 3.9Å; D17-K122 PolarHBondContact OD1-NZ 2.86Å; D17-K122 WeakPolarHBondContact OD2-CD 3.48Å; L117-K122 HydrophobicContact CD2-CB 4.31Å; S119-K122 PolarHBondContact O-N 3.29Å; S119-K122 WeakPolarHBondContact OG-CB 3.4Å; S119-K122 WeakPolarHBondContact OG-CG 3.43Å; S119-K122 PolarHBondContact OG-N 2.92Å; S120-K122 PolarHBondContact O-N 3.04Å; K122-Q124 VanDerWaalsContact C-N 3.31Å; K122-Q124 PolarHBondContact O-N 3.01Å; K122-K125 PolarHBondContact O-N 2.93Å; K122-L126 PolarHBondContact O-N 2.97Å
123	A	86.7	Confident	84.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.5	-39.2	173.3	0	0	0	0	0	112.3	P95 L117 S119 S120 L126 A127	P95-A123 VanDerWaalsContact O-CB 3.28Å; P95-A123 WeakPolarHBondContact O-CB 3.38Å; L117-A123 HydrophobicContact CB-CB 4.29Å; L117-A123 HydrophobicContact CD1-CB 3.88Å; L117-A123 HydrophobicContact CG-CB 4.46Å; S119-A123 PolarHBondContact O-N 2.85Å; S119-A123 VanDerWaalsContact O-N 3.08Å; S120-A123 WeakPolarHBondContact O-CB 3.39Å; S120-A123 PolarHBondContact O-N 3.34Å; A123-L126 PolarHBondContact O-N 3.17Å; A123-A127 WeakPolarHBondContact O-CB 3.33Å; A123-A127 PolarHBondContact O-N 3.26Å
124	Q	83.6	Confident	82	Confident	32 Å²	32	45.7 Å²	45.7	15%	0.15	24%	0.243	C	C	.	.	H	α-helix	trans	-67.8	-42.3	173.8	-65.6	147.9	20.4	0	0	112	S120 S121 K122 L126 A127 R128 P357 W358	S120-Q124 VanDerWaalsContact O-CD 3.32Å; S120-Q124 WeakPolarHBondContact O-CG 3.45Å; S120-Q124 PolarHBondContact O-N 3.38Å; S120-Q124 PolarHBondContact O-NE2 2.72Å; S121-Q124 PolarHBondContact O-N 2.79Å; K122-Q124 VanDerWaalsContact C-N 3.31Å; K122-Q124 PolarHBondContact O-N 3.01Å; Q124-L126 VanDerWaalsContact C-N 3.32Å; Q124-L126 PolarHBondContact O-N 3.26Å; Q124-A127 PolarHBondContact O-N 3.23Å; Q124-R128 WeakPolarHBondContact O-CB 3.15Å; Q124-R128 WeakPolarHBondContact O-CG 2.83Å; Q124-R128 PolarHBondContact O-N 2.91Å; Q124-P357 HydrophobicContact CG-CB 4.44Å; Q124-W358 HydrophobicContact CG-CH2 4.1Å; Q124-W358 HydrophobicContact CG-CZ2 4.36Å; Q124-W358 HydrophobicContact CG-CZ3 4.33Å
125	K	87.5	Confident	79.4	Confident	123 Å²	123	50.7 Å²	50.7	54%	0.535	28%	0.276	S	S	.	.	H	α-helix	trans	-59.5	-42.6	174.6	-76	178.1	-178.2	-175.3	0	111.6	F15 S121 K122 F129	F15-K125 HydrophobicContact CD2-CB 3.81Å; F15-K125 HydrophobicContact CD2-CD 4.43Å; F15-K125 HydrophobicContact CE2-CB 3.75Å; S121-K125 WeakPolarHBondContact O-CG 3.28Å; S121-K125 PolarHBondContact O-N 3.03Å; K122-K125 PolarHBondContact O-N 2.93Å; K125-F129 VanDerWaalsContact O-CB 3.28Å; K125-F129 WeakPolarHBondContact O-CB 3.38Å; K125-F129 PolarHBondContact O-N 2.75Å
126	L	87.4	Confident	76.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.9	-47.3	173.1	180	61.7	0	0	0	111.6	F15 L56 L98 I100 M115 L117 K122 A123 Q124 R128 F129 L130	F15-L126 HydrophobicContact CE1-CB 4.2Å; F15-L126 HydrophobicContact CE1-CD1 4.5Å; F15-L126 HydrophobicContact CZ-CB 4.3Å; L56-L126 HydrophobicContact CD2-CD1 4.12Å; L56-L126 HydrophobicContact CD2-CD2 3.76Å; L98-L126 HydrophobicContact CD1-CD2 4.13Å; L98-L126 HydrophobicContact CD1-CG 4.34Å; L98-L126 HydrophobicContact CD2-CD2 4.14Å; I100-L126 HydrophobicContact CD1-CD2 4.49Å; M115-L126 HydrophobicContact SD-CD2 4.4Å; L117-L126 HydrophobicContact CD1-CD2 4.2Å; L117-L126 HydrophobicContact CD2-CB 4.15Å; L117-L126 HydrophobicContact CD2-CD2 3.93Å; K122-L126 PolarHBondContact O-N 2.97Å; A123-L126 PolarHBondContact O-N 3.17Å; Q124-L126 VanDerWaalsContact C-N 3.32Å; Q124-L126 PolarHBondContact O-N 3.26Å; L126-R128 PolarHBondContact O-N 2.91Å; L126-F129 HydrophobicContact CD1-CD1 4.17Å; L126-F129 PolarHBondContact O-N 2.97Å; L126-L130 HydrophobicContact CD1-CD1 4.17Å; L126-L130 HydrophobicContact CD1-CG 4.13Å; L126-L130 HydrophobicContact CG-CD1 4.07Å; L126-L130 HydrophobicContact CG-CG 4.42Å; L126-L130 VanDerWaalsContact O-CG 3.31Å; L126-L130 WeakPolarHBondContact O-CG 3.26Å; L126-L130 PolarHBondContact O-N 3.21Å
127	A	84.3	Confident	74.4	Confident	4 Å²	4	60.8 Å²	60.8	3%	0.033	32%	0.323	C	S	.	.	H	α-helix	trans	-59.5	-45.7	178	0	0	0	0	0	112.3	F88 L98 A123 Q124 L130 T131 W358	F88-A127 HydrophobicContact CE2-CB 3.72Å; F88-A127 HydrophobicContact CZ-CB 3.86Å; L98-A127 HydrophobicContact CD1-CB 4.32Å; A123-A127 WeakPolarHBondContact O-CB 3.33Å; A123-A127 PolarHBondContact O-N 3.26Å; Q124-A127 PolarHBondContact O-N 3.23Å; A127-L130 PolarHBondContact O-N 2.96Å; A127-T131 WeakPolarHBondContact O-CG2 3.43Å; A127-T131 PolarHBondContact O-N 2.75Å; A127-T131 PolarHBondContact O-OG1 3.06Å; A127-W358 HydrophobicContact CB-CH2 4.36Å; A127-W358 HydrophobicContact CB-CZ3 3.95Å
128	R	81.2	Confident	71.4	Confident	132 Å²	132	67.8 Å²	67.8	50%	0.498	36%	0.361	S	S	.	.	H	α-helix	trans	-58.7	-50.1	175.4	-73.2	177.7	-179.4	-168.4	-2.8	110.9	Q124 L126 L130 T131 E132 E360	Q124-R128 WeakPolarHBondContact O-CB 3.15Å; Q124-R128 WeakPolarHBondContact O-CG 2.83Å; Q124-R128 PolarHBondContact O-N 2.91Å; L126-R128 PolarHBondContact O-N 2.91Å; R128-L130 VanDerWaalsContact C-N 3.31Å; R128-L130 PolarHBondContact O-N 3.01Å; R128-T131 WeakPolarHBondContact CA-OG1 3.5Å; R128-T131 CarbonylContact O-C 3.59Å; R128-T131 PolarHBondContact O-N 2.66Å; R128-T131 PolarHBondContact O-OG1 3.39Å; R128-E132 PolarHBondContact O-N 3.26Å; R128-E360 IonicContact NH2-OE2 3.35Å; R128-E360 PolarHBondContact NH2-OE2 3.02Å
129	F	83.6	Confident	68.6	Low	22 Å²	22	70.6 Å²	70.6	10%	0.096	38%	0.375	C	S	.	.	H	α-helix	trans	-58	-38.3	175.3	165.8	-93.8	0	0	0	113.2	Q14 C58 Y59 I63 L82 K125 L126 T131	Q14-F129 HydrophobicContact CB-CD2 4.35Å; Q14-F129 HydrophobicContact CB-CE2 4.38Å; Q14-F129 HydrophobicContact CG-CE2 4.42Å; C58-F129 HydrophobicContact CB-CD1 4.06Å; C58-F129 HydrophobicContact CB-CD2 4.47Å; C58-F129 HydrophobicContact CB-CE1 3.62Å; C58-F129 HydrophobicContact CB-CE2 4.07Å; C58-F129 HydrophobicContact CB-CG 4.46Å; C58-F129 HydrophobicContact CB-CZ 3.64Å; Y59-F129 WeakPolarHBondContact O-CE2 3.49Å; Y59-F129 WeakPolarHBondContact O-CZ 3.27Å; I63-F129 HydrophobicContact CG2-CE1 3.68Å; I63-F129 HydrophobicContact CG2-CZ 4.34Å; L82-F129 HydrophobicContact CD1-CE1 4.43Å; L82-F129 HydrophobicContact CD1-CE2 4.42Å; L82-F129 HydrophobicContact CD1-CZ 3.84Å; L82-F129 HydrophobicContact CD2-CE1 3.74Å; L82-F129 HydrophobicContact CD2-CZ 3.9Å; L82-F129 HydrophobicContact CG-CZ 4.41Å; K125-F129 VanDerWaalsContact O-CB 3.28Å; K125-F129 WeakPolarHBondContact O-CB 3.38Å; K125-F129 PolarHBondContact O-N 2.75Å; L126-F129 HydrophobicContact CD1-CD1 4.17Å; L126-F129 PolarHBondContact O-N 2.97Å; F129-T131 VanDerWaalsContact C-N 3.3Å; F129-T131 PolarHBondContact O-N 2.82Å
130	L	81.8	Confident	65.6	Low	15 Å²	15	78.8 Å²	78.8	8%	0.079	41%	0.406	C	S	.	.	H	α-helix	trans	-74.9	-15.3	175.1	-67.3	177.5	0	0	0	113.7	L82 I85 F88 I100 L126 A127 R128 A386	L82-L130 HydrophobicContact CD2-CD2 4.05Å; I85-L130 HydrophobicContact CD1-CD2 3.68Å; I85-L130 HydrophobicContact CG2-CD2 4.47Å; F88-L130 HydrophobicContact CB-CD1 4.4Å; F88-L130 HydrophobicContact CD1-CB 3.74Å; F88-L130 HydrophobicContact CD1-CD1 3.86Å; F88-L130 HydrophobicContact CD1-CG 4.47Å; F88-L130 HydrophobicContact CE1-CB 3.65Å; F88-L130 HydrophobicContact CE1-CD1 4.49Å; F88-L130 HydrophobicContact CG-CD1 4.26Å; I100-L130 HydrophobicContact CD1-CD1 4.23Å; I100-L130 HydrophobicContact CG1-CD1 4.24Å; L126-L130 HydrophobicContact CD1-CD1 4.17Å; L126-L130 HydrophobicContact CD1-CG 4.13Å; L126-L130 HydrophobicContact CG-CD1 4.07Å; L126-L130 HydrophobicContact CG-CG 4.42Å; L126-L130 VanDerWaalsContact O-CG 3.31Å; L126-L130 WeakPolarHBondContact O-CG 3.26Å; L126-L130 PolarHBondContact O-N 3.21Å; A127-L130 PolarHBondContact O-N 2.96Å; R128-L130 VanDerWaalsContact C-N 3.31Å; R128-L130 PolarHBondContact O-N 3.01Å; L130-A386 WeakPolarHBondContact O-CB 3.24Å
