A0A077Z0C8_TRITR Loading...

WD40 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z0C8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 244 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	57.6	Low	53.2	Low	26 Å²	26	75.4 Å²	75.4	13%	0.128	37%	0.372	C	S	.	.				0	142.9	0	168	168.5	-94.8	0	0	109.4	L39 N40 G107 A108 L109	M1-L39 HydrophobicContact CB-CD2 4.29Å; M1-N40 VanDerWaalsContact CA-O 3.23Å; M1-N40 WeakPolarHBondContact CA-O 3.4Å; M1-N40 HydrophobicContact CE-CB 3.14Å; M1-N40 VanDerWaalsContact CE-ND2 3.28Å; M1-N40 WeakPolarHBondContact CE-ND2 3.39Å; M1-G107 WeakPolarHBondContact CE-O 3.39Å; M1-A108 WeakPolarHBondContact SD-CA 3.41Å; M1-A108 PolarHBondContact SD-N 3.35Å; M1-L109 HydrophobicContact CG-CD1 4.23Å; M1-L109 HydrophobicContact SD-CB 4.41Å; M1-L109 HydrophobicContact SD-CG 4.41Å
2	F	65.7	Low	50.8	Low	41 Å²	41	83.3 Å²	83.3	18%	0.18	41%	0.411	C	S	.	.			trans	-132.1	149.4	-178.3	-49.2	-77.3	0	0	0	110.6	L58	F2-L58 HydrophobicContact CB-CD1 4.4Å; F2-L58 HydrophobicContact CD1-CD1 3.78Å; F2-L58 HydrophobicContact CD1-CD2 3.75Å; F2-L58 HydrophobicContact CD1-CG 4.25Å; F2-L58 HydrophobicContact CD2-CD1 3.68Å; F2-L58 HydrophobicContact CE1-CB 3.98Å; F2-L58 HydrophobicContact CE1-CD1 3.89Å; F2-L58 HydrophobicContact CE1-CD2 3.81Å; F2-L58 HydrophobicContact CE1-CG 4.1Å; F2-L58 HydrophobicContact CE2-CD1 3.81Å; F2-L58 HydrophobicContact CG-CD1 3.66Å; F2-L58 HydrophobicContact CG-CD2 4.41Å; F2-L58 HydrophobicContact CZ-CB 3.95Å; F2-L58 HydrophobicContact CZ-CD1 3.91Å; F2-L58 HydrophobicContact CZ-CG 4.34Å
3	R	64.4	Low	48.8	Very low	75 Å²	75	84.8 Å²	84.8	28%	0.283	43%	0.434	S	S	.	.			trans	-146.7	111.8	174.4	-119.5	-78.2	-158.4	-166.8	0.4	110.2	D43 L109 W111 E151	R3-D43 WeakPolarHBondContact CA-OD2 3.44Å; R3-L109 HydrophobicContact CB-CB 3.84Å; R3-L109 HydrophobicContact CB-CD1 4.32Å; R3-L109 HydrophobicContact CG-CB 4.02Å; R3-L109 WeakPolarHBondContact CG-O 3.32Å; R3-W111 PolarHBondContact O-NE1 3.46Å; R3-E151 IonicContact CZ-OE2 2.72Å; R3-E151 IonicContact NH2-OE1 3.87Å; R3-E151 PolarHBondContact NH2-OE1 3.14Å; R3-E151 IonicContact NH2-OE2 3.79Å; R3-E151 PolarHBondContact NH2-OE2 2.86Å
4	L	63.5	Low	47.1	Very low	24 Å²	24	94.3 Å²	94.3	13%	0.126	46%	0.462	C	S	.	.			trans	-68.7	140	175.2	-64.6	173.8	0	0	0	110.1	D43 V49 A51 V90	L4-D43 PolarHBondContact N-OD2 2.8Å; L4-V49 HydrophobicContact CD1-CG1 4.36Å; L4-V49 VanDerWaalsContact CD1-O 3.32Å; L4-V49 WeakPolarHBondContact CD1-O 3.42Å; L4-A51 HydrophobicContact CD1-CB 3.98Å; L4-A51 HydrophobicContact CD2-CB 4.25Å; L4-A51 HydrophobicContact CG-CB 4.15Å; L4-V90 HydrophobicContact CD2-CG2 4.29Å
5	H	67.3	Low	45.5	Very low	26 Å²	26	102.2 Å²	102.2	12%	0.12	49%	0.493	C	S	.	.			trans	-74.5	130.3	177.7	-175.8	-64.2	0	0	0	110.4	D7 R8 Y46 W111 G113	H5-D7 VanDerWaalsContact C-N 3.34Å; H5-D7 PolarHBondContact ND1-N 3.46Å; H5-D7 PolarHBondContact O-N 3.08Å; H5-R8 HydrophobicContact CB-CB 4.36Å; H5-R8 PolarHBondContact ND1-N 3.08Å; H5-Y46 WeakPolarHBondContact O-CE1 3.39Å; H5-W111 HydrophobicContact CB-CZ2 4.15Å; H5-W111 AromaticContact CD2-CD2 3.82Å; H5-W111 AromaticContact CD2-CE3 3.54Å; H5-W111 AromaticContact CD2-CH2 3.67Å; H5-W111 AromaticContact CD2-CZ2 3.97Å; H5-W111 AromaticContact CD2-CZ3 3.45Å; H5-W111 VanDerWaalsContact CD2-CZ3 3.45Å; H5-W111 WeakPolarHBondContact CD2-CZ3 3.36Å; H5-G113 PolarHBondContact NE2-O 3.34Å
6	P	62.7	Low	44.2	Very low	46 Å²	46	99.1 Å²	99.1	30%	0.299	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-10	-171.2	27.7	-35.8	0	0	0	116.6	Y46 W111	P6-Y46 VanDerWaalsContact CA-CE1 3.43Å; P6-Y46 WeakPolarHBondContact O-CD1 3.49Å; P6-Y46 WeakPolarHBondContact O-CD2 3.49Å; P6-Y46 WeakPolarHBondContact O-CE1 3.42Å; P6-Y46 WeakPolarHBondContact O-CE2 3.3Å; P6-Y46 PolarHBondContact O-OH 2.88Å; P6-W111 HydrophobicContact CG-CB 4.22Å
7	D	53.9	Low	43	Very low	115 Å²	115	102.4 Å²	102.4	62%	0.615	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.9	-0.7	177	-53.4	-59.1	0	0	0	116.2	H5 Y46	H5-D7 VanDerWaalsContact C-N 3.34Å; H5-D7 PolarHBondContact ND1-N 3.46Å; H5-D7 PolarHBondContact O-N 3.08Å; D7-Y46 WeakPolarHBondContact CA-OH 3.17Å; D7-Y46 PolarHBondContact N-OH 2.86Å; D7-Y46 PolarHBondContact O-OH 2.97Å
8	R	52.6	Low	42.2	Very low	177 Å²	177	103 Å²	103	67%	0.668	53%	0.525	S	S	*	.			trans	-113.7	21	-170.8	-70.5	-162.8	-176.2	-140.8	7	116.8	H5 Y46 N114	H5-R8 HydrophobicContact CB-CB 4.36Å; H5-R8 PolarHBondContact ND1-N 3.08Å; R8-Y46 PolarHBondContact N-OH 2.89Å; R8-N114 PolarHBondContact NH2-OD1 3.49Å; R8-N114 VanDerWaalsContact NH2-OD1 3.12Å
9	V	47.3	Very low	41.2	Very low	31 Å²	31	101.6 Å²	101.6	19%	0.188	53%	0.526	C	S	.	.	S	Bend	trans	-86.7	136.1	167.5	-173.7	0	0	0	0	106	Y46 K47 V49	V9-Y46 HydrophobicContact CG2-CE1 4.12Å; V9-Y46 PolarHBondContact N-OH 2.93Å; V9-K47 HydrophobicContact CB-CB 4.11Å; V9-K47 HydrophobicContact CB-CD 3.67Å; V9-K47 HydrophobicContact CB-CG 3.85Å; V9-K47 HydrophobicContact CG1-CB 3.96Å; V9-K47 HydrophobicContact CG1-CD 3.96Å; V9-K47 HydrophobicContact CG1-CG 4.19Å; V9-K47 VanDerWaalsContact O-CD 3.23Å; V9-K47 WeakPolarHBondContact O-CD 3.43Å; V9-K47 WeakPolarHBondContact O-CE 3.26Å; V9-K47 PolarHBondContact O-NZ 3.26Å; V9-V49 HydrophobicContact CG1-CG2 3.92Å
10	S	27.2	Very low	40.3	Very low	99 Å²	99	108.3 Å²	108.3	69%	0.692	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-73.5	148.2	-177.1	45.9	0	0	0	0	112.5
11	E	23.6	Very low	39.5	Very low	169 Å²	169	108.6 Å²	108.6	79%	0.79	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-64.8	136.8	-178.4	-74.6	-179	133.2	0	0	113.8
12	M	23.7	Very low	37.9	Very low	171 Å²	171	112 Å²	112	84%	0.842	58%	0.579	S	S	*	*			trans	-135.3	97.4	144.8	-88.6	-176.3	174	0	0	108.3
13	S	24.6	Very low	35.9	Very low	102 Å²	102	115.7 Å²	115.7	71%	0.713	61%	0.605	S	S	*	*			trans	43.1	106.7	156.8	158.9	0	0	0	0	118.3
14	R	24.7	Very low	34.2	Very low	218 Å²	218	116.8 Å²	116.8	82%	0.823	61%	0.614	S	S	*	*			trans	-77.9	119.4	163	-83.7	-176.6	174.4	-174.2	-4	111.7
15	K	23.7	Very low	32.5	Very low	213 Å²	213	122.9 Å²	122.9	93%	0.926	64%	0.64	S	S	*	*			trans	-157	110.2	136.8	-82.8	-162.6	-178.6	177.1	0	108.3
16	G	25.3	Very low	30.7	Very low	52 Å²	52	128.2 Å²	128.2	54%	0.536	67%	0.665	S	S	.	*			trans	177.1	119	171.2	0	0	0	0	0	112.2	V18	G16-V18 PolarHBondContact O-N 3.09Å
17	N	23.5	Very low	29.3	Very low	155 Å²	155	135.1 Å²	135.1	83%	0.829	69%	0.69	S	S	*	*			trans	-60.6	128.4	168	-77.6	-16.7	0	0	0	109.2	S19	N17-S19 PolarHBondContact O-N 3.2Å
18	V	27.7	Very low	28.6	Very low	114 Å²	114	135 Å²	135	69%	0.691	69%	0.689	S	S	*	*			trans	-82.2	107.6	171.8	179	0	0	0	0	108.6	G16	G16-V18 PolarHBondContact O-N 3.09Å
19	S	23.7	Very low	27.9	Very low	77 Å²	77	126.7 Å²	126.7	54%	0.538	66%	0.658	S	S	.	*			trans	-90.2	129.3	167.1	55.1	0	0	0	0	110.4	N17	N17-S19 PolarHBondContact O-N 3.2Å
20	R	23.6	Very low	27.4	Very low	234 Å²	234	129.8 Å²	129.8	88%	0.883	68%	0.679	S	S	*	*			trans	39.2	120.3	157.1	-78.2	-179.2	172.3	168.2	-1.8	119.1	T22	R20-T22 PolarHBondContact O-N 3.24Å; R20-T22 VanDerWaalsContact O-N 3.1Å
21	S	23.6	Very low	28.5	Very low	115 Å²	115	126.1 Å²	126.1	80%	0.804	65%	0.653	S	S	*	*			trans	-24.7	104.9	157.6	176.4	0	0	0	0	113.8
22	T	23.3	Very low	29.3	Very low	99 Å²	99	120.5 Å²	120.5	61%	0.607	63%	0.628	S	S	*	*			trans	-84.7	112	161.6	-32.2	0	0	0	0	107.1	R20 M24 G66	R20-T22 PolarHBondContact O-N 3.24Å; R20-T22 VanDerWaalsContact O-N 3.1Å; T22-M24 PolarHBondContact O-N 3.1Å; T22-G66 PolarHBondContact OG1-O 2.96Å; T22-G66 VanDerWaalsContact OG1-O 3.09Å
23	T	24.1	Very low	29.8	Very low	118 Å²	118	116.2 Å²	116.2	72%	0.724	62%	0.615	S	S	*	*			trans	-76	106.5	174	-18.3	0	0	0	0	108	K25	T23-K25 PolarHBondContact O-N 2.68Å
24	M	27.8	Very low	30.7	Very low	97 Å²	97	118.6 Å²	118.6	48%	0.478	61%	0.613	S	S	.	*			trans	-63.1	123.4	169.2	-131.7	-174.7	82.4	0	0	107.8	T22 D28 A29	T22-M24 PolarHBondContact O-N 3.1Å; M24-D28 HydrophobicContact CE-CB 4.19Å; M24-A29 HydrophobicContact CE-CB 3.73Å
25	K	28.3	Very low	31.6	Very low	153 Å²	153	109.5 Å²	109.5	67%	0.665	58%	0.579	S	S	*	*			trans	-83.6	146	-179.7	-72	-178	-179.6	176.5	0	108.6	T23 K27 D28	T23-K25 PolarHBondContact O-N 2.68Å; K25-K27 PolarHBondContact O-N 2.86Å; K25-D28 WeakPolarHBondContact O-CB 3.39Å; K25-D28 PolarHBondContact O-N 3.21Å
26	E	30.4	Very low	32.7	Very low	138 Å²	138	101.5 Å²	101.5	65%	0.645	55%	0.55	S	S	*	*	G	3₁₀ helix	trans	-50.8	-25.6	176.8	-167	179.1	-174.9	0	0	113.4	D28 A29	E26-D28 PolarHBondContact O-N 2.88Å; E26-A29 CarbonylContact O-C 3.56Å; E26-A29 VanDerWaalsContact O-C 3.32Å; E26-A29 PolarHBondContact O-N 3.33Å; E26-A29 VanDerWaalsContact O-N 3.15Å
27	K	32.8	Very low	33.8	Very low	190 Å²	190	106.7 Å²	106.7	83%	0.826	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-58.5	-26.1	173	-82.8	-171.2	172	-175.5	0	114.6	K25	K25-K27 PolarHBondContact O-N 2.86Å
28	D	38.8	Very low	35.1	Very low	112 Å²	112	102 Å²	102	60%	0.599	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-89.1	-8	-177.7	-53.7	-38.3	0	0	0	112	M24 K25 E26	M24-D28 HydrophobicContact CE-CB 4.19Å; K25-D28 WeakPolarHBondContact O-CB 3.39Å; K25-D28 PolarHBondContact O-N 3.21Å; E26-D28 PolarHBondContact O-N 2.88Å
29	A	38.4	Very low	36.5	Very low	3 Å²	3	97.8 Å²	97.8	3%	0.025	51%	0.508	C	S	.	.			trans	-143.9	64.4	179.8	0	0	0	0	0	111.4	M24 E26 S31 I32 L54	M24-A29 HydrophobicContact CE-CB 3.73Å; E26-A29 CarbonylContact O-C 3.56Å; E26-A29 VanDerWaalsContact O-C 3.32Å; E26-A29 PolarHBondContact O-N 3.33Å; E26-A29 VanDerWaalsContact O-N 3.15Å; A29-S31 PolarHBondContact O-N 3.19Å; A29-I32 HydrophobicContact CB-CB 4.32Å; A29-I32 WeakPolarHBondContact O-CB 3.43Å; A29-I32 WeakPolarHBondContact O-CG2 3.38Å; A29-I32 PolarHBondContact O-N 2.96Å; A29-I32 VanDerWaalsContact O-N 3.09Å; A29-L54 HydrophobicContact CB-CD2 3.77Å
30	P	37.2	Very low	38	Very low	97 Å²	97	96.4 Å²	96.4	63%	0.63	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.1	-170.1	22.9	-33.3	0	0	0	114.3	S33	P30-S33 PolarHBondContact O-OG 3.1Å
31	S	49.2	Very low	39.8	Very low	21 Å²	21	86.1 Å²	86.1	15%	0.147	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-10	-179	-46.5	0	0	0	0	114.7	A29 S33 K34 D55	A29-S31 PolarHBondContact O-N 3.19Å; S31-S33 PolarHBondContact O-N 3.19Å; S31-S33 VanDerWaalsContact O-N 3.14Å; S31-K34 PolarHBondContact O-N 2.78Å; S31-K34 VanDerWaalsContact O-N 3.12Å; S31-D55 WeakPolarHBondContact CB-OD1 3.37Å; S31-D55 WeakPolarHBondContact CB-OD2 3.42Å; S31-D55 PolarHBondContact OG-OD2 2.86Å
32	I	40.1	Very low	41.3	Very low	52 Å²	52	83.4 Å²	83.4	27%	0.267	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-62.1	-27.2	-172.8	-152.9	166	0	0	0	112.2	A29 K34 V41 V42 L54	A29-I32 HydrophobicContact CB-CB 4.32Å; A29-I32 WeakPolarHBondContact O-CB 3.43Å; A29-I32 WeakPolarHBondContact O-CG2 3.38Å; A29-I32 PolarHBondContact O-N 2.96Å; A29-I32 VanDerWaalsContact O-N 3.09Å; I32-K34 VanDerWaalsContact C-N 3.27Å; I32-K34 PolarHBondContact O-N 2.88Å; I32-V41 HydrophobicContact CD1-CG2 4.1Å; I32-V41 HydrophobicContact CG1-CG2 3.77Å; I32-V42 HydrophobicContact CD1-CG2 4.16Å; I32-L54 HydrophobicContact CB-CD2 4.46Å
33	S	36	Very low	43.2	Very low	80 Å²	80	80 Å²	80	56%	0.559	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-70	-14.6	179.5	58.1	0	0	0	0	114.6	P30 S31	P30-S33 PolarHBondContact O-OG 3.1Å; S31-S33 PolarHBondContact O-N 3.19Å; S31-S33 VanDerWaalsContact O-N 3.14Å
34	K	42.5	Very low	44.9	Very low	153 Å²	153	81 Å²	81	67%	0.665	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-82	-18.4	180	-66.3	-172.3	-164.6	156.4	0	114	S31 I32 D55	S31-K34 PolarHBondContact O-N 2.78Å; S31-K34 VanDerWaalsContact O-N 3.12Å; I32-K34 VanDerWaalsContact C-N 3.27Å; I32-K34 PolarHBondContact O-N 2.88Å; K34-D55 WeakPolarHBondContact CD-OD1 3.43Å; K34-D55 IonicContact NZ-OD1 3.07Å; K34-D55 PolarHBondContact NZ-OD1 3.18Å
35	F	42.7	Very low	46.7	Very low	27 Å²	27	76.8 Å²	76.8	12%	0.118	39%	0.385	C	S	.	.	S	Bend	trans	-73.8	141.2	175.9	-70.3	-80.6	0	0	0	110.1	H37 L39 V41 G53 D55	F35-H37 PolarHBondContact O-N 2.84Å; F35-L39 HydrophobicContact CB-CD1 4.39Å; F35-L39 HydrophobicContact CD1-CD1 3.92Å; F35-V41 HydrophobicContact CB-CG1 3.76Å; F35-V41 HydrophobicContact CD1-CG1 3.81Å; F35-V41 HydrophobicContact CD2-CB 4.36Å; F35-V41 HydrophobicContact CD2-CG1 3.66Å; F35-V41 HydrophobicContact CE1-CG1 4.23Å; F35-V41 HydrophobicContact CE2-CG1 4.09Å; F35-V41 HydrophobicContact CG-CG1 3.47Å; F35-V41 VanDerWaalsContact CG-CG1 3.47Å; F35-V41 HydrophobicContact CZ-CG1 4.33Å; F35-G53 VanDerWaalsContact CE2-O 3.32Å; F35-G53 WeakPolarHBondContact CE2-O 3.27Å; F35-D55 WeakPolarHBondContact CE1-O 3.48Å; F35-D55 WeakPolarHBondContact CZ-O 3.38Å
36	S	47.7	Very low	48.2	Very low	45 Å²	45	73.6 Å²	73.6	32%	0.315	37%	0.37	S	S	.	.			trans	-56.8	141.3	174.3	90.6	0	0	0	0	109	D38 L39	S36-D38 PolarHBondContact O-N 3.36Å; S36-D38 WeakPolarHBondContact OG-CB 3.35Å; S36-D38 PolarHBondContact OG-OD2 3.34Å; S36-L39 PolarHBondContact O-N 3.1Å
37	H	49.2	Very low	49.7	Very low	161 Å²	161	70.1 Å²	70.1	75%	0.745	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-13.9	179.7	-68.6	-68.4	0	0	0	113.5	F35 K192	F35-H37 PolarHBondContact O-N 2.84Å; H37-K192 PolarHBondContact O-NZ 2.85Å
38	D	50	Low	51.4	Low	56 Å²	56	63.8 Å²	63.8	30%	0.299	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-23.6	179.9	-37.9	-40.4	0	0	0	112.8	S36 R105 K192	S36-D38 PolarHBondContact O-N 3.36Å; S36-D38 WeakPolarHBondContact OG-CB 3.35Å; S36-D38 PolarHBondContact OG-OD2 3.34Å; D38-R105 IonicContact OD2-CZ 2.91Å; D38-R105 IonicContact OD2-NH1 3.32Å; D38-R105 IonicContact OD2-NH2 2.85Å; D38-R105 PolarHBondContact OD2-NH2 3Å; D38-K192 PolarHBondContact O-NZ 2.75Å
39	L	56.7	Low	52.6	Low	26 Å²	26	59.1 Å²	59.1	14%	0.136	30%	0.303	C	S	.	.			trans	-88.2	131.1	-174.5	-65.6	168.2	0	0	0	112.2	M1 F35 S36 V41 K192	M1-L39 HydrophobicContact CB-CD2 4.29Å; F35-L39 HydrophobicContact CB-CD1 4.39Å; F35-L39 HydrophobicContact CD1-CD1 3.92Å; S36-L39 PolarHBondContact O-N 3.1Å; L39-V41 HydrophobicContact CB-CG1 4.05Å; L39-V41 PolarHBondContact O-N 3.1Å; L39-K192 PolarHBondContact O-NZ 2.9Å
40	N	56.5	Low	54.1	Low	48 Å²	48	60 Å²	60	26%	0.257	31%	0.307	S	S	.	.			trans	-80.3	111.3	159.8	-51.8	-19.8	0	0	0	107.9	M1 K192	M1-N40 VanDerWaalsContact CA-O 3.23Å; M1-N40 WeakPolarHBondContact CA-O 3.4Å; M1-N40 HydrophobicContact CE-CB 3.14Å; M1-N40 VanDerWaalsContact CE-ND2 3.28Å; M1-N40 WeakPolarHBondContact CE-ND2 3.39Å; N40-K192 WeakPolarHBondContact OD1-CE 3.25Å; N40-K192 PolarHBondContact OD1-NZ 2.91Å; N40-K192 VanDerWaalsContact OD1-NZ 3.16Å
41	V	60.6	Low	55.5	Low	18 Å²	18	55.4 Å²	55.4	11%	0.109	28%	0.278	C	S	.	.			trans	-103	-3.7	-177.6	-67	0	0	0	0	112.1	I32 F35 L39 V52 G53	I32-V41 HydrophobicContact CD1-CG2 4.1Å; I32-V41 HydrophobicContact CG1-CG2 3.77Å; F35-V41 HydrophobicContact CB-CG1 3.76Å; F35-V41 HydrophobicContact CD1-CG1 3.81Å; F35-V41 HydrophobicContact CD2-CB 4.36Å; F35-V41 HydrophobicContact CD2-CG1 3.66Å; F35-V41 HydrophobicContact CE1-CG1 4.23Å; F35-V41 HydrophobicContact CE2-CG1 4.09Å; F35-V41 HydrophobicContact CG-CG1 3.47Å; F35-V41 VanDerWaalsContact CG-CG1 3.47Å; F35-V41 HydrophobicContact CZ-CG1 4.33Å; L39-V41 HydrophobicContact CB-CG1 4.05Å; L39-V41 PolarHBondContact O-N 3.1Å; V41-V52 CarbonylContact O-C 3.54Å; V41-V52 WeakPolarHBondContact O-CA 3.49Å; V41-G53 PolarHBondContact O-N 2.86Å
42	V	55.2	Low	56.3	Low	57 Å²	57	55.2 Å²	55.2	35%	0.345	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.3	176.8	-173.7	0	0	0	0	108.7	I32 L50 A51 V52	I32-V42 HydrophobicContact CD1-CG2 4.16Å; V42-L50 HydrophobicContact CG1-CD1 3.59Å; V42-L50 HydrophobicContact CG1-CG 4.5Å; V42-A51 CarbonylContact C-O 3.57Å; V42-A51 VanDerWaalsContact CA-O 3.31Å; V42-A51 WeakPolarHBondContact CA-O 3.14Å; V42-V52 HydrophobicContact CG1-CG2 4.41Å; V42-V52 HydrophobicContact CG2-CG1 4.29Å
