A0A077ZLR9_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZLR9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 193 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	35.5	Very low	52.2	Low	210 Å²	210	144.2 Å²	144.2	100%	1.034	72%	0.723	S	S	*	*				0	115.1	0	-64.7	-64.5	-77.1	0	0	107.9	E3	M1-E3 HydrophobicContact CE-CG 4.29Å
2	P	53	Low	54.6	Low	121 Å²	121	133.7 Å²	133.7	79%	0.786	67%	0.669	S	S	*	*			trans	-116.1	126	131.4	30.9	-22.2	0	0	0	107.9	E4	P2-E4 PolarHBondContact O-N 3.12Å
3	E	45.9	Very low	56.9	Low	176 Å²	176	131.1 Å²	131.1	82%	0.822	66%	0.664	S	S	*	*			trans	-65.9	110.6	173.7	-73.2	161.4	115	0	0	108.2	M1 D5	M1-E3 HydrophobicContact CE-CG 4.29Å; E3-D5 VanDerWaalsContact C-N 3.25Å; E3-D5 PolarHBondContact O-N 3.25Å
4	E	49	Very low	59	Low	181 Å²	181	128.3 Å²	128.3	85%	0.846	66%	0.656	S	S	*	*			trans	-67.1	90.5	169	-80.8	162.5	123.3	0	0	108.4	P2 R6	P2-E4 PolarHBondContact O-N 3.12Å; E4-R6 PolarHBondContact O-N 3.5Å
5	D	48.7	Very low	61	Low	106 Å²	106	123.2 Å²	123.2	57%	0.567	65%	0.648	S	S	*	*			trans	-41.6	106.5	160.5	-179.2	27.4	0	0	0	108.6	E3 R7	E3-D5 VanDerWaalsContact C-N 3.25Å; E3-D5 PolarHBondContact O-N 3.25Å; D5-R7 HydrophobicContact CB-CG 4.33Å; D5-R7 PolarHBondContact O-N 3.16Å; D5-R7 VanDerWaalsContact OD2-CG 3.23Å; D5-R7 WeakPolarHBondContact OD2-CG 3.3Å; D5-R7 IonicContact OD2-CZ 3.94Å; D5-R7 IonicContact OD2-NE 3.52Å; D5-R7 PolarHBondContact OD2-NE 2.85Å; D5-R7 IonicContact OD2-NH2 3.67Å
6	R	48.9	Very low	62.5	Low	241 Å²	241	118.7 Å²	118.7	91%	0.909	62%	0.623	S	S	*	*			trans	-67.4	75.8	174.7	-71.2	-177.8	173.4	151.9	-1.7	108.1	E4 D8	E4-R6 PolarHBondContact O-N 3.5Å; R6-D8 PolarHBondContact O-N 3.11Å
7	R	50.7	Low	63.9	Low	184 Å²	184	117.3 Å²	117.3	69%	0.694	61%	0.61	S	S	*	*			trans	-69.3	116.3	172.5	-65.1	175.2	-171.6	171.6	7.1	106.4	D5	D5-R7 HydrophobicContact CB-CG 4.33Å; D5-R7 PolarHBondContact O-N 3.16Å; D5-R7 VanDerWaalsContact OD2-CG 3.23Å; D5-R7 WeakPolarHBondContact OD2-CG 3.3Å; D5-R7 IonicContact OD2-CZ 3.94Å; D5-R7 IonicContact OD2-NE 3.52Å; D5-R7 PolarHBondContact OD2-NE 2.85Å; D5-R7 IonicContact OD2-NH2 3.67Å
8	D	53.5	Low	65.1	Low	136 Å²	136	110.8 Å²	110.8	73%	0.727	58%	0.577	S	S	*	*			trans	-42.8	136.7	164.2	-70.6	-46.3	0	0	0	108.6	R6 A10	R6-D8 PolarHBondContact O-N 3.11Å; D8-A10 PolarHBondContact O-N 3.08Å
9	P	56.6	Low	66.1	Low	125 Å²	125	107.6 Å²	107.6	81%	0.812	56%	0.556	S	S	*	*			trans	-53.2	110.4	-172.1	20	-31.1	0	0	0	108.8
10	A	59.2	Low	67	Low	37 Å²	37	102.6 Å²	102.6	31%	0.306	53%	0.531	S	S	.	.			trans	-59.6	138	178.7	0	0	0	0	0	107.4	D8 Y12 V39	D8-A10 PolarHBondContact O-N 3.08Å; A10-Y12 PolarHBondContact O-N 3Å; A10-V39 HydrophobicContact CB-CG1 3.84Å
11	P	73.5	Confident	67.8	Low	69 Å²	69	99 Å²	99	45%	0.448	51%	0.511	S	S	.	.	S	Bend	trans	-64.4	-3.1	-175.3	23	-31.2	0	0	0	113.6	V54 H59	P11-V54 HydrophobicContact CG-CG1 4.25Å; P11-H59 PolarHBondContact O-CE1 2.89Å; P11-H59 PolarHBondContact O-NE2 3.02Å
12	Y	81	Confident	70	Confident	18 Å²	18	89.9 Å²	89.9	7%	0.071	47%	0.467	C	S	.	.	S	Bend	trans	-136.5	144.1	-177.7	-62	-76	0	0	0	111.1	A10 E16 V18 V45 V54 L57 H59	A10-Y12 PolarHBondContact O-N 3Å; Y12-E16 WeakPolarHBondContact CA-OE2 3.45Å; Y12-V18 HydrophobicContact CD1-CG1 3.63Å; Y12-V18 HydrophobicContact CE1-CG1 3.76Å; Y12-V45 HydrophobicContact CD2-CG2 3.69Å; Y12-V45 HydrophobicContact CG-CG2 4.26Å; Y12-V54 HydrophobicContact CD2-CG1 4.11Å; Y12-V54 HydrophobicContact CE2-CB 4.06Å; Y12-V54 HydrophobicContact CE2-CG1 3.9Å; Y12-L57 HydrophobicContact CD2-CD1 4.12Å; Y12-L57 HydrophobicContact CE1-CB 4.11Å; Y12-L57 HydrophobicContact CE1-CD1 4.4Å; Y12-L57 HydrophobicContact CE2-CB 4.13Å; Y12-L57 HydrophobicContact CE2-CD1 3.89Å; Y12-L57 HydrophobicContact CG-CD1 4.46Å; Y12-L57 WeakPolarHBondContact OH-CB 3.29Å; Y12-H59 AromaticContact CD1-CE1 3.68Å; Y12-H59 AromaticContact CE1-CE1 3.46Å; Y12-H59 VanDerWaalsContact CE1-CE1 3.46Å; Y12-H59 WeakPolarHBondContact CE1-CE1 3.36Å; Y12-H59 AromaticContact CE1-ND1 3.84Å; Y12-H59 AromaticContact CE1-NE2 3.65Å
13	V	83.7	Confident	71.2	Confident	100 Å²	100	89.7 Å²	89.7	61%	0.606	47%	0.469	S	S	*	.			trans	-108.2	143.9	179.2	-174.6	0	0	0	0	110.6	G15 E16 V36	V13-G15 PolarHBondContact O-N 3.09Å; V13-E16 PolarHBondContact N-OE2 3.28Å; V13-E16 WeakPolarHBondContact O-CB 3.43Å; V13-E16 PolarHBondContact O-N 3.06Å; V13-V36 WeakPolarHBondContact O-CB 3.34Å
14	V	87.2	Confident	72.6	Confident	92 Å²	92	88.4 Å²	88.4	56%	0.558	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	128	174.5	179.6	0	0	0	0	109.8
15	G	88	Confident	73.6	Confident	52 Å²	52	81.3 Å²	81.3	54%	0.536	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.2	-8.2	-172.8	0	0	0	0	0	114.6	V13 V36	V13-G15 PolarHBondContact O-N 3.09Å; G15-V36 PolarHBondContact N-O 3.1Å
16	E	86.3	Confident	74.7	Confident	51 Å²	51	84.9 Å²	84.9	24%	0.238	44%	0.441	C	S	.	.			trans	-71.3	138.7	177.9	-168	179.4	164.8	0	0	111.6	Y12 V13 V18 V36 H59	Y12-E16 WeakPolarHBondContact CA-OE2 3.45Å; V13-E16 PolarHBondContact N-OE2 3.28Å; V13-E16 WeakPolarHBondContact O-CB 3.43Å; V13-E16 PolarHBondContact O-N 3.06Å; E16-V18 HydrophobicContact CG-CG1 4.29Å; E16-V36 HydrophobicContact CB-CG2 4.33Å; E16-V36 PolarHBondContact O-N 3.14Å; E16-H59 IonicContact OE1-CE1 2.63Å; E16-H59 PolarHBondContact OE1-CE1 2.93Å; E16-H59 IonicContact OE1-CG 3.54Å; E16-H59 IonicContact OE1-ND1 3.79Å; E16-H59 PolarHBondContact OE1-ND1 3.4Å
17	K	86.1	Confident	75.5	Confident	95 Å²	95	75.8 Å²	75.8	41%	0.413	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	123.7	174.2	-67.4	175.6	-172.1	163.6	0	109.3	R60	K17-R60 VanDerWaalsContact CD-NH1 3.35Å; K17-R60 WeakPolarHBondContact O-CB 3.31Å
18	V	84.7	Confident	76.3	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.006	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	155.6	-177.3	-65.6	0	0	0	0	110.9	Y12 E16 V20 G34 V36 I47	Y12-V18 HydrophobicContact CD1-CG1 3.63Å; Y12-V18 HydrophobicContact CE1-CG1 3.76Å; E16-V18 HydrophobicContact CG-CG1 4.29Å; V18-V20 HydrophobicContact CG2-CG2 3.96Å; V18-G34 PolarHBondContact N-O 2.88Å; V18-G34 PolarHBondContact O-N 2.83Å; V18-V36 HydrophobicContact CG1-CG2 4.08Å; V18-V36 HydrophobicContact CG2-CG2 4.01Å; V18-I47 HydrophobicContact CG2-CD1 3.6Å; V18-I47 HydrophobicContact CG2-CG1 4.43Å
19	W	85.2	Confident	76.9	Confident	50 Å²	50	66.4 Å²	66.4	19%	0.189	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	123.3	171.5	-74.8	118.6	0	0	0	108.8	Y31 R33 L57 R58	W19-Y31 HydrophobicContact CB-CD1 4.09Å; W19-Y31 HydrophobicContact CB-CG 4.3Å; W19-Y31 WeakPolarHBondContact CZ3-O 3.3Å; W19-R33 HydrophobicContact CE3-CB 4.3Å; W19-R33 HydrophobicContact CZ3-CB 4Å; W19-L57 CarbonylContact O-C 3.54Å; W19-L57 WeakPolarHBondContact O-CA 3.38Å; W19-R58 HydrophobicContact CB-CB 3.98Å; W19-R58 PolarHBondContact N-O 3.45Å; W19-R58 PolarHBondContact O-N 3.24Å
20	V	84.2	Confident	77.9	Confident	7 Å²	7	67.9 Å²	67.9	4%	0.042	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.8	-167.4	-170.1	0	0	0	0	110.2	V18 Q32 I47 R52 L57 Y172	V18-V20 HydrophobicContact CG2-CG2 3.96Å; V20-Q32 WeakPolarHBondContact CB-O 3.29Å; V20-Q32 PolarHBondContact N-O 3.4Å; V20-Q32 PolarHBondContact O-N 3.42Å; V20-I47 HydrophobicContact CB-CD1 4.45Å; V20-I47 HydrophobicContact CG1-CD1 4.13Å; V20-I47 HydrophobicContact CG2-CD1 3.48Å; V20-I47 VanDerWaalsContact CG2-CD1 3.48Å; V20-I47 HydrophobicContact CG2-CG2 3.98Å; V20-R52 HydrophobicContact CG1-CG 4.2Å; V20-L57 HydrophobicContact CB-CD2 4.31Å; V20-L57 HydrophobicContact CG1-CD2 3.96Å; V20-L57 HydrophobicContact CG2-CD2 4.04Å; V20-Y172 PolarHBondContact O-OH 3.43Å
21	K	84	Confident	78.9	Confident	28 Å²	28	67.7 Å²	67.7	12%	0.122	37%	0.373	C	S	.	.			trans	-67.6	121.8	168.6	-175.6	168.7	177.9	-166.6	0	110.7	A25 Y31 D56 Y172 L174	K21-A25 HydrophobicContact CD-CB 4.24Å; K21-A25 VanDerWaalsContact CE-CB 3.47Å; K21-A25 HydrophobicContact CG-CB 3.78Å; K21-Y31 HydrophobicContact CB-CE1 4.32Å; K21-D56 HydrophobicContact CB-CB 3.84Å; K21-D56 WeakPolarHBondContact CB-O 3.23Å; K21-D56 PolarHBondContact N-O 2.93Å; K21-Y172 VanDerWaalsContact CA-OH 3.3Å; K21-Y172 WeakPolarHBondContact CA-OH 3.43Å; K21-Y172 HydrophobicContact CB-CD1 4.21Å; K21-Y172 HydrophobicContact CB-CE1 3.49Å; K21-Y172 VanDerWaalsContact CB-CE1 3.49Å; K21-Y172 HydrophobicContact CD-CD1 3.76Å; K21-Y172 HydrophobicContact CD-CE1 3.93Å; K21-Y172 HydrophobicContact CG-CD1 3.64Å; K21-Y172 HydrophobicContact CG-CE1 3.34Å; K21-L174 PolarHBondContact NZ-O 2.86Å