131	T	72.4	Confident	62.8	Low	49 Å²	49	79.5 Å²	79.5	30%	0.301	42%	0.42	S	S	.	.	H	α-helix	trans	-95.9	-17.3	173.4	52.3	0	0	0	0	114.4	F88 A127 R128 F129	F88-T131 HydrophobicContact CE1-CG2 3.77Å; F88-T131 HydrophobicContact CZ-CG2 3.68Å; A127-T131 WeakPolarHBondContact O-CG2 3.43Å; A127-T131 PolarHBondContact O-N 2.75Å; A127-T131 PolarHBondContact O-OG1 3.06Å; R128-T131 WeakPolarHBondContact CA-OG1 3.5Å; R128-T131 CarbonylContact O-C 3.59Å; R128-T131 PolarHBondContact O-N 2.66Å; R128-T131 PolarHBondContact O-OG1 3.39Å; F129-T131 VanDerWaalsContact C-N 3.3Å; F129-T131 PolarHBondContact O-N 2.82Å
132	E	62.5	Low	59.9	Low	138 Å²	138	86.1 Å²	86.1	65%	0.645	45%	0.445	S	S	*	.	S	Bend	trans	-65.8	125.1	-177.8	-84.5	177.9	-176.7	0	0	110.9	R128 N134	R128-E132 PolarHBondContact O-N 3.26Å; E132-N134 PolarHBondContact O-N 2.91Å
133	P	49.1	Very low	57	Low	93 Å²	93	87.9 Å²	87.9	60%	0.604	46%	0.463	S	S	*	.			trans	-67.6	120.3	-178.7	26.5	-33.3	0	0	0	110	P135	P133-P135 WeakPolarHBondContact O-CD 3.43Å; P133-P135 VanDerWaalsContact O-N 3.1Å
134	N	44.7	Very low	54.2	Low	45 Å²	45	94.3 Å²	94.3	24%	0.241	51%	0.508	C	S	.	.			trans	-52.9	115.5	-175.1	-175.5	-28.5	0	0	0	111.4	E132 Q136 L137	E132-N134 PolarHBondContact O-N 2.91Å; N134-Q136 PolarHBondContact O-N 2.9Å; N134-Q136 VanDerWaalsContact O-N 3.09Å; N134-Q136 PolarHBondContact OD1-N 2.81Å; N134-Q136 VanDerWaalsContact OD1-N 3.1Å; N134-L137 PolarHBondContact O-N 2.86Å
135	P	35.8	Very low	51.7	Low	105 Å²	105	95.1 Å²	95.1	68%	0.682	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-68	-13.8	-170.5	25.7	-34.3	0	0	0	113.9	P133 L137 N138	P133-P135 WeakPolarHBondContact O-CD 3.43Å; P133-P135 VanDerWaalsContact O-N 3.1Å; P135-L137 VanDerWaalsContact C-N 3.27Å; P135-L137 PolarHBondContact O-N 2.77Å; P135-N138 PolarHBondContact O-N 2.89Å
136	Q	39	Very low	48.9	Very low	131 Å²	131	95.4 Å²	95.4	61%	0.612	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-75.7	-9.7	-178.7	-58.5	-165.2	15.5	0	0	114.1	N134 N138	N134-Q136 PolarHBondContact O-N 2.9Å; N134-Q136 VanDerWaalsContact O-N 3.09Å; N134-Q136 PolarHBondContact OD1-N 2.81Å; N134-Q136 VanDerWaalsContact OD1-N 3.1Å; Q136-N138 PolarHBondContact O-N 3.17Å
137	L	39.6	Very low	46	Very low	122 Å²	122	105.1 Å²	105.1	64%	0.639	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-79.1	0.4	173.4	-88.3	168.8	0	0	0	114.3	N134 P135 V139	N134-L137 PolarHBondContact O-N 2.86Å; P135-L137 VanDerWaalsContact C-N 3.27Å; P135-L137 PolarHBondContact O-N 2.77Å; L137-V139 PolarHBondContact O-N 3.44Å
138	N	27.9	Very low	43.3	Very low	150 Å²	150	111.6 Å²	111.6	80%	0.802	62%	0.621	S	S	*	*			trans	-81	59.9	178.4	-140.9	0.9	0	0	0	111.8	P135 Q136 K140	P135-N138 PolarHBondContact O-N 2.89Å; Q136-N138 PolarHBondContact O-N 3.17Å; N138-K140 PolarHBondContact O-N 3.43Å
139	V	33.5	Very low	40.6	Very low	117 Å²	117	114.2 Å²	114.2	71%	0.709	64%	0.635	S	S	*	*			trans	-64.8	124.4	172.7	178.2	0	0	0	0	108.8	L137 G141	L137-V139 PolarHBondContact O-N 3.44Å; V139-G141 PolarHBondContact O-N 3.43Å
140	K	27.7	Very low	37.9	Very low	212 Å²	212	118.2 Å²	118.2	92%	0.922	67%	0.667	S	S	*	*	S	Bend	trans	-54.5	104.6	173.7	-75.2	180	173.4	-179.3	0	110.6	N138	N138-K140 PolarHBondContact O-N 3.43Å
141	G	30.9	Very low	35.2	Very low	59 Å²	59	123.4 Å²	123.4	61%	0.608	70%	0.698	S	S	*	*			trans	178.5	90	178.2	0	0	0	0	0	109.5	V139 P143	V139-G141 PolarHBondContact O-N 3.43Å; G141-P143 WeakPolarHBondContact O-CD 3.4Å
142	E	26.1	Very low	33	Very low	196 Å²	196	127.4 Å²	127.4	92%	0.916	72%	0.723	S	S	*	*			trans	-62.1	112.4	172.9	-176.6	176.1	-157.9	0	0	108.9	S144	E142-S144 PolarHBondContact O-N 2.84Å
143	P	32.4	Very low	31.3	Very low	100 Å²	100	127.7 Å²	127.7	65%	0.649	73%	0.728	S	S	*	*			trans	-92.5	110.5	-176.5	29.7	-19.7	0	0	0	109.3	G141 G145	G141-P143 WeakPolarHBondContact O-CD 3.4Å; P143-G145 PolarHBondContact O-N 2.97Å
144	S	28.2	Very low	30.1	Very low	135 Å²	135	125.3 Å²	125.3	94%	0.944	72%	0.72	S	S	*	*			trans	-66.2	81.6	165.9	59.6	0	0	0	0	110.1	E142	E142-S144 PolarHBondContact O-N 2.84Å
145	G	29.4	Very low	29.1	Very low	50 Å²	50	126.8 Å²	126.8	52%	0.515	73%	0.732	S	S	.	*			trans	-135.5	161	179.1	0	0	0	0	0	111	P143 K147	P143-G145 PolarHBondContact O-N 2.97Å; G145-K147 PolarHBondContact O-N 2.89Å
146	P	28.8	Very low	28.8	Very low	128 Å²	128	125.5 Å²	125.5	83%	0.831	72%	0.719	S	S	*	*			trans	-65.6	133.3	-164.4	26.2	-34.5	0	0	0	112.3	V148	P146-V148 PolarHBondContact O-N 2.85Å
147	K	27.5	Very low	28.3	Very low	204 Å²	204	122.9 Å²	122.9	89%	0.887	71%	0.709	S	S	*	*			trans	-47.2	111	178.4	-68.4	-179.2	176.5	-178	0	111	G145 K149	G145-K147 PolarHBondContact O-N 2.89Å; K147-K149 PolarHBondContact O-N 2.95Å; K147-K149 VanDerWaalsContact O-N 3.13Å
148	V	27.5	Very low	27.8	Very low	141 Å²	141	126.6 Å²	126.6	86%	0.855	71%	0.714	S	S	*	*			trans	-66.9	111.5	170.6	-175.9	0	0	0	0	107.9	P146 S150	P146-V148 PolarHBondContact O-N 2.85Å; V148-S150 PolarHBondContact O-N 2.98Å
149	K	24.5	Very low	27.9	Very low	186 Å²	186	128.8 Å²	128.8	81%	0.809	72%	0.717	S	S	*	*			trans	-70.2	113.1	169.3	-72.6	-176.7	176.1	-178.4	0	108.2	K147 V151	K147-K149 PolarHBondContact O-N 2.95Å; K147-K149 VanDerWaalsContact O-N 3.13Å; K149-V151 PolarHBondContact O-N 3.32Å
150	S	27.4	Very low	27.6	Very low	107 Å²	107	128.4 Å²	128.4	75%	0.748	72%	0.719	S	S	*	*			trans	-59.7	127.1	163.5	43.7	0	0	0	0	109	V148	V148-S150 PolarHBondContact O-N 2.98Å
151	V	24.5	Very low	27.7	Very low	123 Å²	123	123.9 Å²	123.9	75%	0.745	71%	0.711	S	S	*	*			trans	-102.9	94.7	175.9	-179.6	0	0	0	0	108.3	K149 I153	K149-V151 PolarHBondContact O-N 3.32Å; V151-I153 HydrophobicContact CG1-CG1 4.3Å; V151-I153 PolarHBondContact O-N 2.97Å
152	T	26.4	Very low	27.5	Very low	133 Å²	133	129.9 Å²	129.9	82%	0.816	72%	0.724	S	S	*	*			trans	-75.5	115.5	167.9	-48.8	0	0	0	0	108.4	G154	T152-G154 PolarHBondContact O-N 3.21Å
153	I	26.7	Very low	27.7	Very low	145 Å²	145	126.4 Å²	126.4	74%	0.744	72%	0.721	S	S	*	*			trans	-84	103.7	-178.1	-58.5	175.4	0	0	0	109.1	V151	V151-I153 HydrophobicContact CG1-CG1 4.3Å; V151-I153 PolarHBondContact O-N 2.97Å
154	G	24	Very low	27.3	Very low	43 Å²	43	127 Å²	127	44%	0.443	73%	0.726	S	S	.	*			trans	-89	147.2	169.6	0	0	0	0	0	112.6	T152	T152-G154 PolarHBondContact O-N 3.21Å
155	P	24.1	Very low	27.4	Very low	76 Å²	76	131.7 Å²	131.7	49%	0.494	73%	0.725	S	S	.	*			trans	-66.3	129.4	165.1	28.4	-31.1	0	0	0	109.5	G185	P155-G185 WeakPolarHBondContact CB-O 3.27Å
156	N	28	Very low	27.4	Very low	78 Å²	78	138.9 Å²	138.9	42%	0.417	74%	0.742	S	S	.	*			trans	-94.9	-167	-176.6	164.1	27	0	0	0	109.7	G185 N186 F188	N156-G185 CarbonylContact O-C 2.76Å; N156-G185 WeakPolarHBondContact O-CA 3.49Å; N156-G185 PolarHBondContact O-N 2.81Å; N156-N186 VanDerWaalsContact C-CB 3.4Å; N156-N186 HydrophobicContact CB-CB 3.66Å; N156-N186 PolarHBondContact ND2-ND2 3.3Å; N156-N186 VanDerWaalsContact ND2-ND2 3.11Å; N156-N186 WeakPolarHBondContact O-CB 3.26Å; N156-N186 PolarHBondContact O-N 3.43Å; N156-F188 HydrophobicContact CB-CD2 4.46Å; N156-F188 HydrophobicContact CB-CE2 3.76Å; N156-F188 HydrophobicContact CB-CZ 4.49Å; N156-F188 WeakPolarHBondContact ND2-CZ 3.35Å
157	I	29.9	Very low	27.2	Very low	76 Å²	76	141.3 Å²	141.3	39%	0.39	74%	0.742	S	S	.	*			trans	-128	135.8	178.5	-64.2	-170.3	0	0	0	114.3	K159 P183 N186	I157-K159 PolarHBondContact O-N 2.85Å; I157-P183 HydrophobicContact CD1-CB 4.27Å; I157-P183 HydrophobicContact CD1-CG 3.84Å; I157-N186 PolarHBondContact N-ND2 3.24Å; I157-N186 VanDerWaalsContact N-ND2 3.2Å; I157-N186 PolarHBondContact O-ND2 2.87Å
158	R	28.6	Very low	27.3	Very low	199 Å²	199	137.1 Å²	137.1	75%	0.751	74%	0.738	S	S	*	*			trans	-87.7	92.9	-179.4	-117.8	-173.7	-164	-157.2	1.7	105.9	S160 N186	R158-S160 PolarHBondContact O-N 3.22Å; R158-N186 WeakPolarHBondContact CA-OD1 3.33Å; R158-N186 WeakPolarHBondContact CB-OD1 3.36Å; R158-N186 WeakPolarHBondContact CG-OD1 3.39Å; R158-N186 PolarHBondContact N-OD1 3.45Å
159	K	29	Very low	27.2	Very low	197 Å²	197	138.4 Å²	138.4	86%	0.857	74%	0.74	S	S	*	*			trans	-60.8	112.3	176.1	-66.9	-172.3	175.3	-172.2	0	109.2	I157	I157-K159 PolarHBondContact O-N 2.85Å
160	S	27.9	Very low	27.2	Very low	108 Å²	108	133 Å²	133	76%	0.755	74%	0.737	S	S	*	*			trans	-65.8	147.8	159.2	-161.1	0	0	0	0	108.6	R158 E162	R158-S160 PolarHBondContact O-N 3.22Å; S160-E162 PolarHBondContact O-N 3.39Å