43	D	63.6	Low	57.3	Low	27 Å²	27	52.7 Å²	52.7	14%	0.144	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	146.2	165.9	-169.6	25.4	0	0	0	110.3	R3 L4 A51	R3-D43 WeakPolarHBondContact CA-OD2 3.44Å; L4-D43 PolarHBondContact N-OD2 2.8Å; D43-A51 PolarHBondContact N-O 2.93Å; D43-A51 PolarHBondContact O-N 3Å
44	W	58.7	Low	58.5	Low	141 Å²	141	50.7 Å²	50.7	53%	0.534	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	118.9	-176.6	-167.9	-8.5	0	0	0	109.5	D48 L50 L63	W44-D48 PolarHBondContact NE1-OD1 3.28Å; W44-L50 HydrophobicContact CB-CD1 4.15Å; W44-L50 HydrophobicContact CG-CD1 4.33Å; W44-L63 HydrophobicContact CH2-CD1 4.28Å; W44-L63 HydrophobicContact CZ2-CD1 3.79Å
45	S	65.9	Low	59.5	Low	8 Å²	8	46.3 Å²	46.3	6%	0.056	23%	0.229	C	C	.	.			trans	-80.8	150	172.7	73.5	0	0	0	0	112.4	K47 D48 V49	S45-K47 PolarHBondContact O-N 2.76Å; S45-K47 PolarHBondContact OG-N 2.85Å; S45-D48 PolarHBondContact O-N 3.37Å; S45-V49 PolarHBondContact N-O 3.15Å; S45-V49 VanDerWaalsContact OG-CB 3.28Å; S45-V49 WeakPolarHBondContact OG-CB 3.49Å; S45-V49 PolarHBondContact OG-N 3.46Å; S45-V49 PolarHBondContact OG-O 2.72Å
46	Y	59.7	Low	60.6	Low	86 Å²	86	49.7 Å²	49.7	34%	0.337	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-8.1	163.7	67.8	-69.2	0	0	0	116.4	H5 P6 D7 R8 V9	H5-Y46 WeakPolarHBondContact O-CE1 3.39Å; P6-Y46 VanDerWaalsContact CA-CE1 3.43Å; P6-Y46 WeakPolarHBondContact O-CD1 3.49Å; P6-Y46 WeakPolarHBondContact O-CD2 3.49Å; P6-Y46 WeakPolarHBondContact O-CE1 3.42Å; P6-Y46 WeakPolarHBondContact O-CE2 3.3Å; P6-Y46 PolarHBondContact O-OH 2.88Å; D7-Y46 WeakPolarHBondContact CA-OH 3.17Å; D7-Y46 PolarHBondContact N-OH 2.86Å; D7-Y46 PolarHBondContact O-OH 2.97Å; R8-Y46 PolarHBondContact N-OH 2.89Å; V9-Y46 HydrophobicContact CG2-CE1 4.12Å; V9-Y46 PolarHBondContact N-OH 2.93Å
47	K	61.9	Low	61.2	Low	64 Å²	64	49.2 Å²	49.2	28%	0.278	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	21.5	173	-57.6	-146.8	-178.9	-169.5	0	113.1	V9 S45 V49	V9-K47 HydrophobicContact CB-CB 4.11Å; V9-K47 HydrophobicContact CB-CD 3.67Å; V9-K47 HydrophobicContact CB-CG 3.85Å; V9-K47 HydrophobicContact CG1-CB 3.96Å; V9-K47 HydrophobicContact CG1-CD 3.96Å; V9-K47 HydrophobicContact CG1-CG 4.19Å; V9-K47 VanDerWaalsContact O-CD 3.23Å; V9-K47 WeakPolarHBondContact O-CD 3.43Å; V9-K47 WeakPolarHBondContact O-CE 3.26Å; V9-K47 PolarHBondContact O-NZ 3.26Å; S45-K47 PolarHBondContact O-N 2.76Å; S45-K47 PolarHBondContact OG-N 2.85Å; K47-V49 PolarHBondContact O-N 2.87Å; K47-V49 VanDerWaalsContact O-N 3.17Å
48	D	68.2	Low	61.9	Low	58 Å²	58	42 Å²	42	31%	0.31	21%	0.206	S	C	.	.	S	Bend	trans	56.8	28.7	-176.3	-65.2	-38.8	0	0	0	114	W44 S45 T62 L63	W44-D48 PolarHBondContact NE1-OD1 3.28Å; S45-D48 PolarHBondContact O-N 3.37Å; D48-T62 CarbonylContact O-C 3.53Å; D48-T62 WeakPolarHBondContact O-CA 3.11Å; D48-L63 HydrophobicContact CB-CB 4.25Å; D48-L63 WeakPolarHBondContact CB-O 3.28Å; D48-L63 PolarHBondContact O-N 3.15Å
49	V	65.2	Low	62.7	Low	13 Å²	13	41.7 Å²	41.7	8%	0.079	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	119.7	168.5	-177.9	0	0	0	0	108.4	L4 V9 S45 K47 V60 C61	L4-V49 HydrophobicContact CD1-CG1 4.36Å; L4-V49 VanDerWaalsContact CD1-O 3.32Å; L4-V49 WeakPolarHBondContact CD1-O 3.42Å; V9-V49 HydrophobicContact CG1-CG2 3.92Å; S45-V49 PolarHBondContact N-O 3.15Å; S45-V49 VanDerWaalsContact OG-CB 3.28Å; S45-V49 WeakPolarHBondContact OG-CB 3.49Å; S45-V49 PolarHBondContact OG-N 3.46Å; S45-V49 PolarHBondContact OG-O 2.72Å; K47-V49 PolarHBondContact O-N 2.87Å; K47-V49 VanDerWaalsContact O-N 3.17Å; V49-V60 HydrophobicContact CG1-CG1 3.09Å; V49-C61 WeakPolarHBondContact CA-O 3.31Å
50	L	69.9	Low	63.4	Low	21 Å²	21	40.9 Å²	40.9	11%	0.11	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125.6	173.9	-176.6	71.5	0	0	0	108.7	V42 W44 V52 V60 C61 L63	V42-L50 HydrophobicContact CG1-CD1 3.59Å; V42-L50 HydrophobicContact CG1-CG 4.5Å; W44-L50 HydrophobicContact CB-CD1 4.15Å; W44-L50 HydrophobicContact CG-CD1 4.33Å; L50-V52 HydrophobicContact CD1-CG2 4.5Å; L50-V52 HydrophobicContact CD2-CG2 3.75Å; L50-V52 HydrophobicContact CG-CG2 3.76Å; L50-V60 VanDerWaalsContact O-CA 3.3Å; L50-V60 WeakPolarHBondContact O-CA 3.38Å; L50-C61 PolarHBondContact N-O 2.92Å; L50-C61 PolarHBondContact O-N 3.17Å; L50-L63 HydrophobicContact CB-CD1 4Å; L50-L63 HydrophobicContact CB-CG 4.26Å; L50-L63 HydrophobicContact CD2-CD1 4.34Å
51	A	66.6	Low	64	Low	2 Å²	2	39.1 Å²	39.1	2%	0.017	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.9	170.4	0	0	0	0	0	109.1	L4 V42 D43 L58 F59 V60	L4-A51 HydrophobicContact CD1-CB 3.98Å; L4-A51 HydrophobicContact CD2-CB 4.25Å; L4-A51 HydrophobicContact CG-CB 4.15Å; V42-A51 CarbonylContact C-O 3.57Å; V42-A51 VanDerWaalsContact CA-O 3.31Å; V42-A51 WeakPolarHBondContact CA-O 3.14Å; D43-A51 PolarHBondContact N-O 2.93Å; D43-A51 PolarHBondContact O-N 3Å; A51-L58 HydrophobicContact CB-CD1 4.25Å; A51-F59 CarbonylContact C-O 3.56Å; A51-F59 WeakPolarHBondContact CA-O 3.3Å; A51-V60 HydrophobicContact CB-CG2 4.2Å
52	V	66.5	Low	64.5	Low	16 Å²	16	41 Å²	41	10%	0.097	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	124.9	-179	-173.3	0	0	0	0	109.2	V41 V42 L50 L54 F59	V41-V52 CarbonylContact O-C 3.54Å; V41-V52 WeakPolarHBondContact O-CA 3.49Å; V42-V52 HydrophobicContact CG1-CG2 4.41Å; V42-V52 HydrophobicContact CG2-CG1 4.29Å; L50-V52 HydrophobicContact CD1-CG2 4.5Å; L50-V52 HydrophobicContact CD2-CG2 3.75Å; L50-V52 HydrophobicContact CG-CG2 3.76Å; V52-L54 HydrophobicContact CG1-CD2 3.8Å; V52-L54 HydrophobicContact CG1-CG 3.93Å; V52-F59 PolarHBondContact N-O 2.98Å; V52-F59 PolarHBondContact O-N 3.4Å
53	G	59.4	Low	64.9	Low	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	126.1	165.8	0	0	0	0	0	110.7	F35 V41 D57	F35-G53 VanDerWaalsContact CE2-O 3.32Å; F35-G53 WeakPolarHBondContact CE2-O 3.27Å; V41-G53 PolarHBondContact O-N 2.86Å; G53-D57 CarbonylContact C-O 3.58Å; G53-D57 WeakPolarHBondContact CA-O 3.38Å
54	L	61.3	Low	65.1	Low	37 Å²	37	44.3 Å²	44.3	19%	0.194	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	122.1	172.9	-58.9	174.5	0	0	0	108.7	A29 I32 V52 Q56 D57 F59	A29-L54 HydrophobicContact CB-CD2 3.77Å; I32-L54 HydrophobicContact CB-CD2 4.46Å; V52-L54 HydrophobicContact CG1-CD2 3.8Å; V52-L54 HydrophobicContact CG1-CG 3.93Å; L54-Q56 PolarHBondContact O-N 3.49Å; L54-D57 PolarHBondContact N-O 3.33Å; L54-D57 PolarHBondContact O-N 2.9Å; L54-F59 HydrophobicContact CB-CD2 3.97Å; L54-F59 HydrophobicContact CB-CE2 3.9Å; L54-F59 HydrophobicContact CD1-CD2 3.86Å; L54-F59 HydrophobicContact CD1-CE2 4.11Å; L54-F59 HydrophobicContact CG-CD2 4.05Å; L54-F59 HydrophobicContact CG-CE2 4.39Å
55	D	64.8	Low	65.6	Low	62 Å²	62	44.4 Å²	44.4	33%	0.332	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	-114	-172.2	-65	-59.8	0	0	0	112.7	S31 K34 F35	S31-D55 WeakPolarHBondContact CB-OD1 3.37Å; S31-D55 WeakPolarHBondContact CB-OD2 3.42Å; S31-D55 PolarHBondContact OG-OD2 2.86Å; K34-D55 WeakPolarHBondContact CD-OD1 3.43Å; K34-D55 IonicContact NZ-OD1 3.07Å; K34-D55 PolarHBondContact NZ-OD1 3.18Å; F35-D55 WeakPolarHBondContact CE1-O 3.48Å; F35-D55 WeakPolarHBondContact CZ-O 3.38Å
56	Q	64.4	Low	65.3	Low	97 Å²	97	45.6 Å²	45.6	45%	0.453	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101	12.8	177.1	-67.3	177.2	5.6	0	0	111.5	L54 E77 Y78	L54-Q56 PolarHBondContact O-N 3.49Å; Q56-E77 HydrophobicContact CB-CG 4.31Å; Q56-E77 CarbonylContact O-C 3.48Å; Q56-E77 VanDerWaalsContact O-CA 3.25Å; Q56-E77 WeakPolarHBondContact O-CA 3.45Å; Q56-Y78 WeakPolarHBondContact O-CB 3.37Å; Q56-Y78 PolarHBondContact O-N 3.03Å
57	D	61	Low	65.1	Low	35 Å²	35	47.1 Å²	47.1	19%	0.187	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	135.2	-170.1	-71	-33	0	0	0	112.8	G53 L54 F59 R74	G53-D57 CarbonylContact C-O 3.58Å; G53-D57 WeakPolarHBondContact CA-O 3.38Å; L54-D57 PolarHBondContact N-O 3.33Å; L54-D57 PolarHBondContact O-N 2.9Å; D57-F59 HydrophobicContact CB-CD2 4.12Å; D57-F59 HydrophobicContact CB-CE2 3.39Å; D57-F59 HydrophobicContact CB-CZ 3.8Å; D57-R74 HydrophobicContact CB-CG 4.3Å; D57-R74 IonicContact OD1-CZ 3.45Å; D57-R74 IonicContact OD1-NE 3.79Å; D57-R74 PolarHBondContact OD1-NE 3.35Å; D57-R74 IonicContact OD1-NH2 2.7Å; D57-R74 PolarHBondContact OD1-NH2 3.19Å; D57-R74 IonicContact OD2-CZ 2.69Å; D57-R74 IonicContact OD2-NE 2.87Å; D57-R74 PolarHBondContact OD2-NE 3.36Å; D57-R74 IonicContact OD2-NH2 2.69Å
58	L	63.8	Low	65.3	Low	10 Å²	10	48 Å²	48	5%	0.052	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.8	167.8	176.8	61.2	0	0	0	109.4	F2 A51 V60 R74 L75 A76	F2-L58 HydrophobicContact CB-CD1 4.4Å; F2-L58 HydrophobicContact CD1-CD1 3.78Å; F2-L58 HydrophobicContact CD1-CD2 3.75Å; F2-L58 HydrophobicContact CD1-CG 4.25Å; F2-L58 HydrophobicContact CD2-CD1 3.68Å; F2-L58 HydrophobicContact CE1-CB 3.98Å; F2-L58 HydrophobicContact CE1-CD1 3.89Å; F2-L58 HydrophobicContact CE1-CD2 3.81Å; F2-L58 HydrophobicContact CE1-CG 4.1Å; F2-L58 HydrophobicContact CE2-CD1 3.81Å; F2-L58 HydrophobicContact CG-CD1 3.66Å; F2-L58 HydrophobicContact CG-CD2 4.41Å; F2-L58 HydrophobicContact CZ-CB 3.95Å; F2-L58 HydrophobicContact CZ-CD1 3.91Å; F2-L58 HydrophobicContact CZ-CG 4.34Å; A51-L58 HydrophobicContact CB-CD1 4.25Å; L58-V60 HydrophobicContact CG-CG2 4.38Å; L58-R74 CarbonylContact O-C 3.49Å; L58-R74 WeakPolarHBondContact O-CA 3.23Å; L58-L75 HydrophobicContact CB-CB 4.49Å; L58-L75 HydrophobicContact CD2-CB 4.11Å; L58-L75 HydrophobicContact CD2-CD1 4.03Å; L58-L75 HydrophobicContact CG-CB 4.23Å; L58-L75 HydrophobicContact CG-CD1 4.46Å; L58-L75 PolarHBondContact O-N 3.08Å; L58-A76 HydrophobicContact CB-CB 4.4Å; L58-A76 PolarHBondContact N-O 2.77Å
59	F	67.3	Low	65	Low	49 Å²	49	49.1 Å²	49.1	22%	0.215	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	146.2	171.9	-65.4	-83.4	0	0	0	111.1	A51 V52 L54 D57 V72 Q73 R74	A51-F59 CarbonylContact C-O 3.56Å; A51-F59 WeakPolarHBondContact CA-O 3.3Å; V52-F59 PolarHBondContact N-O 2.98Å; V52-F59 PolarHBondContact O-N 3.4Å; L54-F59 HydrophobicContact CB-CD2 3.97Å; L54-F59 HydrophobicContact CB-CE2 3.9Å; L54-F59 HydrophobicContact CD1-CD2 3.86Å; L54-F59 HydrophobicContact CD1-CE2 4.11Å; L54-F59 HydrophobicContact CG-CD2 4.05Å; L54-F59 HydrophobicContact CG-CE2 4.39Å; D57-F59 HydrophobicContact CB-CD2 4.12Å; D57-F59 HydrophobicContact CB-CE2 3.39Å; D57-F59 HydrophobicContact CB-CZ 3.8Å; F59-V72 HydrophobicContact CB-CG1 4Å; F59-V72 HydrophobicContact CD1-CG1 3.77Å; F59-V72 HydrophobicContact CG-CG1 4.2Å; F59-Q73 CarbonylContact C-O 3.56Å; F59-Q73 VanDerWaalsContact CA-O 3.29Å; F59-Q73 WeakPolarHBondContact CA-O 3.43Å; F59-R74 HydrophobicContact CD1-CB 4.18Å; F59-R74 HydrophobicContact CE1-CB 3.87Å; F59-R74 HydrophobicContact CE1-CG 4.37Å
60	V	70.1	Confident	64.8	Low	10 Å²	10	50 Å²	50	6%	0.061	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135	174.6	-172.2	0	0	0	0	109.7	V49 L50 A51 L58 Q73 L75 V90	V49-V60 HydrophobicContact CG1-CG1 3.09Å; L50-V60 VanDerWaalsContact O-CA 3.3Å; L50-V60 WeakPolarHBondContact O-CA 3.38Å; A51-V60 HydrophobicContact CB-CG2 4.2Å; L58-V60 HydrophobicContact CG-CG2 4.38Å; V60-Q73 PolarHBondContact N-O 2.95Å; V60-Q73 PolarHBondContact O-N 2.77Å; V60-L75 HydrophobicContact CB-CD1 4.16Å; V60-L75 HydrophobicContact CB-CG 4.37Å; V60-L75 HydrophobicContact CG2-CD1 3.21Å; V60-L75 HydrophobicContact CG2-CG 3.74Å; V60-V90 HydrophobicContact CG1-CG1 4Å
61	C	70.5	Confident	64.4	Low	10 Å²	10	56.1 Å²	56.1	7%	0.068	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	154.8	176.1	69.1	0	0	0	0	111.1	V49 L50 I68 V72	V49-C61 WeakPolarHBondContact CA-O 3.31Å; L50-C61 PolarHBondContact N-O 2.92Å; L50-C61 PolarHBondContact O-N 3.17Å; C61-I68 HydrophobicContact CB-CG2 4.04Å; C61-V72 HydrophobicContact CB-CG2 4.06Å
62	T	70.6	Confident	64.3	Low	59 Å²	59	59.7 Å²	59.7	36%	0.362	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.2	173.4	-52.7	0	0	0	0	109.2	D48 T69 G70	D48-T62 CarbonylContact O-C 3.53Å; D48-T62 WeakPolarHBondContact O-CA 3.11Å; T62-T69 PolarHBondContact O-N 3.39Å; T62-G70 PolarHBondContact O-N 3.24Å
63	L	64.7	Low	64.4	Low	20 Å²	20	61.8 Å²	61.8	11%	0.105	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	143.1	173.6	-57.3	176.3	0	0	0	109.1	W44 D48 L50 D67 I68	W44-L63 HydrophobicContact CH2-CD1 4.28Å; W44-L63 HydrophobicContact CZ2-CD1 3.79Å; D48-L63 HydrophobicContact CB-CB 4.25Å; D48-L63 WeakPolarHBondContact CB-O 3.28Å; D48-L63 PolarHBondContact O-N 3.15Å; L50-L63 HydrophobicContact CB-CD1 4Å; L50-L63 HydrophobicContact CB-CG 4.26Å; L50-L63 HydrophobicContact CD2-CD1 4.34Å; L63-D67 CarbonylContact C-O 3.59Å; L63-D67 VanDerWaalsContact CA-O 3.3Å; L63-D67 WeakPolarHBondContact CA-O 3.32Å; L63-I68 HydrophobicContact CD2-CB 4.41Å; L63-I68 HydrophobicContact CD2-CG1 3.67Å
64	R	66.8	Low	64.8	Low	132 Å²	132	67.9 Å²	67.9	50%	0.498	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	129.9	161.6	-75.5	-177.2	175.6	-154.5	-1	108	G66 D67 T69	R64-G66 PolarHBondContact O-N 2.83Å; R64-D67 PolarHBondContact N-O 2.72Å; R64-D67 PolarHBondContact O-N 2.96Å; R64-D67 VanDerWaalsContact O-N 3.08Å; R64-T69 HydrophobicContact CB-CG2 3.71Å; R64-T69 WeakPolarHBondContact CB-OG1 3.49Å; R64-T69 HydrophobicContact CG-CG2 4.48Å; R64-T69 WeakPolarHBondContact CG-OG1 2.98Å; R64-T69 PolarHBondContact N-OG1 2.92Å
65	Q	68.8	Low	64.9	Low	144 Å²	144	67 Å²	67	67%	0.673	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	36.5	177.5	-60.9	178.8	-19	0	0	113.6	D67	Q65-D67 VanDerWaalsContact C-N 3.3Å; Q65-D67 PolarHBondContact O-N 3.37Å
66	G	60.2	Low	64.6	Low	32 Å²	32	64.6 Å²	64.6	33%	0.33	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	7.1	178	0	0	0	0	0	115	T22 R64	T22-G66 PolarHBondContact OG1-O 2.96Å; T22-G66 VanDerWaalsContact OG1-O 3.09Å; R64-G66 PolarHBondContact O-N 2.83Å
67	D	55.6	Low	64.2	Low	118 Å²	118	66 Å²	66	63%	0.631	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	149.6	178	-132.5	-18.8	0	0	0	111.8	L63 R64 Q65 T69	L63-D67 CarbonylContact C-O 3.59Å; L63-D67 VanDerWaalsContact CA-O 3.3Å; L63-D67 WeakPolarHBondContact CA-O 3.32Å; R64-D67 PolarHBondContact N-O 2.72Å; R64-D67 PolarHBondContact O-N 2.96Å; R64-D67 VanDerWaalsContact O-N 3.08Å; Q65-D67 VanDerWaalsContact C-N 3.3Å; Q65-D67 PolarHBondContact O-N 3.37Å; D67-T69 PolarHBondContact O-N 2.93Å
68	I	65.6	Low	64	Low	84 Å²	84	67 Å²	67	43%	0.431	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	107.5	175.1	-59.7	172.2	0	0	0	107.4	C61 L63 G70 V72	C61-I68 HydrophobicContact CB-CG2 4.04Å; L63-I68 HydrophobicContact CD2-CB 4.41Å; L63-I68 HydrophobicContact CD2-CG1 3.67Å; I68-G70 WeakPolarHBondContact CG2-O 2.86Å; I68-V72 HydrophobicContact CG2-CG2 4.2Å
69	T	62.6	Low	63.5	Low	80 Å²	80	70.1 Å²	70.1	49%	0.491	36%	0.359	S	S	.	.			trans	-104.9	-9	-176.2	54.9	0	0	0	0	113.5	T62 R64 D67	T62-T69 PolarHBondContact O-N 3.39Å; R64-T69 HydrophobicContact CB-CG2 3.71Å; R64-T69 WeakPolarHBondContact CB-OG1 3.49Å; R64-T69 HydrophobicContact CG-CG2 4.48Å; R64-T69 WeakPolarHBondContact CG-OG1 2.98Å; R64-T69 PolarHBondContact N-OG1 2.92Å; D67-T69 PolarHBondContact O-N 2.93Å
70	G	61.1	Low	62.8	Low	31 Å²	31	73.3 Å²	73.3	32%	0.32	37%	0.374	S	S	.	.	S	Bend	trans	-110	166.7	175.6	0	0	0	0	0	113.3	T62 I68	T62-G70 PolarHBondContact O-N 3.24Å; I68-G70 WeakPolarHBondContact CG2-O 2.86Å
71	E	60.4	Low	61.9	Low	150 Å²	150	77.9 Å²	77.9	70%	0.701	40%	0.402	S	S	*	.			trans	-62.6	134.6	169.5	-166.1	-176.6	-159.4	0	0	109.8	Q73	E71-Q73 HydrophobicContact CB-CG 4.38Å; E71-Q73 PolarHBondContact O-N 2.68Å
