A0A093I816_STRCA Loading...

Leucine-rich repeat-containing protein 3

AlphaFold DB (A0A663EYV6), UniProt , Accession A0A093I816, Species STRCA (Struthio camelus australis), Gene n/a, Length 259 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	61.9	Low	200 Å²	200	130.5 Å²	130.5	99%	0.985	64%	0.643	S	S	*	*				0	-51.4	0	-67.1	170.1	83.2	0	0	110.8	L3 V4 D5	M1-L3 PolarHBondContact O-N 3.09Å; M1-V4 PolarHBondContact O-N 3.13Å; M1-D5 PolarHBondContact O-N 3.09Å; M1-D5 VanDerWaalsContact O-OD2 3.11Å
2	H	63.3	Low	63	Low	168 Å²	168	128.4 Å²	128.4	78%	0.778	64%	0.635	S	S	*	*	H	α-helix	trans	-54.9	-34	-179.5	-79.2	-71.3	0	0	0	118.8	L6	H2-L6 WeakPolarHBondContact O-CB 3.42Å; H2-L6 PolarHBondContact O-N 2.67Å
3	L	57.2	Low	64.1	Low	150 Å²	150	123.2 Å²	123.2	79%	0.785	62%	0.619	S	S	*	*	H	α-helix	trans	-74.2	-33.4	-179.5	-102.6	107.9	0	0	0	113.6	M1 W7	M1-L3 PolarHBondContact O-N 3.09Å; L3-W7 WeakPolarHBondContact O-CB 3.4Å; L3-W7 PolarHBondContact O-N 2.6Å
4	V	62.5	Low	65.1	Low	93 Å²	93	123 Å²	123	56%	0.564	62%	0.617	S	S	*	*	H	α-helix	trans	-73.3	-40	-179.6	179.6	0	0	0	0	109.7	M1 W7 L8	M1-V4 PolarHBondContact O-N 3.13Å; V4-W7 PolarHBondContact O-N 3.34Å; V4-L8 HydrophobicContact CG1-CD1 3.9Å; V4-L8 WeakPolarHBondContact O-CB 3.43Å; V4-L8 WeakPolarHBondContact O-CD1 3.37Å; V4-L8 PolarHBondContact O-N 3.02Å
5	D	58.8	Low	66	Low	90 Å²	90	119.5 Å²	119.5	48%	0.481	61%	0.607	S	S	.	*	H	α-helix	trans	-66	-37.8	175.6	-60.7	-37.4	0	0	0	111.9	M1 T9	M1-D5 PolarHBondContact O-N 3.09Å; M1-D5 VanDerWaalsContact O-OD2 3.11Å; D5-T9 WeakPolarHBondContact O-CB 3.33Å; D5-T9 VanDerWaalsContact O-CG2 3.25Å; D5-T9 WeakPolarHBondContact O-CG2 3.39Å; D5-T9 PolarHBondContact O-N 3.21Å; D5-T9 PolarHBondContact O-OG1 3.41Å
6	L	59.4	Low	67	Low	108 Å²	108	118.5 Å²	118.5	57%	0.565	60%	0.603	S	S	*	*	H	α-helix	trans	-69.7	-33.7	175.9	-159.5	75.4	0	0	0	112.5	H2 T9 R10	H2-L6 WeakPolarHBondContact O-CB 3.42Å; H2-L6 PolarHBondContact O-N 2.67Å; L6-T9 WeakPolarHBondContact CA-OG1 3.16Å; L6-T9 PolarHBondContact O-OG1 3.26Å; L6-T9 VanDerWaalsContact O-OG1 3.09Å; L6-R10 WeakPolarHBondContact O-CB 3.35Å; L6-R10 WeakPolarHBondContact O-CG 3.48Å; L6-R10 PolarHBondContact O-N 3.5Å
7	W	57.6	Low	68	Low	200 Å²	200	117.2 Å²	117.2	76%	0.758	60%	0.598	S	S	*	*	H	α-helix	trans	-74.6	-41.1	176.5	-150.9	83.6	0	0	0	111.5	L3 V4 S11	L3-W7 WeakPolarHBondContact O-CB 3.4Å; L3-W7 PolarHBondContact O-N 2.6Å; V4-W7 PolarHBondContact O-N 3.34Å; W7-S11 VanDerWaalsContact O-CB 3.31Å; W7-S11 WeakPolarHBondContact O-CB 3.28Å; W7-S11 PolarHBondContact O-N 3Å
8	L	59.4	Low	68.8	Low	91 Å²	91	117.6 Å²	117.6	48%	0.476	60%	0.6	S	S	.	*	H	α-helix	trans	-62.1	-46.9	173.4	-106.4	85.4	0	0	0	111.9	V4 R10 S11 L12	V4-L8 HydrophobicContact CG1-CD1 3.9Å; V4-L8 WeakPolarHBondContact O-CB 3.43Å; V4-L8 WeakPolarHBondContact O-CD1 3.37Å; V4-L8 PolarHBondContact O-N 3.02Å; L8-R10 PolarHBondContact O-N 3.43Å; L8-S11 PolarHBondContact O-N 3.45Å; L8-L12 WeakPolarHBondContact O-CB 3.36Å; L8-L12 WeakPolarHBondContact O-CD1 3.45Å; L8-L12 PolarHBondContact O-N 3.33Å
9	T	64.8	Low	69.5	Low	83 Å²	83	117.5 Å²	117.5	51%	0.509	60%	0.598	S	S	.	*	H	α-helix	trans	-64.6	-39.1	-179	46	0	0	0	0	112.4	D5 L6 S13	D5-T9 WeakPolarHBondContact O-CB 3.33Å; D5-T9 VanDerWaalsContact O-CG2 3.25Å; D5-T9 WeakPolarHBondContact O-CG2 3.39Å; D5-T9 PolarHBondContact O-N 3.21Å; D5-T9 PolarHBondContact O-OG1 3.41Å; L6-T9 WeakPolarHBondContact CA-OG1 3.16Å; L6-T9 PolarHBondContact O-OG1 3.26Å; L6-T9 VanDerWaalsContact O-OG1 3.09Å; T9-S13 WeakPolarHBondContact O-CB 3.32Å; T9-S13 PolarHBondContact O-N 2.99Å