22	P	81.2	Confident	79.3	Confident	17 Å²	17	69.9 Å²	69.9	11%	0.11	38%	0.378	C	S	.	.			trans	-64.5	145.7	169.5	30.6	-32.8	0	0	0	107.7	E24 A25 Y172	P22-E24 PolarHBondContact O-N 3.13Å; P22-A25 HydrophobicContact CG-CB 4.14Å; P22-A25 WeakPolarHBondContact O-CB 3.34Å; P22-A25 PolarHBondContact O-N 2.81Å; P22-Y172 WeakPolarHBondContact CD-OH 3.32Å; P22-Y172 HydrophobicContact CG-CE2 3.96Å
23	S	76.6	Confident	79.5	Confident	117 Å²	117	76.8 Å²	76.8	82%	0.818	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-33.8	177.7	46	0	0	0	0	112	A25	S23-A25 VanDerWaalsContact C-N 3.34Å; S23-A25 PolarHBondContact O-N 2.78Å
24	E	76.7	Confident	79.7	Confident	149 Å²	149	72.1 Å²	72.1	70%	0.696	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	44.8	177.5	-156.1	-177.6	170.8	0	0	112.4	P22 R26	P22-E24 PolarHBondContact O-N 3.13Å; E24-R26 PolarHBondContact O-N 3.33Å
25	A	69.5	Low	79.7	Confident	33 Å²	33	70.3 Å²	70.3	27%	0.273	37%	0.365	S	S	.	.			trans	-69.8	118.5	180	0	0	0	0	0	111.8	K21 P22 S23 Y172	K21-A25 HydrophobicContact CD-CB 4.24Å; K21-A25 VanDerWaalsContact CE-CB 3.47Å; K21-A25 HydrophobicContact CG-CB 3.78Å; P22-A25 HydrophobicContact CG-CB 4.14Å; P22-A25 WeakPolarHBondContact O-CB 3.34Å; P22-A25 PolarHBondContact O-N 2.81Å; S23-A25 VanDerWaalsContact C-N 3.34Å; S23-A25 PolarHBondContact O-N 2.78Å; A25-Y172 HydrophobicContact CB-CD1 4.26Å; A25-Y172 HydrophobicContact CB-CD2 3.86Å; A25-Y172 HydrophobicContact CB-CE2 4.23Å; A25-Y172 HydrophobicContact CB-CG 3.89Å
26	R	71	Confident	79.7	Confident	181 Å²	181	67.9 Å²	67.9	68%	0.683	34%	0.34	S	S	*	.			trans	-99.4	170.3	160.8	-60.2	-168.1	-177.8	-160.4	1.5	109.5	E24 A28 S29	E24-R26 PolarHBondContact O-N 3.33Å; R26-A28 PolarHBondContact O-N 3.19Å; R26-A28 VanDerWaalsContact O-N 3.09Å; R26-S29 PolarHBondContact N-OG 3.4Å; R26-S29 WeakPolarHBondContact O-CB 3.35Å; R26-S29 PolarHBondContact O-N 2.83Å; R26-S29 PolarHBondContact O-OG 3.48Å
27	C	65.5	Low	80	Confident	49 Å²	49	68.5 Å²	68.5	33%	0.331	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-31	177.7	-59.7	0	0	0	0	113.3	P171 Y172	C27-P171 WeakPolarHBondContact O-CB 3.29Å; C27-Y172 VanDerWaalsContact CA-O 3.29Å; C27-Y172 WeakPolarHBondContact CA-O 3.16Å
28	A	69.3	Low	80	Confident	92 Å²	92	64.5 Å²	64.5	76%	0.76	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-5.6	176.5	0	0	0	0	0	114.8	R26	R26-A28 PolarHBondContact O-N 3.19Å; R26-A28 VanDerWaalsContact O-N 3.09Å
29	S	66.2	Low	80.1	Confident	31 Å²	31	66.4 Å²	66.4	22%	0.217	34%	0.344	C	S	.	.			trans	-69.6	153.7	179.4	-59.2	0	0	0	0	110	R26 Y172	R26-S29 PolarHBondContact N-OG 3.4Å; R26-S29 WeakPolarHBondContact O-CB 3.35Å; R26-S29 PolarHBondContact O-N 2.83Å; R26-S29 PolarHBondContact O-OG 3.48Å; S29-Y172 WeakPolarHBondContact O-CD2 3.16Å; S29-Y172 WeakPolarHBondContact O-CE2 3.43Å
30	R	75.9	Confident	80	Confident	157 Å²	157	67.5 Å²	67.5	59%	0.592	36%	0.358	S	S	*	.			trans	-108.4	153.9	179.5	-63.2	-175.4	-179.9	-171.6	-2.5	112.8	Q32 Y172	R30-Q32 PolarHBondContact O-N 3.36Å; R30-Y172 VanDerWaalsContact C-CZ 3.5Å; R30-Y172 VanDerWaalsContact O-CE2 3.23Å; R30-Y172 WeakPolarHBondContact O-CE2 3.44Å; R30-Y172 PolarHBondContact O-OH 3.27Å
31	Y	80.9	Confident	79.9	Confident	32 Å²	32	69.9 Å²	69.9	13%	0.125	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-61.2	126	167.4	-71.6	-101	0	0	0	110.8	W19 K21 R58 I170 Y172	W19-Y31 HydrophobicContact CB-CD1 4.09Å; W19-Y31 HydrophobicContact CB-CG 4.3Å; W19-Y31 WeakPolarHBondContact CZ3-O 3.3Å; K21-Y31 HydrophobicContact CB-CE1 4.32Å; Y31-R58 HydrophobicContact CD1-CG 4.27Å; Y31-R58 HydrophobicContact CE1-CG 3.73Å; Y31-I170 HydrophobicContact CD2-CB 4.2Å; Y31-I170 HydrophobicContact CD2-CG2 4.28Å; Y31-I170 WeakPolarHBondContact CD2-O 3.39Å; Y31-I170 HydrophobicContact CE2-CB 4.4Å; Y31-I170 HydrophobicContact CE2-CG2 3.96Å; Y31-Y172 WeakPolarHBondContact CA-OH 3.14Å; Y31-Y172 AromaticContact CD1-CE1 3.66Å; Y31-Y172 HydrophobicContact CD1-CE1 3.66Å; Y31-Y172 AromaticContact CD1-CZ 3.97Å; Y31-Y172 HydrophobicContact CD2-CD1 4.14Å; Y31-Y172 AromaticContact CD2-CE1 3.45Å; Y31-Y172 HydrophobicContact CD2-CE1 3.45Å; Y31-Y172 VanDerWaalsContact CD2-CE1 3.45Å; Y31-Y172 HydrophobicContact CD2-CE2 4.3Å; Y31-Y172 AromaticContact CD2-CZ 3.49Å; Y31-Y172 VanDerWaalsContact CD2-CZ 3.49Å; Y31-Y172 HydrophobicContact CE1-CD1 4.18Å; Y31-Y172 AromaticContact CE1-CE1 3.38Å; Y31-Y172 HydrophobicContact CE1-CE1 3.38Å; Y31-Y172 AromaticContact CE2-CD1 3.46Å; Y31-Y172 HydrophobicContact CE2-CD1 3.46Å; Y31-Y172 VanDerWaalsContact CE2-CD1 3.46Å; Y31-Y172 AromaticContact CE2-CE1 3.14Å; Y31-Y172 HydrophobicContact CE2-CE1 3.14Å; Y31-Y172 HydrophobicContact CE2-CG 4.24Å; Y31-Y172 AromaticContact CE2-CZ 3.7Å; Y31-Y172 AromaticContact CG-CE1 3.71Å; Y31-Y172 HydrophobicContact CG-CE1 3.71Å; Y31-Y172 AromaticContact CG-CZ 3.65Å; Y31-Y172 VanDerWaalsContact CG-OH 3.22Å; Y31-Y172 AromaticContact CZ-CD1 3.49Å; Y31-Y172 VanDerWaalsContact CZ-CD1 3.49Å; Y31-Y172 AromaticContact CZ-CE1 3.11Å; Y31-Y172 PolarHBondContact N-OH 3.08Å
32	Q	81.2	Confident	79.8	Confident	116 Å²	116	76.7 Å²	76.7	54%	0.542	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	139	175.4	-69.3	-176.7	-24.1	0	0	107.9	V20 R30	V20-Q32 WeakPolarHBondContact CB-O 3.29Å; V20-Q32 PolarHBondContact N-O 3.4Å; V20-Q32 PolarHBondContact O-N 3.42Å; R30-Q32 PolarHBondContact O-N 3.36Å
33	R	86	Confident	80	Confident	163 Å²	163	80 Å²	80	62%	0.615	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	131.5	173.5	-176.5	177.3	64.2	-164.6	-1	109	W19	W19-R33 HydrophobicContact CE3-CB 4.3Å; W19-R33 HydrophobicContact CZ3-CB 4Å
34	G	87.1	Confident	80.4	Confident	2 Å²	2	75.7 Å²	75.7	2%	0.021	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	160.5	173.4	0	0	0	0	0	111.4	V18	V18-G34 PolarHBondContact N-O 2.88Å; V18-G34 PolarHBondContact O-N 2.83Å
35	T	88.5	Confident	80.9	Confident	54 Å²	54	68.7 Å²	68.7	33%	0.331	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.5	176.2	-48.7	0	0	0	0	109.6	T37 I47 D48	T35-T37 PolarHBondContact O-N 3.4Å; T35-I47 VanDerWaalsContact O-CA 3.31Å; T35-I47 WeakPolarHBondContact O-CA 3.36Å; T35-I47 WeakPolarHBondContact O-CG2 3.1Å; T35-D48 PolarHBondContact N-OD1 2.81Å; T35-D48 PolarHBondContact O-N 3.15Å; T35-D48 VanDerWaalsContact O-N 3.13Å
36	V	88.6	Confident	81.8	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.006	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	114.4	177.3	179.1	0	0	0	0	109.6	V13 G15 E16 V18 V39 V45 E46	V13-V36 WeakPolarHBondContact O-CB 3.34Å; G15-V36 PolarHBondContact N-O 3.1Å; E16-V36 HydrophobicContact CB-CG2 4.33Å; E16-V36 PolarHBondContact O-N 3.14Å; V18-V36 HydrophobicContact CG1-CG2 4.08Å; V18-V36 HydrophobicContact CG2-CG2 4.01Å; V36-V39 HydrophobicContact CG1-CG2 4.21Å; V36-V45 HydrophobicContact CB-CG1 4.21Å; V36-V45 HydrophobicContact CG1-CG1 3.47Å; V36-V45 VanDerWaalsContact CG1-CG1 3.47Å; V36-V45 HydrophobicContact CG2-CG1 3.82Å; V36-E46 CarbonylContact C-O 3.52Å; V36-E46 WeakPolarHBondContact CA-O 3.47Å
37	T	91	Very high	82.6	Confident	64 Å²	64	62 Å²	62	39%	0.393	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	-21.5	177.6	53.4	0	0	0	0	112.6	T35 E46 G49	T35-T37 PolarHBondContact O-N 3.4Å; T37-E46 PolarHBondContact N-O 2.87Å; T37-E46 WeakPolarHBondContact OG1-CB 3.12Å; T37-E46 PolarHBondContact OG1-O 2.98Å; T37-G49 PolarHBondContact OG1-N 2.96Å; T37-G49 VanDerWaalsContact OG1-N 3.16Å
38	G	86.9	Confident	83.7	Confident	11 Å²	11	64.5 Å²	64.5	11%	0.113	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	162.4	-176.7	0	0	0	0	0	112.3	E46	G38-E46 PolarHBondContact N-O 2.75Å; G38-E46 PolarHBondContact O-N 3.48Å
39	V	86.9	Confident	84.5	Confident	40 Å²	40	62.6 Å²	62.6	24%	0.242	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	86.6	175.1	-175.1	0	0	0	0	108.6	A10 V36 S41 V45	A10-V39 HydrophobicContact CB-CG1 3.84Å; V36-V39 HydrophobicContact CG1-CG2 4.21Å; V39-S41 WeakPolarHBondContact CG1-O 2.86Å; V39-S41 PolarHBondContact O-N 3.19Å; V39-V45 HydrophobicContact CG1-CG2 4.47Å; V39-V45 HydrophobicContact CG2-CG1 4.48Å
40	P	82.4	Confident	85.5	Confident	73 Å²	73	65.5 Å²	65.5	47%	0.474	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	-25.5	179.2	25.9	-35.7	0	0	0	112.7	A44 E46	P40-A44 WeakPolarHBondContact CD-O 3.23Å; P40-A44 HydrophobicContact CG-CB 4.12Å; P40-A44 WeakPolarHBondContact CG-O 2.77Å; P40-E46 HydrophobicContact CG-CG 4Å
41	S	82.9	Confident	86.1	Confident	57 Å²	57	61.9 Å²	61.9	40%	0.399	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	163.8	179.7	-169.6	0	0	0	0	112.6	V39 H43 A44	V39-S41 WeakPolarHBondContact CG1-O 2.86Å; V39-S41 PolarHBondContact O-N 3.19Å; S41-H43 PolarHBondContact O-N 2.91Å; S41-A44 PolarHBondContact N-O 2.77Å; S41-A44 VanDerWaalsContact N-O 3.14Å; S41-A44 CarbonylContact O-C 3.59Å; S41-A44 PolarHBondContact O-N 2.82Å; S41-A44 VanDerWaalsContact O-N 3.1Å