161	P	30.7	Very low	27.2	Very low	117 Å²	117	134.8 Å²	134.8	76%	0.76	74%	0.743	S	S	*	*	S	Bend	trans	-92	83.2	-161.7	35.8	-34.1	0	0	0	112.5
162	E	26.3	Very low	27.3	Very low	186 Å²	186	136.5 Å²	136.5	87%	0.869	75%	0.748	S	S	*	*			trans	-153.4	94.1	168.2	-118.9	163	-138.2	0	0	112.6	S160	S160-E162 PolarHBondContact O-N 3.39Å
163	S	30.3	Very low	27.5	Very low	123 Å²	123	139 Å²	139	86%	0.86	75%	0.747	S	S	*	*			trans	-179.7	111.4	149.7	23	0	0	0	0	109.9
164	C	23	Very low	27.4	Very low	112 Å²	112	138.6 Å²	138.6	76%	0.757	75%	0.752	S	S	*	*			trans	-59.4	144.7	157.9	-66.4	0	0	0	0	109.4
165	Y	30.3	Very low	27.5	Very low	233 Å²	233	144.2 Å²	144.2	91%	0.914	77%	0.766	S	S	*	*				-168.7	161.7	121.3	-88	-58	0	0	0	109.9
166	K	29.2	Very low	27.5	Very low	201 Å²	201	150 Å²	150	87%	0.874	79%	0.787	S	S	*	*			trans	-89.4	167.6	-157	-70.1	177.8	173.7	179.6	0	114.9
167	E	26	Very low	27.5	Very low	179 Å²	179	152.6 Å²	152.6	84%	0.836	81%	0.805	S	S	*	*			trans	-44.5	148.2	172	-57.9	158.1	113.6	0	0	115.1
168	S	28.7	Very low	27.2	Very low	116 Å²	116	156.2 Å²	156.2	81%	0.811	82%	0.824	S	S	*	*				176	151	99	44.4	0	0	0	0	114.8
169	N	25.9	Very low	27.1	Very low	168 Å²	168	153.8 Å²	153.8	90%	0.898	83%	0.826	S	S	*	*			trans	-19.2	137.1	171.5	-55.7	-33.8	0	0	0	119.8
170	G	25.3	Very low	27	Very low	72 Å²	72	151 Å²	151	74%	0.742	83%	0.826	S	S	*	*			trans	159	106.9	149.5	0	0	0	0	0	119.1
171	V	26.7	Very low	26.9	Very low	145 Å²	145	154.1 Å²	154.1	88%	0.879	83%	0.833	S	S	*	*			trans	57.7	127.7	142.3	-172.1	0	0	0	0	120.6
172	L	26.8	Very low	26.8	Very low	159 Å²	159	153.8 Å²	153.8	83%	0.832	83%	0.831	S	S	*	*			trans	-60.6	130.3	169.2	-78.1	139.6	0	0	0	113.8
173	K	29.3	Very low	26.8	Very low	186 Å²	186	149.4 Å²	149.4	81%	0.809	82%	0.819	S	S	*	*			trans	-137.1	111.2	146.8	-82.4	-170.4	176.2	-178.7	0	109.9	H175	K173-H175 PolarHBondContact O-N 3.06Å
174	T	24.6	Very low	26.7	Very low	137 Å²	137	149.1 Å²	149.1	84%	0.84	81%	0.812	S	S	*	*			trans	-77.6	110.8	165.7	43.4	0	0	0	0	109.1
175	H	26.6	Very low	26.9	Very low	161 Å²	161	145.7 Å²	145.7	75%	0.745	80%	0.795	S	S	*	*			trans	-105.3	131.5	163.4	-104.2	-82.6	0	0	0	109.2	K173	K173-H175 PolarHBondContact O-N 3.06Å
176	E	24.3	Very low	26.7	Very low	197 Å²	197	136 Å²	136	92%	0.921	76%	0.76	S	S	*	*			trans	-66.8	131.6	164.1	-64.8	175.1	133.6	0	0	108.6
177	V	28.2	Very low	26.5	Very low	133 Å²	133	134.9 Å²	134.9	81%	0.806	76%	0.755	S	S	*	*			trans	-134.8	132	173.8	-177.9	0	0	0	0	109.3
178	L	23.1	Very low	26.5	Very low	152 Å²	152	133.8 Å²	133.8	80%	0.796	75%	0.748	S	S	*	*			trans	-78.4	141.5	-176.9	-149.4	77.3	0	0	0	111.2
179	N	27.9	Very low	26.2	Very low	148 Å²	148	137.3 Å²	137.3	79%	0.791	74%	0.743	S	S	*	*			trans	24.1	102.2	161.1	-64.9	-4.7	0	0	0	120.3
180	T	26.4	Very low	26.3	Very low	139 Å²	139	131.3 Å²	131.3	85%	0.853	71%	0.714	S	S	*	*			trans	-150.6	140.2	145.9	47.4	0	0	0	0	111.6
181	L	26.2	Very low	26.2	Very low	172 Å²	172	133.8 Å²	133.8	90%	0.901	71%	0.706	S	S	*	*			trans	-68.5	142.6	176.8	-75.2	156.8	0	0	0	112.9
182	P	27.6	Very low	26.3	Very low	111 Å²	111	130.9 Å²	130.9	72%	0.721	69%	0.689	S	S	*	*			trans	-95.2	154.9	171.1	36	-32.4	0	0	0	113.7
183	P	26.9	Very low	26.1	Very low	94 Å²	94	129.1 Å²	129.1	61%	0.61	69%	0.685	S	S	*	*			trans	-89.3	176.1	-169.3	34.3	-35.6	0	0	0	116.4	I157	I157-P183 HydrophobicContact CD1-CB 4.27Å; I157-P183 HydrophobicContact CD1-CG 3.84Å
184	T	27.8	Very low	26.1	Very low	116 Å²	116	129 Å²	129	71%	0.712	68%	0.679	S	S	*	*			trans	-84.5	135	-160.3	30.9	0	0	0	0	118
185	G	26.3	Very low	26.4	Very low	40 Å²	40	130 Å²	130	41%	0.412	68%	0.68	S	S	.	*			trans	168	-147	168.7	0	0	0	0	0	116.6	P155 N156	P155-G185 WeakPolarHBondContact CB-O 3.27Å; N156-G185 CarbonylContact O-C 2.76Å; N156-G185 WeakPolarHBondContact O-CA 3.49Å; N156-G185 PolarHBondContact O-N 2.81Å
186	N	26.6	Very low	26.4	Very low	31 Å²	31	131.9 Å²	131.9	17%	0.166	69%	0.686	C	S	.	*			trans	12.9	107.2	174	-65.1	-7.1	0	0	0	122	N156 I157 R158	N156-N186 VanDerWaalsContact C-CB 3.4Å; N156-N186 HydrophobicContact CB-CB 3.66Å; N156-N186 PolarHBondContact ND2-ND2 3.3Å; N156-N186 VanDerWaalsContact ND2-ND2 3.11Å; N156-N186 WeakPolarHBondContact O-CB 3.26Å; N156-N186 PolarHBondContact O-N 3.43Å; I157-N186 PolarHBondContact N-ND2 3.24Å; I157-N186 VanDerWaalsContact N-ND2 3.2Å; I157-N186 PolarHBondContact O-ND2 2.87Å; R158-N186 WeakPolarHBondContact CA-OD1 3.33Å; R158-N186 WeakPolarHBondContact CB-OD1 3.36Å; R158-N186 WeakPolarHBondContact CG-OD1 3.39Å; R158-N186 PolarHBondContact N-OD1 3.45Å
187	K	25.2	Very low	26.6	Very low	176 Å²	176	130.7 Å²	130.7	77%	0.765	68%	0.682	S	S	*	*				-18	124.2	124.5	-57.7	170.4	-176.9	177.7	0	115.8
188	F	25.2	Very low	26.5	Very low	157 Å²	157	131 Å²	131	69%	0.689	69%	0.687	S	S	*	*			trans	-124.9	163.7	155	-88.9	-66.4	0	0	0	110.4	N156	N156-F188 HydrophobicContact CB-CD2 4.46Å; N156-F188 HydrophobicContact CB-CE2 3.76Å; N156-F188 HydrophobicContact CB-CZ 4.49Å; N156-F188 WeakPolarHBondContact ND2-CZ 3.35Å
189	R	23.8	Very low	26.7	Very low	190 Å²	190	126.5 Å²	126.5	72%	0.717	68%	0.678	S	S	*	*			trans	-110.4	128.8	-168.8	177.9	-179	-179.5	-125.6	-6.4	109.9	E191	R189-E191 IonicContact CZ-OE1 3.99Å; R189-E191 IonicContact NE-OE1 2.81Å; R189-E191 IonicContact NH1-OE1 2.61Å; R189-E191 PolarHBondContact NH1-OE1 2.61Å; R189-E191 IonicContact NH2-OE1 2.68Å; R189-E191 PolarHBondContact NH2-OE1 2.85Å
190	S	28.1	Very low	26.8	Very low	41 Å²	41	129.7 Å²	129.7	29%	0.287	68%	0.684	S	S	.	*			trans	-96.9	110.5	178.7	54.9	0	0	0	0	111.8	N368 K369	S190-N368 PolarHBondContact OG-O 3.4Å; S190-K369 PolarHBondContact N-O 2.68Å; S190-K369 WeakPolarHBondContact O-CA 3.21Å; S190-K369 VanDerWaalsContact OG-C 3.31Å; S190-K369 WeakPolarHBondContact OG-CA 3.31Å; S190-K369 PolarHBondContact OG-O 2.98Å; S190-K369 VanDerWaalsContact OG-O 3.14Å
191	E	22.3	Very low	27	Very low	124 Å²	124	132 Å²	132	58%	0.579	69%	0.685	S	S	*	*			trans	-103.4	98.2	161.5	-69.5	-170.2	169.6	0	0	108.5	R189	R189-E191 IonicContact CZ-OE1 3.99Å; R189-E191 IonicContact NE-OE1 2.81Å; R189-E191 IonicContact NH1-OE1 2.61Å; R189-E191 PolarHBondContact NH1-OE1 2.61Å; R189-E191 IonicContact NH2-OE1 2.68Å; R189-E191 PolarHBondContact NH2-OE1 2.85Å
192	V	28.6	Very low	27	Very low	85 Å²	85	133.7 Å²	133.7	52%	0.515	69%	0.686	S	S	.	*			trans	-96	104.4	169	179.6	0	0	0	0	108.2	W194	V192-W194 HydrophobicContact CG1-CD2 4.43Å; V192-W194 HydrophobicContact CG1-CG 4.46Å; V192-W194 HydrophobicContact CG1-CZ2 4.33Å; V192-W194 PolarHBondContact O-N 2.89Å
193	T	23.7	Very low	27.1	Very low	121 Å²	121	136.6 Å²	136.6	74%	0.742	69%	0.689	S	S	*	*			trans	-88.6	99.5	173.5	-46.5	0	0	0	0	108.6	N195	T193-N195 PolarHBondContact O-N 2.84Å
194	W	29.4	Very low	27	Very low	183 Å²	183	141.5 Å²	141.5	69%	0.693	70%	0.701	S	S	*	*			trans	-66.7	122.6	170.7	-67.8	91.4	0	0	0	109.2	V192 K196	V192-W194 HydrophobicContact CG1-CD2 4.43Å; V192-W194 HydrophobicContact CG1-CG 4.46Å; V192-W194 HydrophobicContact CG1-CZ2 4.33Å; V192-W194 PolarHBondContact O-N 2.89Å; W194-K196 PolarHBondContact O-N 2.71Å
195	N	29.4	Very low	27	Very low	160 Å²	160	144.7 Å²	144.7	86%	0.856	71%	0.705	S	S	*	*			trans	-56.6	113	-172.8	-79.8	-29.8	0	0	0	111.3	T193 M197	T193-N195 PolarHBondContact O-N 2.84Å; N195-M197 PolarHBondContact O-N 2.89Å
196	K	26.5	Very low	27.1	Very low	199 Å²	199	148.3 Å²	148.3	87%	0.865	72%	0.722	S	S	*	*			trans	-62.5	135.3	161.2	-75.2	-177.9	175.3	179.2	0	108.2	W194	W194-K196 PolarHBondContact O-N 2.71Å
197	M	28.6	Very low	27.2	Very low	172 Å²	172	153.1 Å²	153.1	85%	0.847	76%	0.755	S	S	*	*			trans	-42.1	132.3	175	-67.7	-78.4	-83.2	0	0	111.7	N195 G199	N195-M197 PolarHBondContact O-N 2.89Å; M197-G199 VanDerWaalsContact C-N 3.29Å; M197-G199 PolarHBondContact O-N 3.25Å
198	P	27.4	Very low	27.3	Very low	140 Å²	140	148.3 Å²	148.3	91%	0.909	76%	0.755	S	S	*	*	S	Bend	trans	-74.1	83.8	177.7	31.2	-34	0	0	0	109.5
199	G	27.3	Very low	27.3	Very low	58 Å²	58	146.8 Å²	146.8	60%	0.598	76%	0.764	S	S	*	*			trans	-177.7	52.6	-168.8	0	0	0	0	0	116.3	M197	M197-G199 VanDerWaalsContact C-N 3.29Å; M197-G199 PolarHBondContact O-N 3.25Å