10	R	69.6	Low	70	Confident	186 Å²	186	114.6 Å²	114.6	70%	0.702	59%	0.588	S	S	*	*	H	α-helix	trans	-67.6	-40.4	173.4	-78.8	-175.7	157.7	-160.4	-5.1	112.9	L6 L8 S13 M14	L6-R10 WeakPolarHBondContact O-CB 3.35Å; L6-R10 WeakPolarHBondContact O-CG 3.48Å; L6-R10 PolarHBondContact O-N 3.5Å; L8-R10 PolarHBondContact O-N 3.43Å; R10-S13 PolarHBondContact O-N 3.37Å; R10-M14 WeakPolarHBondContact O-CG 3.35Å; R10-M14 PolarHBondContact O-N 3.44Å
11	S	71.1	Confident	70.5	Confident	67 Å²	67	115.8 Å²	115.8	47%	0.469	59%	0.589	S	S	.	*	H	α-helix	trans	-64.7	-43.6	176.5	-174.9	0	0	0	0	111.8	W7 L8 M14 C15	W7-S11 VanDerWaalsContact O-CB 3.31Å; W7-S11 WeakPolarHBondContact O-CB 3.28Å; W7-S11 PolarHBondContact O-N 3Å; L8-S11 PolarHBondContact O-N 3.45Å; S11-M14 PolarHBondContact O-N 3.21Å; S11-C15 WeakPolarHBondContact O-CB 2.99Å; S11-C15 PolarHBondContact O-N 3.09Å
12	L	74.6	Confident	71.5	Confident	105 Å²	105	109.7 Å²	109.7	55%	0.55	56%	0.563	S	S	.	*	H	α-helix	trans	-61	-45.9	173.8	-101.5	110.7	0	0	0	112	L8 M14 C15 L16	L8-L12 WeakPolarHBondContact O-CB 3.36Å; L8-L12 WeakPolarHBondContact O-CD1 3.45Å; L8-L12 PolarHBondContact O-N 3.33Å; L12-M14 VanDerWaalsContact C-N 3.34Å; L12-M14 PolarHBondContact O-N 3.06Å; L12-C15 PolarHBondContact O-N 3.27Å; L12-L16 WeakPolarHBondContact O-CB 3.28Å; L12-L16 VanDerWaalsContact O-CG 3.28Å; L12-L16 WeakPolarHBondContact O-CG 3.47Å; L12-L16 PolarHBondContact O-N 3.27Å
13	S	77.4	Confident	71.9	Confident	60 Å²	60	107.1 Å²	107.1	42%	0.42	56%	0.555	S	S	.	*	H	α-helix	trans	-61.9	-41.2	178.9	-179.7	0	0	0	0	112.3	T9 R10 L17	T9-S13 WeakPolarHBondContact O-CB 3.32Å; T9-S13 PolarHBondContact O-N 2.99Å; R10-S13 PolarHBondContact O-N 3.37Å; S13-L17 VanDerWaalsContact O-CG 3.29Å; S13-L17 WeakPolarHBondContact O-CG 3.31Å; S13-L17 PolarHBondContact O-N 3.34Å
14	M	77.8	Confident	72.4	Confident	121 Å²	121	105 Å²	105	60%	0.596	54%	0.542	S	S	*	.	H	α-helix	trans	-66.8	-39.1	176.4	-72	-68.4	118.8	0	0	111.7	R10 S11 L12 L17 L18	R10-M14 WeakPolarHBondContact O-CG 3.35Å; R10-M14 PolarHBondContact O-N 3.44Å; S11-M14 PolarHBondContact O-N 3.21Å; L12-M14 VanDerWaalsContact C-N 3.34Å; L12-M14 PolarHBondContact O-N 3.06Å; M14-L17 HydrophobicContact CE-CD1 3.85Å; M14-L17 PolarHBondContact O-N 3.49Å; M14-L18 WeakPolarHBondContact O-CB 3.45Å; M14-L18 PolarHBondContact O-N 3.49Å
15	C	79.5	Confident	72.6	Confident	70 Å²	70	104.2 Å²	104.2	47%	0.473	53%	0.534	S	S	.	.	H	α-helix	trans	-67.6	-40.5	178.3	-152.8	0	0	0	0	111.9	S11 L12 L18 Q19	S11-C15 WeakPolarHBondContact O-CB 2.99Å; S11-C15 PolarHBondContact O-N 3.09Å; L12-C15 PolarHBondContact O-N 3.27Å; C15-L18 PolarHBondContact O-N 3.49Å; C15-Q19 WeakPolarHBondContact O-CB 3.29Å; C15-Q19 WeakPolarHBondContact O-CG 3.25Å; C15-Q19 PolarHBondContact O-N 3.44Å
16	L	81.9	Confident	72.8	Confident	104 Å²	104	105.3 Å²	105.3	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-64.4	-39.9	174.3	-71.3	168.1	0	0	0	112.3	L12 Q19 S20	L12-L16 WeakPolarHBondContact O-CB 3.28Å; L12-L16 VanDerWaalsContact O-CG 3.28Å; L12-L16 WeakPolarHBondContact O-CG 3.47Å; L12-L16 PolarHBondContact O-N 3.27Å; L16-Q19 PolarHBondContact O-N 3.36Å; L16-S20 WeakPolarHBondContact O-CB 3.36Å; L16-S20 PolarHBondContact O-N 2.94Å; L16-S20 PolarHBondContact O-OG 3.22Å
17	L	84.5	Confident	72.7	Confident	97 Å²	97	103.6 Å²	103.6	51%	0.508	54%	0.535	S	S	.	.	H	α-helix	trans	-65.4	-43.6	174.8	-73.3	169.6	0	0	0	111.4	S13 M14 S20 F21	S13-L17 VanDerWaalsContact O-CG 3.29Å; S13-L17 WeakPolarHBondContact O-CG 3.31Å; S13-L17 PolarHBondContact O-N 3.34Å; M14-L17 HydrophobicContact CE-CD1 3.85Å; M14-L17 PolarHBondContact O-N 3.49Å; L17-S20 PolarHBondContact O-N 2.98Å; L17-S20 PolarHBondContact O-OG 3.4Å; L17-F21 WeakPolarHBondContact O-CB 3.34Å; L17-F21 PolarHBondContact O-N 2.86Å