42	R	82	Confident	86.4	Confident	172 Å²	172	63 Å²	63	65%	0.649	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-24.7	173.8	70.9	177.9	-168.1	-104.9	4.8	114.5
43	H	84.7	Confident	86.6	Confident	85 Å²	85	61 Å²	61	39%	0.394	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109	-6.5	179.8	-53.1	133.1	0	0	0	113.6	S41 H53 V54	S41-H43 PolarHBondContact O-N 2.91Å; H43-H53 CarbonylContact O-C 3.52Å; H43-H53 WeakPolarHBondContact O-CA 3.37Å; H43-H53 PolarHBondContact O-CD2 2.63Å; H43-H53 VanDerWaalsContact O-CD2 3.3Å; H43-V54 HydrophobicContact CB-CG2 4.49Å; H43-V54 PolarHBondContact O-N 3.2Å
44	A	85.7	Confident	86.4	Confident	28 Å²	28	54.4 Å²	54.4	23%	0.231	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	125.1	-174.3	0	0	0	0	0	110.1	P40 S41 R52	P40-A44 WeakPolarHBondContact CD-O 3.23Å; P40-A44 HydrophobicContact CG-CB 4.12Å; P40-A44 WeakPolarHBondContact CG-O 2.77Å; S41-A44 PolarHBondContact N-O 2.77Å; S41-A44 VanDerWaalsContact N-O 3.14Å; S41-A44 CarbonylContact O-C 3.59Å; S41-A44 PolarHBondContact O-N 2.82Å; S41-A44 VanDerWaalsContact O-N 3.1Å; A44-R52 CarbonylContact C-O 3.51Å; A44-R52 VanDerWaalsContact CA-O 3.29Å; A44-R52 WeakPolarHBondContact CA-O 3.3Å
45	V	86.9	Confident	86.2	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.012	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.5	-177.2	178.2	0	0	0	0	107.4	Y12 V36 V39 I47 R52 V54 L57	Y12-V45 HydrophobicContact CD2-CG2 3.69Å; Y12-V45 HydrophobicContact CG-CG2 4.26Å; V36-V45 HydrophobicContact CB-CG1 4.21Å; V36-V45 HydrophobicContact CG1-CG1 3.47Å; V36-V45 VanDerWaalsContact CG1-CG1 3.47Å; V36-V45 HydrophobicContact CG2-CG1 3.82Å; V39-V45 HydrophobicContact CG1-CG2 4.47Å; V39-V45 HydrophobicContact CG2-CG1 4.48Å; V45-I47 HydrophobicContact CG1-CG1 4.26Å; V45-R52 PolarHBondContact N-O 2.86Å; V45-R52 PolarHBondContact O-N 2.88Å; V45-V54 HydrophobicContact CG2-CG1 3.79Å; V45-L57 HydrophobicContact CB-CD1 3.77Å; V45-L57 HydrophobicContact CG1-CD1 4.04Å; V45-L57 HydrophobicContact CG2-CD1 4.09Å
46	E	88.9	Confident	85.9	Confident	65 Å²	65	62.9 Å²	62.9	30%	0.304	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	129.9	173.7	-74.8	172.9	-170.7	0	0	109.9	V36 T37 G38 P40 P51	V36-E46 CarbonylContact C-O 3.52Å; V36-E46 WeakPolarHBondContact CA-O 3.47Å; T37-E46 PolarHBondContact N-O 2.87Å; T37-E46 WeakPolarHBondContact OG1-CB 3.12Å; T37-E46 PolarHBondContact OG1-O 2.98Å; G38-E46 PolarHBondContact N-O 2.75Å; G38-E46 PolarHBondContact O-N 3.48Å; P40-E46 HydrophobicContact CG-CG 4Å; E46-P51 HydrophobicContact CG-CB 4.37Å; E46-P51 HydrophobicContact CG-CG 4.02Å
47	I	88	Confident	85.6	Confident	7 Å²	7	62.9 Å²	62.9	4%	0.036	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	122.8	178.9	-57	-174.8	0	0	0	108	V18 V20 T35 V45 G49 I50 R52 L57	V18-I47 HydrophobicContact CG2-CD1 3.6Å; V18-I47 HydrophobicContact CG2-CG1 4.43Å; V20-I47 HydrophobicContact CB-CD1 4.45Å; V20-I47 HydrophobicContact CG1-CD1 4.13Å; V20-I47 HydrophobicContact CG2-CD1 3.48Å; V20-I47 VanDerWaalsContact CG2-CD1 3.48Å; V20-I47 HydrophobicContact CG2-CG2 3.98Å; T35-I47 VanDerWaalsContact O-CA 3.31Å; T35-I47 WeakPolarHBondContact O-CA 3.36Å; T35-I47 WeakPolarHBondContact O-CG2 3.1Å; V45-I47 HydrophobicContact CG1-CG1 4.26Å; I47-G49 PolarHBondContact O-N 2.73Å; I47-G49 VanDerWaalsContact O-N 3.11Å; I47-I50 PolarHBondContact N-O 3.34Å; I47-I50 PolarHBondContact O-N 2.96Å; I47-R52 HydrophobicContact CD1-CB 4.35Å; I47-R52 HydrophobicContact CD1-CG 4.46Å; I47-L57 HydrophobicContact CD1-CD1 3.79Å; I47-L57 HydrophobicContact CD1-CD2 3.13Å; I47-L57 HydrophobicContact CD1-CG 4.09Å; I47-L57 HydrophobicContact CG1-CD2 4.49Å
48	D	87.2	Confident	85.3	Confident	102 Å²	102	64.2 Å²	64.2	55%	0.545	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	50	35.4	-175.7	-53.1	-45.2	0	0	0	111.9	T35 I50	T35-D48 PolarHBondContact N-OD1 2.81Å; T35-D48 PolarHBondContact O-N 3.15Å; T35-D48 VanDerWaalsContact O-N 3.13Å; D48-I50 VanDerWaalsContact C-N 3.34Å; D48-I50 PolarHBondContact O-N 3.03Å
49	G	87.6	Confident	85	Confident	53 Å²	53	67.9 Å²	67.9	55%	0.546	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	2.3	-177.3	0	0	0	0	0	115.8	T37 I47	T37-G49 PolarHBondContact OG1-N 2.96Å; T37-G49 VanDerWaalsContact OG1-N 3.16Å; I47-G49 PolarHBondContact O-N 2.73Å; I47-G49 VanDerWaalsContact O-N 3.11Å
50	I	86.6	Confident	84.1	Confident	92 Å²	92	69.1 Å²	69.1	47%	0.472	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121	178.2	-44.7	174.7	0	0	0	110.5	I47 D48 R52	I47-I50 PolarHBondContact N-O 3.34Å; I47-I50 PolarHBondContact O-N 2.96Å; D48-I50 VanDerWaalsContact C-N 3.34Å; D48-I50 PolarHBondContact O-N 3.03Å; I50-R52 PolarHBondContact O-N 3.42Å
51	P	88.5	Confident	83	Confident	81 Å²	81	73.2 Å²	73.2	53%	0.526	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	131.5	173.7	-22.6	32.3	0	0	0	112.4	E46	E46-P51 HydrophobicContact CG-CB 4.37Å; E46-P51 HydrophobicContact CG-CG 4.02Å
52	R	86.4	Confident	81.4	Confident	55 Å²	55	74.9 Å²	74.9	21%	0.208	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	151.5	177.4	-72.4	-62.5	-155.7	-79	-5.4	110.9	V20 A44 V45 I47 I50 L57	V20-R52 HydrophobicContact CG1-CG 4.2Å; A44-R52 CarbonylContact C-O 3.51Å; A44-R52 VanDerWaalsContact CA-O 3.29Å; A44-R52 WeakPolarHBondContact CA-O 3.3Å; V45-R52 PolarHBondContact N-O 2.86Å; V45-R52 PolarHBondContact O-N 2.88Å; I47-R52 HydrophobicContact CD1-CB 4.35Å; I47-R52 HydrophobicContact CD1-CG 4.46Å; I50-R52 PolarHBondContact O-N 3.42Å; R52-L57 HydrophobicContact CB-CD2 4.26Å
53	H	86	Confident	79.7	Confident	74 Å²	74	70.9 Å²	70.9	34%	0.343	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	141.9	177.4	-170.2	-91	0	0	0	110.5	H43 R55 D56	H43-H53 CarbonylContact O-C 3.52Å; H43-H53 WeakPolarHBondContact O-CA 3.37Å; H43-H53 PolarHBondContact O-CD2 2.63Å; H43-H53 VanDerWaalsContact O-CD2 3.3Å; H53-R55 WeakPolarHBondContact ND1-CB 3.43Å; H53-R55 PolarHBondContact ND1-N 3.16Å; H53-R55 VanDerWaalsContact ND1-N 3.16Å; H53-R55 PolarHBondContact O-N 3.3Å; H53-D56 VanDerWaalsContact O-CB 3.3Å; H53-D56 WeakPolarHBondContact O-CB 3.49Å; H53-D56 PolarHBondContact O-N 3.06Å
54	V	82.4	Confident	77.6	Confident	25 Å²	25	72.8 Å²	72.8	15%	0.152	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-55.1	-27.6	-179.4	-68.8	0	0	0	0	114.3	P11 Y12 H43 V45 D56 L57	P11-V54 HydrophobicContact CG-CG1 4.25Å; Y12-V54 HydrophobicContact CD2-CG1 4.11Å; Y12-V54 HydrophobicContact CE2-CB 4.06Å; Y12-V54 HydrophobicContact CE2-CG1 3.9Å; H43-V54 HydrophobicContact CB-CG2 4.49Å; H43-V54 PolarHBondContact O-N 3.2Å; V45-V54 HydrophobicContact CG2-CG1 3.79Å; V54-D56 VanDerWaalsContact C-N 3.27Å; V54-D56 PolarHBondContact O-N 2.74Å; V54-L57 WeakPolarHBondContact O-CB 3.39Å; V54-L57 PolarHBondContact O-N 2.99Å
55	R	82.4	Confident	75.4	Confident	187 Å²	187	80.2 Å²	80.2	71%	0.706	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-68.2	-25.6	176.2	-70.5	176.6	-179.6	-176.7	-0.8	113.9	H53 L57 R58	H53-R55 WeakPolarHBondContact ND1-CB 3.43Å; H53-R55 PolarHBondContact ND1-N 3.16Å; H53-R55 VanDerWaalsContact ND1-N 3.16Å; H53-R55 PolarHBondContact O-N 3.3Å; R55-L57 PolarHBondContact O-N 2.92Å; R55-R58 PolarHBondContact O-NH1 2.95Å
56	D	82.9	Confident	73.2	Confident	46 Å²	46	84.6 Å²	84.6	25%	0.246	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-80.4	-4	177.6	-65.3	-30.6	0	0	0	111.6	K21 H53 V54	K21-D56 HydrophobicContact CB-CB 3.84Å; K21-D56 WeakPolarHBondContact CB-O 3.23Å; K21-D56 PolarHBondContact N-O 2.93Å; H53-D56 VanDerWaalsContact O-CB 3.3Å; H53-D56 WeakPolarHBondContact O-CB 3.49Å; H53-D56 PolarHBondContact O-N 3.06Å; V54-D56 VanDerWaalsContact C-N 3.27Å; V54-D56 PolarHBondContact O-N 2.74Å
57	L	82.1	Confident	70.8	Confident	2 Å²	2	91.5 Å²	91.5	1%	0.01	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	148.8	-176.3	-51	-173	0	0	0	111.8	Y12 W19 V20 V45 I47 R52 V54 R55	Y12-L57 HydrophobicContact CD2-CD1 4.12Å; Y12-L57 HydrophobicContact CE1-CB 4.11Å; Y12-L57 HydrophobicContact CE1-CD1 4.4Å; Y12-L57 HydrophobicContact CE2-CB 4.13Å; Y12-L57 HydrophobicContact CE2-CD1 3.89Å; Y12-L57 HydrophobicContact CG-CD1 4.46Å; Y12-L57 WeakPolarHBondContact OH-CB 3.29Å; W19-L57 CarbonylContact O-C 3.54Å; W19-L57 WeakPolarHBondContact O-CA 3.38Å; V20-L57 HydrophobicContact CB-CD2 4.31Å; V20-L57 HydrophobicContact CG1-CD2 3.96Å; V20-L57 HydrophobicContact CG2-CD2 4.04Å; V45-L57 HydrophobicContact CB-CD1 3.77Å; V45-L57 HydrophobicContact CG1-CD1 4.04Å; V45-L57 HydrophobicContact CG2-CD1 4.09Å; I47-L57 HydrophobicContact CD1-CD1 3.79Å; I47-L57 HydrophobicContact CD1-CD2 3.13Å; I47-L57 HydrophobicContact CD1-CG 4.09Å; I47-L57 HydrophobicContact CG1-CD2 4.49Å; R52-L57 HydrophobicContact CB-CD2 4.26Å; V54-L57 WeakPolarHBondContact O-CB 3.39Å; V54-L57 PolarHBondContact O-N 2.99Å; R55-L57 PolarHBondContact O-N 2.92Å