200	K	30.1	Very low	27.4	Very low	214 Å²	214	143.5 Å²	143.5	93%	0.93	77%	0.765	S	S	*	*	S	Bend	trans	-161.3	156.1	147.1	-106.9	154.3	-168.5	-176.7	0	111.1
201	Q	30.1	Very low	27.4	Very low	188 Å²	188	148.1 Å²	148.1	88%	0.879	79%	0.792	S	S	*	*			trans	-71	158.6	-153	-71.2	160.8	-31.4	0	0	114.8	E203	Q201-E203 PolarHBondContact O-N 2.85Å
202	K	25.5	Very low	27.5	Very low	208 Å²	208	148 Å²	148	90%	0.904	80%	0.799	S	S	*	*			trans	-65.3	110	171.1	-67.7	173.2	177.2	173.7	0	110.3
203	E	30.2	Very low	27.4	Very low	171 Å²	171	153 Å²	153	80%	0.799	82%	0.816	S	S	*	*			trans	-103.2	132.8	152.5	-73.1	-169	156.2	0	0	109.6	Q201	Q201-E203 PolarHBondContact O-N 2.85Å
204	K	24.1	Very low	27.4	Very low	198 Å²	198	156.1 Å²	156.1	86%	0.861	82%	0.82	S	S	*	*			trans	-89.9	124.6	-174.1	-63.4	174.2	179	176.1	0	109.5
205	F	28.5	Very low	27.2	Very low	182 Å²	182	154.5 Å²	154.5	80%	0.798	83%	0.825	S	S	*	*			trans	-131.9	141.2	157.8	-74.6	-77.8	0	0	0	110.3
206	P	28.3	Very low	26.8	Very low	116 Å²	116	150.4 Å²	150.4	75%	0.753	82%	0.821	S	S	*	*			trans	-82.8	159.6	-168	33.7	-36.3	0	0	0	113.3
207	P	28.4	Very low	26.8	Very low	133 Å²	133	152.8 Å²	152.8	86%	0.864	82%	0.824	S	S	*	*			trans	-80.2	135.4	-177.3	32.5	-34.1	0	0	0	112.1
208	G	27.6	Very low	26.7	Very low	74 Å²	74	152.7 Å²	152.7	76%	0.763	83%	0.826	S	S	*	*			trans	-166	92	-177.9	0	0	0	0	0	116.2
209	S	26.1	Very low	27	Very low	125 Å²	125	152 Å²	152	87%	0.874	82%	0.822	S	S	*	*			trans	75.2	140.8	150.1	-143.6	0	0	0	0	121.7
210	T	25.5	Very low	26.9	Very low	122 Å²	122	158.8 Å²	158.8	75%	0.748	83%	0.829	S	S	*	*			trans	-99.7	137.3	174.4	44.6	0	0	0	0	111.3
211	T	27.2	Very low	26.9	Very low	138 Å²	138	158 Å²	158	85%	0.847	83%	0.829	S	S	*	*			trans	-177.7	156.2	134.8	15.4	0	0	0	0	112
212	V	24.8	Very low	26.8	Very low	122 Å²	122	153.8 Å²	153.8	74%	0.739	81%	0.812	S	S	*	*			trans	-108.4	128.9	177.6	174.7	0	0	0	0	109.1
213	H	27.8	Very low	27.2	Very low	189 Å²	189	150.6 Å²	150.6	88%	0.875	81%	0.805	S	S	*	*			trans	-145.2	149.2	158.9	-87.9	-72.6	0	0	0	111.6
214	F	23.8	Very low	27.3	Very low	186 Å²	186	149.9 Å²	149.9	82%	0.816	80%	0.802	S	S	*	*			trans	-88.4	167.7	-174.7	-108.5	-104.1	0	0	0	113
215	N	23.8	Very low	27.4	Very low	150 Å²	150	147 Å²	147	80%	0.802	80%	0.795	S	S	*	*			trans	78.1	95.5	163.9	-63.1	-12.5	0	0	0	119.2
216	G	21.9	Very low	27.7	Very low	74 Å²	74	148.3 Å²	148.3	76%	0.763	80%	0.801	S	S	*	*				80.8	103.7	116.7	0	0	0	0	0	119.6
217	R	26.4	Very low	27.6	Very low	248 Å²	248	152.4 Å²	152.4	94%	0.936	81%	0.807	S	S	*	*				-178.1	139.3	126.2	-101.9	170.7	-174.6	-147.8	1.5	111
218	L	26.1	Very low	27.5	Very low	170 Å²	170	149.4 Å²	149.4	89%	0.89	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-72.5	129.2	163.7	-73.4	160.3	0	0	0	108.9
219	P	32.8	Very low	27.5	Very low	126 Å²	126	157.1 Å²	157.1	82%	0.818	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-78.1	128.9	167.6	30.7	-30.1	0	0	0	109.8
220	R	26.6	Very low	27.7	Very low	200 Å²	200	157.8 Å²	157.8	76%	0.755	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-90.4	124.9	176.7	-175.7	-175.3	-167.3	-155.8	12.8	108.4	D222	R220-D222 WeakPolarHBondContact CD-OD2 3.34Å; R220-D222 IonicContact CZ-OD1 3.86Å; R220-D222 IonicContact CZ-OD2 3.79Å; R220-D222 IonicContact NE-OD1 3.14Å; R220-D222 PolarHBondContact NE-OD1 2.93Å; R220-D222 IonicContact NE-OD2 3.27Å; R220-D222 PolarHBondContact NE-OD2 3.07Å; R220-D222 VanDerWaalsContact NE-OD2 3.17Å; R220-D222 IonicContact NH1-OD1 2.66Å; R220-D222 IonicContact NH1-OD2 3.71Å; R220-D222 PolarHBondContact NH1-OD2 2.89Å; R220-D222 IonicContact NH2-OD1 3.04Å; R220-D222 PolarHBondContact O-N 3.44Å
221	E	29.1	Very low	27.8	Very low	198 Å²	198	162.8 Å²	162.8	93%	0.925	80%	0.8	S	S	*	*			trans	-79.6	105.2	159.9	-71.8	-173.6	151.9	0	0	108.2
222	D	29	Very low	27.9	Very low	99 Å²	99	163.4 Å²	163.4	53%	0.529	80%	0.797	S	S	.	*			trans	-105.1	121.5	161	-80.3	-44	0	0	0	108.1	R220	R220-D222 WeakPolarHBondContact CD-OD2 3.34Å; R220-D222 IonicContact CZ-OD1 3.86Å; R220-D222 IonicContact CZ-OD2 3.79Å; R220-D222 IonicContact NE-OD1 3.14Å; R220-D222 PolarHBondContact NE-OD1 2.93Å; R220-D222 IonicContact NE-OD2 3.27Å; R220-D222 PolarHBondContact NE-OD2 3.07Å; R220-D222 VanDerWaalsContact NE-OD2 3.17Å; R220-D222 IonicContact NH1-OD1 2.66Å; R220-D222 IonicContact NH1-OD2 3.71Å; R220-D222 PolarHBondContact NH1-OD2 2.89Å; R220-D222 IonicContact NH2-OD1 3.04Å; R220-D222 PolarHBondContact O-N 3.44Å
223	N	32.6	Very low	28.3	Very low	141 Å²	141	163.7 Å²	163.7	75%	0.754	80%	0.802	S	S	*	*			trans	-135.1	92.5	153.3	-120.9	-24	0	0	0	110.3
224	Q	32.5	Very low	28.2	Very low	156 Å²	156	163.4 Å²	163.4	73%	0.729	80%	0.8	S	S	*	*			trans	62.9	100.2	143.9	-56.7	-175.7	58.4	0	0	117.7
225	L	27.4	Very low	28.5	Very low	138 Å²	138	161.3 Å²	161.3	72%	0.723	80%	0.803	S	S	*	*				75.1	105	85.1	-77.2	166.1	0	0	0	115.3
226	K	33.1	Very low	28.9	Very low	209 Å²	209	163.3 Å²	163.3	91%	0.909	80%	0.804	S	S	*	*				-171.8	152.4	106.9	-98.6	166.1	-173	178.2	0	112.7
227	F	27.3	Very low	29	Very low	203 Å²	203	164.9 Å²	164.9	89%	0.89	80%	0.803	S	S	*	*			trans	-93.2	143.3	-170.6	-83.7	-108.5	0	0	0	114
228	G	25.3	Very low	29.3	Very low	69 Å²	69	159.9 Å²	159.9	71%	0.711	80%	0.801	S	S	*	*				102.3	131.2	114.6	0	0	0	0	0	121.1
229	R	27.6	Very low	29.2	Very low	236 Å²	236	160 Å²	160	89%	0.891	80%	0.797	S	S	*	*			trans	72.4	148	165	-63.6	-179.8	175.2	-163.7	-0.9	115
230	Q	30.3	Very low	29.1	Very low	139 Å²	139	162 Å²	162	65%	0.65	80%	0.799	S	S	*	*			cis	-159	145.4	14.3	-135.9	169.3	32.2	0	0	112.6
231	R	28.6	Very low	29.1	Very low	227 Å²	227	160.3 Å²	160.3	86%	0.857	80%	0.802	S	S	*	*			trans	48.1	143	147.9	-69.6	173.3	-174.6	175.4	0.5	123.6
232	I	29.7	Very low	29.1	Very low	152 Å²	152	158.6 Å²	158.6	78%	0.779	80%	0.799	S	S	*	*			trans	-85.2	160.9	172.9	-46.7	160.9	0	0	0	110.3
233	P	31.8	Very low	29.1	Very low	128 Å²	128	159.2 Å²	159.2	83%	0.831	81%	0.811	S	S	*	*				-137.9	162.8	110.6	34.4	-20.3	0	0	0	115.4
234	Q	25.5	Very low	28.8	Very low	182 Å²	182	163.5 Å²	163.5	85%	0.85	82%	0.817	S	S	*	*			trans	-84.3	158.5	-174	-53.5	162.8	-62.4	0	0	113.5
235	V	31.5	Very low	28.7	Very low	143 Å²	143	165 Å²	165	87%	0.867	82%	0.823	S	S	*	*			trans	-136.2	138.9	144.4	-176.5	0	0	0	0	111
236	K	30.7	Very low	28.9	Very low	192 Å²	192	161.8 Å²	161.8	84%	0.835	82%	0.824	S	S	*	*			trans	-50.6	142.2	178.8	-57.5	153.8	-177.8	178.2	0	112.5
237	S	25	Very low	28.6	Very low	106 Å²	106	159.7 Å²	159.7	74%	0.741	82%	0.819	S	S	*	*				67.3	112.7	54.2	-171.4	0	0	0	0	115.9
238	T	32.2	Very low	28.7	Very low	144 Å²	144	156 Å²	156	88%	0.883	81%	0.809	S	S	*	*			trans	-157.6	141.6	133.3	24.4	0	0	0	0	110.6
239	H	25	Very low	29.1	Very low	173 Å²	173	159 Å²	159	80%	0.801	81%	0.809	S	S	*	*			trans	-87.6	156.9	170.4	-85.6	-108.3	0	0	0	111.2
240	L	29.5	Very low	29.3	Very low	166 Å²	166	153.9 Å²	153.9	87%	0.869	80%	0.799	S	S	*	*			trans	-158.9	125.3	136.4	-111.8	154.5	0	0	0	110.9
241	M	26.5	Very low	29.3	Very low	166 Å²	166	155.5 Å²	155.5	82%	0.818	81%	0.806	S	S	*	*			trans	-96.2	147.1	159.4	-81.4	-168.5	149.1	0	0	108.5
242	N	30.4	Very low	29.8	Very low	162 Å²	162	149.2 Å²	149.2	87%	0.866	80%	0.795	S	S	*	*			trans	-161.1	154.7	136	-105.8	-22.8	0	0	0	111.8
243	S	27.7	Very low	29.8	Very low	111 Å²	111	152 Å²	152	78%	0.776	80%	0.797	S	S	*	*			trans	-101.2	168.9	-171.3	-52.5	0	0	0	0	112.5
244	R	26.5	Very low	29.6	Very low	231 Å²	231	153.2 Å²	153.2	87%	0.872	80%	0.797	S	S	*	*			trans	87.3	116.1	151	-148.8	-174.8	-156.2	173.3	3.8	117
245	E	30.8	Very low	29.6	Very low	187 Å²	187	148.5 Å²	148.5	87%	0.874	80%	0.796	S	S	*	*				164.9	156.5	122	-89	177.8	-179.3	0	0	113.7
246	G	31.1	Very low	29.5	Very low	71 Å²	71	146.7 Å²	146.7	73%	0.732	79%	0.79	S	S	*	*			trans	84.3	94.9	176.6	0	0	0	0	0	115
247	M	27.9	Very low	29.2	Very low	165 Å²	165	144.8 Å²	144.8	81%	0.813	79%	0.789	S	S	*	*			cis	66	128.1	49.7	-66.9	-166.3	78.5	0	0	116.7
248	N	29.6	Very low	29.5	Very low	125 Å²	125	147 Å²	147	67%	0.668	79%	0.791	S	S	*	*			trans	75.4	124.5	155.7	-60.2	-6.4	0	0	0	117.3