18	L	81.8	Confident	72.4	Confident	123 Å²	123	101 Å²	101	64%	0.644	53%	0.53	S	S	*	.	H	α-helix	trans	-63.5	-42.5	176.7	-146.8	97.2	0	0	0	111.5	M14 C15 F21 V22	M14-L18 WeakPolarHBondContact O-CB 3.45Å; M14-L18 PolarHBondContact O-N 3.49Å; C15-L18 PolarHBondContact O-N 3.49Å; L18-F21 PolarHBondContact O-N 3.05Å; L18-V22 WeakPolarHBondContact O-CB 3.37Å; L18-V22 VanDerWaalsContact O-CG2 3.28Å; L18-V22 WeakPolarHBondContact O-CG2 3.43Å; L18-V22 PolarHBondContact O-N 2.97Å
19	Q	81.1	Confident	72	Confident	117 Å²	117	104.7 Å²	104.7	55%	0.547	54%	0.544	S	S	.	.	H	α-helix	trans	-62.2	-43.5	174.5	-78.7	-179.2	-20.5	0	0	111.6	C15 L16 F21 V22 L23	C15-Q19 WeakPolarHBondContact O-CB 3.29Å; C15-Q19 WeakPolarHBondContact O-CG 3.25Å; C15-Q19 PolarHBondContact O-N 3.44Å; L16-Q19 PolarHBondContact O-N 3.36Å; Q19-F21 VanDerWaalsContact C-N 3.33Å; Q19-F21 PolarHBondContact O-N 3.02Å; Q19-V22 PolarHBondContact O-N 3.34Å; Q19-L23 WeakPolarHBondContact O-CB 3.36Å; Q19-L23 PolarHBondContact O-N 3.3Å
20	S	81.3	Confident	71.2	Confident	58 Å²	58	104.9 Å²	104.9	41%	0.406	55%	0.549	S	S	.	.	H	α-helix	trans	-64.3	-37.3	176.2	73.8	0	0	0	0	112.3	L16 L17 L23 M24	L16-S20 WeakPolarHBondContact O-CB 3.36Å; L16-S20 PolarHBondContact O-N 2.94Å; L16-S20 PolarHBondContact O-OG 3.22Å; L17-S20 PolarHBondContact O-N 2.98Å; L17-S20 PolarHBondContact O-OG 3.4Å; S20-L23 PolarHBondContact O-N 3.47Å; S20-M24 WeakPolarHBondContact O-CB 3.31Å; S20-M24 WeakPolarHBondContact O-CG 3.2Å; S20-M24 PolarHBondContact O-N 3.37Å
21	F	79.2	Confident	70.4	Confident	140 Å²	140	99 Å²	99	61%	0.614	54%	0.541	S	S	*	.	H	α-helix	trans	-69.1	-41.5	177	-163	-106.5	0	0	0	111.7	L17 L18 Q19 M24 I25	L17-F21 WeakPolarHBondContact O-CB 3.34Å; L17-F21 PolarHBondContact O-N 2.86Å; L18-F21 PolarHBondContact O-N 3.05Å; Q19-F21 VanDerWaalsContact C-N 3.33Å; Q19-F21 PolarHBondContact O-N 3.02Å; F21-M24 PolarHBondContact O-N 3.42Å; F21-I25 HydrophobicContact CD1-CD1 3.54Å; F21-I25 HydrophobicContact CD1-CG1 4.4Å; F21-I25 HydrophobicContact CE1-CD1 3.53Å; F21-I25 HydrophobicContact CE1-CG1 4.36Å; F21-I25 HydrophobicContact CG-CD1 4.44Å; F21-I25 HydrophobicContact CZ-CD1 4.4Å; F21-I25 VanDerWaalsContact O-CG1 3.27Å; F21-I25 WeakPolarHBondContact O-CG1 3.47Å; F21-I25 PolarHBondContact O-N 3.46Å
22	V	78.8	Confident	69.9	Low	72 Å²	72	99.5 Å²	99.5	44%	0.436	54%	0.544	S	S	.	.	H	α-helix	trans	-64.2	-41.9	172.9	171.2	0	0	0	0	110.9	L18 Q19 M24 I25 L26	L18-V22 WeakPolarHBondContact O-CB 3.37Å; L18-V22 VanDerWaalsContact O-CG2 3.28Å; L18-V22 WeakPolarHBondContact O-CG2 3.43Å; L18-V22 PolarHBondContact O-N 2.97Å; Q19-V22 PolarHBondContact O-N 3.34Å; V22-M24 VanDerWaalsContact C-N 3.32Å; V22-M24 PolarHBondContact O-N 3.46Å; V22-I25 PolarHBondContact O-N 2.94Å; V22-L26 HydrophobicContact CG1-CD1 3.71Å; V22-L26 HydrophobicContact CG1-CG 4.35Å; V22-L26 WeakPolarHBondContact O-CB 3.34Å; V22-L26 WeakPolarHBondContact O-CD1 3.36Å; V22-L26 VanDerWaalsContact O-CG 3.23Å; V22-L26 WeakPolarHBondContact O-CG 3.4Å; V22-L26 PolarHBondContact O-N 2.97Å
23	L	71.8	Confident	69.6	Low	115 Å²	115	100.9 Å²	100.9	60%	0.602	55%	0.549	S	S	*	.	H	α-helix	trans	-62.1	-41.4	175.1	-138.9	96.5	0	0	0	111.1	Q19 S20 L26 C27	Q19-L23 WeakPolarHBondContact O-CB 3.36Å; Q19-L23 PolarHBondContact O-N 3.3Å; S20-L23 PolarHBondContact O-N 3.47Å; L23-L26 PolarHBondContact O-N 3.23Å; L23-C27 VanDerWaalsContact O-CB 3.3Å; L23-C27 WeakPolarHBondContact O-CB 3.45Å; L23-C27 PolarHBondContact O-N 3.01Å; L23-C27 PolarHBondContact O-SG 3.48Å; L23-C27 VanDerWaalsContact O-SG 3.36Å