72	V	65.1	Low	61.3	Low	78 Å²	78	81.7 Å²	81.7	47%	0.473	42%	0.422	S	S	.	.			trans	-75.2	113.4	171.8	179.1	0	0	0	0	107.7	F59 C61 I68	F59-V72 HydrophobicContact CB-CG1 4Å; F59-V72 HydrophobicContact CD1-CG1 3.77Å; F59-V72 HydrophobicContact CG-CG1 4.2Å; C61-V72 HydrophobicContact CB-CG2 4.06Å; I68-V72 HydrophobicContact CG2-CG2 4.2Å
73	Q	67.5	Low	60.9	Low	60 Å²	60	83.3 Å²	83.3	28%	0.28	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.5	-172.5	-64.2	-175.2	-1.3	0	0	111.4	F59 V60 E71 L75	F59-Q73 CarbonylContact C-O 3.56Å; F59-Q73 VanDerWaalsContact CA-O 3.29Å; F59-Q73 WeakPolarHBondContact CA-O 3.43Å; V60-Q73 PolarHBondContact N-O 2.95Å; V60-Q73 PolarHBondContact O-N 2.77Å; E71-Q73 HydrophobicContact CB-CG 4.38Å; E71-Q73 PolarHBondContact O-N 2.68Å; Q73-L75 PolarHBondContact O-N 3Å
74	R	68.9	Low	60.7	Low	128 Å²	128	85.5 Å²	85.5	48%	0.483	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	118	166	-174	-176.4	179.1	-148.9	1.6	108.8	D57 L58 F59 E77	D57-R74 HydrophobicContact CB-CG 4.3Å; D57-R74 IonicContact OD1-CZ 3.45Å; D57-R74 IonicContact OD1-NE 3.79Å; D57-R74 PolarHBondContact OD1-NE 3.35Å; D57-R74 IonicContact OD1-NH2 2.7Å; D57-R74 PolarHBondContact OD1-NH2 3.19Å; D57-R74 IonicContact OD2-CZ 2.69Å; D57-R74 IonicContact OD2-NE 2.87Å; D57-R74 PolarHBondContact OD2-NE 3.36Å; D57-R74 IonicContact OD2-NH2 2.69Å; L58-R74 CarbonylContact O-C 3.49Å; L58-R74 WeakPolarHBondContact O-CA 3.23Å; F59-R74 HydrophobicContact CD1-CB 4.18Å; F59-R74 HydrophobicContact CE1-CB 3.87Å; F59-R74 HydrophobicContact CE1-CG 4.37Å; R74-E77 IonicContact CZ-OE2 3.25Å; R74-E77 IonicContact NH2-OE2 3.76Å; R74-E77 PolarHBondContact NH2-OE2 3.28Å
75	L	62.8	Low	60.8	Low	18 Å²	18	80.2 Å²	80.2	9%	0.094	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-41.3	178.7	-80	-173.3	0	0	0	113.3	L58 V60 Q73 W88 V90 K93	L58-L75 HydrophobicContact CB-CB 4.49Å; L58-L75 HydrophobicContact CD2-CB 4.11Å; L58-L75 HydrophobicContact CD2-CD1 4.03Å; L58-L75 HydrophobicContact CG-CB 4.23Å; L58-L75 HydrophobicContact CG-CD1 4.46Å; L58-L75 PolarHBondContact O-N 3.08Å; V60-L75 HydrophobicContact CB-CD1 4.16Å; V60-L75 HydrophobicContact CB-CG 4.37Å; V60-L75 HydrophobicContact CG2-CD1 3.21Å; V60-L75 HydrophobicContact CG2-CG 3.74Å; Q73-L75 PolarHBondContact O-N 3Å; L75-W88 WeakPolarHBondContact O-CZ3 3.22Å; L75-V90 HydrophobicContact CD1-CB 4.35Å; L75-V90 HydrophobicContact CD1-CG1 4.17Å; L75-V90 HydrophobicContact CD1-CG2 3.91Å; L75-V90 HydrophobicContact CD2-CG1 4.48Å; L75-K93 HydrophobicContact CD2-CB 4.47Å; L75-K93 HydrophobicContact CD2-CG 4.13Å
76	A	59	Low	60.6	Low	12 Å²	12	75.1 Å²	75.1	10%	0.099	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	148.7	-169.3	0	0	0	0	0	111.5	L58 W88	L58-A76 HydrophobicContact CB-CB 4.4Å; L58-A76 PolarHBondContact N-O 2.77Å; A76-W88 HydrophobicContact CB-CD2 4.3Å; A76-W88 HydrophobicContact CB-CE3 4.47Å; A76-W88 HydrophobicContact CB-CH2 3.52Å; A76-W88 HydrophobicContact CB-CZ2 3.3Å; A76-W88 HydrophobicContact CB-CZ3 4.11Å
77	E	56.9	Low	61	Low	125 Å²	125	75.3 Å²	75.3	58%	0.584	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	131.6	161.7	-159.1	166.5	148.3	0	0	108.6	Q56 R74	Q56-E77 HydrophobicContact CB-CG 4.31Å; Q56-E77 CarbonylContact O-C 3.48Å; Q56-E77 VanDerWaalsContact O-CA 3.25Å; Q56-E77 WeakPolarHBondContact O-CA 3.45Å; R74-E77 IonicContact CZ-OE2 3.25Å; R74-E77 IonicContact NH2-OE2 3.76Å; R74-E77 PolarHBondContact NH2-OE2 3.28Å
78	Y	55	Low	61.6	Low	56 Å²	56	73.2 Å²	73.2	22%	0.22	38%	0.377	C	S	.	.			trans	-84.5	110.4	175.8	178.4	-111.9	0	0	0	108.4	Q56 E80	Q56-Y78 WeakPolarHBondContact O-CB 3.37Å; Q56-Y78 PolarHBondContact O-N 3.03Å; Y78-E80 HydrophobicContact CD1-CG 3.7Å; Y78-E80 HydrophobicContact CE1-CB 4.38Å; Y78-E80 HydrophobicContact CE1-CG 3.29Å; Y78-E80 PolarHBondContact O-N 3.47Å
79	D	55.2	Low	61.6	Low	77 Å²	77	71.4 Å²	71.4	41%	0.412	37%	0.369	S	S	.	.			trans	-87.6	103.1	173.4	178.3	12.6	0	0	0	109.9	T81 N82	D79-T81 VanDerWaalsContact CG-OG1 3.3Å; D79-T81 PolarHBondContact O-N 3.09Å; D79-T81 WeakPolarHBondContact OD1-CB 3.12Å; D79-T81 PolarHBondContact OD1-N 3.15Å; D79-T81 PolarHBondContact OD1-OG1 3.23Å; D79-T81 PolarHBondContact OD2-OG1 3.28Å; D79-N82 PolarHBondContact OD2-ND2 3.47Å
80	E	52.5	Low	61.9	Low	116 Å²	116	69.5 Å²	69.5	54%	0.542	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-63	-24.5	175.8	-81.1	-173.3	-179.6	0	0	113.4	Y78 N82	Y78-E80 HydrophobicContact CD1-CG 3.7Å; Y78-E80 HydrophobicContact CE1-CB 4.38Å; Y78-E80 HydrophobicContact CE1-CG 3.29Å; Y78-E80 PolarHBondContact O-N 3.47Å; E80-N82 VanDerWaalsContact C-N 3.33Å; E80-N82 PolarHBondContact O-N 3.04Å
81	T	51.1	Low	62.2	Low	105 Å²	105	71 Å²	71	64%	0.644	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-74.6	-22.3	-166.1	59.8	0	0	0	0	113.9	D79	D79-T81 VanDerWaalsContact CG-OG1 3.3Å; D79-T81 PolarHBondContact O-N 3.09Å; D79-T81 WeakPolarHBondContact OD1-CB 3.12Å; D79-T81 PolarHBondContact OD1-N 3.15Å; D79-T81 PolarHBondContact OD1-OG1 3.23Å; D79-T81 PolarHBondContact OD2-OG1 3.28Å
82	N	56.3	Low	62.7	Low	91 Å²	91	69.8 Å²	69.8	49%	0.487	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-112.5	0.2	-169.8	-71.9	-53.8	0	0	0	115.3	D79 E80 I84	D79-N82 PolarHBondContact OD2-ND2 3.47Å; E80-N82 VanDerWaalsContact C-N 3.33Å; E80-N82 PolarHBondContact O-N 3.04Å; N82-I84 HydrophobicContact CB-CB 4.47Å; N82-I84 HydrophobicContact CB-CD1 3.53Å; N82-I84 HydrophobicContact CB-CG1 3.8Å; N82-I84 WeakPolarHBondContact O-CG1 3.16Å; N82-I84 PolarHBondContact O-N 3.21Å
83	F	63.5	Low	62.9	Low	93 Å²	93	71.5 Å²	71.5	41%	0.408	37%	0.368	S	S	.	.			trans	48.8	26.9	-176.5	-52.9	-57.5	0	0	0	114.1	G103 R105	F83-G103 WeakPolarHBondContact CD2-O 2.75Å; F83-R105 HydrophobicContact CD1-CB 3.73Å; F83-R105 HydrophobicContact CE1-CB 4.18Å
84	I	59.7	Low	63.1	Low	66 Å²	66	74.6 Å²	74.6	34%	0.338	38%	0.38	S	S	.	.			trans	-81.4	122.7	-175.3	-75.9	168.5	0	0	0	108.9	N82 T98	N82-I84 HydrophobicContact CB-CB 4.47Å; N82-I84 HydrophobicContact CB-CD1 3.53Å; N82-I84 HydrophobicContact CB-CG1 3.8Å; N82-I84 WeakPolarHBondContact O-CG1 3.16Å; N82-I84 PolarHBondContact O-N 3.21Å; I84-T98 HydrophobicContact CB-CG2 4.41Å; I84-T98 HydrophobicContact CD1-CG2 4.28Å; I84-T98 HydrophobicContact CG1-CG2 4.22Å; I84-T98 HydrophobicContact CG2-CG2 3.35Å
85	S	68.4	Low	63.2	Low	20 Å²	20	75 Å²	75	14%	0.14	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	149	161.9	-67.3	0	0	0	0	109.5	L99 V106	S85-L99 WeakPolarHBondContact CB-O 3.35Å; S85-L99 PolarHBondContact N-O 2.87Å; S85-L99 VanDerWaalsContact N-O 3.09Å; S85-L99 CarbonylContact O-C 3.49Å; S85-L99 WeakPolarHBondContact O-CA 2.98Å; S85-L99 PolarHBondContact O-N 2.94Å; S85-V106 VanDerWaalsContact OG-CB 3.31Å; S85-V106 WeakPolarHBondContact OG-CB 3.24Å; S85-V106 VanDerWaalsContact OG-CG2 3.25Å; S85-V106 WeakPolarHBondContact OG-CG2 3.5Å
86	A	65.5	Low	63.6	Low	38 Å²	38	78.5 Å²	78.5	31%	0.314	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	138.2	-179.8	0	0	0	0	0	111.5	R95 Q97	A86-R95 HydrophobicContact CB-CG 4.05Å; A86-Q97 CarbonylContact C-O 3.54Å; A86-Q97 VanDerWaalsContact CA-O 3.26Å; A86-Q97 WeakPolarHBondContact CA-O 3.16Å
87	L	68	Low	64.2	Low	35 Å²	35	80 Å²	80	18%	0.183	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.3	167.5	-177.5	70.1	0	0	0	108.9	L96 Q97 W111 M130	L87-L96 HydrophobicContact CD2-CB 4.13Å; L87-L96 HydrophobicContact CD2-CD1 3.88Å; L87-L96 HydrophobicContact CG-CB 4.29Å; L87-L96 HydrophobicContact CG-CD1 4.25Å; L87-L96 PolarHBondContact O-N 3.41Å; L87-Q97 HydrophobicContact CB-CB 4.21Å; L87-Q97 PolarHBondContact N-O 3.42Å; L87-Q97 PolarHBondContact O-N 3.4Å; L87-W111 HydrophobicContact CD1-CH2 3.97Å; L87-W111 HydrophobicContact CD1-CZ2 3.86Å; L87-M130 HydrophobicContact CB-CE 3.76Å; L87-M130 HydrophobicContact CD1-CE 4.31Å; L87-M130 HydrophobicContact CD2-CE 3.36Å; L87-M130 HydrophobicContact CG-CE 3.97Å
88	W	67.8	Low	65	Low	74 Å²	74	77 Å²	77	28%	0.28	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	139.8	178.5	-71.6	81.7	0	0	0	111.2	L75 A76 R95	L75-W88 WeakPolarHBondContact O-CZ3 3.22Å; A76-W88 HydrophobicContact CB-CD2 4.3Å; A76-W88 HydrophobicContact CB-CE3 4.47Å; A76-W88 HydrophobicContact CB-CH2 3.52Å; A76-W88 HydrophobicContact CB-CZ2 3.3Å; A76-W88 HydrophobicContact CB-CZ3 4.11Å; W88-R95 HydrophobicContact CD2-CB 3.97Å; W88-R95 HydrophobicContact CD2-CG 4.39Å; W88-R95 HydrophobicContact CE3-CB 4.04Å; W88-R95 VanDerWaalsContact CE3-N 3.33Å; W88-R95 HydrophobicContact CH2-CB 3.89Å; W88-R95 HydrophobicContact CZ2-CB 3.8Å; W88-R95 HydrophobicContact CZ2-CG 4.14Å; W88-R95 HydrophobicContact CZ3-CB 4.01Å
89	N	67.2	Low	65.7	Low	46 Å²	46	74.7 Å²	74.7	25%	0.246	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	112.4	161.9	-172.6	-27	0	0	0	108	G91 E92 K93 K94 L96	N89-G91 PolarHBondContact OD1-N 2.87Å; N89-E92 HydrophobicContact CB-CB 4.06Å; N89-E92 WeakPolarHBondContact ND2-CG 3.28Å; N89-E92 PolarHBondContact ND2-OE1 3.39Å; N89-E92 PolarHBondContact ND2-OE2 3.17Å; N89-E92 VanDerWaalsContact ND2-OE2 3.12Å; N89-E92 PolarHBondContact OD1-N 3.16Å; N89-E92 VanDerWaalsContact OD1-N 3.14Å; N89-K93 WeakPolarHBondContact O-CA 3.4Å; N89-K93 PolarHBondContact O-N 2.58Å; N89-K94 PolarHBondContact N-O 2.83Å; N89-K94 PolarHBondContact O-N 3.19Å; N89-K94 VanDerWaalsContact O-N 3.09Å; N89-L96 HydrophobicContact CB-CD1 3.87Å; N89-L96 HydrophobicContact CB-CD2 3.9Å; N89-L96 HydrophobicContact CB-CG 3.81Å
90	V	68.9	Low	66.3	Low	41 Å²	41	74.8 Å²	74.8	25%	0.248	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-42.8	-180	179.1	0	0	0	0	111.1	L4 V60 L75 K93	L4-V90 HydrophobicContact CD2-CG2 4.29Å; V60-V90 HydrophobicContact CG1-CG1 4Å; L75-V90 HydrophobicContact CD1-CB 4.35Å; L75-V90 HydrophobicContact CD1-CG1 4.17Å; L75-V90 HydrophobicContact CD1-CG2 3.91Å; L75-V90 HydrophobicContact CD2-CG1 4.48Å; V90-K93 PolarHBondContact O-N 2.96Å
91	G	67	Low	66.8	Low	63 Å²	63	69.8 Å²	69.8	65%	0.649	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-37.5	-177.3	0	0	0	0	0	113.1	N89	N89-G91 PolarHBondContact OD1-N 2.87Å
92	E	70.6	Confident	67.5	Low	124 Å²	124	65.3 Å²	65.3	58%	0.579	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-4.8	176.7	-66.1	175.4	-179.9	0	0	113.4	N89 K94	N89-E92 HydrophobicContact CB-CB 4.06Å; N89-E92 WeakPolarHBondContact ND2-CG 3.28Å; N89-E92 PolarHBondContact ND2-OE1 3.39Å; N89-E92 PolarHBondContact ND2-OE2 3.17Å; N89-E92 VanDerWaalsContact ND2-OE2 3.12Å; N89-E92 PolarHBondContact OD1-N 3.16Å; N89-E92 VanDerWaalsContact OD1-N 3.14Å; E92-K94 HydrophobicContact CB-CB 4.04Å; E92-K94 PolarHBondContact O-N 3.11Å
93	K	70.5	Confident	68.5	Low	113 Å²	113	64.1 Å²	64.1	49%	0.491	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	39.4	-173	-57.9	-175.7	178.7	-173.9	0	112.7	L75 N89 V90	L75-K93 HydrophobicContact CD2-CB 4.47Å; L75-K93 HydrophobicContact CD2-CG 4.13Å; N89-K93 WeakPolarHBondContact O-CA 3.4Å; N89-K93 PolarHBondContact O-N 2.58Å; V90-K93 PolarHBondContact O-N 2.96Å
94	K	69.9	Low	69.4	Low	125 Å²	125	65.9 Å²	65.9	54%	0.543	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	130.7	-169.9	-172.4	177.4	176.9	-177.2	0	111.1	N89 E92 L96	N89-K94 PolarHBondContact N-O 2.83Å; N89-K94 PolarHBondContact O-N 3.19Å; N89-K94 VanDerWaalsContact O-N 3.09Å; E92-K94 HydrophobicContact CB-CB 4.04Å; E92-K94 PolarHBondContact O-N 3.11Å; K94-L96 PolarHBondContact O-N 2.96Å
95	R	72.7	Confident	70.5	Confident	138 Å²	138	65.3 Å²	65.3	52%	0.521	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	114.8	164.9	-171.1	171.9	68	-167.2	1.9	108.7	A86 W88	A86-R95 HydrophobicContact CB-CG 4.05Å; W88-R95 HydrophobicContact CD2-CB 3.97Å; W88-R95 HydrophobicContact CD2-CG 4.39Å; W88-R95 HydrophobicContact CE3-CB 4.04Å; W88-R95 VanDerWaalsContact CE3-N 3.33Å; W88-R95 HydrophobicContact CH2-CB 3.89Å; W88-R95 HydrophobicContact CZ2-CB 3.8Å; W88-R95 HydrophobicContact CZ2-CG 4.14Å; W88-R95 HydrophobicContact CZ3-CB 4.01Å
96	L	71	Confident	71.2	Confident	90 Å²	90	65.1 Å²	65.1	47%	0.471	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	-43	178.8	-65.4	-178	0	0	0	111.4	L87 N89 K94	L87-L96 HydrophobicContact CD2-CB 4.13Å; L87-L96 HydrophobicContact CD2-CD1 3.88Å; L87-L96 HydrophobicContact CG-CB 4.29Å; L87-L96 HydrophobicContact CG-CD1 4.25Å; L87-L96 PolarHBondContact O-N 3.41Å; N89-L96 HydrophobicContact CB-CD1 3.87Å; N89-L96 HydrophobicContact CB-CD2 3.9Å; N89-L96 HydrophobicContact CB-CG 3.81Å; K94-L96 PolarHBondContact O-N 2.96Å
97	Q	71.7	Confident	71.8	Confident	43 Å²	43	63.4 Å²	63.4	20%	0.201	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	142	-174	-167.3	169.5	4.9	0	0	111.5	A86 L87 L99 S135	A86-Q97 CarbonylContact C-O 3.54Å; A86-Q97 VanDerWaalsContact CA-O 3.26Å; A86-Q97 WeakPolarHBondContact CA-O 3.16Å; L87-Q97 HydrophobicContact CB-CB 4.21Å; L87-Q97 PolarHBondContact N-O 3.42Å; L87-Q97 PolarHBondContact O-N 3.4Å; Q97-L99 HydrophobicContact CG-CD2 4.06Å; Q97-S135 PolarHBondContact NE2-OG 3.24Å
98	T	72.1	Confident	72.6	Confident	62 Å²	62	61.9 Å²	61.9	38%	0.38	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	124.5	165.8	-69	0	0	0	0	108.1	I84	I84-T98 HydrophobicContact CB-CG2 4.41Å; I84-T98 HydrophobicContact CD1-CG2 4.28Å; I84-T98 HydrophobicContact CG1-CG2 4.22Å; I84-T98 HydrophobicContact CG2-CG2 3.35Å
99	L	69.7	Low	73.6	Confident	8 Å²	8	59.4 Å²	59.4	4%	0.042	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	92.7	177.3	-57.3	173.3	0	0	0	107.7	S85 Q97 L116 H128 M130	S85-L99 WeakPolarHBondContact CB-O 3.35Å; S85-L99 PolarHBondContact N-O 2.87Å; S85-L99 VanDerWaalsContact N-O 3.09Å; S85-L99 CarbonylContact O-C 3.49Å; S85-L99 WeakPolarHBondContact O-CA 2.98Å; S85-L99 PolarHBondContact O-N 2.94Å; Q97-L99 HydrophobicContact CG-CD2 4.06Å; L99-L116 HydrophobicContact CD1-CD2 3.49Å; L99-L116 VanDerWaalsContact CD1-CD2 3.49Å; L99-H128 HydrophobicContact CD2-CB 4.48Å; L99-M130 HydrophobicContact CD1-CE 4.03Å; L99-M130 HydrophobicContact CD1-SD 4.31Å; L99-M130 HydrophobicContact CD2-CE 4Å; L99-M130 HydrophobicContact CD2-SD 4.16Å; L99-M130 HydrophobicContact CG-CE 4.46Å
100	S	68.6	Low	74.7	Confident	79 Å²	79	57.2 Å²	57.2	55%	0.552	31%	0.309	S	S	*	.			trans	-103.9	110.3	165.6	171.2	0	0	0	0	106.7
101	S	63.2	Low	75.6	Confident	11 Å²	11	56.1 Å²	56.1	8%	0.077	30%	0.301	C	S	.	.			trans	-112.2	-31.4	177.3	63.4	0	0	0	0	111.7	C126 K139	S101-C126 WeakPolarHBondContact CB-SG 3.29Å; S101-C126 PolarHBondContact OG-SG 3.33Å; S101-K139 WeakPolarHBondContact O-CE 3.42Å; S101-K139 PolarHBondContact O-NZ 2.66Å
102	S	65.3	Low	76.7	Confident	12 Å²	12	54.9 Å²	54.9	8%	0.084	28%	0.279	C	S	.	.	S	Bend	trans	-140.7	159.3	176.1	68.6	0	0	0	0	110.8	Y104 D120	S102-Y104 PolarHBondContact O-N 2.85Å; S102-Y104 VanDerWaalsContact O-N 3.16Å; S102-Y104 PolarHBondContact OG-N 3.15Å; S102-D120 WeakPolarHBondContact CB-OD2 3.23Å; S102-D120 WeakPolarHBondContact OG-CB 3.32Å; S102-D120 VanDerWaalsContact OG-CG 3.3Å; S102-D120 PolarHBondContact OG-OD2 2.84Å
103	G	76.9	Confident	77.6	Confident	66 Å²	66	50.7 Å²	50.7	68%	0.68	27%	0.269	S	S	*	.	S	Bend	trans	-76.2	16	172.7	0	0	0	0	0	113.2	F83	F83-G103 WeakPolarHBondContact CD2-O 2.75Å
104	Y	82.9	Confident	78.5	Confident	130 Å²	130	47.8 Å²	47.8	51%	0.51	26%	0.259	S	S	.	.	S	Bend	trans	-113.5	154.2	-179	-71.8	-70.1	0	0	0	110.4	S102 V106 K121	S102-Y104 PolarHBondContact O-N 2.85Å; S102-Y104 VanDerWaalsContact O-N 3.16Å; S102-Y104 PolarHBondContact OG-N 3.15Å; Y104-V106 PolarHBondContact O-N 2.91Å; Y104-K121 HydrophobicContact CD1-CB 4.44Å