58	R	84.7	Confident	68.5	Low	92 Å²	92	99.3 Å²	99.3	35%	0.347	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	139.3	169.5	-61.4	-71	179.7	-88.6	-2.1	107.7	W19 Y31 R55 R60	W19-R58 HydrophobicContact CB-CB 3.98Å; W19-R58 PolarHBondContact N-O 3.45Å; W19-R58 PolarHBondContact O-N 3.24Å; Y31-R58 HydrophobicContact CD1-CG 4.27Å; Y31-R58 HydrophobicContact CE1-CG 3.73Å; R55-R58 PolarHBondContact O-NH1 2.95Å; R58-R60 PolarHBondContact O-N 2.87Å
59	H	80.5	Confident	66	Low	87 Å²	87	103.3 Å²	103.3	40%	0.403	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	139.3	172.9	-71.8	-78.9	0	0	0	109.6	P11 Y12 E16 L61	P11-H59 PolarHBondContact O-CE1 2.89Å; P11-H59 PolarHBondContact O-NE2 3.02Å; Y12-H59 AromaticContact CD1-CE1 3.68Å; Y12-H59 AromaticContact CE1-CE1 3.46Å; Y12-H59 VanDerWaalsContact CE1-CE1 3.46Å; Y12-H59 WeakPolarHBondContact CE1-CE1 3.36Å; Y12-H59 AromaticContact CE1-ND1 3.84Å; Y12-H59 AromaticContact CE1-NE2 3.65Å; E16-H59 IonicContact OE1-CE1 2.63Å; E16-H59 PolarHBondContact OE1-CE1 2.93Å; E16-H59 IonicContact OE1-CG 3.54Å; E16-H59 IonicContact OE1-ND1 3.79Å; E16-H59 PolarHBondContact OE1-ND1 3.4Å; H59-L61 PolarHBondContact O-N 3.19Å
60	R	67.3	Low	63.5	Low	67 Å²	67	105.4 Å²	105.4	25%	0.253	52%	0.517	S	S	.	.			trans	-74.5	110.7	160.1	-170.2	176.6	-171.6	-150.5	-2.3	105.9	K17 R58 E62	K17-R60 VanDerWaalsContact CD-NH1 3.35Å; K17-R60 WeakPolarHBondContact O-CB 3.31Å; R58-R60 PolarHBondContact O-N 2.87Å; R60-E62 WeakPolarHBondContact CD-OE1 3.17Å; R60-E62 HydrophobicContact CG-CG 4.45Å; R60-E62 IonicContact CZ-OE1 3.71Å; R60-E62 IonicContact NE-OE1 3.36Å; R60-E62 IonicContact NH1-OE1 3.69Å; R60-E62 PolarHBondContact NH1-OE1 2.84Å; R60-E62 IonicContact NH1-OE2 2.83Å; R60-E62 PolarHBondContact O-N 3.09Å
61	L	58.5	Low	61.1	Low	158 Å²	158	108.7 Å²	108.7	83%	0.827	53%	0.53	S	S	*	.			trans	-65.5	95.4	154.7	-65	174	0	0	0	104.3	H59	H59-L61 PolarHBondContact O-N 3.19Å
62	E	50.3	Low	59.1	Low	92 Å²	92	111.1 Å²	111.1	43%	0.43	55%	0.546	S	S	.	.			trans	-57.1	129.3	163.1	-69.7	-94.2	152.2	0	0	105	R60 E64	R60-E62 WeakPolarHBondContact CD-OE1 3.17Å; R60-E62 HydrophobicContact CG-CG 4.45Å; R60-E62 IonicContact CZ-OE1 3.71Å; R60-E62 IonicContact NE-OE1 3.36Å; R60-E62 IonicContact NH1-OE1 3.69Å; R60-E62 PolarHBondContact NH1-OE1 2.84Å; R60-E62 IonicContact NH1-OE2 2.83Å; R60-E62 PolarHBondContact O-N 3.09Å; E62-E64 PolarHBondContact O-N 3.47Å
63	P	45.7	Very low	57	Low	88 Å²	88	116.7 Å²	116.7	57%	0.571	58%	0.575	S	S	*	*			trans	-57.4	114.9	158.5	25.6	-28.1	0	0	0	104.6	E65	P63-E65 PolarHBondContact O-N 3.01Å
64	E	40.2	Very low	55	Low	126 Å²	126	121 Å²	121	59%	0.589	60%	0.6	S	S	*	*			trans	-59.5	80	175.7	-77.9	-80.9	146.2	0	0	109.1	E62 S66 R67	E62-E64 PolarHBondContact O-N 3.47Å; E64-S66 PolarHBondContact O-N 2.85Å; E64-S66 VanDerWaalsContact O-N 3.15Å; E64-R67 HydrophobicContact CB-CG 4.03Å; E64-R67 HydrophobicContact CG-CG 4.45Å
65	E	40.4	Very low	53.2	Low	184 Å²	184	127.2 Å²	127.2	86%	0.86	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	15.8	163	-63.8	-170.7	137.5	0	0	110.5	P63	P63-E65 PolarHBondContact O-N 3.01Å
66	S	39.8	Very low	51.5	Low	94 Å²	94	122 Å²	122	66%	0.657	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133	16.4	-179.6	-51.1	0	0	0	0	113.7	E64 E68	E64-S66 PolarHBondContact O-N 2.85Å; E64-S66 VanDerWaalsContact O-N 3.15Å; S66-E68 PolarHBondContact O-N 3.26Å
67	R	40.3	Very low	50	Low	210 Å²	210	128 Å²	128	79%	0.792	66%	0.657	S	S	*	*			trans	-70.9	76.6	156.8	-82.3	-177.8	179.1	-174.7	-0.7	109	E64 Q69	E64-R67 HydrophobicContact CB-CG 4.03Å; E64-R67 HydrophobicContact CG-CG 4.45Å; R67-Q69 PolarHBondContact O-N 2.69Å
68	E	38.8	Very low	48.6	Very low	171 Å²	171	133.4 Å²	133.4	80%	0.799	69%	0.686	S	S	*	*			trans	-50.5	105.8	158.2	-74	175	133.3	0	0	108.1	S66 A70	S66-E68 PolarHBondContact O-N 3.26Å; E68-A70 PolarHBondContact O-N 2.92Å
69	Q	34.5	Very low	47	Very low	186 Å²	186	136.9 Å²	136.9	87%	0.869	71%	0.706	S	S	*	*			trans	45.8	62.7	147	-55.5	178.5	-80.2	0	0	116	R67	R67-Q69 PolarHBondContact O-N 2.69Å
70	A	35.6	Very low	45.8	Very low	96 Å²	96	140.3 Å²	140.3	79%	0.793	73%	0.726	S	S	*	*			trans	-96.3	105.6	150.1	0	0	0	0	0	106.6	E68	E68-A70 PolarHBondContact O-N 2.92Å
71	Q	36.3	Very low	45.1	Very low	161 Å²	161	140.2 Å²	140.2	75%	0.752	73%	0.733	S	S	*	*			trans	-53.7	141.3	-178.8	-62.9	-174.5	-98.7	0	0	110	E73	Q71-E73 VanDerWaalsContact C-N 3.32Å; Q71-E73 WeakPolarHBondContact O-CG 2.92Å; Q71-E73 PolarHBondContact O-N 2.84Å
72	P	45.2	Very low	44.9	Very low	132 Å²	132	138.8 Å²	138.8	86%	0.857	73%	0.726	S	S	*	*			trans	-67.3	98.2	168.3	28.3	-30.4	0	0	0	107.2	D74	P72-D74 PolarHBondContact O-N 3.29Å; P72-D74 VanDerWaalsContact O-N 3.15Å
73	E	44.1	Very low	44.5	Very low	173 Å²	173	142.2 Å²	142.2	81%	0.808	74%	0.741	S	S	*	*			trans	-74.8	101.1	172.5	-47.2	-161.2	-157.9	0	0	106.6	Q71 D75	Q71-E73 VanDerWaalsContact C-N 3.32Å; Q71-E73 WeakPolarHBondContact O-CG 2.92Å; Q71-E73 PolarHBondContact O-N 2.84Å; E73-D75 PolarHBondContact O-N 2.75Å
74	D	42.9	Very low	45.1	Very low	164 Å²	164	144.8 Å²	144.8	88%	0.877	74%	0.744	S	S	*	*			trans	-4.9	87.5	157.1	-168.9	28.3	0	0	0	115	P72	P72-D74 PolarHBondContact O-N 3.29Å; P72-D74 VanDerWaalsContact O-N 3.15Å
75	D	44.8	Very low	45.3	Very low	155 Å²	155	143.3 Å²	143.3	83%	0.829	75%	0.753	S	S	*	*			trans	-154.5	101.7	157.7	-151	5.1	0	0	0	109.7	E73	E73-D75 PolarHBondContact O-N 2.75Å
76	S	47.3	Very low	45.4	Very low	79 Å²	79	143 Å²	143	55%	0.552	75%	0.751	S	S	*	*			trans	36.5	107.9	167.7	-147.9	0	0	0	0	117.7	D78	S76-D78 PolarHBondContact O-N 2.71Å; S76-D78 PolarHBondContact OG-OD1 3.31Å
77	D	50.9	Low	45.8	Very low	170 Å²	170	144.2 Å²	144.2	91%	0.909	76%	0.757	S	S	*	*			trans	-62.5	70	155.6	-126.1	-17.1	0	0	0	108.7	E79	D77-E79 PolarHBondContact O-N 3.31Å
78	D	53.6	Low	45.8	Very low	117 Å²	117	143.7 Å²	143.7	63%	0.626	76%	0.76	S	S	*	*			trans	-72.8	85.3	167.4	-73.6	-16.3	0	0	0	106.2	S76 L80	S76-D78 PolarHBondContact O-N 2.71Å; S76-D78 PolarHBondContact OG-OD1 3.31Å; D78-L80 VanDerWaalsContact C-N 3.35Å; D78-L80 PolarHBondContact O-N 3.49Å
79	E	50.7	Low	46.1	Very low	164 Å²	164	140.6 Å²	140.6	77%	0.766	76%	0.764	S	S	*	*			trans	-44	103.2	163.2	-169.3	-173	155.2	0	0	107	D77 V81	D77-E79 PolarHBondContact O-N 3.31Å; E79-V81 HydrophobicContact CB-CG2 4.13Å; E79-V81 VanDerWaalsContact CD-CG2 3.41Å; E79-V81 HydrophobicContact CG-CG2 3.48Å; E79-V81 VanDerWaalsContact CG-CG2 3.48Å; E79-V81 PolarHBondContact O-N 3.08Å; E79-V81 WeakPolarHBondContact OE1-CG2 3.36Å
80	L	55.7	Low	46.4	Very low	160 Å²	160	140.4 Å²	140.4	84%	0.838	76%	0.763	S	S	*	*			trans	-71.9	70.5	177.3	-68	178.2	0	0	0	108.3	D78 L82	D78-L80 VanDerWaalsContact C-N 3.35Å; D78-L80 PolarHBondContact O-N 3.49Å; L80-L82 PolarHBondContact O-N 3.34Å; L80-L82 VanDerWaalsContact O-N 3.14Å
81	V	51.4	Low	46.8	Very low	64 Å²	64	141.5 Å²	141.5	39%	0.388	77%	0.765	S	S	.	*			trans	-72.7	105.6	171.2	-171.4	0	0	0	0	107	E79 H83	E79-V81 HydrophobicContact CB-CG2 4.13Å; E79-V81 VanDerWaalsContact CD-CG2 3.41Å; E79-V81 HydrophobicContact CG-CG2 3.48Å; E79-V81 VanDerWaalsContact CG-CG2 3.48Å; E79-V81 PolarHBondContact O-N 3.08Å; E79-V81 WeakPolarHBondContact OE1-CG2 3.36Å; V81-H83 VanDerWaalsContact CG1-NE2 3.31Å; V81-H83 WeakPolarHBondContact CG1-NE2 3.42Å; V81-H83 PolarHBondContact O-N 3.29Å
82	L	55.6	Low	47	Very low	129 Å²	129	141.9 Å²	141.9	68%	0.675	77%	0.769	S	S	*	*			trans	-67.6	88.2	166.4	-117	85.2	0	0	0	108.6	L80 F84	L80-L82 PolarHBondContact O-N 3.34Å; L80-L82 VanDerWaalsContact O-N 3.14Å; L82-F84 HydrophobicContact CB-CE2 4.18Å; L82-F84 HydrophobicContact CB-CZ 4.32Å; L82-F84 HydrophobicContact CD2-CE1 3.89Å; L82-F84 HydrophobicContact CD2-CE2 4.17Å; L82-F84 HydrophobicContact CD2-CZ 3.47Å; L82-F84 VanDerWaalsContact CD2-CZ 3.47Å; L82-F84 HydrophobicContact CG-CZ 4.43Å; L82-F84 PolarHBondContact O-N 2.73Å
83	H	41.1	Very low	46.8	Very low	163 Å²	163	141.2 Å²	141.2	76%	0.755	76%	0.764	S	S	*	*			trans	-75.7	102.6	170.8	-74.9	-77.8	0	0	0	109.9	V81 A85	V81-H83 VanDerWaalsContact CG1-NE2 3.31Å; V81-H83 WeakPolarHBondContact CG1-NE2 3.42Å; V81-H83 PolarHBondContact O-N 3.29Å; H83-A85 PolarHBondContact O-N 2.98Å