24	M	67.5	Low	69.9	Low	104 Å²	104	100 Å²	100	51%	0.512	54%	0.543	S	S	.	.	H	α-helix	trans	-63.8	-44.9	175	-73.5	-67.5	-75.4	0	0	111.3	S20 F21 V22 L26 C27 F28	S20-M24 WeakPolarHBondContact O-CB 3.31Å; S20-M24 WeakPolarHBondContact O-CG 3.2Å; S20-M24 PolarHBondContact O-N 3.37Å; F21-M24 PolarHBondContact O-N 3.42Å; V22-M24 VanDerWaalsContact C-N 3.32Å; V22-M24 PolarHBondContact O-N 3.46Å; M24-L26 VanDerWaalsContact C-N 3.33Å; M24-L26 PolarHBondContact O-N 2.94Å; M24-C27 CarbonylContact O-C 3.6Å; M24-C27 PolarHBondContact O-N 3.1Å; M24-F28 HydrophobicContact CB-CD2 4.47Å; M24-F28 HydrophobicContact CB-CE2 4.45Å; M24-F28 HydrophobicContact CE-CE2 3.81Å; M24-F28 HydrophobicContact CE-CZ 4.28Å; M24-F28 WeakPolarHBondContact O-CB 3.18Å; M24-F28 WeakPolarHBondContact O-CD2 3.36Å; M24-F28 PolarHBondContact O-N 3.36Å
25	I	66.9	Low	70.3	Confident	78 Å²	78	95 Å²	95	40%	0.4	52%	0.519	S	S	.	.	H	α-helix	trans	-61.7	-40	175.9	-68.7	163.4	0	0	0	111.7	F21 V22 F28 H29	F21-I25 HydrophobicContact CD1-CD1 3.54Å; F21-I25 HydrophobicContact CD1-CG1 4.4Å; F21-I25 HydrophobicContact CE1-CD1 3.53Å; F21-I25 HydrophobicContact CE1-CG1 4.36Å; F21-I25 HydrophobicContact CG-CD1 4.44Å; F21-I25 HydrophobicContact CZ-CD1 4.4Å; F21-I25 VanDerWaalsContact O-CG1 3.27Å; F21-I25 WeakPolarHBondContact O-CG1 3.47Å; F21-I25 PolarHBondContact O-N 3.46Å; V22-I25 PolarHBondContact O-N 2.94Å; I25-F28 PolarHBondContact O-N 2.87Å; I25-H29 PolarHBondContact O-N 3.39Å; I25-H29 PolarHBondContact O-ND1 3.45Å
26	L	64.1	Low	70.5	Confident	112 Å²	112	101.4 Å²	101.4	59%	0.586	54%	0.539	S	S	*	.	H	α-helix	trans	-68.7	-37.6	176	-71.8	164.6	0	0	0	111.8	V22 L23 M24 S30	V22-L26 HydrophobicContact CG1-CD1 3.71Å; V22-L26 HydrophobicContact CG1-CG 4.35Å; V22-L26 WeakPolarHBondContact O-CB 3.34Å; V22-L26 WeakPolarHBondContact O-CD1 3.36Å; V22-L26 VanDerWaalsContact O-CG 3.23Å; V22-L26 WeakPolarHBondContact O-CG 3.4Å; V22-L26 PolarHBondContact O-N 2.97Å; L23-L26 PolarHBondContact O-N 3.23Å; M24-L26 VanDerWaalsContact C-N 3.33Å; M24-L26 PolarHBondContact O-N 2.94Å; L26-S30 PolarHBondContact O-OG 3.19Å
27	C	56.7	Low	70.5	Confident	73 Å²	73	99.5 Å²	99.5	49%	0.493	54%	0.544	S	S	.	.	H	α-helix	trans	-71	-33	173.7	-78.1	0	0	0	0	112.9	L23 M24 S30 A31	L23-C27 VanDerWaalsContact O-CB 3.3Å; L23-C27 WeakPolarHBondContact O-CB 3.45Å; L23-C27 PolarHBondContact O-N 3.01Å; L23-C27 PolarHBondContact O-SG 3.48Å; L23-C27 VanDerWaalsContact O-SG 3.36Å; M24-C27 CarbonylContact O-C 3.6Å; M24-C27 PolarHBondContact O-N 3.1Å; C27-S30 WeakPolarHBondContact CA-OG 3.15Å; C27-S30 CarbonylContact O-C 3.39Å; C27-S30 PolarHBondContact O-N 2.92Å; C27-S30 PolarHBondContact O-OG 3.25Å; C27-A31 PolarHBondContact O-N 3.41Å
28	F	51.5	Low	70.8	Confident	145 Å²	145	95.6 Å²	95.6	64%	0.636	53%	0.525	S	S	*	.	H	α-helix	trans	-68.7	-33.3	175.4	-86	-67.7	0	0	0	112.4	M24 I25 S30	M24-F28 HydrophobicContact CB-CD2 4.47Å; M24-F28 HydrophobicContact CB-CE2 4.45Å; M24-F28 HydrophobicContact CE-CE2 3.81Å; M24-F28 HydrophobicContact CE-CZ 4.28Å; M24-F28 WeakPolarHBondContact O-CB 3.18Å; M24-F28 WeakPolarHBondContact O-CD2 3.36Å; M24-F28 PolarHBondContact O-N 3.36Å; I25-F28 PolarHBondContact O-N 2.87Å; F28-S30 PolarHBondContact O-N 3.29Å