105	R	82.5	Confident	79.4	Confident	54 Å²	54	42.8 Å²	42.8	20%	0.204	24%	0.238	C	C	.	.			trans	-55.6	137.6	169.7	71	176.6	-171.8	-172	6.3	110.2	D38 F83 D120 K121 D146	D38-R105 IonicContact OD2-CZ 2.91Å; D38-R105 IonicContact OD2-NH1 3.32Å; D38-R105 IonicContact OD2-NH2 2.85Å; D38-R105 PolarHBondContact OD2-NH2 3Å; F83-R105 HydrophobicContact CD1-CB 3.73Å; F83-R105 HydrophobicContact CE1-CB 4.18Å; R105-D120 CarbonylContact O-C 3.57Å; R105-D120 VanDerWaalsContact O-CA 3.28Å; R105-D120 WeakPolarHBondContact O-CA 3.47Å; R105-D120 WeakPolarHBondContact O-CB 3.43Å; R105-K121 HydrophobicContact CG-CB 3.59Å; R105-K121 HydrophobicContact CG-CD 4.04Å; R105-K121 HydrophobicContact CG-CG 4.37Å; R105-K121 PolarHBondContact O-N 3.11Å; R105-D146 IonicContact CZ-OD2 3.8Å; R105-D146 IonicContact NE-OD2 3.76Å; R105-D146 PolarHBondContact NE-OD2 3.18Å; R105-D146 IonicContact NH2-OD2 3.81Å; R105-D146 PolarHBondContact NH2-OD2 2.75Å
106	V	83	Confident	80.2	Confident	16 Å²	16	36.7 Å²	36.7	10%	0.097	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	115	168.9	174.6	0	0	0	0	108.4	S85 Y104 L109 A118 G119	S85-V106 VanDerWaalsContact OG-CB 3.31Å; S85-V106 WeakPolarHBondContact OG-CB 3.24Å; S85-V106 VanDerWaalsContact OG-CG2 3.25Å; S85-V106 WeakPolarHBondContact OG-CG2 3.5Å; Y104-V106 PolarHBondContact O-N 2.91Å; V106-L109 HydrophobicContact CG1-CD2 3.88Å; V106-L109 HydrophobicContact CG1-CG 4.05Å; V106-A118 HydrophobicContact CG1-CB 3.85Å; V106-A118 HydrophobicContact CG2-CB 4.42Å; V106-G119 CarbonylContact C-O 3.51Å
107	G	78.1	Confident	81.2	Confident	2 Å²	2	32.4 Å²	32.4	2%	0.021	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	-18.3	-174.7	0	0	0	0	0	114.1	M1 G119	M1-G107 WeakPolarHBondContact CE-O 3.39Å; G107-G119 PolarHBondContact N-O 2.91Å
108	A	85.9	Confident	82	Confident	2 Å²	2	30.5 Å²	30.5	2%	0.017	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	142	-178.1	0	0	0	0	0	112	M1 A118 G119 I147 L150	M1-A108 WeakPolarHBondContact SD-CA 3.41Å; M1-A108 PolarHBondContact SD-N 3.35Å; A108-A118 WeakPolarHBondContact O-CA 3.44Å; A108-G119 PolarHBondContact N-O 2.94Å; A108-G119 VanDerWaalsContact N-O 3.16Å; A108-G119 PolarHBondContact O-N 3.31Å; A108-I147 HydrophobicContact CB-CG2 4.13Å; A108-I147 WeakPolarHBondContact CB-O 3.33Å; A108-L150 HydrophobicContact CB-CB 3.42Å; A108-L150 VanDerWaalsContact CB-CB 3.42Å; A108-L150 HydrophobicContact CB-CD2 4.27Å; A108-L150 HydrophobicContact CB-CG 4.48Å
109	L	88.8	Confident	82.9	Confident	22 Å²	22	27.6 Å²	27.6	12%	0.115	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	141.1	177.9	-72.1	170.4	0	0	0	111	M1 R3 V106 L116 T117 A118	M1-L109 HydrophobicContact CG-CD1 4.23Å; M1-L109 HydrophobicContact SD-CB 4.41Å; M1-L109 HydrophobicContact SD-CG 4.41Å; R3-L109 HydrophobicContact CB-CB 3.84Å; R3-L109 HydrophobicContact CB-CD1 4.32Å; R3-L109 HydrophobicContact CG-CB 4.02Å; R3-L109 WeakPolarHBondContact CG-O 3.32Å; V106-L109 HydrophobicContact CG1-CD2 3.88Å; V106-L109 HydrophobicContact CG1-CG 4.05Å; L109-L116 HydrophobicContact CB-CD1 4.4Å; L109-L116 HydrophobicContact CD2-CD1 4.02Å; L109-L116 HydrophobicContact CD2-CD2 4.34Å; L109-L116 HydrophobicContact CD2-CG 4.25Å; L109-T117 CarbonylContact C-O 3.41Å; L109-T117 VanDerWaalsContact CA-O 3.31Å; L109-T117 WeakPolarHBondContact CA-O 3.29Å; L109-A118 HydrophobicContact CD2-CB 3.66Å
110	S	89.2	Confident	83.9	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.007	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	141.9	172.1	-172.4	0	0	0	0	112.2	T117 W152	S110-T117 PolarHBondContact N-O 2.79Å; S110-T117 PolarHBondContact O-N 3.12Å; S110-W152 PolarHBondContact OG-N 2.9Å
111	W	89	Confident	84.9	Confident	18 Å²	18	28.2 Å²	28.2	7%	0.068	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	146.8	176.8	-72.4	100.8	0	0	0	112.7	R3 H5 P6 L87 I115 L116 M130 W152	R3-W111 PolarHBondContact O-NE1 3.46Å; H5-W111 HydrophobicContact CB-CZ2 4.15Å; H5-W111 AromaticContact CD2-CD2 3.82Å; H5-W111 AromaticContact CD2-CE3 3.54Å; H5-W111 AromaticContact CD2-CH2 3.67Å; H5-W111 AromaticContact CD2-CZ2 3.97Å; H5-W111 AromaticContact CD2-CZ3 3.45Å; H5-W111 VanDerWaalsContact CD2-CZ3 3.45Å; H5-W111 WeakPolarHBondContact CD2-CZ3 3.36Å; P6-W111 HydrophobicContact CG-CB 4.22Å; L87-W111 HydrophobicContact CD1-CH2 3.97Å; L87-W111 HydrophobicContact CD1-CZ2 3.86Å; W111-I115 CarbonylContact C-O 3.59Å; W111-I115 WeakPolarHBondContact CA-O 3.22Å; W111-L116 HydrophobicContact CD2-CB 4.21Å; W111-L116 HydrophobicContact CD2-CD1 3.87Å; W111-L116 HydrophobicContact CE3-CB 3.85Å; W111-L116 HydrophobicContact CE3-CD1 4.39Å; W111-L116 HydrophobicContact CG-CD1 4.23Å; W111-L116 HydrophobicContact CH2-CB 3.81Å; W111-L116 HydrophobicContact CH2-CD2 4.3Å; W111-L116 HydrophobicContact CH2-CG 4.45Å; W111-L116 HydrophobicContact CZ2-CB 4.14Å; W111-L116 HydrophobicContact CZ2-CD1 4Å; W111-L116 HydrophobicContact CZ2-CD2 4.09Å; W111-L116 HydrophobicContact CZ2-CG 4.31Å; W111-L116 HydrophobicContact CZ3-CB 3.65Å; W111-M130 HydrophobicContact CH2-CB 4.37Å; W111-M130 HydrophobicContact CH2-CG 3.61Å; W111-M130 HydrophobicContact CZ3-CB 4.25Å; W111-M130 HydrophobicContact CZ3-CG 3.52Å; W111-W152 WeakPolarHBondContact O-CB 3.36Å
112	N	90.2	Very high	86.3	Confident	37 Å²	37	29 Å²	29	20%	0.198	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	93.4	164.9	-178.2	3.3	0	0	0	108.8	N114 I115 W152 G156	N112-N114 PolarHBondContact O-N 2.89Å; N112-I115 PolarHBondContact N-O 2.8Å; N112-I115 WeakPolarHBondContact O-CB 3.41Å; N112-I115 PolarHBondContact O-N 2.78Å; N112-W152 HydrophobicContact CB-CB 4.27Å; N112-W152 HydrophobicContact CB-CD2 3.54Å; N112-W152 HydrophobicContact CB-CE3 4.12Å; N112-W152 HydrophobicContact CB-CG 3.6Å; N112-W152 HydrophobicContact CB-CZ2 4.27Å; N112-W152 VanDerWaalsContact ND2-CZ3 3.33Å; N112-W152 WeakPolarHBondContact ND2-CZ3 3.37Å; N112-G156 PolarHBondContact ND2-O 2.83Å
113	G	88.8	Confident	87.6	Confident	36 Å²	36	28.4 Å²	28.4	37%	0.371	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	-123.3	-168.3	0	0	0	0	0	110.9	H5 I115	H5-G113 PolarHBondContact NE2-O 3.34Å; G113-I115 VanDerWaalsContact C-N 3.28Å; G113-I115 PolarHBondContact O-N 2.93Å
114	N	88.6	Confident	88.4	Confident	51 Å²	51	27 Å²	27	27%	0.273	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-1.6	179.2	-59.5	-72.4	0	0	0	114.2	R8 N112 M130 R131	R8-N114 PolarHBondContact NH2-OD1 3.49Å; R8-N114 VanDerWaalsContact NH2-OD1 3.12Å; N112-N114 PolarHBondContact O-N 2.89Å; N114-M130 WeakPolarHBondContact O-CG 3.32Å; N114-M130 PolarHBondContact O-N 2.94Å; N114-R131 HydrophobicContact CB-CG 3.94Å
115	I	89.4	Confident	88.9	Confident	21 Å²	21	20.8 Å²	20.8	11%	0.108	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	117.6	177.4	-54.8	-55.9	0	0	0	109.2	W111 N112 G113 H127 H128 D129 V137	W111-I115 CarbonylContact C-O 3.59Å; W111-I115 WeakPolarHBondContact CA-O 3.22Å; N112-I115 PolarHBondContact N-O 2.8Å; N112-I115 WeakPolarHBondContact O-CB 3.41Å; N112-I115 PolarHBondContact O-N 2.78Å; G113-I115 VanDerWaalsContact C-N 3.28Å; G113-I115 PolarHBondContact O-N 2.93Å; I115-H127 HydrophobicContact CG2-CB 4.03Å; I115-H128 CarbonylContact C-O 3.36Å; I115-H128 VanDerWaalsContact CA-O 3.3Å; I115-H128 WeakPolarHBondContact CA-O 3.36Å; I115-D129 HydrophobicContact CD1-CB 3.64Å; I115-V137 HydrophobicContact CD1-CG2 4.47Å
116	L	90	Very high	89.3	Confident	9 Å²	9	18.2 Å²	18.2	5%	0.047	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	127.2	165	177.7	60.3	0	0	0	108.8	L99 L109 W111 H128 M130	L99-L116 HydrophobicContact CD1-CD2 3.49Å; L99-L116 VanDerWaalsContact CD1-CD2 3.49Å; L109-L116 HydrophobicContact CB-CD1 4.4Å; L109-L116 HydrophobicContact CD2-CD1 4.02Å; L109-L116 HydrophobicContact CD2-CD2 4.34Å; L109-L116 HydrophobicContact CD2-CG 4.25Å; W111-L116 HydrophobicContact CD2-CB 4.21Å; W111-L116 HydrophobicContact CD2-CD1 3.87Å; W111-L116 HydrophobicContact CE3-CB 3.85Å; W111-L116 HydrophobicContact CE3-CD1 4.39Å; W111-L116 HydrophobicContact CG-CD1 4.23Å; W111-L116 HydrophobicContact CH2-CB 3.81Å; W111-L116 HydrophobicContact CH2-CD2 4.3Å; W111-L116 HydrophobicContact CH2-CG 4.45Å; W111-L116 HydrophobicContact CZ2-CB 4.14Å; W111-L116 HydrophobicContact CZ2-CD1 4Å; W111-L116 HydrophobicContact CZ2-CD2 4.09Å; W111-L116 HydrophobicContact CZ2-CG 4.31Å; W111-L116 HydrophobicContact CZ3-CB 3.65Å; L116-H128 HydrophobicContact CB-CB 4.36Å; L116-H128 PolarHBondContact N-O 2.83Å; L116-H128 PolarHBondContact O-N 3.14Å; L116-M130 HydrophobicContact CB-CG 3.98Å; L116-M130 HydrophobicContact CB-SD 4.05Å; L116-M130 HydrophobicContact CD2-SD 4.48Å
117	T	90.8	Very high	89.7	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	133.1	174.5	-51	0	0	0	0	109.9	L109 S110 I125 C126 H127 L150 W152 L159	L109-T117 CarbonylContact C-O 3.41Å; L109-T117 VanDerWaalsContact CA-O 3.31Å; L109-T117 WeakPolarHBondContact CA-O 3.29Å; S110-T117 PolarHBondContact N-O 2.79Å; S110-T117 PolarHBondContact O-N 3.12Å; T117-I125 HydrophobicContact CG2-CG2 3.48Å; T117-I125 VanDerWaalsContact CG2-CG2 3.48Å; T117-C126 CarbonylContact C-O 3.59Å; T117-C126 WeakPolarHBondContact CA-O 3.45Å; T117-H127 VanDerWaalsContact CG2-CE1 3.46Å; T117-H127 WeakPolarHBondContact CG2-CE1 3.15Å; T117-H127 VanDerWaalsContact CG2-ND1 3.31Å; T117-H127 WeakPolarHBondContact CG2-ND1 3.31Å; T117-H127 PolarHBondContact OG1-ND1 3.34Å; T117-L150 HydrophobicContact CG2-CD2 4Å; T117-W152 PolarHBondContact OG1-NE1 3.19Å; T117-L159 HydrophobicContact CG2-CD2 3.81Å
118	A	90	Very high	90.2	Very high	4 Å²	4	17.7 Å²	17.7	3%	0.033	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	134.3	178.1	0	0	0	0	0	110.3	V106 A108 L109 I125 C126	V106-A118 HydrophobicContact CG1-CB 3.85Å; V106-A118 HydrophobicContact CG2-CB 4.42Å; A108-A118 WeakPolarHBondContact O-CA 3.44Å; L109-A118 HydrophobicContact CD2-CB 3.66Å; A118-I125 CarbonylContact O-C 3.32Å; A118-I125 WeakPolarHBondContact O-CA 3.29Å; A118-C126 PolarHBondContact N-O 2.78Å; A118-C126 PolarHBondContact O-N 2.97Å
119	G	90.6	Very high	90.4	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	133.6	169.4	0	0	0	0	0	109.7	V106 G107 A108 Q124	V106-G119 CarbonylContact C-O 3.51Å; G107-G119 PolarHBondContact N-O 2.91Å; A108-G119 PolarHBondContact N-O 2.94Å; A108-G119 VanDerWaalsContact N-O 3.16Å; A108-G119 PolarHBondContact O-N 3.31Å; G119-Q124 WeakPolarHBondContact CA-O 3.26Å
120	D	91	Very high	90.1	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.011	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	170.9	-177.4	70.5	35.8	0	0	0	114.2	S102 R105 G122 G123 Q124 I147	S102-D120 WeakPolarHBondContact CB-OD2 3.23Å; S102-D120 WeakPolarHBondContact OG-CB 3.32Å; S102-D120 VanDerWaalsContact OG-CG 3.3Å; S102-D120 PolarHBondContact OG-OD2 2.84Å; R105-D120 CarbonylContact O-C 3.57Å; R105-D120 VanDerWaalsContact O-CA 3.28Å; R105-D120 WeakPolarHBondContact O-CA 3.47Å; R105-D120 WeakPolarHBondContact O-CB 3.43Å; D120-G122 PolarHBondContact O-N 2.94Å; D120-G122 WeakPolarHBondContact OD1-CA 3.39Å; D120-G122 PolarHBondContact OD1-N 2.9Å; D120-G123 PolarHBondContact O-N 2.85Å; D120-G123 VanDerWaalsContact O-N 3.1Å; D120-G123 PolarHBondContact OD1-N 2.79Å; D120-Q124 PolarHBondContact N-O 2.63Å; D120-Q124 WeakPolarHBondContact OD1-CB 3.38Å; D120-Q124 PolarHBondContact OD1-N 3.44Å; D120-Q124 WeakPolarHBondContact OD2-CB 3.49Å; D120-I147 PolarHBondContact O-N 3.27Å; D120-I147 VanDerWaalsContact O-N 3.1Å
121	K	89.4	Confident	90	Very high	98 Å²	98	26.6 Å²	26.6	43%	0.426	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-23.2	177.7	-176.1	-179.6	-176.6	-179.9	0	114.1	Y104 R105 G123 D146	Y104-K121 HydrophobicContact CD1-CB 4.44Å; R105-K121 HydrophobicContact CG-CB 3.59Å; R105-K121 HydrophobicContact CG-CD 4.04Å; R105-K121 HydrophobicContact CG-CG 4.37Å; R105-K121 PolarHBondContact O-N 3.11Å; K121-G123 PolarHBondContact O-N 2.88Å; K121-D146 WeakPolarHBondContact CA-OD1 3.35Å; K121-D146 HydrophobicContact CB-CB 4.46Å; K121-D146 HydrophobicContact CG-CB 4.13Å; K121-D146 WeakPolarHBondContact O-CA 3.44Å; K121-D146 PolarHBondContact O-N 3.36Å
122	G	91.8	Very high	89.7	Confident	28 Å²	28	30 Å²	30	29%	0.289	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	5	176.2	0	0	0	0	0	113.7	D120 Q124	D120-G122 PolarHBondContact O-N 2.94Å; D120-G122 WeakPolarHBondContact OD1-CA 3.39Å; D120-G122 PolarHBondContact OD1-N 2.9Å; G122-Q124 VanDerWaalsContact C-N 3.32Å
123	G	93.4	Very high	89.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	80.4	13.1	-178.2	0	0	0	0	0	113.8	D120 K121 A142 H143 D145	D120-G123 PolarHBondContact O-N 2.85Å; D120-G123 VanDerWaalsContact O-N 3.1Å; D120-G123 PolarHBondContact OD1-N 2.79Å; K121-G123 PolarHBondContact O-N 2.88Å; G123-A142 PolarHBondContact O-N 3.31Å; G123-H143 WeakPolarHBondContact CA-O 3.11Å; G123-H143 PolarHBondContact O-N 3.36Å; G123-D145 WeakPolarHBondContact CA-O 3.42Å
124	Q	93.4	Very high	88.9	Confident	35 Å²	35	40.3 Å²	40.3	16%	0.164	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	136.7	-173.7	162.1	169.1	94.6	0	0	112.6	G119 D120 G122 K139 Y140 V141	G119-Q124 WeakPolarHBondContact CA-O 3.26Å; D120-Q124 PolarHBondContact N-O 2.63Å; D120-Q124 WeakPolarHBondContact OD1-CB 3.38Å; D120-Q124 PolarHBondContact OD1-N 3.44Å; D120-Q124 WeakPolarHBondContact OD2-CB 3.49Å; G122-Q124 VanDerWaalsContact C-N 3.32Å; Q124-K139 HydrophobicContact CG-CG 4.23Å; Q124-Y140 CarbonylContact C-O 3.56Å; Q124-Y140 WeakPolarHBondContact CA-O 3.49Å; Q124-V141 HydrophobicContact CB-CG2 4.48Å
125	I	92.8	Very high	88.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131	173	-64.6	-178.2	0	0	0	108.9	T117 A118 K139 Y140 A142 I147 L150 L159	T117-I125 HydrophobicContact CG2-CG2 3.48Å; T117-I125 VanDerWaalsContact CG2-CG2 3.48Å; A118-I125 CarbonylContact O-C 3.32Å; A118-I125 WeakPolarHBondContact O-CA 3.29Å; I125-K139 WeakPolarHBondContact O-CA 3.45Å; I125-Y140 HydrophobicContact CB-CD2 4.27Å; I125-Y140 HydrophobicContact CB-CE1 4.44Å; I125-Y140 HydrophobicContact CB-CE2 3.82Å; I125-Y140 HydrophobicContact CD1-CE2 3.96Å; I125-Y140 HydrophobicContact CG1-CE2 4.31Å; I125-Y140 HydrophobicContact CG2-CE1 4.22Å; I125-Y140 HydrophobicContact CG2-CE2 4.2Å; I125-Y140 PolarHBondContact N-O 3.45Å; I125-Y140 PolarHBondContact O-N 3.33Å; I125-A142 HydrophobicContact CD1-CB 3.59Å; I125-A142 HydrophobicContact CG1-CB 3.88Å; I125-I147 HydrophobicContact CD1-CD1 4.13Å; I125-I147 HydrophobicContact CG1-CD1 3.4Å; I125-L150 HydrophobicContact CD1-CD1 4.26Å; I125-L159 HydrophobicContact CD1-CD2 4.25Å; I125-L159 HydrophobicContact CG2-CD2 4.27Å
126	C	91.9	Very high	88.7	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.1	174.2	-63.7	0	0	0	0	110.1	S101 T117 A118 A138	S101-C126 WeakPolarHBondContact CB-SG 3.29Å; S101-C126 PolarHBondContact OG-SG 3.33Å; T117-C126 CarbonylContact C-O 3.59Å; T117-C126 WeakPolarHBondContact CA-O 3.45Å; A118-C126 PolarHBondContact N-O 2.78Å; A118-C126 PolarHBondContact O-N 2.97Å; C126-A138 WeakPolarHBondContact CA-O 3.22Å
127	H	91.6	Very high	88.7	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.019	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	126.7	174	-59.9	-78.8	0	0	0	109.7	I115 T117 I136 V137 A138 Y140 W152 M176	I115-H127 HydrophobicContact CG2-CB 4.03Å; T117-H127 VanDerWaalsContact CG2-CE1 3.46Å; T117-H127 WeakPolarHBondContact CG2-CE1 3.15Å; T117-H127 VanDerWaalsContact CG2-ND1 3.31Å; T117-H127 WeakPolarHBondContact CG2-ND1 3.31Å; T117-H127 PolarHBondContact OG1-ND1 3.34Å; H127-I136 WeakPolarHBondContact O-CA 3.45Å; H127-V137 HydrophobicContact CB-CG2 3.93Å; H127-V137 WeakPolarHBondContact O-CG2 3.47Å; H127-V137 PolarHBondContact O-N 2.85Å; H127-A138 HydrophobicContact CB-CB 4.24Å; H127-A138 PolarHBondContact N-O 2.91Å; H127-Y140 AromaticContact CD2-CE1 3.66Å; H127-Y140 AromaticContact NE2-CE1 3.37Å; H127-Y140 WeakPolarHBondContact NE2-CE1 3.38Å; H127-Y140 AromaticContact NE2-CZ 3.56Å; H127-Y140 PolarHBondContact NE2-OH 3.12Å; H127-W152 AromaticContact CE1-CZ2 3.75Å; H127-W152 AromaticContact ND1-CZ2 3.94Å; H127-M176 HydrophobicContact CB-CE 3.51Å; H127-M176 VanDerWaalsContact CG-CE 3.42Å