84	F	57.7	Low	46.9	Very low	143 Å²	143	143.4 Å²	143.4	63%	0.627	77%	0.765	S	S	*	*			trans	-75.1	109	166.7	-59.4	-78	0	0	0	109	L82 H86	L82-F84 HydrophobicContact CB-CE2 4.18Å; L82-F84 HydrophobicContact CB-CZ 4.32Å; L82-F84 HydrophobicContact CD2-CE1 3.89Å; L82-F84 HydrophobicContact CD2-CE2 4.17Å; L82-F84 HydrophobicContact CD2-CZ 3.47Å; L82-F84 VanDerWaalsContact CD2-CZ 3.47Å; L82-F84 HydrophobicContact CG-CZ 4.43Å; L82-F84 PolarHBondContact O-N 2.73Å; F84-H86 PolarHBondContact O-N 3.4Å; F84-H86 VanDerWaalsContact O-N 3.08Å
85	A	45.4	Very low	46.8	Very low	94 Å²	94	143.1 Å²	143.1	78%	0.777	76%	0.758	S	S	*	*			trans	-65.9	107.7	173	0	0	0	0	0	109.3	H83 P87	H83-A85 PolarHBondContact O-N 2.98Å; A85-P87 WeakPolarHBondContact O-CD 3.37Å
86	H	41.6	Very low	47.1	Very low	178 Å²	178	144.8 Å²	144.8	82%	0.824	76%	0.761	S	S	*	*			trans	-59.7	116.1	170.2	-80.6	144.2	0	0	0	109.6	F84 K88	F84-H86 PolarHBondContact O-N 3.4Å; F84-H86 VanDerWaalsContact O-N 3.08Å; H86-K88 PolarHBondContact O-N 2.69Å
87	P	48.3	Very low	47.3	Very low	119 Å²	119	149.3 Å²	149.3	77%	0.773	77%	0.774	S	S	*	*			trans	-68.3	120.8	171.9	27.8	-30.8	0	0	0	108.6	A85 A89	A85-P87 WeakPolarHBondContact O-CD 3.37Å; P87-A89 PolarHBondContact O-N 2.53Å; P87-A89 VanDerWaalsContact O-N 3.14Å
88	K	41.3	Very low	46.9	Very low	199 Å²	199	146.9 Å²	146.9	87%	0.865	77%	0.767	S	S	*	*			trans	-62.9	113.3	176.3	-149	170.8	-170.4	172.8	0	108	H86 Q90	H86-K88 PolarHBondContact O-N 2.69Å; K88-Q90 PolarHBondContact O-N 3.15Å
89	A	44.1	Very low	46.1	Very low	106 Å²	106	148.6 Å²	148.6	88%	0.876	78%	0.775	S	S	*	*			trans	-53.8	108.4	-178	0	0	0	0	0	111.4	P87	P87-A89 PolarHBondContact O-N 2.53Å; P87-A89 VanDerWaalsContact O-N 3.14Å
90	Q	41.7	Very low	45.7	Very low	182 Å²	182	147.5 Å²	147.5	85%	0.85	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-91.5	118.6	165.8	-68.9	-175	-11.4	0	0	107.4	K88 M92	K88-Q90 PolarHBondContact O-N 3.15Å; Q90-M92 PolarHBondContact O-N 2.82Å
91	S	43.4	Very low	44.6	Very low	120 Å²	120	146.4 Å²	146.4	84%	0.839	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-60.1	120	175.4	52.9	0	0	0	0	110.6
92	M	40.9	Very low	43.6	Very low	169 Å²	169	148.4 Å²	148.4	83%	0.833	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-73.8	139.7	171.3	-75	-64.2	-65.7	0	0	110.8	Q90	Q90-M92 PolarHBondContact O-N 2.82Å
93	P	41.2	Very low	42.5	Very low	117 Å²	117	148.2 Å²	148.2	76%	0.76	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-72.2	144.2	178.2	29	-31.6	0	0	0	111.6
94	R	44.5	Very low	42.1	Very low	219 Å²	219	148.7 Å²	148.7	83%	0.826	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-81	133.6	-179.3	-106.8	174.7	170.2	176.7	-1.4	111.3
95	E	41.3	Very low	40.6	Very low	158 Å²	158	144.5 Å²	144.5	74%	0.738	81%	0.806	S	S	*	*			trans	75.9	125.8	151.3	-57.3	160	-140.4	0	0	113.4
96	E	50.9	Low	40.1	Very low	191 Å²	191	148.9 Å²	148.9	89%	0.893	81%	0.81	S	S	*	*				-163.2	152.4	67.9	-67.5	-175.2	132.1	0	0	113.6
97	E	52.1	Low	39.9	Very low	173 Å²	173	148.7 Å²	148.7	81%	0.808	81%	0.807	S	S	*	*			trans	75.9	114.3	157.3	-104.1	-165.5	127.4	0	0	123.5
98	P	43	Very low	39.2	Very low	119 Å²	119	151.5 Å²	151.5	77%	0.773	81%	0.81	S	S	*	*			trans	-109.1	112.8	174.2	36.1	-22.5	0	0	0	112.6
99	L	36.1	Very low	39	Very low	153 Å²	153	147.7 Å²	147.7	80%	0.801	80%	0.804	S	S	*	*			trans	-144.4	76.7	165.2	-72.2	178.5	0	0	0	111.2
100	T	42.1	Very low	38.6	Very low	142 Å²	142	148.5 Å²	148.5	87%	0.871	79%	0.793	S	S	*	*			trans	-153	114.1	144.9	-26.4	0	0	0	0	110.7	C102	T100-C102 PolarHBondContact O-N 2.73Å
101	T	32.7	Very low	38.4	Very low	137 Å²	137	142 Å²	142	84%	0.84	77%	0.766	S	S	*	*			trans	-56.4	121	169.8	-110.5	0	0	0	0	109.9
102	C	31.5	Very low	38.2	Very low	105 Å²	105	140.2 Å²	140.2	71%	0.709	76%	0.758	S	S	*	*			trans	-130.1	135.6	145.9	-79.4	0	0	0	0	105.1	T100 I104	T100-C102 PolarHBondContact O-N 2.73Å; C102-I104 PolarHBondContact O-N 2.64Å
103	P	32.3	Very low	38.2	Very low	126 Å²	126	136.7 Å²	136.7	82%	0.818	74%	0.736	S	S	*	*			trans	-61.1	118.9	-173.6	26.3	-32.3	0	0	0	108.7	G105	P103-G105 PolarHBondContact O-N 3.21Å
104	I	32.4	Very low	38.5	Very low	173 Å²	173	134.8 Å²	134.8	89%	0.887	72%	0.719	S	S	*	*			trans	-64.6	82.2	160	-62.8	165.9	0	0	0	105.1	C102	C102-I104 PolarHBondContact O-N 2.64Å
105	G	25.5	Very low	38.6	Very low	55 Å²	55	132.8 Å²	132.8	57%	0.567	72%	0.716	S	S	*	*			trans	-98	110.5	161.9	0	0	0	0	0	106.8	P103	P103-G105 PolarHBondContact O-N 3.21Å
106	E	36.3	Very low	38.9	Very low	185 Å²	185	129.3 Å²	129.3	86%	0.864	70%	0.703	S	S	*	*	S	Bend	trans	58	64.6	152	-57.3	175.8	161.7	0	0	116
107	F	36.5	Very low	39	Very low	174 Å²	174	121.4 Å²	121.4	76%	0.763	67%	0.668	S	S	*	*			trans	-132.8	35.9	151.5	-137.8	-93.2	0	0	0	111.2	L110	F107-L110 HydrophobicContact CE1-CD2 4.26Å; F107-L110 HydrophobicContact CE1-CG 4.22Å; F107-L110 HydrophobicContact CZ-CD2 4.44Å
108	E	33.4	Very low	39.2	Very low	178 Å²	178	117.9 Å²	117.9	83%	0.832	65%	0.654	S	S	*	*			trans	-87.7	145.7	145.9	-63.3	-158.1	169.1	0	0	106.4
109	V	38.1	Very low	39.7	Very low	120 Å²	120	120 Å²	120	73%	0.727	65%	0.647	S	S	*	*			trans	83.1	60	-171.6	-155	0	0	0	0	113.5	P111	V109-P111 HydrophobicContact CG1-CB 3.8Å; V109-P111 WeakPolarHBondContact O-CD 3.48Å; V109-P111 VanDerWaalsContact O-N 3.14Å
110	L	35.8	Very low	40.7	Very low	123 Å²	123	115.4 Å²	115.4	64%	0.644	63%	0.625	S	S	*	*				-60.6	106.2	127.3	-79.1	178.1	0	0	0	103.9	F107 A112	F107-L110 HydrophobicContact CE1-CD2 4.26Å; F107-L110 HydrophobicContact CE1-CG 4.22Å; F107-L110 HydrophobicContact CZ-CD2 4.44Å; L110-A112 PolarHBondContact O-N 3.43Å
111	P	37.9	Very low	41.5	Very low	46 Å²	46	116.8 Å²	116.8	30%	0.299	62%	0.615	S	S	.	*			trans	-60.9	141.5	-168.3	26.9	-32.6	0	0	0	106.6	V109 R113 L114	V109-P111 HydrophobicContact CG1-CB 3.8Å; V109-P111 WeakPolarHBondContact O-CD 3.48Å; V109-P111 VanDerWaalsContact O-N 3.14Å; P111-R113 HydrophobicContact CB-CB 3.89Å; P111-R113 HydrophobicContact CB-CG 3.81Å; P111-R113 HydrophobicContact CG-CB 4.11Å; P111-R113 PolarHBondContact O-N 2.05Å; P111-L114 PolarHBondContact O-N 3.21Å
112	A	37.3	Very low	42.7	Very low	81 Å²	81	115.6 Å²	115.6	67%	0.669	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.8	10.4	168.2	0	0	0	0	0	114.2	L110	L110-A112 PolarHBondContact O-N 3.43Å
113	R	41	Very low	44.1	Very low	96 Å²	96	111.4 Å²	111.4	36%	0.362	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95	-3.1	-179.7	-55.1	-179.6	90.2	-177.4	6.2	113.5	P111 K115 D116 E134	P111-R113 HydrophobicContact CB-CB 3.89Å; P111-R113 HydrophobicContact CB-CG 3.81Å; P111-R113 HydrophobicContact CG-CB 4.11Å; P111-R113 PolarHBondContact O-N 2.05Å; R113-K115 PolarHBondContact O-N 3.37Å; R113-D116 PolarHBondContact O-N 3.33Å; R113-E134 WeakPolarHBondContact CB-OE2 3.34Å; R113-E134 VanDerWaalsContact CG-OE2 3.32Å; R113-E134 WeakPolarHBondContact CG-OE2 2.99Å; R113-E134 IonicContact CZ-OE1 3.31Å; R113-E134 IonicContact CZ-OE2 2.75Å; R113-E134 IonicContact NE-OE1 2.73Å; R113-E134 PolarHBondContact NE-OE1 2.94Å; R113-E134 IonicContact NE-OE2 2.71Å; R113-E134 PolarHBondContact NE-OE2 2.76Å; R113-E134 IonicContact NH2-OE1 3.34Å; R113-E134 PolarHBondContact NH2-OE1 3.33Å; R113-E134 IonicContact NH2-OE2 3.42Å
114	L	48.2	Very low	45.1	Very low	76 Å²	76	117.4 Å²	117.4	40%	0.398	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-68.5	-10.8	172.7	-133.3	93.5	0	0	0	113.2	P111 D116 C117	P111-L114 PolarHBondContact O-N 3.21Å; L114-D116 PolarHBondContact O-N 3.46Å; L114-C117 VanDerWaalsContact CA-SG 3.55Å; L114-C117 PolarHBondContact O-N 3.19Å; L114-C117 PolarHBondContact O-SG 2.97Å
115	K	47.3	Very low	46.4	Very low	178 Å²	178	115.6 Å²	115.6	77%	0.774	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-69.6	-15.4	179.7	-53.6	-177.7	-172.7	-176.7	0	112.9	R113	R113-K115 PolarHBondContact O-N 3.37Å
116	D	46.1	Very low	48.1	Very low	85 Å²	85	114 Å²	114	46%	0.455	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-110.7	14	-178.5	-59	-29.6	0	0	0	112.6	R113 L114 L118	R113-D116 PolarHBondContact O-N 3.33Å; L114-D116 PolarHBondContact O-N 3.46Å; D116-L118 PolarHBondContact O-N 3.3Å
117	C	54.5	Low	49.1	Very low	25 Å²	25	107.7 Å²	107.7	17%	0.169	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	115.2	174.7	-53.7	0	0	0	0	109.1	L114 I130 Y131 C132	L114-C117 VanDerWaalsContact CA-SG 3.55Å; L114-C117 PolarHBondContact O-N 3.19Å; L114-C117 PolarHBondContact O-SG 2.97Å; C117-I130 HydrophobicContact CB-CG2 4.27Å; C117-Y131 WeakPolarHBondContact CA-O 3.46Å; C117-C132 HydrophobicContact CB-CB 4.15Å; C117-C132 WeakPolarHBondContact CB-SG 3.1Å; C117-C132 WeakPolarHBondContact SG-CB 3.32Å; C117-C132 CovalentContact SG-SG 2.05Å; C117-C132 PolarHBondContact SG-SG 3.12Å