29	H	51.4	Low	71.3	Confident	168 Å²	168	96.3 Å²	96.3	78%	0.778	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-12.4	172.5	-89.5	79.4	0	0	0	113.7	I25	I25-H29 PolarHBondContact O-N 3.39Å; I25-H29 PolarHBondContact O-ND1 3.45Å
30	S	46.5	Very low	71.8	Confident	87 Å²	87	92.6 Å²	92.6	61%	0.608	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	10.6	-176.5	38.5	0	0	0	0	113.5	L26 C27 F28 S32	L26-S30 PolarHBondContact O-OG 3.19Å; C27-S30 WeakPolarHBondContact CA-OG 3.15Å; C27-S30 CarbonylContact O-C 3.39Å; C27-S30 PolarHBondContact O-N 2.92Å; C27-S30 PolarHBondContact O-OG 3.25Å; F28-S30 PolarHBondContact O-N 3.29Å; S30-S32 VanDerWaalsContact C-N 3.34Å; S30-S32 PolarHBondContact O-N 3.33Å
31	A	53.2	Low	72.3	Confident	64 Å²	64	92.7 Å²	92.7	53%	0.529	52%	0.516	S	S	.	.	S	Bend	trans	-73.2	94.1	160.2	0	0	0	0	0	107.7	C27 M33	C27-A31 PolarHBondContact O-N 3.41Å; A31-M33 PolarHBondContact O-N 3.19Å
32	S	61.3	Low	72.8	Confident	77 Å²	77	92.1 Å²	92.1	54%	0.538	52%	0.515	S	S	.	.			trans	-46.8	104.4	171	52.4	0	0	0	0	109.4	S30 C34	S30-S32 VanDerWaalsContact C-N 3.34Å; S30-S32 PolarHBondContact O-N 3.33Å; S32-C34 PolarHBondContact O-N 3.03Å
33	M	67.2	Low	72.8	Confident	133 Å²	133	92.5 Å²	92.5	66%	0.655	52%	0.521	S	S	*	.			trans	-70.8	72.2	178.6	-78	171	62.3	0	0	108.7	A31 P63	A31-M33 PolarHBondContact O-N 3.19Å; M33-P63 VanDerWaalsContact O-CG 3.23Å; M33-P63 WeakPolarHBondContact O-CG 3.29Å
34	C	84.1	Confident	73	Confident	43 Å²	43	91.6 Å²	91.6	29%	0.291	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-78.9	127.4	173.5	-160.7	0	0	0	0	108.6	S32 C38 C40	S32-C34 PolarHBondContact O-N 3.03Å; C34-C38 PolarHBondContact SG-O 2.69Å; C34-C38 VanDerWaalsContact SG-O 3.39Å; C34-C40 WeakPolarHBondContact CA-SG 3.49Å; C34-C40 HydrophobicContact CB-CB 3.76Å; C34-C40 WeakPolarHBondContact CB-SG 3.32Å; C34-C40 WeakPolarHBondContact SG-CB 3.35Å; C34-C40 PolarHBondContact SG-N 2.97Å; C34-C40 CovalentContact SG-SG 2.04Å; C34-C40 PolarHBondContact SG-SG 2.91Å
35	P	85.5	Confident	73.9	Confident	16 Å²	16	87.9 Å²	87.9	10%	0.104	53%	0.528	C	S	.	.	P	Polyproline II helix	trans	-59.6	148.4	177.7	-15.7	24.3	0	0	0	111.3	G37 C38 P59 L62	P35-G37 PolarHBondContact O-N 2.77Å; P35-C38 HydrophobicContact CB-CB 4.3Å; P35-C38 HydrophobicContact CG-CB 4.43Å; P35-C38 WeakPolarHBondContact O-CB 3.38Å; P35-C38 PolarHBondContact O-N 3.25Å; P35-P59 HydrophobicContact CB-CB 4.15Å; P35-P59 HydrophobicContact CB-CG 4.4Å; P35-P59 HydrophobicContact CG-CB 4.32Å; P35-L62 HydrophobicContact CG-CD2 3.88Å
36	K	84	Confident	75	Confident	203 Å²	203	84.5 Å²	84.5	88%	0.883	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	130.2	177.9	-65.2	-176	-178.2	176.8	0	110.1	C38	K36-C38 VanDerWaalsContact C-N 3.32Å
37	G	82.4	Confident	76.5	Confident	64 Å²	64	81 Å²	81	66%	0.66	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	3.5	-177.7	0	0	0	0	0	114.3	P35	P35-G37 PolarHBondContact O-N 2.77Å
38	C	91.3	Very high	78.3	Confident	16 Å²	16	77.5 Å²	77.5	11%	0.108	47%	0.469	C	S	.	.			trans	-109.1	154.8	174.4	-54.3	0	0	0	0	111.7	C34 P35 K36 V48 S49 C50	C34-C38 PolarHBondContact SG-O 2.69Å; C34-C38 VanDerWaalsContact SG-O 3.39Å; P35-C38 HydrophobicContact CB-CB 4.3Å; P35-C38 HydrophobicContact CG-CB 4.43Å; P35-C38 WeakPolarHBondContact O-CB 3.38Å; P35-C38 PolarHBondContact O-N 3.25Å; K36-C38 VanDerWaalsContact C-N 3.32Å; C38-V48 HydrophobicContact CB-CG1 4.25Å; C38-S49 CarbonylContact C-O 3.6Å; C38-S49 VanDerWaalsContact CA-O 3.27Å; C38-S49 WeakPolarHBondContact CA-O 3.1Å; C38-C50 HydrophobicContact CB-CB 4.05Å; C38-C50 WeakPolarHBondContact CB-SG 3.29Å; C38-C50 WeakPolarHBondContact SG-CB 2.94Å; C38-C50 CovalentContact SG-SG 2.02Å; C38-C50 PolarHBondContact SG-SG 3.42Å