128	H	88.2	Confident	88.7	Confident	3 Å²	3	43.9 Å²	43.9	1%	0.014	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	115.7	179.5	-63	-91.5	0	0	0	110	L99 I115 L116 M130 S135 I136	L99-H128 HydrophobicContact CD2-CB 4.48Å; I115-H128 CarbonylContact C-O 3.36Å; I115-H128 VanDerWaalsContact CA-O 3.3Å; I115-H128 WeakPolarHBondContact CA-O 3.36Å; L116-H128 HydrophobicContact CB-CB 4.36Å; L116-H128 PolarHBondContact N-O 2.83Å; L116-H128 PolarHBondContact O-N 3.14Å; H128-M130 HydrophobicContact CB-SD 3.56Å; H128-M130 VanDerWaalsContact CB-SD 3.56Å; H128-M130 PolarHBondContact O-N 2.95Å; H128-S135 CarbonylContact C-O 3.57Å; H128-S135 WeakPolarHBondContact CA-O 3.46Å; H128-S135 PolarHBondContact ND1-OG 2.98Å; H128-I136 WeakPolarHBondContact CE1-CG1 3.43Å
129	D	89.4	Confident	88.8	Confident	12 Å²	12	48.5 Å²	48.5	6%	0.064	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	108.4	164	-169.5	-27.6	0	0	0	109.2	I115 R131 M132 S135 V137	I115-D129 HydrophobicContact CD1-CB 3.64Å; D129-R131 PolarHBondContact O-N 2.79Å; D129-R131 VanDerWaalsContact O-N 3.15Å; D129-R131 VanDerWaalsContact OD1-CB 3.29Å; D129-R131 WeakPolarHBondContact OD1-CB 3.26Å; D129-R131 WeakPolarHBondContact OD1-CG 3.46Å; D129-R131 IonicContact OD1-CZ 3.74Å; D129-R131 PolarHBondContact OD1-N 3.4Å; D129-R131 IonicContact OD1-NE 3.79Å; D129-R131 PolarHBondContact OD1-NE 3.44Å; D129-R131 IonicContact OD1-NH2 2.89Å; D129-R131 IonicContact OD2-CZ 2.79Å; D129-R131 IonicContact OD2-NE 2.68Å; D129-R131 PolarHBondContact OD2-NE 3.37Å; D129-R131 IonicContact OD2-NH2 3.37Å; D129-R131 PolarHBondContact OD2-NH2 2.91Å; D129-M132 HydrophobicContact CB-CB 4.49Å; D129-M132 HydrophobicContact CB-CG 4.05Å; D129-M132 HydrophobicContact CB-SD 3.82Å; D129-M132 PolarHBondContact O-N 2.77Å; D129-S135 PolarHBondContact N-O 2.76Å; D129-V137 HydrophobicContact CB-CG1 3.67Å; D129-V137 HydrophobicContact CB-CG2 4.42Å
130	M	83.9	Confident	88.9	Confident	32 Å²	32	49.3 Å²	49.3	16%	0.158	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	0.1	-172.3	-57.4	-53.6	-63.6	0	0	113.4	L87 L99 W111 N114 L116 H128	L87-M130 HydrophobicContact CB-CE 3.76Å; L87-M130 HydrophobicContact CD1-CE 4.31Å; L87-M130 HydrophobicContact CD2-CE 3.36Å; L87-M130 HydrophobicContact CG-CE 3.97Å; L99-M130 HydrophobicContact CD1-CE 4.03Å; L99-M130 HydrophobicContact CD1-SD 4.31Å; L99-M130 HydrophobicContact CD2-CE 4Å; L99-M130 HydrophobicContact CD2-SD 4.16Å; L99-M130 HydrophobicContact CG-CE 4.46Å; W111-M130 HydrophobicContact CH2-CB 4.37Å; W111-M130 HydrophobicContact CH2-CG 3.61Å; W111-M130 HydrophobicContact CZ3-CB 4.25Å; W111-M130 HydrophobicContact CZ3-CG 3.52Å; N114-M130 WeakPolarHBondContact O-CG 3.32Å; N114-M130 PolarHBondContact O-N 2.94Å; L116-M130 HydrophobicContact CB-CG 3.98Å; L116-M130 HydrophobicContact CB-SD 4.05Å; L116-M130 HydrophobicContact CD2-SD 4.48Å; H128-M130 HydrophobicContact CB-SD 3.56Å; H128-M130 VanDerWaalsContact CB-SD 3.56Å; H128-M130 PolarHBondContact O-N 2.95Å
131	R	85.6	Confident	89	Confident	169 Å²	169	53.5 Å²	53.5	64%	0.638	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-14.7	169.9	-55.1	171.5	-65.6	173.3	5.5	111.8	N114 D129	N114-R131 HydrophobicContact CB-CG 3.94Å; D129-R131 PolarHBondContact O-N 2.79Å; D129-R131 VanDerWaalsContact O-N 3.15Å; D129-R131 VanDerWaalsContact OD1-CB 3.29Å; D129-R131 WeakPolarHBondContact OD1-CB 3.26Å; D129-R131 WeakPolarHBondContact OD1-CG 3.46Å; D129-R131 IonicContact OD1-CZ 3.74Å; D129-R131 PolarHBondContact OD1-N 3.4Å; D129-R131 IonicContact OD1-NE 3.79Å; D129-R131 PolarHBondContact OD1-NE 3.44Å; D129-R131 IonicContact OD1-NH2 2.89Å; D129-R131 IonicContact OD2-CZ 2.79Å; D129-R131 IonicContact OD2-NE 2.68Å; D129-R131 PolarHBondContact OD2-NE 3.37Å; D129-R131 IonicContact OD2-NH2 3.37Å; D129-R131 PolarHBondContact OD2-NH2 2.91Å
132	M	83.6	Confident	89.3	Confident	90 Å²	90	49.4 Å²	49.4	44%	0.443	26%	0.258	S	S	.	.	S	Bend	trans	-104.7	141.6	-171.4	-60.5	-180	63.3	0	0	111.6	D129 A134 V137	D129-M132 HydrophobicContact CB-CB 4.49Å; D129-M132 HydrophobicContact CB-CG 4.05Å; D129-M132 HydrophobicContact CB-SD 3.82Å; D129-M132 PolarHBondContact O-N 2.77Å; M132-A134 WeakPolarHBondContact CB-O 3.39Å; M132-V137 HydrophobicContact SD-CG1 3.85Å
133	K	79	Confident	89.4	Confident	210 Å²	210	48.1 Å²	48.1	91%	0.913	25%	0.245	S	C	*	.	S	Bend	trans	-65.9	-46.6	174.8	-169.5	177.1	-178.3	-179.2	0	111.4	S135	K133-S135 PolarHBondContact O-N 3.25Å
134	A	83.2	Confident	89.6	Confident	79 Å²	79	57 Å²	57	65%	0.653	28%	0.283	S	S	*	.	S	Bend	trans	-85	89.7	163.8	0	0	0	0	0	107.6	M132	M132-A134 WeakPolarHBondContact CB-O 3.39Å
135	S	84.9	Confident	89.6	Confident	10 Å²	10	58.4 Å²	58.4	7%	0.07	29%	0.292	C	S	.	.			trans	-74.7	-29.9	-167.6	58.9	0	0	0	0	113.5	Q97 H128 D129 K133 V137	Q97-S135 PolarHBondContact NE2-OG 3.24Å; H128-S135 CarbonylContact C-O 3.57Å; H128-S135 WeakPolarHBondContact CA-O 3.46Å; H128-S135 PolarHBondContact ND1-OG 2.98Å; D129-S135 PolarHBondContact N-O 2.76Å; K133-S135 PolarHBondContact O-N 3.25Å; S135-V137 PolarHBondContact O-N 3.46Å; S135-V137 VanDerWaalsContact O-N 3.09Å
136	I	88.6	Confident	89.6	Confident	72 Å²	72	58.8 Å²	58.8	37%	0.369	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	112.3	-176	-59.9	172.3	0	0	0	110.1	H127 H128 K139	H127-I136 WeakPolarHBondContact O-CA 3.45Å; H128-I136 WeakPolarHBondContact CE1-CG1 3.43Å; I136-K139 HydrophobicContact CG2-CB 4.19Å
137	V	89.9	Confident	89.7	Confident	60 Å²	60	58.8 Å²	58.8	36%	0.364	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-20.9	177.5	-68	0	0	0	0	112.9	I115 H127 D129 M132 S135 M176	I115-V137 HydrophobicContact CD1-CG2 4.47Å; H127-V137 HydrophobicContact CB-CG2 3.93Å; H127-V137 WeakPolarHBondContact O-CG2 3.47Å; H127-V137 PolarHBondContact O-N 2.85Å; D129-V137 HydrophobicContact CB-CG1 3.67Å; D129-V137 HydrophobicContact CB-CG2 4.42Å; M132-V137 HydrophobicContact SD-CG1 3.85Å; S135-V137 PolarHBondContact O-N 3.46Å; S135-V137 VanDerWaalsContact O-N 3.09Å; V137-M176 HydrophobicContact CG2-CE 4.03Å; V137-M176 HydrophobicContact CG2-SD 4.31Å
138	A	91.3	Very high	89.6	Confident	13 Å²	13	58.9 Å²	58.9	11%	0.107	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	147.3	173.4	0	0	0	0	0	111	C126 H127 M176	C126-A138 WeakPolarHBondContact CA-O 3.22Å; H127-A138 HydrophobicContact CB-CB 4.24Å; H127-A138 PolarHBondContact N-O 2.91Å; A138-M176 HydrophobicContact CB-CB 3.98Å; A138-M176 HydrophobicContact CB-CE 3.98Å; A138-M176 HydrophobicContact CB-SD 4.08Å
139	K	91.4	Very high	89.7	Confident	102 Å²	102	58.9 Å²	58.9	44%	0.443	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	124.2	-176.9	177.2	172.1	-175.7	-175.6	0	110.1	S101 Q124 I125 I136	S101-K139 WeakPolarHBondContact O-CE 3.42Å; S101-K139 PolarHBondContact O-NZ 2.66Å; Q124-K139 HydrophobicContact CG-CG 4.23Å; I125-K139 WeakPolarHBondContact O-CA 3.45Å; I136-K139 HydrophobicContact CG2-CB 4.19Å
140	Y	93.4	Very high	89.8	Confident	16 Å²	16	58.9 Å²	58.9	6%	0.063	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	155.6	-178.8	52.2	-89.1	0	0	0	112.3	Q124 I125 H127 A142 H171 A178	Q124-Y140 CarbonylContact C-O 3.56Å; Q124-Y140 WeakPolarHBondContact CA-O 3.49Å; I125-Y140 HydrophobicContact CB-CD2 4.27Å; I125-Y140 HydrophobicContact CB-CE1 4.44Å; I125-Y140 HydrophobicContact CB-CE2 3.82Å; I125-Y140 HydrophobicContact CD1-CE2 3.96Å; I125-Y140 HydrophobicContact CG1-CE2 4.31Å; I125-Y140 HydrophobicContact CG2-CE1 4.22Å; I125-Y140 HydrophobicContact CG2-CE2 4.2Å; I125-Y140 PolarHBondContact N-O 3.45Å; I125-Y140 PolarHBondContact O-N 3.33Å; H127-Y140 AromaticContact CD2-CE1 3.66Å; H127-Y140 AromaticContact NE2-CE1 3.37Å; H127-Y140 WeakPolarHBondContact NE2-CE1 3.38Å; H127-Y140 AromaticContact NE2-CZ 3.56Å; H127-Y140 PolarHBondContact NE2-OH 3.12Å; Y140-A142 HydrophobicContact CD2-CB 4.23Å; Y140-A142 HydrophobicContact CE2-CB 4.15Å; Y140-H171 AromaticContact CE2-CD2 3.74Å; Y140-H171 AromaticContact CE2-NE2 3.57Å; Y140-A178 HydrophobicContact CD2-CB 4.43Å; Y140-A178 HydrophobicContact CG-CB 4.26Å
141	V	93.2	Very high	90.3	Very high	90 Å²	90	59.6 Å²	59.6	55%	0.545	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	116.5	171.9	-178.1	0	0	0	0	108	Q124 H143	Q124-V141 HydrophobicContact CB-CG2 4.48Å; V141-H143 VanDerWaalsContact CG1-O 3.28Å; V141-H143 WeakPolarHBondContact CG1-O 3.41Å
142	A	94.2	Very high	90.6	Very high	12 Å²	12	52.1 Å²	52.1	10%	0.099	27%	0.27	C	S	.	.			trans	-98.9	-47.8	177.8	0	0	0	0	0	110.5	G123 I125 Y140 I147 Q169	G123-A142 PolarHBondContact O-N 3.31Å; I125-A142 HydrophobicContact CD1-CB 3.59Å; I125-A142 HydrophobicContact CG1-CB 3.88Å; Y140-A142 HydrophobicContact CD2-CB 4.23Å; Y140-A142 HydrophobicContact CE2-CB 4.15Å; A142-I147 HydrophobicContact CB-CD1 4.47Å; A142-Q169 VanDerWaalsContact O-CD 3.23Å; A142-Q169 PolarHBondContact O-NE2 3.12Å; A142-Q169 PolarHBondContact O-OE1 3.38Å; A142-Q169 VanDerWaalsContact O-OE1 3.1Å
143	H	95.6	Very high	91	Very high	2 Å²	2	48 Å²	48	1%	0.009	25%	0.25	C	S	.	.			trans	-108.6	161.2	-176	-69.8	-95.1	0	0	0	111.7	G123 V141 D145 I147 S161 G163 D165 R167	G123-H143 WeakPolarHBondContact CA-O 3.11Å; G123-H143 PolarHBondContact O-N 3.36Å; V141-H143 VanDerWaalsContact CG1-O 3.28Å; V141-H143 WeakPolarHBondContact CG1-O 3.41Å; H143-D145 VanDerWaalsContact C-N 3.34Å; H143-D145 WeakPolarHBondContact CB-O 3.43Å; H143-I147 HydrophobicContact CB-CG1 4.08Å; H143-S161 WeakPolarHBondContact NE2-CB 3.22Å; H143-S161 PolarHBondContact NE2-O 3.29Å; H143-S161 PolarHBondContact NE2-OG 3.02Å; H143-G163 PolarHBondContact CE1-N 3.22Å; H143-D165 WeakPolarHBondContact CA-OD2 3.33Å; H143-D165 WeakPolarHBondContact CB-OD2 3.35Å; H143-D165 IonicContact CE1-OD1 3.76Å; H143-D165 IonicContact CG-OD1 3.98Å; H143-D165 IonicContact CG-OD2 2.75Å; H143-D165 IonicContact ND1-OD1 3.28Å; H143-D165 PolarHBondContact ND1-OD1 2.78Å; H143-D165 IonicContact ND1-OD2 3.93Å; H143-D165 PolarHBondContact ND1-OD2 3.34Å; H143-R167 PolarHBondContact CE1-O 3.14Å
144	K	95.9	Very high	91.4	Very high	187 Å²	187	41.6 Å²	41.6	81%	0.813	23%	0.23	S	C	*	.	S	Bend	trans	-87	-8.9	174.5	-66.9	-177.2	179.3	-177.4	0	113.3	D165	K144-D165 HydrophobicContact CB-CB 4.33Å; K144-D165 PolarHBondContact N-OD2 2.93Å
145	D	95.2	Very high	91.7	Very high	63 Å²	63	40.4 Å²	40.4	34%	0.337	22%	0.217	S	C	.	.	S	Bend	trans	-148.7	-177.1	-176.8	-159.9	-1.1	0	0	0	109.2	G123 H143 I147 N164 D165	G123-D145 WeakPolarHBondContact CA-O 3.42Å; H143-D145 VanDerWaalsContact C-N 3.34Å; H143-D145 WeakPolarHBondContact CB-O 3.43Å; D145-I147 PolarHBondContact O-N 2.81Å; D145-N164 HydrophobicContact CB-CB 4.15Å; D145-N164 PolarHBondContact OD2-ND2 2.88Å; D145-D165 HydrophobicContact CB-CB 4.16Å
146	D	92.4	Very high	92	Very high	8 Å²	8	40.4 Å²	40.4	4%	0.043	22%	0.219	C	C	.	.			trans	-48.6	127.1	-173	-162.9	-11.9	0	0	0	113.7	R105 K121 C148 G163 N164	R105-D146 IonicContact CZ-OD2 3.8Å; R105-D146 IonicContact NE-OD2 3.76Å; R105-D146 PolarHBondContact NE-OD2 3.18Å; R105-D146 IonicContact NH2-OD2 3.81Å; R105-D146 PolarHBondContact NH2-OD2 2.75Å; K121-D146 WeakPolarHBondContact CA-OD1 3.35Å; K121-D146 HydrophobicContact CB-CB 4.46Å; K121-D146 HydrophobicContact CG-CB 4.13Å; K121-D146 WeakPolarHBondContact O-CA 3.44Å; K121-D146 PolarHBondContact O-N 3.36Å; D146-C148 PolarHBondContact O-N 2.92Å; D146-G163 CarbonylContact O-C 3.42Å; D146-G163 VanDerWaalsContact O-CA 3.26Å; D146-G163 WeakPolarHBondContact O-CA 3.41Å; D146-N164 HydrophobicContact CB-CB 4.11Å; D146-N164 PolarHBondContact O-N 3.44Å
147	I	93.4	Very high	92.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	102	170.1	-56.8	-176.1	0	0	0	108.3	A108 D120 I125 A142 H143 D145 G149 L150	A108-I147 HydrophobicContact CB-CG2 4.13Å; A108-I147 WeakPolarHBondContact CB-O 3.33Å; D120-I147 PolarHBondContact O-N 3.27Å; D120-I147 VanDerWaalsContact O-N 3.1Å; I125-I147 HydrophobicContact CD1-CD1 4.13Å; I125-I147 HydrophobicContact CG1-CD1 3.4Å; A142-I147 HydrophobicContact CB-CD1 4.47Å; H143-I147 HydrophobicContact CB-CG1 4.08Å; D145-I147 PolarHBondContact O-N 2.81Å; I147-G149 WeakPolarHBondContact CG2-O 2.91Å; I147-L150 HydrophobicContact CG2-CD1 4.43Å
148	C	88.9	Confident	92.4	Very high	7 Å²	7	42.2 Å²	42.2	5%	0.047	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-18.8	179.9	57.5	0	0	0	0	113.4	D146 G162 K192	D146-C148 PolarHBondContact O-N 2.92Å; C148-G162 PolarHBondContact N-O 2.8Å; C148-G162 VanDerWaalsContact N-O 3.12Å; C148-K192 HydrophobicContact CB-CB 4.25Å; C148-K192 HydrophobicContact CB-CG 4.49Å
149	G	90.2	Very high	92.6	Very high	2 Å²	2	41.6 Å²	41.6	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	133.4	174.3	0	0	0	0	0	111.3	I147 S161 G162 K192	I147-G149 WeakPolarHBondContact CG2-O 2.91Å; G149-S161 CarbonylContact O-C 3.58Å; G149-S161 WeakPolarHBondContact O-CA 3.37Å; G149-G162 PolarHBondContact N-O 3.47Å; G149-G162 PolarHBondContact O-N 3.03Å; G149-K192 WeakPolarHBondContact CA-O 3.41Å
150	L	92.7	Very high	92.8	Very high	12 Å²	12	36.8 Å²	36.8	6%	0.063	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	118.1	177.3	-166.9	70.6	0	0	0	110.5	A108 T117 I125 I147 L159 A160	A108-L150 HydrophobicContact CB-CB 3.42Å; A108-L150 VanDerWaalsContact CB-CB 3.42Å; A108-L150 HydrophobicContact CB-CD2 4.27Å; A108-L150 HydrophobicContact CB-CG 4.48Å; T117-L150 HydrophobicContact CG2-CD2 4Å; I125-L150 HydrophobicContact CD1-CD1 4.26Å; I147-L150 HydrophobicContact CG2-CD1 4.43Å; L150-L159 HydrophobicContact CD1-CD1 3.69Å; L150-L159 HydrophobicContact CD1-CD2 4.06Å; L150-L159 HydrophobicContact CD1-CG 4.03Å; L150-L159 HydrophobicContact CG-CD1 3.96Å; L150-A160 WeakPolarHBondContact CA-O 3.5Å
151	E	93.2	Very high	92.9	Very high	47 Å²	47	36 Å²	36	22%	0.22	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	126.8	179.9	-167.6	67.7	-170.2	0	0	111.4	R3 A160 I194 W196	R3-E151 IonicContact CZ-OE2 2.72Å; R3-E151 IonicContact NH2-OE1 3.87Å; R3-E151 PolarHBondContact NH2-OE1 3.14Å; R3-E151 IonicContact NH2-OE2 3.79Å; R3-E151 PolarHBondContact NH2-OE2 2.86Å; E151-A160 PolarHBondContact N-O 3.33Å; E151-A160 PolarHBondContact O-N 3.27Å; E151-I194 HydrophobicContact CB-CB 4.48Å; E151-I194 HydrophobicContact CB-CG2 3.99Å; E151-W196 PolarHBondContact O-NE1 2.84Å
152	W	92.7	Very high	93	Very high	12 Å²	12	31.7 Å²	31.7	5%	0.045	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	141.5	168.7	-82.8	104.4	0	0	0	111.2	S110 W111 N112 T117 H127 Y158 L159 H173	S110-W152 PolarHBondContact OG-N 2.9Å; W111-W152 WeakPolarHBondContact O-CB 3.36Å; N112-W152 HydrophobicContact CB-CB 4.27Å; N112-W152 HydrophobicContact CB-CD2 3.54Å; N112-W152 HydrophobicContact CB-CE3 4.12Å; N112-W152 HydrophobicContact CB-CG 3.6Å; N112-W152 HydrophobicContact CB-CZ2 4.27Å; N112-W152 VanDerWaalsContact ND2-CZ3 3.33Å; N112-W152 WeakPolarHBondContact ND2-CZ3 3.37Å; T117-W152 PolarHBondContact OG1-NE1 3.19Å; H127-W152 AromaticContact CE1-CZ2 3.75Å; H127-W152 AromaticContact ND1-CZ2 3.94Å; W152-Y158 VanDerWaalsContact CE3-O 3.24Å; W152-L159 HydrophobicContact CD2-CB 3.98Å; W152-L159 HydrophobicContact CD2-CD1 3.98Å; W152-L159 HydrophobicContact CE3-CB 3.89Å; W152-L159 HydrophobicContact CG-CD1 3.95Å; W152-L159 HydrophobicContact CH2-CB 3.95Å; W152-L159 HydrophobicContact CZ2-CB 4.08Å; W152-L159 HydrophobicContact CZ2-CD2 4.3Å; W152-L159 HydrophobicContact CZ3-CB 3.85Å; W152-H173 HydrophobicContact CH2-CB 3.94Å; W152-H173 AromaticContact CH2-ND1 3.54Å; W152-H173 HydrophobicContact CZ3-CB 3.76Å