118	L	56.1	Low	50	Low	99 Å²	99	100 Å²	100	52%	0.518	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-22.5	-167.1	-166.6	73.7	0	0	0	111.3	D116 Y131 P171	D116-L118 PolarHBondContact O-N 3.3Å; L118-Y131 PolarHBondContact N-O 2.92Å; L118-P171 HydrophobicContact CD2-CG 4.08Å
119	W	52.5	Low	51.3	Low	162 Å²	162	93.3 Å²	93.3	61%	0.614	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.4	135.9	-175.4	-69	78.3	0	0	0	112.8	Y131	W119-Y131 HydrophobicContact CB-CD2 4.03Å; W119-Y131 PolarHBondContact O-N 3.36Å
120	V	58.3	Low	52.5	Low	57 Å²	57	88.3 Å²	88.3	35%	0.345	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.6	170.6	-179.5	0	0	0	0	107.7	L128 I129 I130 I157	V120-L128 HydrophobicContact CG1-CD1 3.36Å; V120-L128 HydrophobicContact CG1-CG 4.21Å; V120-I129 WeakPolarHBondContact CA-O 3.43Å; V120-I130 HydrophobicContact CG2-CG2 4.48Å; V120-I157 HydrophobicContact CG2-CG2 4.32Å
121	R	58.7	Low	53.4	Low	172 Å²	172	87 Å²	87	65%	0.649	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.6	136.2	175.3	-173.4	179	171.9	106.7	1.6	111.3	I129	R121-I129 PolarHBondContact N-O 3.18Å; R121-I129 PolarHBondContact O-N 3.31Å
122	F	57.9	Low	54.2	Low	112 Å²	112	85.9 Å²	85.9	49%	0.491	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	119.3	168.9	-147.3	-99.4	0	0	0	110.2	L128	F122-L128 HydrophobicContact CD2-CD1 4.38Å
123	G	59.9	Low	54.8	Low	16 Å²	16	85.3 Å²	85.3	17%	0.165	40%	0.395	C	S	.	.			trans	-76.4	153.5	172.6	0	0	0	0	0	111.4	N125 G126 H127	G123-N125 PolarHBondContact O-N 3.22Å; G123-G126 PolarHBondContact O-N 2.97Å; G123-H127 PolarHBondContact N-O 3.21Å
124	R	54.6	Low	55.1	Low	252 Å²	252	84.7 Å²	84.7	95%	0.951	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-10.9	-179.3	-71.7	-179.8	173.6	162.7	-2.8	114.8
125	N	59.7	Low	54.7	Low	135 Å²	135	85.4 Å²	85.4	72%	0.722	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	21	-175.9	-59.5	-15.6	0	0	0	113.6	G123 H127	G123-N125 PolarHBondContact O-N 3.22Å; N125-H127 VanDerWaalsContact C-N 3.27Å; N125-H127 PolarHBondContact O-N 2.53Å
126	G	59.7	Low	54.4	Low	21 Å²	21	82.9 Å²	82.9	22%	0.216	39%	0.389	C	S	.	.	S	Bend	trans	75.9	15.3	-176.4	0	0	0	0	0	114.3	G123 L143	G123-G126 PolarHBondContact O-N 2.97Å; G126-L143 PolarHBondContact O-N 2.84Å
127	H	57.8	Low	54.1	Low	54 Å²	54	83.3 Å²	83.3	25%	0.25	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	125.7	173.1	-88.5	-105	0	0	0	110.3	G123 N125 S140 H142	G123-H127 PolarHBondContact N-O 3.21Å; N125-H127 VanDerWaalsContact C-N 3.27Å; N125-H127 PolarHBondContact O-N 2.53Å; H127-S140 PolarHBondContact CE1-OG 2.9Å; H127-S140 PolarHBondContact ND1-OG 3.23Å; H127-H142 AromaticContact CD2-CD2 3.91Å; H127-H142 AromaticContact NE2-CD2 3.39Å; H127-H142 PolarHBondContact NE2-CD2 3.4Å
128	L	55.7	Low	53.7	Low	11 Å²	11	87 Å²	87	6%	0.058	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	122.3	164.8	-175.6	71.2	0	0	0	108.1	V120 F122 I130 F141 L143 L154	V120-L128 HydrophobicContact CG1-CD1 3.36Å; V120-L128 HydrophobicContact CG1-CG 4.21Å; F122-L128 HydrophobicContact CD2-CD1 4.38Å; L128-I130 HydrophobicContact CD2-CD1 3.85Å; L128-I130 HydrophobicContact CD2-CG1 3.97Å; L128-I130 HydrophobicContact CG-CD1 4.37Å; L128-I130 HydrophobicContact CG-CG1 3.94Å; L128-F141 PolarHBondContact N-O 3.39Å; L128-F141 PolarHBondContact O-N 3.15Å; L128-F141 VanDerWaalsContact O-N 3.14Å; L128-L143 HydrophobicContact CB-CD1 3.35Å; L128-L143 HydrophobicContact CD2-CD1 3.95Å; L128-L143 HydrophobicContact CG-CD1 4.28Å; L128-L154 HydrophobicContact CD1-CD1 4.36Å; L128-L154 HydrophobicContact CD2-CD1 3.49Å; L128-L154 VanDerWaalsContact CD2-CD1 3.49Å
129	I	61.3	Low	53.2	Low	38 Å²	38	86 Å²	86	20%	0.195	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	114.2	175.7	-50.3	179.7	0	0	0	107.6	V120 R121 Y131 I138	V120-I129 WeakPolarHBondContact CA-O 3.43Å; R121-I129 PolarHBondContact N-O 3.18Å; R121-I129 PolarHBondContact O-N 3.31Å; I129-Y131 HydrophobicContact CB-CE2 4.17Å; I129-Y131 HydrophobicContact CG2-CD2 4.12Å; I129-Y131 HydrophobicContact CG2-CE1 4.12Å; I129-Y131 HydrophobicContact CG2-CE2 3.42Å; I129-Y131 VanDerWaalsContact CG2-CE2 3.42Å; I129-Y131 VanDerWaalsContact CG2-CZ 3.43Å; I129-I138 HydrophobicContact CG2-CG2 3.78Å
130	I	61.9	Low	52.8	Low	15 Å²	15	81.7 Å²	81.7	8%	0.077	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126	178	-52.1	179.5	0	0	0	108	C117 V120 L128 C132 Y139 F141	C117-I130 HydrophobicContact CB-CG2 4.27Å; V120-I130 HydrophobicContact CG2-CG2 4.48Å; L128-I130 HydrophobicContact CD2-CD1 3.85Å; L128-I130 HydrophobicContact CD2-CG1 3.97Å; L128-I130 HydrophobicContact CG-CD1 4.37Å; L128-I130 HydrophobicContact CG-CG1 3.94Å; I130-C132 VanDerWaalsContact CG2-SG 3.58Å; I130-Y139 PolarHBondContact N-O 3.01Å; I130-F141 HydrophobicContact CD1-CD2 4.06Å; I130-F141 HydrophobicContact CD1-CE2 4.03Å
131	Y	55.5	Low	52.2	Low	96 Å²	96	83.8 Å²	83.8	38%	0.376	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	110.8	175.4	-60.9	-87.9	0	0	0	109.8	C117 L118 W119 I129 I138	C117-Y131 WeakPolarHBondContact CA-O 3.46Å; L118-Y131 PolarHBondContact N-O 2.92Å; W119-Y131 HydrophobicContact CB-CD2 4.03Å; W119-Y131 PolarHBondContact O-N 3.36Å; I129-Y131 HydrophobicContact CB-CE2 4.17Å; I129-Y131 HydrophobicContact CG2-CD2 4.12Å; I129-Y131 HydrophobicContact CG2-CE1 4.12Å; I129-Y131 HydrophobicContact CG2-CE2 3.42Å; I129-Y131 VanDerWaalsContact CG2-CE2 3.42Å; I129-Y131 VanDerWaalsContact CG2-CZ 3.43Å; Y131-I138 HydrophobicContact CE1-CD1 4.41Å; Y131-I138 HydrophobicContact CE1-CG1 4.23Å
132	C	54.9	Low	51.4	Low	23 Å²	23	81.5 Å²	81.5	16%	0.155	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	133.8	177.6	-57.5	0	0	0	0	110.8	C117 I130 E134	C117-C132 HydrophobicContact CB-CB 4.15Å; C117-C132 WeakPolarHBondContact CB-SG 3.1Å; C117-C132 WeakPolarHBondContact SG-CB 3.32Å; C117-C132 CovalentContact SG-SG 2.05Å; C117-C132 PolarHBondContact SG-SG 3.12Å; I130-C132 VanDerWaalsContact CG2-SG 3.58Å; C132-E134 VanDerWaalsContact C-N 3.25Å; C132-E134 PolarHBondContact O-N 2.93Å
133	N	49.9	Very low	50.9	Low	68 Å²	68	77.4 Å²	77.4	36%	0.364	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-17.7	-175.1	-90.7	-65.6	0	0	0	114.2
134	E	47.3	Very low	50	Low	84 Å²	84	79.9 Å²	79.9	39%	0.393	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-5.7	-171	-92.3	-162	114.8	0	0	115.5	R113 C132	R113-E134 WeakPolarHBondContact CB-OE2 3.34Å; R113-E134 VanDerWaalsContact CG-OE2 3.32Å; R113-E134 WeakPolarHBondContact CG-OE2 2.99Å; R113-E134 IonicContact CZ-OE1 3.31Å; R113-E134 IonicContact CZ-OE2 2.75Å; R113-E134 IonicContact NE-OE1 2.73Å; R113-E134 PolarHBondContact NE-OE1 2.94Å; R113-E134 IonicContact NE-OE2 2.71Å; R113-E134 PolarHBondContact NE-OE2 2.76Å; R113-E134 IonicContact NH2-OE1 3.34Å; R113-E134 PolarHBondContact NH2-OE1 3.33Å; R113-E134 IonicContact NH2-OE2 3.42Å; C132-E134 VanDerWaalsContact C-N 3.25Å; C132-E134 PolarHBondContact O-N 2.93Å
135	M	39.8	Very low	49.6	Very low	90 Å²	90	76 Å²	76	44%	0.443	39%	0.386	S	S	.	.	S	Bend	trans	-145.3	136.4	168.5	-76.3	-155.5	-169.7	0	0	108.4	E137	M135-E137 HydrophobicContact CB-CB 4.22Å; M135-E137 HydrophobicContact CB-CG 4.16Å; M135-E137 PolarHBondContact O-N 3.14Å; M135-E137 HydrophobicContact SD-CG 4.44Å
136	F	40.3	Very low	48.8	Very low	126 Å²	126	73.7 Å²	73.7	55%	0.553	39%	0.385	S	S	*	.	S	Bend	trans	-66.6	41	168.7	-77.9	-88.6	0	0	0	112.1
137	E	39.2	Very low	48.1	Very low	93 Å²	93	76.4 Å²	76.4	44%	0.435	40%	0.395	S	S	.	.			trans	-106.4	107.9	179.4	-70.6	-168.4	-174.1	0	0	108.4	M135 Y139	M135-E137 HydrophobicContact CB-CB 4.22Å; M135-E137 HydrophobicContact CB-CG 4.16Å; M135-E137 PolarHBondContact O-N 3.14Å; M135-E137 HydrophobicContact SD-CG 4.44Å; E137-Y139 HydrophobicContact CB-CD2 4.19Å; E137-Y139 HydrophobicContact CB-CE1 4.22Å; E137-Y139 HydrophobicContact CB-CE2 3.68Å; E137-Y139 PolarHBondContact O-N 2.92Å; E137-Y139 WeakPolarHBondContact OE2-CE1 3.22Å; E137-Y139 PolarHBondContact OE2-OH 3.15Å
138	I	47.7	Very low	47.4	Very low	104 Å²	104	81.4 Å²	81.4	53%	0.533	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	102.6	161.1	-62	174.8	0	0	0	105.1	I129 Y131 S140	I129-I138 HydrophobicContact CG2-CG2 3.78Å; Y131-I138 HydrophobicContact CE1-CD1 4.41Å; Y131-I138 HydrophobicContact CE1-CG1 4.23Å; I138-S140 PolarHBondContact O-N 2.75Å