249	N	33.5	Very low	29.3	Very low	132 Å²	132	144.7 Å²	144.7	71%	0.706	78%	0.781	S	S	*	*			cis	-166.5	151.6	30.7	-85.3	-38.4	0	0	0	112.9
250	N	31.1	Very low	29.3	Very low	129 Å²	129	145.5 Å²	145.5	69%	0.69	78%	0.782	S	S	*	*			trans	12.3	147.5	133	-50.6	-17	0	0	0	119.5
251	H	31.5	Very low	29.3	Very low	173 Å²	173	145.4 Å²	145.4	80%	0.801	78%	0.782	S	S	*	*			cis	-161.5	176.3	21.6	-113.9	-35.4	0	0	0	111
252	P	37.6	Very low	29.3	Very low	95 Å²	95	142 Å²	142	62%	0.617	77%	0.774	S	S	*	*			trans	-97.9	163.2	-171.2	39	-36.9	0	0	0	115.7
253	Y	31.3	Very low	29.1	Very low	212 Å²	212	139.2 Å²	139.2	83%	0.831	77%	0.767	S	S	*	*				176.2	144.8	123.2	-109	-80.6	0	0	0	113.8
254	N	27.1	Very low	29	Very low	153 Å²	153	144.1 Å²	144.1	82%	0.818	78%	0.775	S	S	*	*			trans	10.7	133	161.3	-71.6	-14.3	0	0	0	122.7
255	G	26.1	Very low	29	Very low	82 Å²	82	143.9 Å²	143.9	85%	0.845	78%	0.776	S	S	*	*			trans	173.3	109.5	155.6	0	0	0	0	0	114
256	S	27.6	Very low	28.8	Very low	106 Å²	106	140.7 Å²	140.7	74%	0.741	77%	0.771	S	S	*	*			trans	-88.7	131.4	-174	53.7	0	0	0	0	114.5
257	N	24.7	Very low	28.7	Very low	151 Å²	151	146.3 Å²	146.3	81%	0.807	78%	0.778	S	S	*	*				169.4	174.1	126.6	-95.8	-53.7	0	0	0	113.1
258	I	33	Very low	28.8	Very low	153 Å²	153	142.7 Å²	142.7	79%	0.785	77%	0.769	S	S	*	*			trans	105.9	93.3	161.1	-53.4	167.4	0	0	0	116.7
259	S	27.5	Very low	28.5	Very low	95 Å²	95	142 Å²	142	66%	0.664	78%	0.781	S	S	*	*			trans	30.6	133.1	141	68.9	0	0	0	0	124.1
260	K	25.1	Very low	28.3	Very low	191 Å²	191	145.2 Å²	145.2	83%	0.83	79%	0.789	S	S	*	*			trans	32.6	110.8	130.3	-58.2	177.6	179.3	177.4	0	118
261	L	29.8	Very low	28.1	Very low	164 Å²	164	142.4 Å²	142.4	86%	0.859	79%	0.79	S	S	*	*				-163.3	165.5	107.9	-128.9	77.1	0	0	0	113.3
262	S	25.2	Very low	27.8	Very low	95 Å²	95	143.2 Å²	143.2	66%	0.664	79%	0.794	S	S	*	*			trans	-44.2	163.8	-179.4	52.6	0	0	0	0	121
263	S	26	Very low	27	Very low	102 Å²	102	144.2 Å²	144.2	71%	0.713	80%	0.798	S	S	*	*			trans	101.2	98.1	141.3	82.6	0	0	0	0	118.9
264	F	26.3	Very low	26.7	Very low	215 Å²	215	139.5 Å²	139.5	94%	0.943	80%	0.796	S	S	*	*			trans	-127.4	114.2	145.9	-81.6	-82.3	0	0	0	109
265	Y	25.3	Very low	26.5	Very low	226 Å²	226	141.6 Å²	141.6	89%	0.886	80%	0.798	S	S	*	*			trans	-136.1	157.3	167.3	-101.9	-55.5	0	0	0	106.4
266	P	28	Very low	26.5	Very low	119 Å²	119	148.9 Å²	148.9	77%	0.773	80%	0.8	S	S	*	*				-109.9	161.1	-108.3	37.5	-30.7	0	0	0	113.6	S268	P266-S268 PolarHBondContact O-N 2.64Å
267	E	29.1	Very low	26.2	Very low	189 Å²	189	152.5 Å²	152.5	88%	0.883	81%	0.805	S	S	*	*			trans	-86.2	108.3	-173.1	-162.9	162.5	-158.8	0	0	113.3
268	S	29.7	Very low	26.2	Very low	90 Å²	90	150.3 Å²	150.3	63%	0.629	80%	0.802	S	S	*	*			trans	51.4	104.3	159.6	70.9	0	0	0	0	120	P266	P266-S268 PolarHBondContact O-N 2.64Å
269	A	23.9	Very low	25.7	Very low	111 Å²	111	149.3 Å²	149.3	92%	0.917	80%	0.803	S	S	*	*			trans	-97.4	116.7	142.4	0	0	0	0	0	108.8
270	K	29.2	Very low	25.8	Very low	199 Å²	199	149.7 Å²	149.7	87%	0.865	81%	0.812	S	S	*	*			trans	-112	135.5	173.3	-78.1	178.4	176.6	172.4	0	109.7
271	G	25.1	Very low	25.7	Very low	70 Å²	70	143.8 Å²	143.8	72%	0.722	81%	0.805	S	S	*	*			trans	121.8	79.5	153.3	0	0	0	0	0	118
272	H	25.8	Very low	25.5	Very low	189 Å²	189	147.1 Å²	147.1	88%	0.875	81%	0.808	S	S	*	*			trans	47.6	117.2	140.9	-78.6	-85.7	0	0	0	122.3
273	V	20.9	Very low	25.5	Very low	117 Å²	117	149.7 Å²	149.7	71%	0.709	81%	0.814	S	S	*	*			trans	-67.7	137	148.3	176.1	0	0	0	0	109.8	F275	V273-F275 HydrophobicContact CG1-CD2 4Å; V273-F275 HydrophobicContact CG1-CE2 3.75Å
274	S	25.1	Very low	25.6	Very low	112 Å²	112	150.6 Å²	150.6	78%	0.783	81%	0.811	S	S	*	*			trans	-143.6	136.2	155	74.6	0	0	0	0	110.3
275	F	22.6	Very low	25.6	Very low	198 Å²	198	147.8 Å²	147.8	87%	0.868	80%	0.799	S	S	*	*			trans	-99.3	136.3	170.1	-70.5	-91.3	0	0	0	108.4	V273	V273-F275 HydrophobicContact CG1-CD2 4Å; V273-F275 HydrophobicContact CG1-CE2 3.75Å
276	R	26.1	Very low	25.7	Very low	234 Å²	234	144.3 Å²	144.3	88%	0.883	79%	0.792	S	S	*	*			trans	-131.3	110.1	164	-152	178.6	-168.5	-153.7	2.1	110.6
277	Q	21.6	Very low	25.7	Very low	182 Å²	182	145 Å²	145	85%	0.85	79%	0.789	S	S	*	*			trans	-85.4	131.8	173.5	-169.4	176.8	24	0	0	108.1
278	S	25.6	Very low	25.7	Very low	106 Å²	106	141.4 Å²	141.4	74%	0.741	78%	0.776	S	S	*	*			trans	-151.8	130.8	166.3	-76.4	0	0	0	0	110.2
279	T	22.7	Very low	25.6	Very low	132 Å²	132	146.7 Å²	146.7	81%	0.81	78%	0.783	S	S	*	*			trans	-109.3	131	-172.1	45.7	0	0	0	0	111.5
280	A	28.3	Very low	25.7	Very low	102 Å²	102	145.8 Å²	145.8	84%	0.843	77%	0.77	S	S	*	*			trans	174	145.7	150.6	0	0	0	0	0	106.9
281	G	22.6	Very low	25.8	Very low	67 Å²	67	143.6 Å²	143.6	69%	0.691	77%	0.768	S	S	*	*			cis	108.7	119.4	9.3	0	0	0	0	0	111.1
282	Y	25.5	Very low	25.9	Very low	235 Å²	235	144 Å²	144	92%	0.922	77%	0.772	S	S	*	*			trans	84.5	129.3	175.2	-83.7	-97.2	0	0	0	120.4
283	N	25.1	Very low	26.4	Very low	149 Å²	149	140.6 Å²	140.6	80%	0.797	77%	0.767	S	S	*	*			trans	-79.8	153.9	161.8	-49.1	-45.5	0	0	0	109.5
284	D	28.3	Very low	26.9	Very low	121 Å²	121	142.1 Å²	142.1	65%	0.647	77%	0.769	S	S	*	*				-179.1	144.6	101.7	-133.3	-10.1	0	0	0	113.4
285	K	28	Very low	27.1	Very low	156 Å²	156	143.6 Å²	143.6	68%	0.678	77%	0.767	S	S	*	*			trans	50.6	134.3	143.6	-79.9	160.8	-158.5	138.7	0	125.4
286	M	26.3	Very low	27.4	Very low	152 Å²	152	142.5 Å²	142.5	75%	0.749	77%	0.77	S	S	*	*			trans	90.8	113.6	130.1	-75.9	168.5	65	0	0	121.9
287	L	28.7	Very low	27.5	Very low	133 Å²	133	136.5 Å²	136.5	70%	0.696	76%	0.764	S	S	*	*				53.9	126	121.2	-62.1	169.9	0	0	0	117.7
288	N	28.2	Very low	27.9	Very low	115 Å²	115	135.6 Å²	135.6	62%	0.615	76%	0.76	S	S	*	*				173.8	157.4	53.5	-112.7	-15.9	0	0	0	112.3
289	Y	27.5	Very low	28	Very low	201 Å²	201	140.7 Å²	140.7	79%	0.788	76%	0.763	S	S	*	*			trans	32.2	120.5	154.9	-58.4	-70.5	0	0	0	121
290	S	25.5	Very low	28.1	Very low	91 Å²	91	138.7 Å²	138.7	64%	0.636	76%	0.759	S	S	*	*				96.8	120.1	54	-172.6	0	0	0	0	113.7
291	N	31.3	Very low	28.2	Very low	154 Å²	154	139.8 Å²	139.8	82%	0.824	76%	0.761	S	S	*	*				156.8	123.3	129.9	-79.1	-8.3	0	0	0	115
292	G	27.9	Very low	28.5	Very low	78 Å²	78	145.3 Å²	145.3	80%	0.804	77%	0.769	S	S	*	*			trans	93.2	132.5	134.7	0	0	0	0	0	119.5
293	P	35.9	Very low	28.6	Very low	118 Å²	118	143 Å²	143	77%	0.766	77%	0.766	S	S	*	*			trans	-112.4	169.5	-176.5	41.2	-33.1	0	0	0	114.6
294	I	31.5	Very low	28.7	Very low	149 Å²	149	140.8 Å²	140.8	76%	0.764	76%	0.763	S	S	*	*				-175.3	117.7	126.9	-93.3	153.7	0	0	0	111.6
295	I	29.7	Very low	28.6	Very low	143 Å²	143	138.6 Å²	138.6	73%	0.733	77%	0.769	S	S	*	*			trans	28.8	120.6	141.2	-34.5	170.1	0	0	0	119.5
296	N	29.7	Very low	28.6	Very low	174 Å²	174	140.3 Å²	140.3	93%	0.93	78%	0.777	S	S	*	*			trans	-136.4	137.6	134.3	-101	-33.4	0	0	0	108.7
297	S	27.4	Very low	28.6	Very low	108 Å²	108	140.6 Å²	140.6	76%	0.755	78%	0.781	S	S	*	*			trans	-100.4	121.6	-173.2	154.6	0	0	0	0	111
298	E	29.9	Very low	28.7	Very low	163 Å²	163	140 Å²	140	76%	0.762	78%	0.784	S	S	*	*			trans	-162.9	134.2	142.3	-118.8	-178.3	-147	0	0	113.8
299	R	27.6	Very low	28.7	Very low	213 Å²	213	139 Å²	139	80%	0.804	78%	0.784	S	S	*	*			trans	75.1	90.5	145.1	-133.2	174	-160.4	113	1.7	120.7
300	A	24.6	Very low	28.8	Very low	90 Å²	90	138.3 Å²	138.3	74%	0.744	79%	0.785	S	S	*	*			trans	49.1	109	135.1	0	0	0	0	0	120.6
301	S	31.5	Very low	29.2	Very low	126 Å²	126	140.2 Å²	140.2	88%	0.881	80%	0.795	S	S	*	*				-162.2	133.9	122.2	-79	0	0	0	0	110.6
302	E	28.8	Very low	29.3	Very low	182 Å²	182	142.2 Å²	142.2	85%	0.85	79%	0.793	S	S	*	*			trans	-83.8	139.4	-179.6	-67.4	157.3	162.1	0	0	110.8
303	E	26.3	Very low	29.8	Very low	186 Å²	186	142.7 Å²	142.7	87%	0.869	78%	0.777	S	S	*	*				45.9	97.2	124	-160.4	170.7	-148.7	0	0	119.3
304	S	29.2	Very low	29.9	Very low	103 Å²	103	142.1 Å²	142.1	72%	0.72	77%	0.773	S	S	*	*				-169.6	98.7	124.2	45.1	0	0	0	0	111.1
305	G	24.5	Very low	30	Very low	76 Å²	76	141.6 Å²	141.6	78%	0.784	77%	0.771	S	S	*	*			trans	-77.8	129.6	159.1	0	0	0	0	0	109.2