39	L	92	Very high	80.4	Confident	137 Å²	137	72.4 Å²	72.4	72%	0.717	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	122.7	173.3	-65.4	172.3	0	0	0	108.6	S49	L39-S49 PolarHBondContact N-O 3.48Å; L39-S49 PolarHBondContact O-N 2.92Å
40	C	91.8	Very high	82.5	Confident	39 Å²	39	64.4 Å²	64.4	26%	0.264	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128.6	178.4	-62.6	0	0	0	0	109.7	C34 L46 N47	C34-C40 WeakPolarHBondContact CA-SG 3.49Å; C34-C40 HydrophobicContact CB-CB 3.76Å; C34-C40 WeakPolarHBondContact CB-SG 3.32Å; C34-C40 WeakPolarHBondContact SG-CB 3.35Å; C34-C40 PolarHBondContact SG-N 2.97Å; C34-C40 CovalentContact SG-SG 2.04Å; C34-C40 PolarHBondContact SG-SG 2.91Å; C40-L46 HydrophobicContact CB-CD1 4.1Å; C40-N47 CarbonylContact C-O 3.47Å; C40-N47 VanDerWaalsContact CA-O 3.31Å; C40-N47 WeakPolarHBondContact CA-O 3.41Å
41	S	91.8	Very high	84.8	Confident	60 Å²	60	62.3 Å²	62.3	42%	0.42	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	138.6	-179.7	-178.7	0	0	0	0	110.8	N47	S41-N47 PolarHBondContact N-O 2.91Å; S41-N47 PolarHBondContact O-N 3.47Å
42	H	88.1	Confident	86.8	Confident	128 Å²	128	64.7 Å²	64.7	59%	0.593	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	87.9	177.6	-67.3	-96.1	0	0	0	109.7
43	S	80.2	Confident	88.4	Confident	80 Å²	80	62.4 Å²	62.4	56%	0.559	39%	0.389	S	S	*	.	S	Bend	trans	-132.5	89.2	178.2	60.2	0	0	0	0	110.1	G45	S43-G45 PolarHBondContact N-O 2.92Å; S43-G45 VanDerWaalsContact N-O 3.13Å; S43-G45 PolarHBondContact O-N 3.42Å
44	G	75.9	Confident	89.7	Confident	96 Å²	96	61.1 Å²	61.1	99%	0.99	39%	0.385	S	S	*	.	S	Bend	trans	72.7	14	-176.4	0	0	0	0	0	114.7
45	G	85.1	Confident	90.2	Very high	27 Å²	27	60.4 Å²	60.4	28%	0.278	38%	0.378	S	S	.	.	S	Bend	trans	149.8	162.7	-172.8	0	0	0	0	0	109.1	S43 N47	S43-G45 PolarHBondContact N-O 2.92Å; S43-G45 VanDerWaalsContact N-O 3.13Å; S43-G45 PolarHBondContact O-N 3.42Å; G45-N47 PolarHBondContact O-N 3.48Å
46	L	91.6	Very high	90.7	Very high	6 Å²	6	66.6 Å²	66.6	3%	0.031	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	117.7	173.9	177.3	67.7	0	0	0	109.6	C40 V48 P63 E65 V67 L68	C40-L46 HydrophobicContact CB-CD1 4.1Å; L46-V48 HydrophobicContact CD1-CG2 4.49Å; L46-V48 HydrophobicContact CD2-CG2 4.05Å; L46-V48 HydrophobicContact CG-CG2 3.96Å; L46-P63 HydrophobicContact CD2-CB 3.42Å; L46-P63 VanDerWaalsContact CD2-CB 3.42Å; L46-P63 HydrophobicContact CD2-CG 3.71Å; L46-E65 HydrophobicContact CB-CG 3.96Å; L46-E65 WeakPolarHBondContact CB-O 3.36Å; L46-E65 HydrophobicContact CD2-CG 3.76Å; L46-E65 HydrophobicContact CG-CG 4.5Å; L46-V67 PolarHBondContact O-N 3.35Å; L46-L68 PolarHBondContact O-N 3.2Å
47	N	94.5	Very high	91.2	Very high	38 Å²	38	63.6 Å²	63.6	20%	0.203	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.5	172.6	-179.5	7.8	0	0	0	109	C40 S41 G45 L68 Y70	C40-N47 CarbonylContact C-O 3.47Å; C40-N47 VanDerWaalsContact CA-O 3.31Å; C40-N47 WeakPolarHBondContact CA-O 3.41Å; S41-N47 PolarHBondContact N-O 2.91Å; S41-N47 PolarHBondContact O-N 3.47Å; G45-N47 PolarHBondContact O-N 3.48Å; N47-L68 HydrophobicContact CB-CB 4.31Å; N47-L68 HydrophobicContact CB-CD1 4.33Å; N47-Y70 WeakPolarHBondContact OD1-CD2 3.44Å; N47-Y70 WeakPolarHBondContact OD1-CE2 3.24Å