139	Y	45.5	Very low	46.7	Very low	78 Å²	78	85.7 Å²	85.7	31%	0.306	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	109.3	169.3	-63.1	-80.5	0	0	0	108.5	I130 E137 F141	I130-Y139 PolarHBondContact N-O 3.01Å; E137-Y139 HydrophobicContact CB-CD2 4.19Å; E137-Y139 HydrophobicContact CB-CE1 4.22Å; E137-Y139 HydrophobicContact CB-CE2 3.68Å; E137-Y139 PolarHBondContact O-N 2.92Å; E137-Y139 WeakPolarHBondContact OE2-CE1 3.22Å; E137-Y139 PolarHBondContact OE2-OH 3.15Å; Y139-F141 HydrophobicContact CD1-CE2 4.22Å; Y139-F141 AromaticContact CD1-CZ 3.93Å; Y139-F141 HydrophobicContact CD1-CZ 3.93Å; Y139-F141 AromaticContact CG-CE2 3.88Å; Y139-F141 HydrophobicContact CG-CE2 3.88Å; Y139-F141 HydrophobicContact CG-CZ 4.07Å
140	S	42.9	Very low	45.9	Very low	71 Å²	71	87.1 Å²	87.1	50%	0.497	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	93.6	171.8	-168.1	0	0	0	0	107.1	H127 I138	H127-S140 PolarHBondContact CE1-OG 2.9Å; H127-S140 PolarHBondContact ND1-OG 3.23Å; I138-S140 PolarHBondContact O-N 2.75Å
141	F	46.7	Very low	44.9	Very low	100 Å²	100	93.9 Å²	93.9	44%	0.439	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	118.3	174.7	-66.6	-75.4	0	0	0	108.5	L128 I130 Y139 L143	L128-F141 PolarHBondContact N-O 3.39Å; L128-F141 PolarHBondContact O-N 3.15Å; L128-F141 VanDerWaalsContact O-N 3.14Å; I130-F141 HydrophobicContact CD1-CD2 4.06Å; I130-F141 HydrophobicContact CD1-CE2 4.03Å; Y139-F141 HydrophobicContact CD1-CE2 4.22Å; Y139-F141 AromaticContact CD1-CZ 3.93Å; Y139-F141 HydrophobicContact CD1-CZ 3.93Å; Y139-F141 AromaticContact CG-CE2 3.88Å; Y139-F141 HydrophobicContact CG-CE2 3.88Å; Y139-F141 HydrophobicContact CG-CZ 4.07Å; F141-L143 HydrophobicContact CB-CD1 4.32Å; F141-L143 PolarHBondContact O-N 3.03Å; F141-L143 VanDerWaalsContact O-N 3.12Å
142	H	41.9	Very low	44.3	Very low	125 Å²	125	93 Å²	93	58%	0.579	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	98.8	163.2	-164.3	-76.9	0	0	0	106.5	H127 S144	H127-H142 AromaticContact CD2-CD2 3.91Å; H127-H142 AromaticContact NE2-CD2 3.39Å; H127-H142 PolarHBondContact NE2-CD2 3.4Å; H142-S144 PolarHBondContact O-N 3.12Å
143	L	47.8	Very low	43.7	Very low	25 Å²	25	98.9 Å²	98.9	13%	0.131	51%	0.51	C	S	.	.			trans	-70.2	92	166.9	-85.5	94.4	0	0	0	106.8	G126 L128 F141 L145 I150	G126-L143 PolarHBondContact O-N 2.84Å; L128-L143 HydrophobicContact CB-CD1 3.35Å; L128-L143 HydrophobicContact CD2-CD1 3.95Å; L128-L143 HydrophobicContact CG-CD1 4.28Å; F141-L143 HydrophobicContact CB-CD1 4.32Å; F141-L143 PolarHBondContact O-N 3.03Å; F141-L143 VanDerWaalsContact O-N 3.12Å; L143-L145 PolarHBondContact O-N 3.37Å; L143-I150 HydrophobicContact CD2-CB 4.39Å
144	S	40.7	Very low	43.4	Very low	68 Å²	68	97.4 Å²	97.4	48%	0.476	50%	0.502	S	S	.	.			trans	-53.4	136.5	156.1	-178.3	0	0	0	0	107.5	H142 A146 N147	H142-S144 PolarHBondContact O-N 3.12Å; S144-A146 PolarHBondContact O-N 3.42Å; S144-N147 PolarHBondContact O-N 3.4Å
145	L	46.2	Very low	42.9	Very low	172 Å²	172	97.6 Å²	97.6	90%	0.901	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-8.5	-179.2	-81.2	95.4	0	0	0	113.9	L143	L143-L145 PolarHBondContact O-N 3.37Å
146	A	41.4	Very low	42.7	Very low	86 Å²	86	99.5 Å²	99.5	71%	0.711	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-15.8	173.5	0	0	0	0	0	115.4	S144 Q148	S144-A146 PolarHBondContact O-N 3.42Å; A146-Q148 PolarHBondContact O-N 3.46Å
147	N	45.4	Very low	42.6	Very low	78 Å²	78	97.5 Å²	97.5	42%	0.417	52%	0.516	S	S	.	.			trans	-97.7	68.8	-178.2	-96.5	-44	0	0	0	112.6	S144 T149 I150	S144-N147 PolarHBondContact O-N 3.4Å; N147-T149 PolarHBondContact O-N 3.25Å; N147-I150 HydrophobicContact CB-CD1 3.89Å; N147-I150 HydrophobicContact CB-CG1 4.19Å
148	Q	44.4	Very low	42.1	Very low	158 Å²	158	98.5 Å²	98.5	74%	0.738	52%	0.524	S	S	*	.	H	α-helix	trans	-64.7	-28.2	172.7	-77.7	-178.1	10.3	0	0	112.8	A146 I150 R151	A146-Q148 PolarHBondContact O-N 3.46Å; Q148-I150 PolarHBondContact O-N 3.2Å; Q148-R151 PolarHBondContact O-N 2.71Å
149	T	40.7	Very low	41.2	Very low	102 Å²	102	102.9 Å²	102.9	63%	0.626	54%	0.54	S	S	*	.	H	α-helix	trans	-69.3	-31.1	-174.9	-46.7	0	0	0	0	113.8	N147 R151 S152	N147-T149 PolarHBondContact O-N 3.25Å; T149-R151 VanDerWaalsContact C-N 3.29Å; T149-R151 PolarHBondContact O-N 2.82Å; T149-S152 PolarHBondContact O-OG 2.93Å
150	I	43.3	Very low	40.5	Very low	68 Å²	68	103.9 Å²	103.9	35%	0.349	55%	0.554	S	S	.	*	H	α-helix	trans	-75.7	-23.9	-177.9	-51.1	177.8	0	0	0	110.8	L143 N147 Q148 L154	L143-I150 HydrophobicContact CD2-CB 4.39Å; N147-I150 HydrophobicContact CB-CD1 3.89Å; N147-I150 HydrophobicContact CB-CG1 4.19Å; Q148-I150 PolarHBondContact O-N 3.2Å; I150-L154 HydrophobicContact CG2-CD1 3.79Å; I150-L154 HydrophobicContact CG2-CG 4.34Å; I150-L154 WeakPolarHBondContact O-CD1 3.22Å; I150-L154 VanDerWaalsContact O-CG 3.32Å; I150-L154 WeakPolarHBondContact O-CG 3.14Å; I150-L154 PolarHBondContact O-N 3.14Å
151	R	42.6	Very low	40	Very low	157 Å²	157	106.4 Å²	106.4	59%	0.592	57%	0.571	S	S	*	*	H	α-helix	trans	-68.5	-35.8	178.8	-78.9	-178.9	153.1	-179.8	-7.3	112.7	Q148 T149	Q148-R151 PolarHBondContact O-N 2.71Å; T149-R151 VanDerWaalsContact C-N 3.29Å; T149-R151 PolarHBondContact O-N 2.82Å
152	S	41.7	Very low	39.1	Very low	77 Å²	77	106.4 Å²	106.4	54%	0.538	58%	0.576	S	S	.	*	H	α-helix	trans	-73.9	-24.9	-179	42.9	0	0	0	0	114.6	T149	T149-S152 PolarHBondContact O-OG 2.93Å
153	E	43.3	Very low	39	Very low	146 Å²	146	110 Å²	110	68%	0.682	59%	0.593	S	S	*	*	H	α-helix	trans	-87.9	-24.2	177.4	-72.9	-168	130.6	0	0	112.9
154	L	43.5	Very low	38.4	Very low	38 Å²	38	113.5 Å²	113.5	20%	0.199	62%	0.62	C	S	.	*	H	α-helix	trans	-79.2	-18.1	179.4	-72.5	170.4	0	0	0	113.7	L128 I150 V156 I157	L128-L154 HydrophobicContact CD1-CD1 4.36Å; L128-L154 HydrophobicContact CD2-CD1 3.49Å; L128-L154 VanDerWaalsContact CD2-CD1 3.49Å; I150-L154 HydrophobicContact CG2-CD1 3.79Å; I150-L154 HydrophobicContact CG2-CG 4.34Å; I150-L154 WeakPolarHBondContact O-CD1 3.22Å; I150-L154 VanDerWaalsContact O-CG 3.32Å; I150-L154 WeakPolarHBondContact O-CG 3.14Å; I150-L154 PolarHBondContact O-N 3.14Å; L154-V156 PolarHBondContact O-N 2.9Å; L154-V156 VanDerWaalsContact O-N 3.15Å; L154-I157 HydrophobicContact CD2-CD1 3.99Å; L154-I157 PolarHBondContact O-N 2.74Å
155	D	35.1	Very low	38	Very low	88 Å²	88	115.1 Å²	115.1	47%	0.471	63%	0.631	S	S	.	*	G	3₁₀ helix	trans	-62	-20.1	176.1	-80.8	-29.1	0	0	0	113.1	I157 N158	D155-I157 VanDerWaalsContact C-N 3.33Å; D155-N158 PolarHBondContact O-ND2 3Å
156	V	37.3	Very low	37.4	Very low	129 Å²	129	110.3 Å²	110.3	78%	0.782	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-78	-17.5	176.6	-174.3	0	0	0	0	112.4	L154	L154-V156 PolarHBondContact O-N 2.9Å; L154-V156 VanDerWaalsContact O-N 3.15Å
157	I	37.6	Very low	37.3	Very low	84 Å²	84	110.5 Å²	110.5	43%	0.431	61%	0.606	S	S	.	*	G	3₁₀ helix	trans	-95.4	6.1	-176.9	-48.6	-179	0	0	0	111.7	V120 L154 D155 F159	V120-I157 HydrophobicContact CG2-CG2 4.32Å; L154-I157 HydrophobicContact CD2-CD1 3.99Å; L154-I157 PolarHBondContact O-N 2.74Å; D155-I157 VanDerWaalsContact C-N 3.33Å; I157-F159 PolarHBondContact O-N 2.81Å
158	N	28.6	Very low	37	Very low	115 Å²	115	112.6 Å²	112.6	62%	0.615	61%	0.613	S	S	*	*			trans	-73.2	91.2	173.7	-71.2	-48.3	0	0	0	110.4	D155	D155-N158 PolarHBondContact O-ND2 3Å
159	F	27.6	Very low	36.7	Very low	195 Å²	195	108.2 Å²	108.2	86%	0.855	60%	0.603	S	S	*	*			trans	-126.6	117.3	168.6	-139.6	-105.3	0	0	0	110.8	I157	I157-F159 PolarHBondContact O-N 2.81Å
160	V	32.4	Very low	37	Very low	100 Å²	100	108 Å²	108	61%	0.606	60%	0.598	S	S	*	*			trans	69.6	80	151	-176.4	0	0	0	0	116.3	D162	V160-D162 VanDerWaalsContact C-N 3.28Å; V160-D162 HydrophobicContact CG1-CB 3.68Å
161	S	32.2	Very low	37	Very low	123 Å²	123	107.2 Å²	107.2	86%	0.86	60%	0.597	S	S	*	*			trans	-83.3	79	135.8	-67.7	0	0	0	0	107.5
162	D	27.7	Very low	36.9	Very low	101 Å²	101	100 Å²	100	54%	0.54	57%	0.57	S	S	.	*			trans	-89.7	103.5	162.4	-162.1	-49.8	0	0	0	107.1	V160 S164	V160-D162 VanDerWaalsContact C-N 3.28Å; V160-D162 HydrophobicContact CG1-CB 3.68Å; D162-S164 PolarHBondContact O-N 3.03Å; D162-S164 VanDerWaalsContact OD1-CB 3.22Å; D162-S164 WeakPolarHBondContact OD1-CB 3.46Å; D162-S164 PolarHBondContact OD1-N 3.04Å; D162-S164 VanDerWaalsContact OD1-N 3.12Å; D162-S164 PolarHBondContact OD1-OG 3.45Å
163	E	39.7	Very low	36.5	Very low	201 Å²	201	99.4 Å²	99.4	94%	0.939	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	7.6	178.2	-87.4	178.2	72.4	0	0	114.1
164	S	34.6	Very low	36.5	Very low	98 Å²	98	96.7 Å²	96.7	69%	0.685	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-4.8	179.8	73.3	0	0	0	0	115.7	D162 S166	D162-S164 PolarHBondContact O-N 3.03Å; D162-S164 VanDerWaalsContact OD1-CB 3.22Å; D162-S164 WeakPolarHBondContact OD1-CB 3.46Å; D162-S164 PolarHBondContact OD1-N 3.04Å; D162-S164 VanDerWaalsContact OD1-N 3.12Å; D162-S164 PolarHBondContact OD1-OG 3.45Å; S164-S166 PolarHBondContact O-N 2.76Å