306	F	27.9	Very low	30	Very low	192 Å²	192	141.9 Å²	141.9	84%	0.842	77%	0.77	S	S	*	*			trans	-120.1	95.7	159.3	-93.3	-77.8	0	0	0	108.9	T308	F306-T308 PolarHBondContact O-N 2.98Å
307	D	26.3	Very low	30	Very low	157 Å²	157	140.1 Å²	140.1	84%	0.84	76%	0.76	S	S	*	*			trans	-58.9	115.2	157.9	-85.7	-48.6	0	0	0	109
308	T	32.4	Very low	30.4	Very low	121 Å²	121	140.5 Å²	140.5	74%	0.742	75%	0.753	S	S	*	*			trans	-99.8	108.8	148.8	53.7	0	0	0	0	107.1	F306	F306-T308 PolarHBondContact O-N 2.98Å
309	P	27.6	Very low	30.2	Very low	95 Å²	95	139.8 Å²	139.8	62%	0.617	75%	0.749	S	S	*	*			trans	-63.8	157.2	167.1	29.6	-33.4	0	0	0	109.2
310	F	28.5	Very low	30.1	Very low	186 Å²	186	137.9 Å²	137.9	82%	0.816	75%	0.749	S	S	*	*			trans	81.1	100.4	-176.1	-47.8	-67.6	0	0	0	115.9
311	P	34	Very low	30.2	Very low	131 Å²	131	142.7 Å²	142.7	85%	0.851	75%	0.754	S	S	*	*			trans	-72.3	129.8	158.7	31.6	-31.2	0	0	0	109.2	D313	P311-D313 PolarHBondContact O-N 3.05Å
312	Y	34.3	Very low	29.8	Very low	196 Å²	196	141.8 Å²	141.8	77%	0.769	75%	0.748	S	S	*	*			trans	-77	114.3	179.1	-171.9	-86.2	0	0	0	110.4	P314	Y312-P314 HydrophobicContact CE1-CB 4.5Å; Y312-P314 WeakPolarHBondContact O-CD 3.26Å
313	D	37.5	Very low	29.7	Very low	88 Å²	88	140.8 Å²	140.8	47%	0.471	75%	0.746	S	S	.	*			trans	-85.3	114.3	170.5	-170.9	-18	0	0	0	110	P311 N315 E316	P311-D313 PolarHBondContact O-N 3.05Å; D313-N315 PolarHBondContact O-N 3.01Å; D313-N315 VanDerWaalsContact O-N 3.15Å; D313-N315 WeakPolarHBondContact OD1-CB 3.41Å; D313-N315 PolarHBondContact OD1-N 2.99Å; D313-E316 HydrophobicContact CB-CG 4.44Å; D313-E316 PolarHBondContact O-N 3.15Å
314	P	38.7	Very low	29.5	Very low	105 Å²	105	134.5 Å²	134.5	68%	0.682	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	0	178.8	31.5	-36.4	0	0	0	114.5	Y312	Y312-P314 HydrophobicContact CE1-CB 4.5Å; Y312-P314 WeakPolarHBondContact O-CD 3.26Å
315	N	33.2	Very low	29.2	Very low	138 Å²	138	139.1 Å²	139.1	74%	0.738	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	4.2	176.5	-63.4	-55.1	0	0	0	114.6	D313 N317	D313-N315 PolarHBondContact O-N 3.01Å; D313-N315 VanDerWaalsContact O-N 3.15Å; D313-N315 WeakPolarHBondContact OD1-CB 3.41Å; D313-N315 PolarHBondContact OD1-N 2.99Å; N315-N317 PolarHBondContact O-N 3.26Å
316	E	30.7	Very low	29.3	Very low	150 Å²	150	146.4 Å²	146.4	70%	0.701	74%	0.74	S	S	*	*			trans	-64.3	110.2	168.1	-81.2	-168.1	160.4	0	0	110.1	D313 I318	D313-E316 HydrophobicContact CB-CG 4.44Å; D313-E316 PolarHBondContact O-N 3.15Å; E316-I318 PolarHBondContact O-N 3.34Å
317	N	29.7	Very low	29.1	Very low	137 Å²	137	144.1 Å²	144.1	73%	0.733	74%	0.737	S	S	*	*			trans	-60.3	101.6	164.5	-92.7	-14.3	0	0	0	108.3	N315 E319	N315-N317 PolarHBondContact O-N 3.26Å; N317-E319 HydrophobicContact CB-CG 4.42Å; N317-E319 PolarHBondContact O-N 2.9Å
318	I	34.5	Very low	29.3	Very low	115 Å²	115	142.7 Å²	142.7	59%	0.59	73%	0.734	S	S	*	*			trans	-75.5	55.9	167.8	-40.7	178.1	0	0	0	109.6	E316 F321	E316-I318 PolarHBondContact O-N 3.34Å; I318-F321 HydrophobicContact CG2-CD2 4.03Å; I318-F321 HydrophobicContact CG2-CE2 3.92Å
319	E	26.1	Very low	29	Very low	148 Å²	148	145.2 Å²	145.2	69%	0.692	74%	0.738	S	S	*	*			trans	-81.7	151.7	152.8	-59.9	-163.9	124.2	0	0	107.4	N317	N317-E319 HydrophobicContact CB-CG 4.42Å; N317-E319 PolarHBondContact O-N 2.9Å
320	E	25.3	Very low	29	Very low	173 Å²	173	148.6 Å²	148.6	81%	0.808	75%	0.751	S	S	*	*			trans	61.9	78.8	179.9	-53.8	-162.4	139.8	0	0	117.7
321	F	27	Very low	28.9	Very low	191 Å²	191	142.7 Å²	142.7	84%	0.838	74%	0.742	S	S	*	*			trans	-109.5	100.2	132.3	-78	-75.8	0	0	0	108.5	I318	I318-F321 HydrophobicContact CG2-CD2 4.03Å; I318-F321 HydrophobicContact CG2-CE2 3.92Å
322	S	23.5	Very low	28.6	Very low	108 Å²	108	147 Å²	147	76%	0.755	75%	0.748	S	S	*	*			trans	-72.7	123.1	171	-74.6	0	0	0	0	109.8	G324	S322-G324 PolarHBondContact O-N 3.27Å
323	I	26.5	Very low	28.3	Very low	160 Å²	160	140.7 Å²	140.7	82%	0.821	74%	0.742	S	S	*	*			trans	-75.5	102.9	165.7	-62.1	173.9	0	0	0	106.2	Y325	I323-Y325 PolarHBondContact O-N 2.95Å
324	G	23	Very low	27.7	Very low	55 Å²	55	144 Å²	144	57%	0.567	76%	0.758	S	S	*	*			trans	-64.5	128	173.7	0	0	0	0	0	110.6	S322 Y326	S322-G324 PolarHBondContact O-N 3.27Å; G324-Y326 PolarHBondContact O-N 3.46Å
325	Y	23.1	Very low	27.2	Very low	199 Å²	199	145.5 Å²	145.5	78%	0.78	76%	0.76	S	S	*	*			trans	-74.8	113.6	160.6	-69	-98.7	0	0	0	107.1	I323 N327	I323-Y325 PolarHBondContact O-N 2.95Å; Y325-N327 PolarHBondContact O-N 3.31Å
326	Y	25.1	Very low	27.2	Very low	229 Å²	229	146.3 Å²	146.3	90%	0.898	76%	0.764	S	S	*	*			trans	-79.1	101.2	158.7	-74.1	-75.1	0	0	0	107.2	G324	G324-Y326 PolarHBondContact O-N 3.46Å
327	N	24.7	Very low	27	Very low	144 Å²	144	149.1 Å²	149.1	77%	0.77	77%	0.769	S	S	*	*			trans	-65	135.9	156.1	-74	-16.4	0	0	0	107.2	Y325	Y325-N327 PolarHBondContact O-N 3.31Å
328	T	29.6	Very low	27	Very low	127 Å²	127	150.6 Å²	150.6	78%	0.779	78%	0.777	S	S	*	*	S	Bend	trans	-57.1	147.6	163.5	42.8	0	0	0	0	110.5
329	E	26.6	Very low	26.8	Very low	175 Å²	175	152 Å²	152	82%	0.818	78%	0.784	S	S	*	*			trans	113.6	125.3	169.4	-62.3	171.5	-167	0	0	115.7
330	D	27.3	Very low	27	Very low	166 Å²	166	151.8 Å²	151.8	89%	0.888	79%	0.787	S	S	*	*			trans	66.7	108.1	161.5	-58	-19	0	0	0	122.4
331	G	26.2	Very low	27.1	Very low	61 Å²	61	150 Å²	150	63%	0.629	78%	0.778	S	S	*	*			trans	143.1	141.7	146.4	0	0	0	0	0	117.2
332	F	28.7	Very low	27.2	Very low	223 Å²	223	148.4 Å²	148.4	98%	0.978	77%	0.77	S	S	*	*			trans	69.2	119.3	173.5	-48	-81.8	0	0	0	115
333	G	26.8	Very low	27.3	Very low	62 Å²	62	153.6 Å²	153.6	64%	0.639	77%	0.773	S	S	*	*			cis	102.1	91.5	27.5	0	0	0	0	0	108.7
334	I	26.2	Very low	27.5	Very low	157 Å²	157	153.2 Å²	153.2	81%	0.805	77%	0.772	S	S	*	*				49.1	114.2	94.6	-54	173.3	0	0	0	110.2
335	D	28.7	Very low	28	Very low	137 Å²	137	159.6 Å²	159.6	73%	0.733	79%	0.787	S	S	*	*			cis	-131.7	169.5	12.7	-93.1	-49.7	0	0	0	108.1
336	D	32.2	Very low	28.2	Very low	155 Å²	155	159.1 Å²	159.1	83%	0.829	79%	0.789	S	S	*	*				-166.2	164	65.5	-137.7	-25.6	0	0	0	114.1
337	R	25.6	Very low	28.4	Very low	210 Å²	210	157 Å²	157	79%	0.792	79%	0.787	S	S	*	*			trans	-89.6	140	-165.9	-59.2	174.4	178.5	-179	0	113.6
338	D	30.5	Very low	28.9	Very low	168 Å²	168	157.7 Å²	157.7	90%	0.898	79%	0.789	S	S	*	*				-152.8	91.3	128.6	-113.4	-21.4	0	0	0	112
339	I	30.6	Very low	29.2	Very low	144 Å²	144	158.5 Å²	158.5	74%	0.738	79%	0.788	S	S	*	*			trans	-103.9	119.8	169.8	-64.1	165.9	0	0	0	107.1
340	L	29.4	Very low	29.3	Very low	144 Å²	144	156.4 Å²	156.4	75%	0.754	79%	0.788	S	S	*	*			trans	-153.9	91.7	155.4	-132.2	103	0	0	0	115.6
341	H	28	Very low	29.5	Very low	134 Å²	134	155.2 Å²	155.2	62%	0.62	78%	0.782	S	S	*	*			trans	75.3	145.3	141	-60.2	-5.5	0	0	0	118.6
342	K	28.2	Very low	30	Very low	158 Å²	158	160 Å²	160	69%	0.687	79%	0.793	S	S	*	*			cis	-158.7	125.6	0.9	-119	165.5	-171.1	170.3	0	111.2
343	R	25.9	Very low	30.4	Very low	217 Å²	217	153.5 Å²	153.5	82%	0.819	78%	0.775	S	S	*	*				75.4	138.2	126.7	-137	178.8	-110.2	-164.4	-5.8	120.4
344	I	30.9	Very low	30.9	Very low	153 Å²	153	160.3 Å²	160.3	79%	0.785	79%	0.79	S	S	*	*			trans	80.3	113.4	169.5	-48	164.4	0	0	0	111.4
345	E	34.6	Very low	31.2	Very low	189 Å²	189	158.9 Å²	158.9	88%	0.883	78%	0.78	S	S	*	*			cis	-125.6	-170.5	15.7	-61.2	-170.2	131.7	0	0	114
346	K	27.3	Very low	31.7	Very low	189 Å²	189	156.5 Å²	156.5	82%	0.822	77%	0.767	S	S	*	*			trans	-91	160.8	-162.5	-72	173.7	169.4	-177.5	0	115.9
347	E	28.5	Very low	32.1	Very low	185 Å²	185	151.7 Å²	151.7	86%	0.864	75%	0.745	S	S	*	*			trans	61.5	71.8	153.5	-76.7	169.9	164.8	0	0	117.6
348	I	35.9	Very low	32.8	Very low	157 Å²	157	142.6 Å²	142.6	81%	0.805	71%	0.71	S	S	*	*			trans	-125.6	128.5	137.9	-61	-179.1	0	0	0	107	T350	I348-T350 PolarHBondContact O-N 3.38Å
349	D	34.4	Very low	33.1	Very low	144 Å²	144	139.8 Å²	139.8	77%	0.77	70%	0.699	S	S	*	*			trans	-69.6	110.2	-177.1	-147.5	-14.7	0	0	0	109.7	N351	D349-N351 PolarHBondContact O-N 2.93Å; D349-N351 VanDerWaalsContact O-N 3.15Å
350	T	29.1	Very low	33.1	Very low	132 Å²	132	138.9 Å²	138.9	81%	0.81	69%	0.691	S	S	*	*			trans	-88.9	77.4	-175.7	52.4	0	0	0	0	110.6	I348	I348-T350 PolarHBondContact O-N 3.38Å