48	V	94.7	Very high	91.8	Very high	0 Å²	0	61 Å²	61	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	111.5	177.1	-177.6	0	0	0	0	108.5	C38 L46 L62 T66 L68 L69 Y70	C38-V48 HydrophobicContact CB-CG1 4.25Å; L46-V48 HydrophobicContact CD1-CG2 4.49Å; L46-V48 HydrophobicContact CD2-CG2 4.05Å; L46-V48 HydrophobicContact CG-CG2 3.96Å; V48-L62 HydrophobicContact CG1-CD2 4.1Å; V48-T66 HydrophobicContact CB-CG2 4.13Å; V48-T66 HydrophobicContact CG2-CG2 3.75Å; V48-T66 WeakPolarHBondContact CG2-OG1 3.47Å; V48-L68 PolarHBondContact N-O 2.89Å; V48-L69 HydrophobicContact CB-CD1 4.01Å; V48-L69 HydrophobicContact CG1-CD1 3.98Å; V48-L69 WeakPolarHBondContact O-CA 3.3Å; V48-Y70 PolarHBondContact O-N 3.29Å
49	S	95.4	Very high	91.8	Very high	38 Å²	38	61.4 Å²	61.4	27%	0.266	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	116.2	177.2	178.7	0	0	0	0	110.9	C38 L39 S51	C38-S49 CarbonylContact C-O 3.6Å; C38-S49 VanDerWaalsContact CA-O 3.27Å; C38-S49 WeakPolarHBondContact CA-O 3.1Å; L39-S49 PolarHBondContact N-O 3.48Å; L39-S49 PolarHBondContact O-N 2.92Å; S49-S51 PolarHBondContact OG-OG 2.71Å
50	C	95.5	Very high	91.6	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	37%	0.369	C	S	.	.			trans	-119.1	26.6	178.6	-54.9	0	0	0	0	110.8	C38 A53 L55 Y70 L71 N74	C38-C50 HydrophobicContact CB-CB 4.05Å; C38-C50 WeakPolarHBondContact CB-SG 3.29Å; C38-C50 WeakPolarHBondContact SG-CB 2.94Å; C38-C50 CovalentContact SG-SG 2.02Å; C38-C50 PolarHBondContact SG-SG 3.42Å; C50-A53 VanDerWaalsContact O-CB 3.3Å; C50-A53 WeakPolarHBondContact O-CB 3.01Å; C50-A53 PolarHBondContact O-N 3.31Å; C50-L55 HydrophobicContact CB-CD1 3.78Å; C50-Y70 WeakPolarHBondContact CA-O 2.98Å; C50-Y70 WeakPolarHBondContact CB-O 3.41Å; C50-Y70 PolarHBondContact N-O 3.23Å; C50-L71 HydrophobicContact CB-CD2 3.72Å; C50-N74 PolarHBondContact O-ND2 3.29Å
51	S	95.9	Very high	91.3	Very high	43 Å²	43	68.2 Å²	68.2	30%	0.301	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	135.1	-174.5	-49.7	0	0	0	0	110.7	S49 A53 D72	S49-S51 PolarHBondContact OG-OG 2.71Å; S51-A53 PolarHBondContact O-N 2.95Å; S51-D72 VanDerWaalsContact CA-O 3.3Å; S51-D72 WeakPolarHBondContact CA-O 3.45Å; S51-D72 WeakPolarHBondContact CB-OD1 3.29Å; S51-D72 PolarHBondContact OG-OD1 3.48Å
52	N	95.6	Very high	91.2	Very high	115 Å²	115	66.3 Å²	66.3	62%	0.615	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	35.1	-179.4	-166.2	43.2	0	0	0	114.6	N54 D72 S73	N52-N54 VanDerWaalsContact C-N 3.34Å; N52-D72 PolarHBondContact N-O 3.48Å; N52-D72 VanDerWaalsContact N-O 3.13Å; N52-S73 VanDerWaalsContact CA-O 3.3Å; N52-S73 WeakPolarHBondContact CA-O 3.44Å
53	A	94.2	Very high	91.3	Very high	28 Å²	28	60.7 Å²	60.7	23%	0.231	35%	0.345	C	S	.	.	S	Bend	trans	-91.6	9.3	179.6	0	0	0	0	0	113.5	C50 S51 L55 N74	C50-A53 VanDerWaalsContact O-CB 3.3Å; C50-A53 WeakPolarHBondContact O-CB 3.01Å; C50-A53 PolarHBondContact O-N 3.31Å; S51-A53 PolarHBondContact O-N 2.95Å; A53-L55 HydrophobicContact CB-CD1 4.29Å; A53-L55 HydrophobicContact CB-CD2 4.45Å; A53-L55 HydrophobicContact CB-CG 3.93Å; A53-L55 PolarHBondContact O-N 2.96Å; A53-N74 PolarHBondContact N-OD1 2.86Å
54	N	94.9	Very high	91.8	Very high	106 Å²	106	60.6 Å²	60.6	57%	0.567	34%	0.342	S	S	*	.			trans	55.6	32.2	-175.5	-62.7	-63.3	0	0	0	113.7	N52 N74 Q75	N52-N54 VanDerWaalsContact C-N 3.34Å; N54-N74 PolarHBondContact N-OD1 3.36Å; N54-Q75 PolarHBondContact OD1-NE2 3.33Å
55	L	94.4	Very high	92.5	Very high	29 Å²	29	59.9 Å²	59.9	15%	0.152	31%	0.313	C	S	.	.			trans	-70.5	132.3	179.3	-62.2	175.2	0	0	0	110.4	C50 A53 P59 L71 N74 Q75 I76	C50-L55 HydrophobicContact CB-CD1 3.78Å; A53-L55 HydrophobicContact CB-CD1 4.29Å; A53-L55 HydrophobicContact CB-CD2 4.45Å; A53-L55 HydrophobicContact CB-CG 3.93Å; A53-L55 PolarHBondContact O-N 2.96Å; L55-P59 HydrophobicContact CD1-CG 4.09Å; L55-L71 HydrophobicContact CD1-CD2 3.65Å; L55-N74 HydrophobicContact CB-CB 4.11Å; L55-N74 PolarHBondContact N-OD1 2.89Å; L55-Q75 CarbonylContact O-C 3.58Å; L55-Q75 VanDerWaalsContact O-C 3.24Å; L55-Q75 VanDerWaalsContact O-CA 3.29Å; L55-Q75 WeakPolarHBondContact O-CA 3.3Å; L55-Q75 PolarHBondContact O-N 3.49Å; L55-I76 HydrophobicContact CB-CG1 4.43Å; L55-I76 PolarHBondContact O-N 3.47Å