153	S	91.7	Very high	93.1	Very high	4 Å²	4	31.1 Å²	31.1	3%	0.028	16%	0.155	C	C	.	.			trans	-64.8	150.5	172.7	77.9	0	0	0	0	110.7	S155 G156 R157 Y158	S153-S155 PolarHBondContact O-N 2.85Å; S153-S155 VanDerWaalsContact O-N 3.12Å; S153-S155 PolarHBondContact OG-OG 2.89Å; S153-G156 WeakPolarHBondContact O-CA 3.45Å; S153-G156 PolarHBondContact O-N 3.33Å; S153-R157 PolarHBondContact OG-N 2.82Å; S153-Y158 WeakPolarHBondContact CB-O 3.36Å; S153-Y158 PolarHBondContact N-O 3.25Å; S153-Y158 PolarHBondContact OG-N 3.12Å; S153-Y158 PolarHBondContact OG-O 3.23Å
154	P	87	Confident	93.1	Very high	76 Å²	76	34.6 Å²	34.6	49%	0.494	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.3	177.9	-26.8	32.9	0	0	0	113	G156 W196	P154-G156 PolarHBondContact O-N 3.42Å; P154-W196 VanDerWaalsContact CD-CB 3.49Å; P154-W196 HydrophobicContact CG-CB 4.29Å
155	S	89.3	Confident	93.1	Very high	54 Å²	54	27.1 Å²	27.1	38%	0.378	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-2.8	176.3	78.2	0	0	0	0	113.8	S153 R157	S153-S155 PolarHBondContact O-N 2.85Å; S153-S155 VanDerWaalsContact O-N 3.12Å; S153-S155 PolarHBondContact OG-OG 2.89Å; S155-R157 PolarHBondContact O-N 2.98Å; S155-R157 VanDerWaalsContact O-N 3.08Å; S155-R157 WeakPolarHBondContact OG-CB 3.48Å; S155-R157 WeakPolarHBondContact OG-CG 3.33Å; S155-R157 PolarHBondContact OG-NE 2.84Å
156	G	91.4	Very high	93.2	Very high	10 Å²	10	26.7 Å²	26.7	10%	0.103	14%	0.14	C	C	.	.	S	Bend	trans	64.5	10.2	-175.5	0	0	0	0	0	115	N112 S153 P154 H173	N112-G156 PolarHBondContact ND2-O 2.83Å; S153-G156 WeakPolarHBondContact O-CA 3.45Å; S153-G156 PolarHBondContact O-N 3.33Å; P154-G156 PolarHBondContact O-N 3.42Å; G156-H173 WeakPolarHBondContact O-CB 3.44Å
157	R	92.5	Very high	93.5	Very high	116 Å²	116	31 Å²	31	44%	0.438	16%	0.156	S	C	.	.	S	Bend	trans	-87.5	-28.9	-172.2	-69.5	-170.4	-63.8	171.2	-1.1	112.8	S153 S155 H173 S201	S153-R157 PolarHBondContact OG-N 2.82Å; S155-R157 PolarHBondContact O-N 2.98Å; S155-R157 VanDerWaalsContact O-N 3.08Å; S155-R157 WeakPolarHBondContact OG-CB 3.48Å; S155-R157 WeakPolarHBondContact OG-CG 3.33Å; S155-R157 PolarHBondContact OG-NE 2.84Å; R157-H173 PolarHBondContact O-N 3.39Å; R157-S201 PolarHBondContact NH2-OG 2.86Å
158	Y	94.5	Very high	93.7	Very high	54 Å²	54	31 Å²	31	21%	0.212	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139.5	-175.3	-59.9	-69.6	0	0	0	110.4	W152 S153 I170 H171 W196 I220	W152-Y158 VanDerWaalsContact CE3-O 3.24Å; S153-Y158 WeakPolarHBondContact CB-O 3.36Å; S153-Y158 PolarHBondContact N-O 3.25Å; S153-Y158 PolarHBondContact OG-N 3.12Å; S153-Y158 PolarHBondContact OG-O 3.23Å; Y158-I170 HydrophobicContact CD1-CG2 3.97Å; Y158-I170 HydrophobicContact CG-CG2 4.23Å; Y158-H171 CarbonylContact C-O 3.59Å; Y158-H171 VanDerWaalsContact CA-O 3.29Å; Y158-H171 WeakPolarHBondContact CA-O 3.41Å; Y158-W196 HydrophobicContact CD2-CH2 4.42Å; Y158-W196 HydrophobicContact CG-CH2 4.21Å; Y158-I220 HydrophobicContact CD1-CD1 4.28Å; Y158-I220 HydrophobicContact CD2-CD1 3.44Å; Y158-I220 VanDerWaalsContact CD2-CD1 3.44Å; Y158-I220 HydrophobicContact CE1-CD1 4.39Å; Y158-I220 HydrophobicContact CE2-CD1 3.57Å; Y158-I220 HydrophobicContact CG-CD1 3.82Å
159	L	95.4	Very high	94	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	126.5	166.6	174.4	65.6	0	0	0	108	T117 I125 L150 W152 I170 H171	T117-L159 HydrophobicContact CG2-CD2 3.81Å; I125-L159 HydrophobicContact CD1-CD2 4.25Å; I125-L159 HydrophobicContact CG2-CD2 4.27Å; L150-L159 HydrophobicContact CD1-CD1 3.69Å; L150-L159 HydrophobicContact CD1-CD2 4.06Å; L150-L159 HydrophobicContact CD1-CG 4.03Å; L150-L159 HydrophobicContact CG-CD1 3.96Å; W152-L159 HydrophobicContact CD2-CB 3.98Å; W152-L159 HydrophobicContact CD2-CD1 3.98Å; W152-L159 HydrophobicContact CE3-CB 3.89Å; W152-L159 HydrophobicContact CG-CD1 3.95Å; W152-L159 HydrophobicContact CH2-CB 3.95Å; W152-L159 HydrophobicContact CZ2-CB 4.08Å; W152-L159 HydrophobicContact CZ2-CD2 4.3Å; W152-L159 HydrophobicContact CZ3-CB 3.85Å; L159-I170 CarbonylContact O-C 3.56Å; L159-I170 WeakPolarHBondContact O-CA 3.46Å; L159-H171 HydrophobicContact CB-CB 4.37Å; L159-H171 PolarHBondContact N-O 3.32Å; L159-H171 PolarHBondContact O-N 3.27Å
160	A	95.9	Very high	94.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	129.9	167.7	0	0	0	0	0	109.1	L150 E151 Q169 I170 I194 W196 L204	L150-A160 WeakPolarHBondContact CA-O 3.5Å; E151-A160 PolarHBondContact N-O 3.33Å; E151-A160 PolarHBondContact O-N 3.27Å; A160-Q169 WeakPolarHBondContact CA-O 3.35Å; A160-I170 HydrophobicContact CB-CD1 3.77Å; A160-I194 HydrophobicContact CB-CG2 3.7Å; A160-W196 HydrophobicContact CB-CZ2 3.66Å; A160-L204 HydrophobicContact CB-CD1 3.97Å; A160-L204 HydrophobicContact CB-CD2 4.09Å
161	S	95.5	Very high	94.5	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	137.9	171.4	60.1	0	0	0	0	110	H143 G149 V168 Q169	H143-S161 WeakPolarHBondContact NE2-CB 3.22Å; H143-S161 PolarHBondContact NE2-O 3.29Å; H143-S161 PolarHBondContact NE2-OG 3.02Å; G149-S161 CarbonylContact O-C 3.58Å; G149-S161 WeakPolarHBondContact O-CA 3.37Å; S161-V168 CarbonylContact O-C 3.52Å; S161-V168 VanDerWaalsContact O-CA 3.24Å; S161-V168 WeakPolarHBondContact O-CA 3.3Å; S161-Q169 PolarHBondContact N-O 2.83Å; S161-Q169 PolarHBondContact O-N 3.09Å; S161-Q169 PolarHBondContact OG-O 2.89Å
162	G	96	Very high	94.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	134.2	178	0	0	0	0	0	109.5	C148 G149 R167 V191 I194	C148-G162 PolarHBondContact N-O 2.8Å; C148-G162 VanDerWaalsContact N-O 3.12Å; G149-G162 PolarHBondContact N-O 3.47Å; G149-G162 PolarHBondContact O-N 3.03Å; G162-R167 WeakPolarHBondContact CA-O 3.36Å; G162-V191 CarbonylContact C-O 3.57Å; G162-V191 VanDerWaalsContact CA-O 3.29Å; G162-V191 WeakPolarHBondContact CA-O 3.41Å; G162-I194 VanDerWaalsContact N-CD1 3.31Å
163	G	95.5	Very high	93.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	164	-173.9	0	0	0	0	0	113.1	H143 D146 D165 N166 R167 V191	H143-G163 PolarHBondContact CE1-N 3.22Å; D146-G163 CarbonylContact O-C 3.42Å; D146-G163 VanDerWaalsContact O-CA 3.26Å; D146-G163 WeakPolarHBondContact O-CA 3.41Å; G163-D165 WeakPolarHBondContact CA-OD1 3.43Å; G163-D165 PolarHBondContact O-N 3.17Å; G163-N166 PolarHBondContact O-N 2.91Å; G163-R167 PolarHBondContact N-O 2.79Å; G163-V191 PolarHBondContact O-N 3.03Å; G163-V191 VanDerWaalsContact O-N 3.15Å
164	N	95.9	Very high	93	Very high	74 Å²	74	40.6 Å²	40.6	40%	0.396	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-6	165.2	-157	57.9	0	0	0	112.2	D145 D146 N166 A190	D145-N164 HydrophobicContact CB-CB 4.15Å; D145-N164 PolarHBondContact OD2-ND2 2.88Å; D146-N164 HydrophobicContact CB-CB 4.11Å; D146-N164 PolarHBondContact O-N 3.44Å; N164-N166 PolarHBondContact O-N 2.88Å; N164-N166 PolarHBondContact O-OD1 2.79Å; N164-A190 VanDerWaalsContact OD1-CB 3.22Å; N164-A190 WeakPolarHBondContact OD1-CB 3.26Å
165	D	97.2	Very high	91.9	Very high	31 Å²	31	38.6 Å²	38.6	17%	0.166	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	12.3	168	68	-5.5	0	0	0	113.6	H143 K144 D145 G163 R167	H143-D165 WeakPolarHBondContact CA-OD2 3.33Å; H143-D165 WeakPolarHBondContact CB-OD2 3.35Å; H143-D165 IonicContact CE1-OD1 3.76Å; H143-D165 IonicContact CG-OD1 3.98Å; H143-D165 IonicContact CG-OD2 2.75Å; H143-D165 IonicContact ND1-OD1 3.28Å; H143-D165 PolarHBondContact ND1-OD1 2.78Å; H143-D165 IonicContact ND1-OD2 3.93Å; H143-D165 PolarHBondContact ND1-OD2 3.34Å; K144-D165 HydrophobicContact CB-CB 4.33Å; K144-D165 PolarHBondContact N-OD2 2.93Å; D145-D165 HydrophobicContact CB-CB 4.16Å; G163-D165 WeakPolarHBondContact CA-OD1 3.43Å; G163-D165 PolarHBondContact O-N 3.17Å; D165-R167 PolarHBondContact O-N 3.29Å; D165-R167 PolarHBondContact OD1-N 2.99Å
166	N	97	Very high	90.9	Very high	53 Å²	53	39 Å²	39	28%	0.283	19%	0.19	S	C	.	.	S	Bend	trans	64.1	12.7	178.8	-50.5	-16.4	0	0	0	114.7	G163 N164 Q188 A189 A190	G163-N166 PolarHBondContact O-N 2.91Å; N164-N166 PolarHBondContact O-N 2.88Å; N164-N166 PolarHBondContact O-OD1 2.79Å; N166-Q188 VanDerWaalsContact ND2-C 3.33Å; N166-Q188 PolarHBondContact ND2-O 3.4Å; N166-A189 VanDerWaalsContact CG-C 3.45Å; N166-A189 VanDerWaalsContact CG-CA 3.49Å; N166-A189 WeakPolarHBondContact OD1-CA 3.37Å; N166-A189 PolarHBondContact OD1-O 3.1Å; N166-A190 PolarHBondContact OD1-N 3.26Å; N166-A190 VanDerWaalsContact OD1-N 3.11Å
167	R	97.4	Very high	89.9	Confident	99 Å²	99	45.6 Å²	45.6	37%	0.374	22%	0.216	S	C	.	.			trans	-101.9	151.5	-178.4	-62.2	-170.5	175.7	-137.6	-5.3	111.4	H143 G162 G163 D165 L184 T185	H143-R167 PolarHBondContact CE1-O 3.14Å; G162-R167 WeakPolarHBondContact CA-O 3.36Å; G163-R167 PolarHBondContact N-O 2.79Å; D165-R167 PolarHBondContact O-N 3.29Å; D165-R167 PolarHBondContact OD1-N 2.99Å; R167-L184 WeakPolarHBondContact CA-O 3.39Å; R167-T185 HydrophobicContact CG-CG2 4.39Å
168	V	97.3	Very high	89.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.1	162	-175	0	0	0	0	108.3	S161 I170 L184 V191 L204 T206	S161-V168 CarbonylContact O-C 3.52Å; S161-V168 VanDerWaalsContact O-CA 3.24Å; S161-V168 WeakPolarHBondContact O-CA 3.3Å; V168-I170 HydrophobicContact CG1-CD1 4.17Å; V168-L184 HydrophobicContact CB-CB 4.09Å; V168-L184 HydrophobicContact CB-CD1 4.13Å; V168-L184 HydrophobicContact CB-CG 4.49Å; V168-L184 HydrophobicContact CG1-CD1 4.18Å; V168-L184 PolarHBondContact N-O 2.99Å; V168-L184 PolarHBondContact O-N 3Å; V168-V191 HydrophobicContact CG2-CB 3.93Å; V168-V191 HydrophobicContact CG2-CG1 3.53Å; V168-V191 HydrophobicContact CG2-CG2 3.97Å; V168-L204 HydrophobicContact CG1-CD2 4.18Å; V168-T206 HydrophobicContact CG1-CG2 4.18Å; V168-T206 HydrophobicContact CG2-CG2 4.04Å
169	Q	96.9	Very high	89	Confident	16 Å²	16	45.2 Å²	45.2	8%	0.075	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	136	176.8	-66.6	-170.5	6.1	0	0	110.6	A142 A160 S161 H171 P180 L182 T183	A142-Q169 VanDerWaalsContact O-CD 3.23Å; A142-Q169 PolarHBondContact O-NE2 3.12Å; A142-Q169 PolarHBondContact O-OE1 3.38Å; A142-Q169 VanDerWaalsContact O-OE1 3.1Å; A160-Q169 WeakPolarHBondContact CA-O 3.35Å; S161-Q169 PolarHBondContact N-O 2.83Å; S161-Q169 PolarHBondContact O-N 3.09Å; S161-Q169 PolarHBondContact OG-O 2.89Å; Q169-H171 PolarHBondContact OE1-CE1 3.12Å; Q169-H171 VanDerWaalsContact OE1-CE1 3.27Å; Q169-P180 HydrophobicContact CB-CB 4.02Å; Q169-P180 HydrophobicContact CG-CB 4.36Å; Q169-P180 HydrophobicContact CG-CG 4.35Å; Q169-L182 WeakPolarHBondContact CA-O 3.31Å; Q169-T183 HydrophobicContact CG-CG2 4.34Å
170	I	96.5	Very high	88.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	123.7	175.1	-47	-57.8	0	0	0	108	Y158 L159 A160 V168 P180 V181 L182 W196 L204 I220	Y158-I170 HydrophobicContact CD1-CG2 3.97Å; Y158-I170 HydrophobicContact CG-CG2 4.23Å; L159-I170 CarbonylContact O-C 3.56Å; L159-I170 WeakPolarHBondContact O-CA 3.46Å; A160-I170 HydrophobicContact CB-CD1 3.77Å; V168-I170 HydrophobicContact CG1-CD1 4.17Å; I170-P180 CarbonylContact O-C 3.59Å; I170-P180 WeakPolarHBondContact O-CA 3.46Å; I170-P180 WeakPolarHBondContact O-CB 3.47Å; I170-V181 HydrophobicContact CB-CG2 4.06Å; I170-V181 HydrophobicContact CG2-CG2 3.92Å; I170-V181 WeakPolarHBondContact O-CG2 3.28Å; I170-V181 PolarHBondContact O-N 2.68Å; I170-L182 HydrophobicContact CB-CB 4.05Å; I170-L182 HydrophobicContact CG1-CB 4.04Å; I170-L182 HydrophobicContact CG1-CD2 4.3Å; I170-L182 PolarHBondContact N-O 2.85Å; I170-L182 PolarHBondContact O-N 3.25Å; I170-W196 HydrophobicContact CD1-CH2 4.37Å; I170-W196 HydrophobicContact CD1-CZ2 4.43Å; I170-W196 HydrophobicContact CG2-CH2 4.2Å; I170-L204 HydrophobicContact CD1-CD2 3.66Å; I170-I220 HydrophobicContact CD1-CG2 4.23Å; I170-I220 HydrophobicContact CG1-CG2 4.08Å
171	H	95	Very high	88.9	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.019	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	136.8	176.1	-65.7	84.9	0	0	0	109.7	Y140 Y158 L159 Q169	Y140-H171 AromaticContact CE2-CD2 3.74Å; Y140-H171 AromaticContact CE2-NE2 3.57Å; Y158-H171 CarbonylContact C-O 3.59Å; Y158-H171 VanDerWaalsContact CA-O 3.29Å; Y158-H171 WeakPolarHBondContact CA-O 3.41Å; L159-H171 HydrophobicContact CB-CB 4.37Å; L159-H171 PolarHBondContact N-O 3.32Å; L159-H171 PolarHBondContact O-N 3.27Å; Q169-H171 PolarHBondContact OE1-CE1 3.12Å; Q169-H171 VanDerWaalsContact OE1-CE1 3.27Å
172	S	91.6	Very high	88.9	Confident	24 Å²	24	52.5 Å²	52.5	17%	0.168	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	136	170.7	174.1	0	0	0	0	109.9	M174 A175	S172-M174 PolarHBondContact O-N 3.16Å; S172-M174 PolarHBondContact OG-N 3.44Å; S172-A175 PolarHBondContact O-N 2.89Å
173	H	83.3	Confident	88.9	Confident	72 Å²	72	55.1 Å²	55.1	33%	0.333	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-39.6	173.5	179.4	63.5	0	0	0	112.2	W152 G156 R157 A175 M176	W152-H173 HydrophobicContact CH2-CB 3.94Å; W152-H173 AromaticContact CH2-ND1 3.54Å; W152-H173 HydrophobicContact CZ3-CB 3.76Å; G156-H173 WeakPolarHBondContact O-CB 3.44Å; R157-H173 PolarHBondContact O-N 3.39Å; H173-A175 PolarHBondContact O-N 2.91Å; H173-M176 WeakPolarHBondContact O-CG 3.37Å
174	M	72.7	Confident	89	Confident	170 Å²	170	55.5 Å²	55.5	84%	0.837	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-21.8	-178.5	-68.9	-172.7	-99.6	0	0	113.4	S172	S172-M174 PolarHBondContact O-N 3.16Å; S172-M174 PolarHBondContact OG-N 3.44Å
175	A	63.6	Low	89.1	Confident	33 Å²	33	55.7 Å²	55.7	27%	0.273	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-35.4	-174	0	0	0	0	0	111.8	S172 H173 K177	S172-A175 PolarHBondContact O-N 2.89Å; H173-A175 PolarHBondContact O-N 2.91Å; A175-K177 HydrophobicContact CB-CB 4.29Å; A175-K177 WeakPolarHBondContact O-CB 3.33Å; A175-K177 WeakPolarHBondContact O-CD 3.21Å; A175-K177 WeakPolarHBondContact O-CG 3Å; A175-K177 PolarHBondContact O-N 2.85Å
176	M	68	Low	89.1	Confident	64 Å²	64	58.7 Å²	58.7	32%	0.315	32%	0.316	S	S	.	.			trans	32.4	37.6	-169.8	-62.9	-144.1	104.2	0	0	113.5	H127 V137 A138 H173	H127-M176 HydrophobicContact CB-CE 3.51Å; H127-M176 VanDerWaalsContact CG-CE 3.42Å; V137-M176 HydrophobicContact CG2-CE 4.03Å; V137-M176 HydrophobicContact CG2-SD 4.31Å; A138-M176 HydrophobicContact CB-CB 3.98Å; A138-M176 HydrophobicContact CB-CE 3.98Å; A138-M176 HydrophobicContact CB-SD 4.08Å; H173-M176 WeakPolarHBondContact O-CG 3.37Å
177	K	69.8	Low	89	Confident	147 Å²	147	56.4 Å²	56.4	64%	0.639	30%	0.303	S	S	*	.	S	Bend	trans	-126.5	157.8	-168	-87.6	163.7	-170.9	-173.4	0	109	A175 T179	A175-K177 HydrophobicContact CB-CB 4.29Å; A175-K177 WeakPolarHBondContact O-CB 3.33Å; A175-K177 WeakPolarHBondContact O-CD 3.21Å; A175-K177 WeakPolarHBondContact O-CG 3Å; A175-K177 PolarHBondContact O-N 2.85Å; K177-T179 PolarHBondContact O-N 2.85Å
178	A	77.2	Confident	88.9	Confident	53 Å²	53	57.4 Å²	57.4	44%	0.438	31%	0.312	S	S	.	.	S	Bend	trans	-64.7	-15.5	179.2	0	0	0	0	0	114.9	Y140 P180	Y140-A178 HydrophobicContact CD2-CB 4.43Å; Y140-A178 HydrophobicContact CG-CB 4.26Å; A178-P180 WeakPolarHBondContact O-CD 3.49Å
179	T	91.3	Very high	88.8	Confident	109 Å²	109	57.8 Å²	57.8	67%	0.669	32%	0.315	S	S	*	.	S	Bend	trans	-92.4	114.8	-175.5	-47.7	0	0	0	0	110.2	K177	K177-T179 PolarHBondContact O-N 2.85Å
180	P	94.3	Very high	88.6	Confident	30 Å²	30	58 Å²	58	20%	0.195	32%	0.32	C	S	.	.			trans	-68.4	147.9	175.5	28.8	-35.1	0	0	0	110.7	Q169 I170 A178 L182 T183	Q169-P180 HydrophobicContact CB-CB 4.02Å; Q169-P180 HydrophobicContact CG-CB 4.36Å; Q169-P180 HydrophobicContact CG-CG 4.35Å; I170-P180 CarbonylContact O-C 3.59Å; I170-P180 WeakPolarHBondContact O-CA 3.46Å; I170-P180 WeakPolarHBondContact O-CB 3.47Å; A178-P180 WeakPolarHBondContact O-CD 3.49Å; P180-L182 VanDerWaalsContact C-N 3.28Å; P180-T183 WeakPolarHBondContact CG-OG1 3.25Å
181	V	94.5	Very high	88.4	Confident	85 Å²	85	58 Å²	58	52%	0.515	32%	0.32	S	S	.	.	S	Bend	trans	-74.3	-24.2	171.7	-62.6	0	0	0	0	111.8	I170	I170-V181 HydrophobicContact CB-CG2 4.06Å; I170-V181 HydrophobicContact CG2-CG2 3.92Å; I170-V181 WeakPolarHBondContact O-CG2 3.28Å; I170-V181 PolarHBondContact O-N 2.68Å