351	N	32.4	Very low	33.3	Very low	141 Å²	141	140 Å²	140	75%	0.754	70%	0.698	S	S	*	*			trans	-129.6	13.9	175.6	-100.8	-21	0	0	0	113.9	D349 S353	D349-N351 PolarHBondContact O-N 2.93Å; D349-N351 VanDerWaalsContact O-N 3.15Å; N351-S353 PolarHBondContact O-N 2.8Å; N351-S353 VanDerWaalsContact O-N 3.13Å
352	D	36.1	Very low	33.5	Very low	162 Å²	162	136.4 Å²	136.4	87%	0.866	68%	0.683	S	S	*	*			trans	-77	98.8	168.8	-82.3	-9.3	0	0	0	109.9
353	S	36.7	Very low	33.8	Very low	85 Å²	85	135 Å²	135	59%	0.594	69%	0.688	S	S	*	*			trans	-56.6	164.6	153.8	57.3	0	0	0	0	110	N351 E355	N351-S353 PolarHBondContact O-N 2.8Å; N351-S353 VanDerWaalsContact O-N 3.13Å; S353-E355 PolarHBondContact O-N 3.27Å
354	Q	37.8	Very low	34.3	Very low	205 Å²	205	128.8 Å²	128.8	96%	0.958	67%	0.665	S	S	*	*	S	Bend	trans	-76.8	52.6	-166.6	-151.2	175.4	27	0	0	113.5
355	E	33.7	Very low	34.6	Very low	128 Å²	128	125.9 Å²	125.9	60%	0.598	65%	0.65	S	S	*	*			trans	-61.5	140	179	-63.8	-161.8	155.4	0	0	111.5	S353 P357	S353-E355 PolarHBondContact O-N 3.27Å; E355-P357 WeakPolarHBondContact O-CD 3.48Å; E355-P357 VanDerWaalsContact O-N 3.12Å
356	N	38.9	Very low	34.6	Very low	86 Å²	86	117.8 Å²	117.8	46%	0.46	62%	0.615	S	S	.	*			trans	-67.9	108.6	173.3	173.9	9	0	0	0	108.4	W358 V359	N356-W358 PolarHBondContact O-N 3.04Å; N356-V359 HydrophobicContact CB-CG2 3.77Å; N356-V359 WeakPolarHBondContact O-CB 3.47Å; N356-V359 VanDerWaalsContact O-CG2 3.32Å; N356-V359 WeakPolarHBondContact O-CG2 3.38Å; N356-V359 PolarHBondContact O-N 2.87Å
357	P	40.6	Very low	35	Very low	55 Å²	55	113 Å²	113	36%	0.357	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.5	15	-160.4	35.7	-39.1	0	0	0	113.6	Q124 E355	Q124-P357 HydrophobicContact CG-CB 4.44Å; E355-P357 WeakPolarHBondContact O-CD 3.48Å; E355-P357 VanDerWaalsContact O-N 3.12Å
358	W	40.3	Very low	35.4	Very low	18 Å²	18	106.3 Å²	106.3	7%	0.068	57%	0.568	C	S	.	*	T	Hydrogen-bonded Turn	trans	-109.1	1	172.9	-56.5	109.6	0	0	0	112.6	V90 Q124 A127 N356 I362	V90-W358 HydrophobicContact CB-CH2 3.78Å; V90-W358 HydrophobicContact CB-CZ2 3.92Å; V90-W358 HydrophobicContact CB-CZ3 4.16Å; V90-W358 HydrophobicContact CG1-CH2 3.61Å; V90-W358 HydrophobicContact CG1-CZ2 4.18Å; V90-W358 HydrophobicContact CG1-CZ3 4.06Å; V90-W358 HydrophobicContact CG2-CD2 4.14Å; V90-W358 HydrophobicContact CG2-CE3 3.84Å; V90-W358 HydrophobicContact CG2-CH2 3.85Å; V90-W358 HydrophobicContact CG2-CZ2 4.12Å; V90-W358 HydrophobicContact CG2-CZ3 3.7Å; Q124-W358 HydrophobicContact CG-CH2 4.1Å; Q124-W358 HydrophobicContact CG-CZ2 4.36Å; Q124-W358 HydrophobicContact CG-CZ3 4.33Å; A127-W358 HydrophobicContact CB-CH2 4.36Å; A127-W358 HydrophobicContact CB-CZ3 3.95Å; N356-W358 PolarHBondContact O-N 3.04Å; W358-I362 HydrophobicContact CE3-CD1 4.32Å
359	V	35.5	Very low	35.5	Very low	109 Å²	109	105.8 Å²	105.8	66%	0.661	56%	0.56	S	S	*	*			trans	-81.7	-27.4	-177.4	175.1	0	0	0	0	112.1	N356 N361	N356-V359 HydrophobicContact CB-CG2 3.77Å; N356-V359 WeakPolarHBondContact O-CB 3.47Å; N356-V359 VanDerWaalsContact O-CG2 3.32Å; N356-V359 WeakPolarHBondContact O-CG2 3.38Å; N356-V359 PolarHBondContact O-N 2.87Å; V359-N361 PolarHBondContact O-N 2.68Å
360	E	30.5	Very low	35.8	Very low	125 Å²	125	104.8 Å²	104.8	58%	0.584	55%	0.554	S	S	*	*	S	Bend	trans	-75.4	109.6	177.8	-64.6	-161.1	121.5	0	0	113	R128 I362	R128-E360 IonicContact NH2-OE2 3.35Å; R128-E360 PolarHBondContact NH2-OE2 3.02Å; E360-I362 PolarHBondContact O-N 3.46Å
361	N	33.2	Very low	36.3	Very low	167 Å²	167	100.5 Å²	100.5	89%	0.893	54%	0.536	S	S	*	.	S	Bend	trans	68	23.7	147.8	-123	-4.4	0	0	0	119.1	V359	V359-N361 PolarHBondContact O-N 2.68Å
362	I	33.8	Very low	36.5	Very low	60 Å²	60	100.7 Å²	100.7	31%	0.308	53%	0.531	S	S	.	.			trans	-101.4	115.9	172.5	-38.2	177.1	0	0	0	111.7	W358 E360 Y364 Y384	W358-I362 HydrophobicContact CE3-CD1 4.32Å; E360-I362 PolarHBondContact O-N 3.46Å; I362-Y364 PolarHBondContact O-N 2.91Å; I362-Y364 VanDerWaalsContact O-N 3.08Å; I362-Y384 HydrophobicContact CB-CD1 4.05Å; I362-Y384 HydrophobicContact CB-CE1 3.95Å; I362-Y384 HydrophobicContact CD1-CD1 4.16Å; I362-Y384 HydrophobicContact CD1-CE1 3.94Å; I362-Y384 HydrophobicContact CG2-CD1 3.44Å; I362-Y384 VanDerWaalsContact CG2-CD1 3.44Å; I362-Y384 HydrophobicContact CG2-CE1 3.89Å; I362-Y384 HydrophobicContact CG2-CG 4.45Å
363	T	34.2	Very low	36.8	Very low	128 Å²	128	94.4 Å²	94.4	79%	0.785	50%	0.501	S	S	*	.			trans	-68.9	106.3	179.4	-52.1	0	0	0	0	111.2	I365	T363-I365 PolarHBondContact O-N 3.18Å
364	Y	36.5	Very low	36.9	Very low	87 Å²	87	92 Å²	92	34%	0.341	48%	0.483	S	S	.	.			trans	-69.5	122	179.9	175.8	-113	0	0	0	112.8	I362 A373 Y382	I362-Y364 PolarHBondContact O-N 2.91Å; I362-Y364 VanDerWaalsContact O-N 3.08Å; Y364-A373 VanDerWaalsContact OH-CA 3.28Å; Y364-A373 WeakPolarHBondContact OH-CA 3.37Å; Y364-A373 PolarHBondContact OH-N 3.29Å; Y364-Y382 HydrophobicContact CE2-CD1 4.22Å
365	I	36.1	Very low	37	Very low	91 Å²	91	87.3 Å²	87.3	47%	0.467	47%	0.468	S	S	.	.			trans	-109.9	87.2	172.2	-53.2	-178.5	0	0	0	109.9	T363 N367	T363-I365 PolarHBondContact O-N 3.18Å; I365-N367 PolarHBondContact O-N 2.78Å
366	S	36.2	Very low	37.2	Very low	20 Å²	20	82.6 Å²	82.6	14%	0.14	45%	0.448	C	S	.	.			trans	-64.1	114.9	164.5	158.8	0	0	0	0	110.8	N368 G371	S366-N368 PolarHBondContact O-N 3.39Å; S366-N368 WeakPolarHBondContact OG-CA 3.2Å; S366-N368 WeakPolarHBondContact OG-CB 3.43Å; S366-N368 PolarHBondContact OG-N 2.88Å; S366-N368 PolarHBondContact OG-O 3.25Å; S366-G371 WeakPolarHBondContact OG-CA 3.49Å
367	N	35.1	Very low	37.1	Very low	88 Å²	88	83.8 Å²	83.8	47%	0.471	46%	0.463	S	S	.	.			trans	-81.7	10.1	162.6	-155.2	18.5	0	0	0	112.9	I365	I365-N367 PolarHBondContact O-N 2.78Å
368	N	36.7	Very low	36.9	Very low	44 Å²	44	85.6 Å²	85.6	24%	0.235	47%	0.47	C	S	.	.	S	Bend	trans	-84.2	130.6	167.7	-179.9	-3.4	0	0	0	109	S190 S366 N370 G371 K372	S190-N368 PolarHBondContact OG-O 3.4Å; S366-N368 PolarHBondContact O-N 3.39Å; S366-N368 WeakPolarHBondContact OG-CA 3.2Å; S366-N368 WeakPolarHBondContact OG-CB 3.43Å; S366-N368 PolarHBondContact OG-N 2.88Å; S366-N368 PolarHBondContact OG-O 3.25Å; N368-N370 PolarHBondContact O-N 3.26Å; N368-N370 PolarHBondContact OD1-N 2.8Å; N368-G371 PolarHBondContact O-N 2.95Å; N368-K372 PolarHBondContact ND2-O 3.13Å
369	K	38.3	Very low	36.4	Very low	147 Å²	147	85.8 Å²	85.8	64%	0.639	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-17.3	179.9	-65.7	-178.6	177.7	-179.9	0	114.3	S190	S190-K369 PolarHBondContact N-O 2.68Å; S190-K369 WeakPolarHBondContact O-CA 3.21Å; S190-K369 VanDerWaalsContact OG-C 3.31Å; S190-K369 WeakPolarHBondContact OG-CA 3.31Å; S190-K369 PolarHBondContact OG-O 2.98Å; S190-K369 VanDerWaalsContact OG-O 3.14Å
370	N	40.1	Very low	36.5	Very low	122 Å²	122	83 Å²	83	65%	0.652	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	5.5	-177.2	-62.7	-15.9	0	0	0	113.6	N368 K372	N368-N370 PolarHBondContact O-N 3.26Å; N368-N370 PolarHBondContact OD1-N 2.8Å; N370-K372 PolarHBondContact O-N 3.1Å
371	G	39.5	Very low	36.7	Very low	42 Å²	42	77.8 Å²	77.8	43%	0.433	44%	0.439	S	S	.	.			trans	68.1	3.1	178.2	0	0	0	0	0	116.1	S366 N368	S366-G371 WeakPolarHBondContact OG-CA 3.49Å; N368-G371 PolarHBondContact O-N 2.95Å
372	K	37.8	Very low	37.2	Very low	146 Å²	146	73.4 Å²	73.4	64%	0.635	41%	0.411	S	S	*	.			trans	-92.2	145.1	-178.2	-69	-166.7	174.8	-167	0	112.4	N368 N370 T374	N368-K372 PolarHBondContact ND2-O 3.13Å; N370-K372 PolarHBondContact O-N 3.1Å; K372-T374 PolarHBondContact O-N 3.4Å
373	A	42.3	Very low	37.5	Very low	29 Å²	29	72.5 Å²	72.5	24%	0.24	41%	0.407	C	S	.	.			trans	-46.6	135.9	167.2	0	0	0	0	0	110.9	Y364 V375 Y382	Y364-A373 VanDerWaalsContact OH-CA 3.28Å; Y364-A373 WeakPolarHBondContact OH-CA 3.37Å; Y364-A373 PolarHBondContact OH-N 3.29Å; A373-V375 PolarHBondContact O-N 3.12Å; A373-Y382 HydrophobicContact CB-CE1 3.95Å