165	S	32.7	Very low	36	Very low	101 Å²	101	97.4 Å²	97.4	71%	0.706	57%	0.571	S	S	*	*	S	Bend	trans	-92.5	104	-177.8	-143.7	0	0	0	0	112.2
166	S	32.9	Very low	36.1	Very low	71 Å²	71	98.1 Å²	98.1	50%	0.497	58%	0.583	S	S	.	*			trans	-20.1	140.1	163.1	-175.3	0	0	0	0	114.6	S164 E168	S164-S166 PolarHBondContact O-N 2.76Å; S166-E168 PolarHBondContact O-N 3.44Å
167	P	40.3	Very low	36.1	Very low	91 Å²	91	96.2 Å²	96.2	59%	0.591	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	17.8	-176.1	26.9	-36	0	0	0	116.2	A169	P167-A169 PolarHBondContact O-N 2.91Å
168	E	37.8	Very low	36	Very low	122 Å²	122	97.7 Å²	97.7	57%	0.57	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	0.7	179.9	-68.3	-153.8	132.1	0	0	115.3	S166	S166-E168 PolarHBondContact O-N 3.44Å
169	A	38.4	Very low	36.4	Very low	65 Å²	65	98.6 Å²	98.6	54%	0.537	60%	0.6	S	S	.	*			trans	-120.3	35.4	-165	0	0	0	0	0	115.9	P167 P171	P167-A169 PolarHBondContact O-N 2.91Å; A169-P171 WeakPolarHBondContact O-CD 3.2Å
170	I	48.2	Very low	37.1	Very low	99 Å²	99	94.8 Å²	94.8	51%	0.508	59%	0.594	S	S	.	*			trans	-94.4	98.9	172	-50.4	178.1	0	0	0	110.1	Y31	Y31-I170 HydrophobicContact CD2-CB 4.2Å; Y31-I170 HydrophobicContact CD2-CG2 4.28Å; Y31-I170 WeakPolarHBondContact CD2-O 3.39Å; Y31-I170 HydrophobicContact CE2-CB 4.4Å; Y31-I170 HydrophobicContact CE2-CG2 3.96Å
171	P	42.7	Very low	37.3	Very low	50 Å²	50	93.3 Å²	93.3	33%	0.325	60%	0.6	S	S	.	*			trans	-69.4	148.4	172.2	26.6	-33.2	0	0	0	112.3	C27 L118 A169	C27-P171 WeakPolarHBondContact O-CB 3.29Å; L118-P171 HydrophobicContact CD2-CG 4.08Å; A169-P171 WeakPolarHBondContact O-CD 3.2Å
172	Y	40.4	Very low	37.7	Very low	6 Å²	6	99 Å²	99	2%	0.024	60%	0.602	C	S	.	*			trans	-77.9	126	178.6	-65.5	-79.5	0	0	0	113	V20 K21 P22 A25 C27 S29 R30 Y31	V20-Y172 PolarHBondContact O-OH 3.43Å; K21-Y172 VanDerWaalsContact CA-OH 3.3Å; K21-Y172 WeakPolarHBondContact CA-OH 3.43Å; K21-Y172 HydrophobicContact CB-CD1 4.21Å; K21-Y172 HydrophobicContact CB-CE1 3.49Å; K21-Y172 VanDerWaalsContact CB-CE1 3.49Å; K21-Y172 HydrophobicContact CD-CD1 3.76Å; K21-Y172 HydrophobicContact CD-CE1 3.93Å; K21-Y172 HydrophobicContact CG-CD1 3.64Å; K21-Y172 HydrophobicContact CG-CE1 3.34Å; P22-Y172 WeakPolarHBondContact CD-OH 3.32Å; P22-Y172 HydrophobicContact CG-CE2 3.96Å; A25-Y172 HydrophobicContact CB-CD1 4.26Å; A25-Y172 HydrophobicContact CB-CD2 3.86Å; A25-Y172 HydrophobicContact CB-CE2 4.23Å; A25-Y172 HydrophobicContact CB-CG 3.89Å; C27-Y172 VanDerWaalsContact CA-O 3.29Å; C27-Y172 WeakPolarHBondContact CA-O 3.16Å; S29-Y172 WeakPolarHBondContact O-CD2 3.16Å; S29-Y172 WeakPolarHBondContact O-CE2 3.43Å; R30-Y172 VanDerWaalsContact C-CZ 3.5Å; R30-Y172 VanDerWaalsContact O-CE2 3.23Å; R30-Y172 WeakPolarHBondContact O-CE2 3.44Å; R30-Y172 PolarHBondContact O-OH 3.27Å; Y31-Y172 WeakPolarHBondContact CA-OH 3.14Å; Y31-Y172 AromaticContact CD1-CE1 3.66Å; Y31-Y172 HydrophobicContact CD1-CE1 3.66Å; Y31-Y172 AromaticContact CD1-CZ 3.97Å; Y31-Y172 HydrophobicContact CD2-CD1 4.14Å; Y31-Y172 AromaticContact CD2-CE1 3.45Å; Y31-Y172 HydrophobicContact CD2-CE1 3.45Å; Y31-Y172 VanDerWaalsContact CD2-CE1 3.45Å; Y31-Y172 HydrophobicContact CD2-CE2 4.3Å; Y31-Y172 AromaticContact CD2-CZ 3.49Å; Y31-Y172 VanDerWaalsContact CD2-CZ 3.49Å; Y31-Y172 HydrophobicContact CE1-CD1 4.18Å; Y31-Y172 AromaticContact CE1-CE1 3.38Å; Y31-Y172 HydrophobicContact CE1-CE1 3.38Å; Y31-Y172 AromaticContact CE2-CD1 3.46Å; Y31-Y172 HydrophobicContact CE2-CD1 3.46Å; Y31-Y172 VanDerWaalsContact CE2-CD1 3.46Å; Y31-Y172 AromaticContact CE2-CE1 3.14Å; Y31-Y172 HydrophobicContact CE2-CE1 3.14Å; Y31-Y172 HydrophobicContact CE2-CG 4.24Å; Y31-Y172 AromaticContact CE2-CZ 3.7Å; Y31-Y172 AromaticContact CG-CE1 3.71Å; Y31-Y172 HydrophobicContact CG-CE1 3.71Å; Y31-Y172 AromaticContact CG-CZ 3.65Å; Y31-Y172 VanDerWaalsContact CG-OH 3.22Å; Y31-Y172 AromaticContact CZ-CD1 3.49Å; Y31-Y172 VanDerWaalsContact CZ-CD1 3.49Å; Y31-Y172 AromaticContact CZ-CE1 3.11Å; Y31-Y172 PolarHBondContact N-OH 3.08Å
173	C	33.9	Very low	38.5	Very low	64 Å²	64	98.7 Å²	98.7	43%	0.432	61%	0.614	S	S	.	*			trans	-141.3	79.4	157	-78.6	0	0	0	0	109.2
174	L	42.8	Very low	38.6	Very low	89 Å²	89	96.1 Å²	96.1	47%	0.466	61%	0.606	S	S	.	*	S	Bend	trans	-136	116.5	162.2	-74.7	177.4	0	0	0	107.9	K21	K21-L174 PolarHBondContact NZ-O 2.86Å
175	G	34	Very low	38.9	Very low	53 Å²	53	97 Å²	97	55%	0.546	61%	0.61	S	S	.	*			trans	-45.4	130.4	-162.1	0	0	0	0	0	117.3
176	S	35.9	Very low	39.4	Very low	103 Å²	103	101.1 Å²	101.1	72%	0.72	62%	0.615	S	S	*	*			trans	-152.1	89.6	148.4	-76.7	0	0	0	0	106.6
177	S	36.6	Very low	40	Very low	89 Å²	89	102.8 Å²	102.8	62%	0.622	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-65.7	131.7	163.1	-71.4	0	0	0	0	108.4	V179	S177-V179 PolarHBondContact O-N 2.77Å
178	P	36.9	Very low	40.4	Very low	116 Å²	116	105.2 Å²	105.2	75%	0.753	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-64.7	126.3	162.6	26.9	-29.1	0	0	0	107.7	P180	P178-P180 VanDerWaalsContact O-CD 3.29Å; P178-P180 WeakPolarHBondContact O-CD 3.31Å
179	V	36.5	Very low	40.8	Very low	133 Å²	133	110.5 Å²	110.5	81%	0.806	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-58.5	119.3	170.1	-178.1	0	0	0	0	107	S177 G181	S177-V179 PolarHBondContact O-N 2.77Å; V179-G181 PolarHBondContact O-N 3.39Å
180	P	42.5	Very low	41.3	Very low	115 Å²	115	118.7 Å²	118.7	75%	0.747	67%	0.671	S	S	*	*			trans	-65.2	114.9	170.4	25.3	-29.5	0	0	0	107.2	P178 R182	P178-P180 VanDerWaalsContact O-CD 3.29Å; P178-P180 WeakPolarHBondContact O-CD 3.31Å; P180-R182 PolarHBondContact O-N 3.36Å; P180-R182 VanDerWaalsContact O-N 3.09Å
181	G	36	Very low	41.5	Very low	70 Å²	70	119.9 Å²	119.9	72%	0.722	69%	0.688	S	S	*	*			trans	-50.7	119.3	173.9	0	0	0	0	0	109.3	V179 A183	V179-G181 PolarHBondContact O-N 3.39Å; G181-A183 PolarHBondContact O-N 3.14Å
182	R	42.2	Very low	42	Very low	242 Å²	242	126.5 Å²	126.5	91%	0.913	71%	0.712	S	S	*	*			trans	-53.4	112.3	167.5	-98.2	-178	170.4	-158.6	-1.4	107.3	P180 D184	P180-R182 PolarHBondContact O-N 3.36Å; P180-R182 VanDerWaalsContact O-N 3.09Å; R182-D184 PolarHBondContact O-N 3.22Å; R182-D184 VanDerWaalsContact O-N 3.08Å
183	A	44.2	Very low	42.5	Very low	94 Å²	94	139 Å²	139	78%	0.777	77%	0.77	S	S	*	*			trans	-57.2	112.5	163.3	0	0	0	0	0	107.6	G181 P185	G181-A183 PolarHBondContact O-N 3.14Å; A183-P185 VanDerWaalsContact O-CD 3.3Å; A183-P185 WeakPolarHBondContact O-CD 3.2Å
184	D	41.1	Very low	42.9	Very low	147 Å²	147	142.8 Å²	142.8	79%	0.786	79%	0.787	S	S	*	*			trans	-76.3	113.4	171.3	-119.3	-33.5	0	0	0	108.2	R182 K186	R182-D184 PolarHBondContact O-N 3.22Å; R182-D184 VanDerWaalsContact O-N 3.08Å; D184-K186 PolarHBondContact O-N 3.32Å; D184-K186 VanDerWaalsContact O-N 3.12Å
185	P	40.7	Very low	42.9	Very low	117 Å²	117	145.6 Å²	145.6	76%	0.76	80%	0.804	S	S	*	*			trans	-90.3	56.7	179.7	36.7	-31.2	0	0	0	109.7	A183	A183-P185 VanDerWaalsContact O-CD 3.3Å; A183-P185 WeakPolarHBondContact O-CD 3.2Å
186	K	42.8	Very low	43.4	Very low	188 Å²	188	150.8 Å²	150.8	82%	0.817	82%	0.818	S	S	*	*			trans	-150	78.8	176.2	-66.9	-169.2	-177.7	177.6	0	112.9	D184	D184-K186 PolarHBondContact O-N 3.32Å; D184-K186 VanDerWaalsContact O-N 3.12Å
187	S	46.1	Very low	43.8	Very low	106 Å²	106	153.6 Å²	153.6	74%	0.741	82%	0.824	S	S	*	*			trans	-149.3	73	153.7	175.3	0	0	0	0	110.6	R189	S187-R189 PolarHBondContact O-N 3.01Å
188	V	48.4	Very low	44.3	Very low	142 Å²	142	157.6 Å²	157.6	86%	0.861	84%	0.837	S	S	*	*			trans	-64.1	108.6	153.2	168	0	0	0	0	107.3
189	R	47.6	Very low	44.8	Very low	232 Å²	232	160.4 Å²	160.4	88%	0.875	84%	0.842	S	S	*	*			trans	-135.1	107.5	154.8	-80.5	-165.4	177.1	-169.7	0.4	109.6	S187	S187-R189 PolarHBondContact O-N 3.01Å
190	R	48.3	Very low	45.4	Very low	238 Å²	238	162.4 Å²	162.4	90%	0.898	85%	0.845	S	S	*	*			trans	-45.6	137.3	156.2	-85.9	172.3	161	178.4	-4	109.9
191	S	51.9	Low	45.6	Very low	123 Å²	123	166 Å²	166	86%	0.86	85%	0.852	S	S	*	*			trans	-150.1	131.7	130.4	-148.9	0	0	0	0	110.2
192	K	52.4	Low	46.4	Very low	189 Å²	189	174 Å²	174	82%	0.822	86%	0.863	S	S	*	*			trans	-78	137.2	175.4	-74.7	172.8	165.2	-174.8	0	109.4
193	H	50.8	Low	46.8	Very low	270 Å²	270	167.8 Å²	167.8	100%	1.25	86%	0.859	S	S	*	*			trans	-142.6	0	133.2	-101.5	15.5	0	0	0	107.9

Retrieved 193 of 193 residues in 26.7 ms (Link to these results)

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