182	L	95.5	Very high	88.1	Confident	39 Å²	39	59 Å²	59	20%	0.204	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	138.1	177.8	-172.2	64.1	0	0	0	109.9	Q169 I170 P180 L184 I220	Q169-L182 WeakPolarHBondContact CA-O 3.31Å; I170-L182 HydrophobicContact CB-CB 4.05Å; I170-L182 HydrophobicContact CG1-CB 4.04Å; I170-L182 HydrophobicContact CG1-CD2 4.3Å; I170-L182 PolarHBondContact N-O 2.85Å; I170-L182 PolarHBondContact O-N 3.25Å; P180-L182 VanDerWaalsContact C-N 3.28Å; L182-L184 HydrophobicContact CD1-CD2 4.31Å; L182-L184 HydrophobicContact CD2-CD2 3.58Å; L182-L184 HydrophobicContact CD2-CG 4.24Å; L182-L184 HydrophobicContact CG-CD2 3.72Å; L182-L184 HydrophobicContact CG-CG 4.26Å; L182-I220 HydrophobicContact CD2-CB 4.34Å; L182-I220 HydrophobicContact CD2-CG2 4.36Å
183	T	96.6	Very high	87.8	Confident	54 Å²	54	58 Å²	58	33%	0.331	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	119.8	171	-59.1	0	0	0	0	108.6	Q169 P180 T185	Q169-T183 HydrophobicContact CG-CG2 4.34Å; P180-T183 WeakPolarHBondContact CG-OG1 3.25Å; T183-T185 HydrophobicContact CG2-CG2 3.88Å
184	L	97.4	Very high	88.1	Confident	9 Å²	9	55.4 Å²	55.4	5%	0.047	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	125.2	179.8	-50	171.1	0	0	0	108.4	R167 V168 L182 L204 W218	R167-L184 WeakPolarHBondContact CA-O 3.39Å; V168-L184 HydrophobicContact CB-CB 4.09Å; V168-L184 HydrophobicContact CB-CD1 4.13Å; V168-L184 HydrophobicContact CB-CG 4.49Å; V168-L184 HydrophobicContact CG1-CD1 4.18Å; V168-L184 PolarHBondContact N-O 2.99Å; V168-L184 PolarHBondContact O-N 3Å; L182-L184 HydrophobicContact CD1-CD2 4.31Å; L182-L184 HydrophobicContact CD2-CD2 3.58Å; L182-L184 HydrophobicContact CD2-CG 4.24Å; L182-L184 HydrophobicContact CG-CD2 3.72Å; L182-L184 HydrophobicContact CG-CG 4.26Å; L184-L204 HydrophobicContact CD1-CD2 4.49Å; L184-W218 HydrophobicContact CB-CH2 3.95Å; L184-W218 HydrophobicContact CB-CZ2 4.15Å; L184-W218 HydrophobicContact CB-CZ3 4.17Å; L184-W218 HydrophobicContact CD1-CB 4.4Å; L184-W218 HydrophobicContact CD1-CD2 3.61Å; L184-W218 HydrophobicContact CD1-CE3 3.93Å; L184-W218 HydrophobicContact CD1-CG 3.81Å; L184-W218 HydrophobicContact CD1-CZ2 4.26Å; L184-W218 HydrophobicContact CD1-CZ3 4.39Å; L184-W218 HydrophobicContact CD2-CD2 4.22Å; L184-W218 HydrophobicContact CD2-CE3 3.64Å; L184-W218 HydrophobicContact CD2-CH2 4.38Å; L184-W218 HydrophobicContact CD2-CZ3 3.74Å; L184-W218 HydrophobicContact CG-CD2 4.39Å; L184-W218 HydrophobicContact CG-CE3 4.25Å; L184-W218 HydrophobicContact CG-CZ3 4.32Å
185	T	97.4	Very high	88.9	Confident	77 Å²	77	48 Å²	48	47%	0.472	27%	0.271	S	S	.	.			trans	-124.2	15.3	-168.2	60.1	0	0	0	0	113.6	R167 T183	R167-T185 HydrophobicContact CG-CG2 4.39Å; T183-T185 HydrophobicContact CG2-CG2 3.88Å
186	E	96.9	Very high	90	Very high	95 Å²	95	47 Å²	47	44%	0.444	26%	0.26	S	S	.	.			trans	-85.2	-19.7	-173.4	-63.1	-149.8	155.7	0	0	115	Q188 K216 W218	E186-Q188 PolarHBondContact O-NE2 3.1Å; E186-K216 HydrophobicContact CB-CD 3.98Å; E186-K216 IonicContact OE2-NZ 2.72Å; E186-K216 PolarHBondContact OE2-NZ 3.44Å; E186-W218 HydrophobicContact CB-CH2 3.89Å; E186-W218 HydrophobicContact CG-CH2 3.9Å; E186-W218 HydrophobicContact CG-CZ3 4.43Å
187	H	94.8	Very high	90.9	Very high	5 Å²	5	45.2 Å²	45.2	2%	0.023	25%	0.254	C	S	.	.			trans	-67	141.1	173.7	-76.6	-69.3	0	0	0	110	V191 T206 G208 D212 K214	H187-V191 HydrophobicContact CB-CG2 3.6Å; H187-T206 WeakPolarHBondContact NE2-CB 3.48Å; H187-T206 PolarHBondContact NE2-OG1 2.92Å; H187-G208 PolarHBondContact CE1-N 3.28Å; H187-D212 IonicContact CE1-OD2 3.37Å; H187-D212 IonicContact CG-OD2 3.84Å; H187-D212 IonicContact ND1-OD1 3.55Å; H187-D212 IonicContact ND1-OD2 2.93Å; H187-D212 PolarHBondContact ND1-OD2 3.17Å; H187-K214 PolarHBondContact CE1-O 2.8Å
188	Q	97	Very high	91.4	Very high	119 Å²	119	41.6 Å²	41.6	56%	0.556	25%	0.246	S	C	*	.	S	Bend	trans	-100.2	4.9	178.9	-56.5	-55	-59	0	0	113.3	N166 E186 D212	N166-Q188 VanDerWaalsContact ND2-C 3.33Å; N166-Q188 PolarHBondContact ND2-O 3.4Å; E186-Q188 PolarHBondContact O-NE2 3.1Å; Q188-D212 HydrophobicContact CB-CB 4.23Å; Q188-D212 PolarHBondContact N-OD1 3.45Å
189	A	94.2	Very high	91.6	Very high	8 Å²	8	46.8 Å²	46.8	7%	0.066	27%	0.265	C	S	.	.	S	Bend	trans	-150	173.8	-179.6	0	0	0	0	0	109.9	N166 D211 D212	N166-A189 VanDerWaalsContact CG-C 3.45Å; N166-A189 VanDerWaalsContact CG-CA 3.49Å; N166-A189 WeakPolarHBondContact OD1-CA 3.37Å; N166-A189 PolarHBondContact OD1-O 3.1Å; A189-D211 HydrophobicContact CB-CB 4.05Å; A189-D212 HydrophobicContact CB-CB 3.65Å
190	A	92.2	Very high	91.4	Very high	20 Å²	20	47.1 Å²	47.1	17%	0.165	26%	0.259	C	S	.	.			trans	-50.1	141	-179.5	0	0	0	0	0	112.6	N164 N166 G208 G209	N164-A190 VanDerWaalsContact OD1-CB 3.22Å; N164-A190 WeakPolarHBondContact OD1-CB 3.26Å; N166-A190 PolarHBondContact OD1-N 3.26Å; N166-A190 VanDerWaalsContact OD1-N 3.11Å; A190-G208 CarbonylContact O-C 3.49Å; A190-G209 PolarHBondContact O-N 2.69Å
191	V	93	Very high	91.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.263	C	S	.	.			trans	-113.6	84.4	-178.2	-169.2	0	0	0	0	110.5	G162 G163 V168 H187 I194	G162-V191 CarbonylContact C-O 3.57Å; G162-V191 VanDerWaalsContact CA-O 3.29Å; G162-V191 WeakPolarHBondContact CA-O 3.41Å; G163-V191 PolarHBondContact O-N 3.03Å; G163-V191 VanDerWaalsContact O-N 3.15Å; V168-V191 HydrophobicContact CG2-CB 3.93Å; V168-V191 HydrophobicContact CG2-CG1 3.53Å; V168-V191 HydrophobicContact CG2-CG2 3.97Å; H187-V191 HydrophobicContact CB-CG2 3.6Å; V191-I194 HydrophobicContact CG1-CG1 4.39Å
192	K	89	Confident	91	Very high	27 Å²	27	46 Å²	46	12%	0.117	25%	0.252	C	S	.	.			trans	-84.9	-42.1	175.2	177.5	168.6	170.2	162.5	0	112.1	H37 D38 L39 N40 C148 G149 I194 I236	H37-K192 PolarHBondContact O-NZ 2.85Å; D38-K192 PolarHBondContact O-NZ 2.75Å; L39-K192 PolarHBondContact O-NZ 2.9Å; N40-K192 WeakPolarHBondContact OD1-CE 3.25Å; N40-K192 PolarHBondContact OD1-NZ 2.91Å; N40-K192 VanDerWaalsContact OD1-NZ 3.16Å; C148-K192 HydrophobicContact CB-CB 4.25Å; C148-K192 HydrophobicContact CB-CG 4.49Å; G149-K192 WeakPolarHBondContact CA-O 3.41Å; K192-I194 PolarHBondContact O-N 3.37Å; K192-I236 HydrophobicContact CD-CG2 4.43Å; K192-I236 WeakPolarHBondContact CG-O 3.4Å
193	A	85.6	Confident	90.8	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.008	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	114.4	-176.7	0	0	0	0	0	110.8	T206 G207 A235 F238	A193-T206 CarbonylContact O-C 3.59Å; A193-T206 VanDerWaalsContact O-CA 3.27Å; A193-T206 WeakPolarHBondContact O-CA 3.36Å; A193-G207 PolarHBondContact O-N 3.19Å; A193-A235 HydrophobicContact CB-CB 4.2Å; A193-F238 HydrophobicContact CB-CD2 3.72Å; A193-F238 HydrophobicContact CB-CE2 3.52Å; A193-F238 HydrophobicContact CB-CZ 4.17Å
194	I	88.4	Confident	90.6	Very high	18 Å²	18	42.6 Å²	42.6	9%	0.092	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	129.6	178.6	-59.7	-175.9	0	0	0	108.5	E151 A160 G162 V191 K192 L204	E151-I194 HydrophobicContact CB-CB 4.48Å; E151-I194 HydrophobicContact CB-CG2 3.99Å; A160-I194 HydrophobicContact CB-CG2 3.7Å; G162-I194 VanDerWaalsContact N-CD1 3.31Å; V191-I194 HydrophobicContact CG1-CG1 4.39Å; K192-I194 PolarHBondContact O-N 3.37Å; I194-L204 HydrophobicContact CG2-CD1 3.8Å
195	A	89.5	Confident	90.2	Very high	15 Å²	15	43 Å²	43	12%	0.124	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	134.3	171.2	0	0	0	0	0	111.6	A205 F238	A195-A205 PolarHBondContact N-O 2.93Å; A195-A205 PolarHBondContact O-N 3.37Å; A195-F238 HydrophobicContact CB-CB 3.63Å; A195-F238 HydrophobicContact CB-CD2 4.12Å; A195-F238 HydrophobicContact CB-CG 4.21Å
196	W	87.3	Confident	89.9	Confident	12 Å²	12	39.3 Å²	39.3	5%	0.045	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	145.9	170.9	-68.6	93.8	0	0	0	110.5	E151 P154 Y158 A160 I170 L204 I220	E151-W196 PolarHBondContact O-NE1 2.84Å; P154-W196 VanDerWaalsContact CD-CB 3.49Å; P154-W196 HydrophobicContact CG-CB 4.29Å; Y158-W196 HydrophobicContact CD2-CH2 4.42Å; Y158-W196 HydrophobicContact CG-CH2 4.21Å; A160-W196 HydrophobicContact CB-CZ2 3.66Å; I170-W196 HydrophobicContact CD1-CH2 4.37Å; I170-W196 HydrophobicContact CD1-CZ2 4.43Å; I170-W196 HydrophobicContact CG2-CH2 4.2Å; W196-L204 HydrophobicContact CD2-CD1 3.58Å; W196-L204 HydrophobicContact CE3-CB 4.28Å; W196-L204 HydrophobicContact CE3-CD1 3.98Å; W196-L204 HydrophobicContact CG-CD1 3.91Å; W196-L204 HydrophobicContact CH2-CD1 4.39Å; W196-L204 HydrophobicContact CZ2-CD1 4.06Å; W196-L204 HydrophobicContact CZ3-CB 4.29Å; W196-L204 HydrophobicContact CZ3-CD1 4.36Å; W196-I220 HydrophobicContact CH2-CD1 3.68Å; W196-I220 HydrophobicContact CH2-CG1 4.3Å; W196-I220 HydrophobicContact CH2-CG2 4.23Å; W196-I220 HydrophobicContact CZ3-CD1 3.54Å; W196-I220 HydrophobicContact CZ3-CG1 3.9Å; W196-I220 HydrophobicContact CZ3-CG2 4.24Å
197	S	86.6	Confident	89.3	Confident	27 Å²	27	34.8 Å²	34.8	19%	0.189	19%	0.193	C	C	.	.			trans	-64.7	129.5	167.9	175.7	0	0	0	0	109.6	L199 E200 I203	S197-L199 VanDerWaalsContact C-N 3.28Å; S197-L199 PolarHBondContact OG-N 2.93Å; S197-E200 WeakPolarHBondContact CB-O 3.31Å; S197-E200 PolarHBondContact OG-N 3.1Å; S197-E200 VanDerWaalsContact OG-N 3.08Å; S197-I203 PolarHBondContact N-O 2.81Å
198	P	79.9	Confident	88.7	Confident	71 Å²	71	34.6 Å²	34.6	46%	0.461	19%	0.192	S	C	.	.	S	Bend	trans	-69.7	-27.8	174.4	27.3	-32.1	0	0	0	112.1
199	L	82.8	Confident	88.1	Confident	161 Å²	161	29 Å²	29	84%	0.843	17%	0.166	S	C	*	.	S	Bend	trans	-91.8	-31.2	-175.7	-58.5	176.9	0	0	0	112.9	S197	S197-L199 VanDerWaalsContact C-N 3.28Å; S197-L199 PolarHBondContact OG-N 2.93Å
200	E	87.1	Confident	87.6	Confident	117 Å²	117	31.8 Å²	31.8	55%	0.547	19%	0.185	S	C	.	.			trans	-124.7	102.4	-175.5	-67.4	-175.3	-121.2	0	0	111.1	S197 N202 I203	S197-E200 WeakPolarHBondContact CB-O 3.31Å; S197-E200 PolarHBondContact OG-N 3.1Å; S197-E200 VanDerWaalsContact OG-N 3.08Å; E200-N202 PolarHBondContact O-N 2.99Å; E200-I203 HydrophobicContact CB-CB 4.08Å; E200-I203 HydrophobicContact CB-CG1 3.56Å; E200-I203 HydrophobicContact CG-CG1 4.37Å; E200-I203 PolarHBondContact O-N 2.7Å; E200-I203 WeakPolarHBondContact OE2-CG1 3.36Å
201	S	89	Confident	87.5	Confident	40 Å²	40	37.7 Å²	37.7	28%	0.28	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-14.1	-171.1	71.7	0	0	0	0	116.1	R157	R157-S201 PolarHBondContact NH2-OG 2.86Å
202	N	91.1	Very high	87.3	Confident	50 Å²	50	38 Å²	38	27%	0.267	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	3.8	-178.1	-62.9	-26.5	0	0	0	112.9	E200 N219 I220 A221	E200-N202 PolarHBondContact O-N 2.99Å; N202-N219 WeakPolarHBondContact O-CA 3.28Å; N202-I220 HydrophobicContact CB-CG1 3.99Å; N202-I220 WeakPolarHBondContact O-CG1 3.38Å; N202-I220 PolarHBondContact O-N 3.01Å; N202-A221 HydrophobicContact CB-CB 4.13Å
203	I	91.3	Very high	87.2	Confident	22 Å²	22	42 Å²	42	11%	0.113	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	127.6	179.9	-58.1	-60.8	0	0	0	109.5	S197 E200 L217 W218 N219 I226	S197-I203 PolarHBondContact N-O 2.81Å; E200-I203 HydrophobicContact CB-CB 4.08Å; E200-I203 HydrophobicContact CB-CG1 3.56Å; E200-I203 HydrophobicContact CG-CG1 4.37Å; E200-I203 PolarHBondContact O-N 2.7Å; E200-I203 WeakPolarHBondContact OE2-CG1 3.36Å; I203-L217 HydrophobicContact CG2-CD2 4.22Å; I203-W218 WeakPolarHBondContact CA-O 3.43Å; I203-N219 HydrophobicContact CD1-CB 4.35Å; I203-I226 HydrophobicContact CD1-CD1 3.55Å
204	L	92.5	Very high	87.1	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	135	178.2	-176.9	75.4	0	0	0	109.3	A160 V168 I170 L184 I194 W196 T206 L217 W218 I220	A160-L204 HydrophobicContact CB-CD1 3.97Å; A160-L204 HydrophobicContact CB-CD2 4.09Å; V168-L204 HydrophobicContact CG1-CD2 4.18Å; I170-L204 HydrophobicContact CD1-CD2 3.66Å; L184-L204 HydrophobicContact CD1-CD2 4.49Å; I194-L204 HydrophobicContact CG2-CD1 3.8Å; W196-L204 HydrophobicContact CD2-CD1 3.58Å; W196-L204 HydrophobicContact CE3-CB 4.28Å; W196-L204 HydrophobicContact CE3-CD1 3.98Å; W196-L204 HydrophobicContact CG-CD1 3.91Å; W196-L204 HydrophobicContact CH2-CD1 4.39Å; W196-L204 HydrophobicContact CZ2-CD1 4.06Å; W196-L204 HydrophobicContact CZ3-CB 4.29Å; W196-L204 HydrophobicContact CZ3-CD1 4.36Å; L204-T206 HydrophobicContact CD2-CG2 3.71Å; L204-T206 HydrophobicContact CG-CG2 3.9Å; L204-L217 CarbonylContact O-C 3.57Å; L204-L217 WeakPolarHBondContact O-CA 3.35Å; L204-W218 HydrophobicContact CB-CB 4.34Å; L204-W218 PolarHBondContact N-O 2.7Å; L204-W218 VanDerWaalsContact N-O 3.1Å; L204-W218 PolarHBondContact O-N 3.36Å; L204-I220 HydrophobicContact CB-CG2 4.19Å; L204-I220 HydrophobicContact CD2-CG2 4.5Å
205	A	89.4	Confident	87.1	Confident	18 Å²	18	46.7 Å²	46.7	15%	0.149	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134.7	167.1	0	0	0	0	0	109.7	A195 K216 L217 F238	A195-A205 PolarHBondContact N-O 2.93Å; A195-A205 PolarHBondContact O-N 3.37Å; A205-K216 CarbonylContact C-O 3.59Å; A205-K216 WeakPolarHBondContact CA-O 3.01Å; A205-L217 HydrophobicContact CB-CD2 3.77Å; A205-F238 HydrophobicContact CB-CE2 4.35Å
206	T	90.2	Very high	87.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	147.1	175.2	63.8	0	0	0	0	110.6	V168 H187 A193 L204 I215 K216 W218	V168-T206 HydrophobicContact CG1-CG2 4.18Å; V168-T206 HydrophobicContact CG2-CG2 4.04Å; H187-T206 WeakPolarHBondContact NE2-CB 3.48Å; H187-T206 PolarHBondContact NE2-OG1 2.92Å; A193-T206 CarbonylContact O-C 3.59Å; A193-T206 VanDerWaalsContact O-CA 3.27Å; A193-T206 WeakPolarHBondContact O-CA 3.36Å; L204-T206 HydrophobicContact CD2-CG2 3.71Å; L204-T206 HydrophobicContact CG-CG2 3.9Å; T206-I215 CarbonylContact O-C 3.59Å; T206-I215 WeakPolarHBondContact O-CA 3.5Å; T206-K216 PolarHBondContact N-O 3.09Å; T206-K216 PolarHBondContact O-N 2.7Å; T206-W218 PolarHBondContact OG1-NE1 2.82Å
207	G	83.4	Confident	87.4	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	129.9	-176.5	0	0	0	0	0	111.1	A193 K214	A193-G207 PolarHBondContact O-N 3.19Å; G207-K214 WeakPolarHBondContact CA-O 3.22Å
208	G	82.7	Confident	87.8	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.			trans	-89.9	156.6	180	0	0	0	0	0	114	H187 A190 D212 K214 A235	H187-G208 PolarHBondContact CE1-N 3.28Å; A190-G208 CarbonylContact O-C 3.49Å; G208-D212 WeakPolarHBondContact CA-OD2 3.48Å; G208-K214 PolarHBondContact N-O 3.26Å; G208-A235 PolarHBondContact O-N 3.49Å
209	G	84.5	Confident	88.5	Confident	2 Å²	2	46 Å²	46	2%	0.021	24%	0.239	C	C	.	.			trans	-60.2	-174.9	175.5	0	0	0	0	0	115.4	A190 D211 D212 R213	A190-G209 PolarHBondContact O-N 2.69Å; G209-D211 PolarHBondContact O-N 2.69Å; G209-D211 VanDerWaalsContact O-N 3.15Å; G209-D212 PolarHBondContact O-N 2.87Å; G209-R213 PolarHBondContact O-N 2.67Å
210	S	83.5	Confident	89.1	Confident	67 Å²	67	39.1 Å²	39.1	47%	0.469	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-30.5	-176	-59.3	0	0	0	0	115.6	R213 Q234	S210-R213 VanDerWaalsContact O-CD 3.26Å; S210-R213 WeakPolarHBondContact O-CD 3.4Å; S210-R213 WeakPolarHBondContact O-CG 3.29Å; S210-Q234 PolarHBondContact OG-OE1 3.16Å; S210-Q234 VanDerWaalsContact OG-OE1 3.11Å
211	D	89.9	Confident	89.4	Confident	144 Å²	144	36.8 Å²	36.8	77%	0.77	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-9.7	178.7	-61	-36.3	0	0	0	113.3	A189 G209	A189-D211 HydrophobicContact CB-CB 4.05Å; G209-D211 PolarHBondContact O-N 2.69Å; G209-D211 VanDerWaalsContact O-N 3.15Å
212	D	90	Very high	89.7	Confident	5 Å²	5	42 Å²	42	3%	0.027	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-51.6	177.4	-179.7	75	0	0	0	112.6	H187 Q188 A189 G208 G209 K214	H187-D212 IonicContact CE1-OD2 3.37Å; H187-D212 IonicContact CG-OD2 3.84Å; H187-D212 IonicContact ND1-OD1 3.55Å; H187-D212 IonicContact ND1-OD2 2.93Å; H187-D212 PolarHBondContact ND1-OD2 3.17Å; Q188-D212 HydrophobicContact CB-CB 4.23Å; Q188-D212 PolarHBondContact N-OD1 3.45Å; A189-D212 HydrophobicContact CB-CB 3.65Å; G208-D212 WeakPolarHBondContact CA-OD2 3.48Å; G209-D212 PolarHBondContact O-N 2.87Å; D212-K214 WeakPolarHBondContact O-CG 3.44Å; D212-K214 PolarHBondContact O-N 3.21Å; D212-K214 VanDerWaalsContact O-N 3.1Å; D212-K214 WeakPolarHBondContact OD2-CB 3.19Å; D212-K214 PolarHBondContact OD2-N 2.79Å