374	T	38	Very low	37.9	Very low	36 Å²	36	67.4 Å²	67.4	22%	0.221	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	103.2	178.5	-17.9	0	0	0	0	107	K35 K372 T376 V381	K35-T374 PolarHBondContact NZ-OG1 3.11Å; K372-T374 PolarHBondContact O-N 3.4Å; T374-T376 PolarHBondContact O-N 2.84Å; T374-V381 PolarHBondContact O-N 3.27Å
375	V	39.3	Very low	37.7	Very low	105 Å²	105	66.3 Å²	66.3	64%	0.636	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	113.2	174.3	-172.7	0	0	0	0	107.1	A373	A373-V375 PolarHBondContact O-N 3.12Å
376	T	39	Very low	37.4	Very low	29 Å²	29	62.4 Å²	62.4	18%	0.178	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	168.1	169.5	68.3	0	0	0	0	109.4	T374 N378 G379 V381	T374-T376 PolarHBondContact O-N 2.84Å; T376-N378 PolarHBondContact O-N 2.75Å; T376-N378 PolarHBondContact OG1-N 2.89Å; T376-G379 PolarHBondContact N-O 3.01Å; T376-G379 PolarHBondContact O-N 2.91Å; T376-G379 PolarHBondContact OG1-N 3.33Å; T376-G379 PolarHBondContact OG1-O 3.04Å; T376-V381 HydrophobicContact CG2-CG2 3.94Å
377	S	36.1	Very low	37.2	Very low	111 Å²	111	68.7 Å²	68.7	78%	0.776	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-20.7	168.8	43.5	0	0	0	0	113.5
378	N	36.9	Very low	36.9	Very low	93 Å²	93	70.8 Å²	70.8	50%	0.497	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	10.8	179.1	-56	-30	0	0	0	113.1	L43 T376	L43-N378 HydrophobicContact CD1-CB 3.58Å; T376-N378 PolarHBondContact O-N 2.75Å; T376-N378 PolarHBondContact OG1-N 2.89Å
379	G	30.2	Very low	36.4	Very low	23 Å²	23	72.7 Å²	72.7	24%	0.237	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	109.8	-179.3	176.9	0	0	0	0	0	115.6	T376	T376-G379 PolarHBondContact N-O 3.01Å; T376-G379 PolarHBondContact O-N 2.91Å; T376-G379 PolarHBondContact OG1-N 3.33Å; T376-G379 PolarHBondContact OG1-O 3.04Å
380	S	37.1	Very low	35.8	Very low	51 Å²	51	71.6 Å²	71.6	36%	0.357	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	125.2	-178.7	-52	0	0	0	0	112.5
381	V	35.1	Very low	35.1	Very low	14 Å²	14	69.8 Å²	69.8	9%	0.085	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	125.3	177.9	-177.1	0	0	0	0	109	A39 F89 T374 T376	A39-V381 HydrophobicContact CB-CG2 3.51Å; F89-V381 HydrophobicContact CD1-CG1 3.79Å; F89-V381 HydrophobicContact CE1-CG1 4.09Å; T374-V381 PolarHBondContact O-N 3.27Å; T376-V381 HydrophobicContact CG2-CG2 3.94Å
382	Y	43.8	Very low	34.5	Very low	76 Å²	76	77.2 Å²	77.2	30%	0.298	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	115.9	-177.7	-62.1	-90	0	0	0	109.7	F89 P92 Y364 A373 Y384	F89-Y382 WeakPolarHBondContact CD1-O 3.45Å; P92-Y382 HydrophobicContact CG-CD2 4.18Å; P92-Y382 HydrophobicContact CG-CE2 4.17Å; Y364-Y382 HydrophobicContact CE2-CD1 4.22Å; A373-Y382 HydrophobicContact CB-CE1 3.95Å; Y382-Y384 WeakPolarHBondContact O-CD2 3.37Å
383	L	38.6	Very low	34	Very low	41 Å²	41	78.8 Å²	78.8	22%	0.215	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	125.1	171.1	174.1	64.2	0	0	0	109.1	F89 V385	F89-L383 HydrophobicContact CD1-CB 4.33Å; F89-L383 HydrophobicContact CD1-CD1 4.26Å; F89-L383 HydrophobicContact CE1-CB 3.7Å; F89-L383 HydrophobicContact CE1-CD1 3.6Å; F89-L383 HydrophobicContact CE1-CG 4.23Å; F89-L383 HydrophobicContact CE2-CD1 4.17Å; F89-L383 HydrophobicContact CZ-CB 4.41Å; F89-L383 HydrophobicContact CZ-CD1 3.54Å; L383-V385 HydrophobicContact CD1-CG2 4.33Å; L383-V385 HydrophobicContact CD2-CG2 3.87Å; L383-V385 HydrophobicContact CG-CG2 3.9Å
384	Y	42.9	Very low	33.2	Very low	20 Å²	20	85.3 Å²	85.3	8%	0.078	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	104	169.4	-63.1	-81.5	0	0	0	108.3	F88 V90 I362 Y382 A386	F88-Y384 HydrophobicContact CE2-CG 4.47Å; F88-Y384 PolarHBondContact N-O 2.87Å; F88-Y384 PolarHBondContact O-N 3.46Å; V90-Y384 HydrophobicContact CG2-CD2 3.51Å; V90-Y384 HydrophobicContact CG2-CE2 3.34Å; I362-Y384 HydrophobicContact CB-CD1 4.05Å; I362-Y384 HydrophobicContact CB-CE1 3.95Å; I362-Y384 HydrophobicContact CD1-CD1 4.16Å; I362-Y384 HydrophobicContact CD1-CE1 3.94Å; I362-Y384 HydrophobicContact CG2-CD1 3.44Å; I362-Y384 VanDerWaalsContact CG2-CD1 3.44Å; I362-Y384 HydrophobicContact CG2-CE1 3.89Å; I362-Y384 HydrophobicContact CG2-CG 4.45Å; Y382-Y384 WeakPolarHBondContact O-CD2 3.37Å; Y384-A386 PolarHBondContact O-N 3.03Å
385	V	32.5	Very low	32.7	Very low	65 Å²	65	89.4 Å²	89.4	39%	0.394	47%	0.473	S	S	.	.			trans	-75.9	114	177.1	-179.2	0	0	0	0	107.3	L383 Q387	L383-V385 HydrophobicContact CD1-CG2 4.33Å; L383-V385 HydrophobicContact CD2-CG2 3.87Å; L383-V385 HydrophobicContact CG-CG2 3.9Å; V385-Q387 PolarHBondContact O-N 3.42Å
386	A	30	Very low	32.4	Very low	9 Å²	9	91.7 Å²	91.7	7%	0.074	48%	0.48	C	S	.	.			trans	-59.6	130.8	165.1	0	0	0	0	0	107.3	F88 L130 Y384 Q388	F88-A386 HydrophobicContact CD1-CB 4.42Å; F88-A386 HydrophobicContact CE1-CB 4.41Å; L130-A386 WeakPolarHBondContact O-CB 3.24Å; Y384-A386 PolarHBondContact O-N 3.03Å; A386-Q388 PolarHBondContact O-N 3.4Å
387	Q	31.5	Very low	32.2	Very low	151 Å²	151	101 Å²	101	71%	0.706	53%	0.528	S	S	*	.			trans	-72.1	89.9	-163.8	-165.3	175	19.7	0	0	110.8	V385 V389	V385-Q387 PolarHBondContact O-N 3.42Å; Q387-V389 VanDerWaalsContact C-N 3.33Å; Q387-V389 PolarHBondContact O-N 2.86Å
388	Q	29.1	Very low	32	Very low	133 Å²	133	100.5 Å²	100.5	62%	0.621	52%	0.516	S	S	*	.			trans	-67.1	94.5	174.3	-163.2	178.7	34.6	0	0	108.9	A386 N390	A386-Q388 PolarHBondContact O-N 3.4Å; Q388-N390 PolarHBondContact O-N 3.15Å; Q388-N390 VanDerWaalsContact O-N 3.14Å
389	V	26.6	Very low	31.7	Very low	83 Å²	83	100.8 Å²	100.8	50%	0.503	52%	0.517	S	S	.	.			trans	-61.3	114.8	175.7	-174.1	0	0	0	0	108	Q387	Q387-V389 VanDerWaalsContact C-N 3.33Å; Q387-V389 PolarHBondContact O-N 2.86Å
390	N	25.3	Very low	31.8	Very low	124 Å²	124	105.2 Å²	105.2	66%	0.663	53%	0.532	S	S	*	.			trans	12.6	114.1	170.5	-91.5	-43.9	0	0	0	116.6	Q388 R392	Q388-N390 PolarHBondContact O-N 3.15Å; Q388-N390 VanDerWaalsContact O-N 3.14Å; N390-R392 HydrophobicContact CB-CG 4.29Å; N390-R392 PolarHBondContact O-N 3.24Å
391	P	26.3	Very low	31.5	Very low	85 Å²	85	108.4 Å²	108.4	55%	0.552	54%	0.543	S	S	*	.			trans	-65.2	89.8	152.2	30.2	-32	0	0	0	107.9	F393	P391-F393 HydrophobicContact CB-CD2 4.21Å; P391-F393 HydrophobicContact CB-CE2 3.87Å; P391-F393 HydrophobicContact CG-CE2 4.21Å; P391-F393 WeakPolarHBondContact O-CD2 3.18Å; P391-F393 PolarHBondContact O-N 2.65Å
392	R	26.1	Very low	31.3	Very low	197 Å²	197	114.3 Å²	114.3	74%	0.743	57%	0.571	S	S	*	*			trans	-66.7	88.7	166.1	-75	-173.2	-178.3	160.8	2	107.1	N390 E394	N390-R392 HydrophobicContact CB-CG 4.29Å; N390-R392 PolarHBondContact O-N 3.24Å; R392-E394 VanDerWaalsContact C-N 3.28Å; R392-E394 PolarHBondContact O-N 3.38Å
393	F	28.6	Very low	30.4	Very low	180 Å²	180	116.8 Å²	116.8	79%	0.789	59%	0.589	S	S	*	*			trans	-65.8	95.3	161.1	-72.6	-81.2	0	0	0	107.7	P391 T395	P391-F393 HydrophobicContact CB-CD2 4.21Å; P391-F393 HydrophobicContact CB-CE2 3.87Å; P391-F393 HydrophobicContact CG-CE2 4.21Å; P391-F393 WeakPolarHBondContact O-CD2 3.18Å; P391-F393 PolarHBondContact O-N 2.65Å; F393-T395 VanDerWaalsContact C-N 3.35Å; F393-T395 PolarHBondContact O-N 3.17Å
394	E	25.1	Very low	29.9	Very low	165 Å²	165	122.2 Å²	122.2	77%	0.771	62%	0.616	S	S	*	*			trans	-65	101.6	157.5	-71.1	-175.6	177	0	0	107.2	R392 I396	R392-E394 VanDerWaalsContact C-N 3.28Å; R392-E394 PolarHBondContact O-N 3.38Å; E394-I396 VanDerWaalsContact C-N 3.25Å; E394-I396 PolarHBondContact O-N 3.37Å
395	T	27.2	Very low	28.9	Very low	123 Å²	123	130.1 Å²	130.1	76%	0.755	66%	0.658	S	S	*	*			trans	-66.6	92.6	160.5	45.4	0	0	0	0	107.7	F393 N397	F393-T395 VanDerWaalsContact C-N 3.35Å; F393-T395 PolarHBondContact O-N 3.17Å; T395-N397 PolarHBondContact O-N 3.27Å
396	I	32.3	Very low	28.6	Very low	152 Å²	152	135.5 Å²	135.5	78%	0.779	68%	0.68	S	S	*	*			trans	-68.1	109.4	163.8	-56.8	174.7	0	0	0	106.5	E394	E394-I396 VanDerWaalsContact C-N 3.25Å; E394-I396 PolarHBondContact O-N 3.37Å
397	N	34.9	Very low	28.4	Very low	224 Å²	224	147 Å²	147	100%	1.198	74%	0.735	S	S	*	*			trans	-106.7	0	164.2	-90.5	-7.2	0	0	0	108.3	T395	T395-N397 PolarHBondContact O-N 3.27Å

Retrieved 397 of 397 residues in 351.4 ms (Link to these results)

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