213	R	86.5	Confident	89.8	Confident	111 Å²	111	41.2 Å²	41.2	42%	0.419	23%	0.225	S	C	.	.			trans	52.1	30.3	177.1	-53.3	176.3	-65.6	-168	-4.4	114	G209 S210 T231	G209-R213 PolarHBondContact O-N 2.67Å; S210-R213 VanDerWaalsContact O-CD 3.26Å; S210-R213 WeakPolarHBondContact O-CD 3.4Å; S210-R213 WeakPolarHBondContact O-CG 3.29Å; R213-T231 PolarHBondContact O-N 3.31Å; R213-T231 PolarHBondContact O-OG1 2.81Å
214	K	84.3	Confident	90	Very high	69 Å²	69	44.3 Å²	44.3	30%	0.3	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	142.2	178.5	-69.5	160.3	-173.5	170.1	0	110.6	H187 G207 G208 D212 T228 K229	H187-K214 PolarHBondContact CE1-O 2.8Å; G207-K214 WeakPolarHBondContact CA-O 3.22Å; G208-K214 PolarHBondContact N-O 3.26Å; D212-K214 WeakPolarHBondContact O-CG 3.44Å; D212-K214 PolarHBondContact O-N 3.21Å; D212-K214 VanDerWaalsContact O-N 3.1Å; D212-K214 WeakPolarHBondContact OD2-CB 3.19Å; D212-K214 PolarHBondContact OD2-N 2.79Å; K214-T228 HydrophobicContact CB-CG2 4.15Å; K214-T228 HydrophobicContact CD-CG2 3.92Å; K214-T228 HydrophobicContact CG-CG2 4.06Å; K214-K229 CarbonylContact C-O 3.58Å; K214-K229 VanDerWaalsContact CA-O 3.32Å; K214-K229 WeakPolarHBondContact CA-O 3.33Å
215	I	88.1	Confident	90.2	Very high	50 Å²	50	46 Å²	46	26%	0.256	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.7	159.4	-61.3	171.8	0	0	0	107.4	T206 T228 K229 T231 F238	T206-I215 CarbonylContact O-C 3.59Å; T206-I215 WeakPolarHBondContact O-CA 3.5Å; I215-T228 CarbonylContact O-C 3.57Å; I215-T228 WeakPolarHBondContact O-CA 3.45Å; I215-K229 PolarHBondContact N-O 3.32Å; I215-K229 PolarHBondContact O-N 2.92Å; I215-T231 HydrophobicContact CD1-CG2 3.5Å; I215-T231 HydrophobicContact CG1-CG2 3.68Å; I215-F238 HydrophobicContact CB-CZ 4.5Å; I215-F238 HydrophobicContact CD1-CE1 3.87Å; I215-F238 HydrophobicContact CD1-CZ 4.32Å; I215-F238 HydrophobicContact CG1-CE1 4.03Å; I215-F238 HydrophobicContact CG1-CZ 3.95Å; I215-F238 HydrophobicContact CG2-CE1 4.25Å; I215-F238 HydrophobicContact CG2-CZ 3.95Å
216	K	89.9	Confident	90.5	Very high	9 Å²	9	49.6 Å²	49.6	4%	0.039	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	133.3	175.1	-67.3	-179.3	174.8	-79.1	0	109.8	E186 A205 T206 W218 R227 T228	E186-K216 HydrophobicContact CB-CD 3.98Å; E186-K216 IonicContact OE2-NZ 2.72Å; E186-K216 PolarHBondContact OE2-NZ 3.44Å; A205-K216 CarbonylContact C-O 3.59Å; A205-K216 WeakPolarHBondContact CA-O 3.01Å; T206-K216 PolarHBondContact N-O 3.09Å; T206-K216 PolarHBondContact O-N 2.7Å; K216-W218 HydrophobicContact CB-CZ2 3.64Å; K216-W218 HydrophobicContact CD-CH2 3.87Å; K216-W218 HydrophobicContact CD-CZ2 3.4Å; K216-W218 VanDerWaalsContact CD-CZ2 3.4Å; K216-W218 HydrophobicContact CG-CZ2 4.14Å; K216-R227 CarbonylContact C-O 3.52Å; K216-R227 WeakPolarHBondContact CA-O 3.35Å; K216-T228 HydrophobicContact CG-CG2 4.28Å; K216-T228 PolarHBondContact NZ-OG1 2.9Å; K216-T228 VanDerWaalsContact NZ-OG1 3.1Å
217	L	92.3	Very high	90.5	Very high	66 Å²	66	58.2 Å²	58.2	35%	0.346	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.8	171.9	-78.6	167.6	0	0	0	109.1	I203 L204 A205 C225 I226 R227	I203-L217 HydrophobicContact CG2-CD2 4.22Å; L204-L217 CarbonylContact O-C 3.57Å; L204-L217 WeakPolarHBondContact O-CA 3.35Å; A205-L217 HydrophobicContact CB-CD2 3.77Å; L217-C225 CarbonylContact O-C 3.59Å; L217-I226 PolarHBondContact O-N 3.38Å; L217-R227 HydrophobicContact CB-CB 4.22Å; L217-R227 HydrophobicContact CD1-CB 4.32Å; L217-R227 PolarHBondContact N-O 2.93Å; L217-R227 PolarHBondContact O-N 3.09Å
218	W	95	Very high	90.9	Very high	7 Å²	7	61.1 Å²	61.1	3%	0.027	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	142.2	-173	-50.3	91.6	0	0	0	111	L184 E186 I203 L204 T206 K216 I224 C225	L184-W218 HydrophobicContact CB-CH2 3.95Å; L184-W218 HydrophobicContact CB-CZ2 4.15Å; L184-W218 HydrophobicContact CB-CZ3 4.17Å; L184-W218 HydrophobicContact CD1-CB 4.4Å; L184-W218 HydrophobicContact CD1-CD2 3.61Å; L184-W218 HydrophobicContact CD1-CE3 3.93Å; L184-W218 HydrophobicContact CD1-CG 3.81Å; L184-W218 HydrophobicContact CD1-CZ2 4.26Å; L184-W218 HydrophobicContact CD1-CZ3 4.39Å; L184-W218 HydrophobicContact CD2-CD2 4.22Å; L184-W218 HydrophobicContact CD2-CE3 3.64Å; L184-W218 HydrophobicContact CD2-CH2 4.38Å; L184-W218 HydrophobicContact CD2-CZ3 3.74Å; L184-W218 HydrophobicContact CG-CD2 4.39Å; L184-W218 HydrophobicContact CG-CE3 4.25Å; L184-W218 HydrophobicContact CG-CZ3 4.32Å; E186-W218 HydrophobicContact CB-CH2 3.89Å; E186-W218 HydrophobicContact CG-CH2 3.9Å; E186-W218 HydrophobicContact CG-CZ3 4.43Å; I203-W218 WeakPolarHBondContact CA-O 3.43Å; L204-W218 HydrophobicContact CB-CB 4.34Å; L204-W218 PolarHBondContact N-O 2.7Å; L204-W218 VanDerWaalsContact N-O 3.1Å; L204-W218 PolarHBondContact O-N 3.36Å; T206-W218 PolarHBondContact OG1-NE1 2.82Å; K216-W218 HydrophobicContact CB-CZ2 3.64Å; K216-W218 HydrophobicContact CD-CH2 3.87Å; K216-W218 HydrophobicContact CD-CZ2 3.4Å; K216-W218 VanDerWaalsContact CD-CZ2 3.4Å; K216-W218 HydrophobicContact CG-CZ2 4.14Å; W218-I224 WeakPolarHBondContact CA-O 3.43Å; W218-C225 HydrophobicContact CD2-CB 4.46Å; W218-C225 HydrophobicContact CE3-CB 3.67Å; W218-C225 HydrophobicContact CH2-CB 4.2Å; W218-C225 HydrophobicContact CZ3-CB 3.52Å
219	N	95.1	Very high	91	Very high	27 Å²	27	67.8 Å²	67.8	14%	0.144	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	102.1	160	-171.1	-55.6	0	0	0	107.6	N202 I203 A221 K222 G223 I224 I226	N202-N219 WeakPolarHBondContact O-CA 3.28Å; I203-N219 HydrophobicContact CD1-CB 4.35Å; N219-A221 VanDerWaalsContact C-N 3.28Å; N219-A221 PolarHBondContact O-N 3.45Å; N219-A221 WeakPolarHBondContact OD1-CB 3.4Å; N219-A221 PolarHBondContact OD1-N 2.81Å; N219-A221 VanDerWaalsContact OD1-N 3.15Å; N219-K222 HydrophobicContact CB-CB 4.19Å; N219-K222 PolarHBondContact O-N 2.56Å; N219-K222 PolarHBondContact OD1-N 3.06Å; N219-G223 PolarHBondContact O-N 2.93Å; N219-I224 HydrophobicContact CB-CG1 4.2Å; N219-I224 PolarHBondContact N-O 3.05Å; N219-I224 PolarHBondContact O-N 3.17Å; N219-I226 HydrophobicContact CB-CD1 3.68Å; N219-I226 HydrophobicContact CB-CG1 3.88Å
220	I	94.8	Very high	91	Very high	17 Å²	17	71.8 Å²	71.8	9%	0.087	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-26.5	-175.9	55.5	139.8	0	0	0	113.1	Y158 I170 L182 W196 N202 L204 K222 G223	Y158-I220 HydrophobicContact CD1-CD1 4.28Å; Y158-I220 HydrophobicContact CD2-CD1 3.44Å; Y158-I220 VanDerWaalsContact CD2-CD1 3.44Å; Y158-I220 HydrophobicContact CE1-CD1 4.39Å; Y158-I220 HydrophobicContact CE2-CD1 3.57Å; Y158-I220 HydrophobicContact CG-CD1 3.82Å; I170-I220 HydrophobicContact CD1-CG2 4.23Å; I170-I220 HydrophobicContact CG1-CG2 4.08Å; L182-I220 HydrophobicContact CD2-CB 4.34Å; L182-I220 HydrophobicContact CD2-CG2 4.36Å; W196-I220 HydrophobicContact CH2-CD1 3.68Å; W196-I220 HydrophobicContact CH2-CG1 4.3Å; W196-I220 HydrophobicContact CH2-CG2 4.23Å; W196-I220 HydrophobicContact CZ3-CD1 3.54Å; W196-I220 HydrophobicContact CZ3-CG1 3.9Å; W196-I220 HydrophobicContact CZ3-CG2 4.24Å; N202-I220 HydrophobicContact CB-CG1 3.99Å; N202-I220 WeakPolarHBondContact O-CG1 3.38Å; N202-I220 PolarHBondContact O-N 3.01Å; L204-I220 HydrophobicContact CB-CG2 4.19Å; L204-I220 HydrophobicContact CD2-CG2 4.5Å; I220-K222 VanDerWaalsContact C-N 3.34Å; I220-G223 PolarHBondContact O-N 3.15Å
221	A	93.5	Very high	90.7	Very high	68 Å²	68	71.5 Å²	71.5	56%	0.562	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-32.3	176.9	0	0	0	0	0	112	N202 N219	N202-A221 HydrophobicContact CB-CB 4.13Å; N219-A221 VanDerWaalsContact C-N 3.28Å; N219-A221 PolarHBondContact O-N 3.45Å; N219-A221 WeakPolarHBondContact OD1-CB 3.4Å; N219-A221 PolarHBondContact OD1-N 2.81Å; N219-A221 VanDerWaalsContact OD1-N 3.15Å
222	K	95	Very high	89.8	Confident	150 Å²	150	67.1 Å²	67.1	65%	0.652	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-14.6	175.6	-66.8	-178.3	-179.8	-178	0	113.2	N219 I220 I224	N219-K222 HydrophobicContact CB-CB 4.19Å; N219-K222 PolarHBondContact O-N 2.56Å; N219-K222 PolarHBondContact OD1-N 3.06Å; I220-K222 VanDerWaalsContact C-N 3.34Å; K222-I224 VanDerWaalsContact C-N 3.3Å; K222-I224 HydrophobicContact CB-CD1 4.08Å; K222-I224 HydrophobicContact CB-CG1 3.85Å; K222-I224 HydrophobicContact CB-CG2 4.47Å; K222-I224 HydrophobicContact CD-CD1 4.03Å; K222-I224 PolarHBondContact O-N 2.76Å
223	G	94.4	Very high	88.7	Confident	34 Å²	34	69.5 Å²	69.5	35%	0.351	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	25	-176.1	0	0	0	0	0	114.3	N219 I220	N219-G223 PolarHBondContact O-N 2.93Å; I220-G223 PolarHBondContact O-N 3.15Å
224	I	95.4	Very high	88.1	Confident	86 Å²	86	68.4 Å²	68.4	44%	0.441	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	148.5	-173.6	65.7	178.1	0	0	0	112.9	W218 N219 K222	W218-I224 WeakPolarHBondContact CA-O 3.43Å; N219-I224 HydrophobicContact CB-CG1 4.2Å; N219-I224 PolarHBondContact N-O 3.05Å; N219-I224 PolarHBondContact O-N 3.17Å; K222-I224 VanDerWaalsContact C-N 3.3Å; K222-I224 HydrophobicContact CB-CD1 4.08Å; K222-I224 HydrophobicContact CB-CG1 3.85Å; K222-I224 HydrophobicContact CB-CG2 4.47Å; K222-I224 HydrophobicContact CD-CD1 4.03Å; K222-I224 PolarHBondContact O-N 2.76Å
225	C	96.3	Very high	87	Confident	37 Å²	37	65.8 Å²	65.8	25%	0.25	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	115.9	164.1	-170	0	0	0	0	108.9	L217 W218 T228	L217-C225 CarbonylContact O-C 3.59Å; W218-C225 HydrophobicContact CD2-CB 4.46Å; W218-C225 HydrophobicContact CE3-CB 3.67Å; W218-C225 HydrophobicContact CH2-CB 4.2Å; W218-C225 HydrophobicContact CZ3-CB 3.52Å; C225-T228 PolarHBondContact SG-OG1 2.98Å; C225-T228 VanDerWaalsContact SG-OG1 3.36Å
226	I	95.9	Very high	86	Confident	93 Å²	93	67.6 Å²	67.6	48%	0.477	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-39	179.2	-48.4	172.7	0	0	0	110.1	I203 L217 N219	I203-I226 HydrophobicContact CD1-CD1 3.55Å; L217-I226 PolarHBondContact O-N 3.38Å; N219-I226 HydrophobicContact CB-CD1 3.68Å; N219-I226 HydrophobicContact CB-CG1 3.88Å
227	R	90.4	Very high	85	Confident	180 Å²	180	72.5 Å²	72.5	68%	0.679	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.2	139.1	-174.8	-161.2	164.4	-178	130.5	-2.4	110.8	K216 L217	K216-R227 CarbonylContact C-O 3.52Å; K216-R227 WeakPolarHBondContact CA-O 3.35Å; L217-R227 HydrophobicContact CB-CB 4.22Å; L217-R227 HydrophobicContact CD1-CB 4.32Å; L217-R227 PolarHBondContact N-O 2.93Å; L217-R227 PolarHBondContact O-N 3.09Å
228	T	91.6	Very high	83.6	Confident	62 Å²	62	71.8 Å²	71.8	38%	0.38	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	137.1	169.6	-66.2	0	0	0	0	108.4	K214 I215 K216 C225	K214-T228 HydrophobicContact CB-CG2 4.15Å; K214-T228 HydrophobicContact CD-CG2 3.92Å; K214-T228 HydrophobicContact CG-CG2 4.06Å; I215-T228 CarbonylContact O-C 3.57Å; I215-T228 WeakPolarHBondContact O-CA 3.45Å; K216-T228 HydrophobicContact CG-CG2 4.28Å; K216-T228 PolarHBondContact NZ-OG1 2.9Å; K216-T228 VanDerWaalsContact NZ-OG1 3.1Å; C225-T228 PolarHBondContact SG-OG1 2.98Å; C225-T228 VanDerWaalsContact SG-OG1 3.36Å
229	K	83.9	Confident	81.6	Confident	140 Å²	140	79.2 Å²	79.2	61%	0.609	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.1	121.5	174.5	178.7	60.5	178.7	174.2	0	109.5	K214 I215	K214-K229 CarbonylContact C-O 3.58Å; K214-K229 VanDerWaalsContact CA-O 3.32Å; K214-K229 WeakPolarHBondContact CA-O 3.33Å; I215-K229 PolarHBondContact N-O 3.32Å; I215-K229 PolarHBondContact O-N 2.92Å
230	D	86.1	Confident	79.3	Confident	86 Å²	86	80.8 Å²	80.8	46%	0.46	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	127.6	166.7	-164.3	-38.2	0	0	0	109	G232	D230-G232 PolarHBondContact OD1-N 2.56Å
231	T	76.4	Confident	76.7	Confident	60 Å²	60	86.1 Å²	86.1	37%	0.368	47%	0.472	S	S	.	.			trans	-99.7	-13	-179.3	52.3	0	0	0	0	112.6	R213 I215 A233	R213-T231 PolarHBondContact O-N 3.31Å; R213-T231 PolarHBondContact O-OG1 2.81Å; I215-T231 HydrophobicContact CD1-CG2 3.5Å; I215-T231 HydrophobicContact CG1-CG2 3.68Å; T231-A233 PolarHBondContact O-N 3.34Å; T231-A233 PolarHBondContact OG1-O 2.95Å
232	G	71.8	Confident	74.3	Confident	52 Å²	52	89.6 Å²	89.6	54%	0.536	47%	0.474	S	S	.	.	S	Bend	trans	70.1	-0.9	-171.8	0	0	0	0	0	114.8	D230	D230-G232 PolarHBondContact OD1-N 2.56Å
233	A	66.8	Low	71.1	Confident	55 Å²	55	90.1 Å²	90.1	46%	0.455	48%	0.479	S	S	.	.	S	Bend	trans	-146.4	155.3	-177.3	0	0	0	0	0	111.3	T231	T231-A233 PolarHBondContact O-N 3.34Å; T231-A233 PolarHBondContact OG1-O 2.95Å
234	Q	73.6	Confident	68	Low	88 Å²	88	99.1 Å²	99.1	41%	0.411	52%	0.519	S	S	.	.			trans	-60.4	136.6	176.3	175	168.5	31.9	0	0	111.5	S210 I236	S210-Q234 PolarHBondContact OG-OE1 3.16Å; S210-Q234 VanDerWaalsContact OG-OE1 3.11Å; Q234-I236 HydrophobicContact CG-CG1 4.08Å
235	A	61.7	Low	66.6	Low	15 Å²	15	99.8 Å²	99.8	12%	0.124	52%	0.523	C	S	.	.			trans	-91.2	123	168.3	0	0	0	0	0	109.7	A193 G208	A193-A235 HydrophobicContact CB-CB 4.2Å; G208-A235 PolarHBondContact O-N 3.49Å
236	I	66.8	Low	65.1	Low	87 Å²	87	103.1 Å²	103.1	45%	0.446	54%	0.537	S	S	.	.			trans	-105.3	-42.1	-175	-55.9	175.7	0	0	0	111.1	K192 Q234	K192-I236 HydrophobicContact CD-CG2 4.43Å; K192-I236 WeakPolarHBondContact CG-O 3.4Å; Q234-I236 HydrophobicContact CG-CG1 4.08Å
237	E	69.1	Low	63.4	Low	112 Å²	112	103.6 Å²	103.6	52%	0.523	54%	0.541	S	S	.	.			trans	-154.6	151.5	-177.3	-173.2	171.2	-170.5	0	0	110.1
238	F	62.6	Low	61.8	Low	52 Å²	52	99.1 Å²	99.1	23%	0.228	53%	0.533	C	S	.	.			trans	-112.9	126.5	169.7	-66.4	-64.4	0	0	0	109.5	A193 A195 A205 I215	A193-F238 HydrophobicContact CB-CD2 3.72Å; A193-F238 HydrophobicContact CB-CE2 3.52Å; A193-F238 HydrophobicContact CB-CZ 4.17Å; A195-F238 HydrophobicContact CB-CB 3.63Å; A195-F238 HydrophobicContact CB-CD2 4.12Å; A195-F238 HydrophobicContact CB-CG 4.21Å; A205-F238 HydrophobicContact CB-CE2 4.35Å; I215-F238 HydrophobicContact CB-CZ 4.5Å; I215-F238 HydrophobicContact CD1-CE1 3.87Å; I215-F238 HydrophobicContact CD1-CZ 4.32Å; I215-F238 HydrophobicContact CG1-CE1 4.03Å; I215-F238 HydrophobicContact CG1-CZ 3.95Å; I215-F238 HydrophobicContact CG2-CE1 4.25Å; I215-F238 HydrophobicContact CG2-CZ 3.95Å
239	L	52	Low	59.9	Low	163 Å²	163	101.4 Å²	101.4	85%	0.853	54%	0.542	S	S	*	.			trans	-90.6	123	169.3	-70.5	163.4	0	0	0	108.5
240	S	47.2	Very low	58.3	Low	59 Å²	59	98.9 Å²	98.9	41%	0.413	54%	0.538	S	S	.	.			trans	-96.8	124.1	169.4	59.8	0	0	0	0	109	K242	S240-K242 PolarHBondContact O-N 2.66Å
241	D	39.9	Very low	56.3	Low	130 Å²	130	99.8 Å²	99.8	70%	0.695	54%	0.543	S	S	*	.			trans	-76.8	101.1	169.8	-161.2	9.5	0	0	0	107.3	Q243	D241-Q243 VanDerWaalsContact C-N 3.32Å; D241-Q243 PolarHBondContact O-N 3.33Å; D241-Q243 VanDerWaalsContact O-N 3.14Å
242	K	43	Very low	54.8	Low	140 Å²	140	102.8 Å²	102.8	61%	0.609	56%	0.557	S	S	*	*			trans	-83.2	82.2	175.4	-68	-170.4	-178.8	-177.7	0	107.9	S240 D244	S240-K242 PolarHBondContact O-N 2.66Å; K242-D244 PolarHBondContact O-N 3.32Å
243	Q	27.6	Very low	53.4	Low	161 Å²	161	107.1 Å²	107.1	75%	0.752	56%	0.559	S	S	*	*			trans	-76.7	105.2	166.3	-78.3	-174	-13.8	0	0	109	D241	D241-Q243 VanDerWaalsContact C-N 3.32Å; D241-Q243 PolarHBondContact O-N 3.33Å; D241-Q243 VanDerWaalsContact O-N 3.14Å
244	D	30.2	Very low	52.2	Low	223 Å²	223	111.8 Å²	111.8	100%	1.193	57%	0.568	S	S	*	*			trans	-142	0	157.1	-76.9	-39.1	0	0	0	110	K242	K242-D244 PolarHBondContact O-N 3.32Å

Retrieved 244 of 244 residues in 279.3 ms (Link to these results)

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