56	K	95.1	Very high	92.9	Very high	146 Å²	146	58.6 Å²	58.6	64%	0.635	30%	0.3	S	S	*	.	S	Bend	trans	-93.3	-20.1	172.9	-64.2	-176.3	178.3	-177.3	0	112.8	I76	K56-I76 WeakPolarHBondContact O-CA 3.26Å
57	E	95.1	Very high	93.1	Very high	139 Å²	139	59.2 Å²	59.2	65%	0.65	30%	0.304	S	S	*	.	S	Bend	trans	-143.2	158.7	-176.9	-65.2	-178.5	-161.4	0	0	109.3
58	I	95	Very high	93.2	Very high	11 Å²	11	59.7 Å²	59.7	6%	0.056	31%	0.306	C	S	.	.			trans	-71.7	126.5	174.8	-60	166.3	0	0	0	108.5	R60 L62 L71 I76 I79 I83 F84 L95	I58-R60 PolarHBondContact O-N 2.92Å; I58-L62 HydrophobicContact CG2-CD1 4.29Å; I58-L71 HydrophobicContact CG1-CD1 4.39Å; I58-L71 HydrophobicContact CG2-CD1 4.03Å; I58-I76 HydrophobicContact CG1-CD1 4.02Å; I58-I76 HydrophobicContact CG1-CG2 4.07Å; I58-I79 HydrophobicContact CD1-CB 4.46Å; I58-I79 HydrophobicContact CD1-CG1 4.38Å; I58-I79 HydrophobicContact CD1-CG2 3.99Å; I58-I83 HydrophobicContact CB-CG1 4.07Å; I58-I83 HydrophobicContact CD1-CG1 4.5Å; I58-I83 HydrophobicContact CD1-CG2 4.22Å; I58-I83 HydrophobicContact CG2-CG1 3.81Å; I58-F84 HydrophobicContact CD1-CE1 4.44Å; I58-F84 HydrophobicContact CD1-CE2 4.47Å; I58-F84 HydrophobicContact CD1-CZ 3.78Å; I58-F84 HydrophobicContact CG2-CE1 3.97Å; I58-F84 HydrophobicContact CG2-CZ 4.37Å; I58-L95 HydrophobicContact CD1-CD2 4.43Å; I58-L95 HydrophobicContact CG1-CD2 4.47Å
59	P	91.4	Very high	93.3	Very high	24 Å²	24	59.7 Å²	59.7	16%	0.156	31%	0.306	C	S	.	.			trans	-60.1	134.2	177.2	-20.6	31.5	0	0	0	111.2	P35 L55 L62	P35-P59 HydrophobicContact CB-CB 4.15Å; P35-P59 HydrophobicContact CB-CG 4.4Å; P35-P59 HydrophobicContact CG-CB 4.32Å; L55-P59 HydrophobicContact CD1-CG 4.09Å; P59-L62 HydrophobicContact CB-CG 4.46Å; P59-L62 WeakPolarHBondContact O-CD1 3.38Å; P59-L62 WeakPolarHBondContact O-CG 3.2Å
60	R	87.5	Confident	93.4	Very high	205 Å²	205	61.2 Å²	61.2	77%	0.774	31%	0.306	S	S	*	.	S	Bend	trans	-79.8	-25.4	176.5	-63.9	-176.2	-176.7	-174.4	1	112.7	I58 L62 I83	I58-R60 PolarHBondContact O-N 2.92Å; R60-L62 PolarHBondContact O-N 3.44Å; R60-L62 VanDerWaalsContact O-N 3.08Å; R60-I83 HydrophobicContact CG-CD1 3.99Å
61	D	85.2	Confident	93.5	Very high	114 Å²	114	61.2 Å²	61.2	61%	0.61	31%	0.306	S	S	*	.			trans	-88.7	50.8	-175.2	-52.4	-37.5	0	0	0	111.2
62	L	90.7	Very high	93.6	Very high	20 Å²	20	60.5 Å²	60.5	11%	0.105	30%	0.299	C	S	.	.			trans	-88.6	132.9	176.5	-70.3	166.7	0	0	0	109.8	P35 V48 I58 P59 R60 L69 L87	P35-L62 HydrophobicContact CG-CD2 3.88Å; V48-L62 HydrophobicContact CG1-CD2 4.1Å; I58-L62 HydrophobicContact CG2-CD1 4.29Å; P59-L62 HydrophobicContact CB-CG 4.46Å; P59-L62 WeakPolarHBondContact O-CD1 3.38Å; P59-L62 WeakPolarHBondContact O-CG 3.2Å; R60-L62 PolarHBondContact O-N 3.44Å; R60-L62 VanDerWaalsContact O-N 3.08Å; L62-L69 HydrophobicContact CD1-CD1 4.48Å; L62-L69 HydrophobicContact CD1-CD2 3.7Å; L62-L69 HydrophobicContact CD2-CD1 3.91Å; L62-L87 HydrophobicContact CB-CD1 4.33Å; L62-L87 HydrophobicContact CB-CD2 3.97Å; L62-L87 HydrophobicContact CD1-CD1 4.04Å
63	P	90.1	Very high	93.7	Very high	10 Å²	10	57 Å²	57	7%	0.065	28%	0.284	C	S	.	.			trans	-63.9	136.7	179.1	-23.3	34	0	0	0	112	M33 L46 E65 T66 L87	M33-P63 VanDerWaalsContact O-CG 3.23Å; M33-P63 WeakPolarHBondContact O-CG 3.29Å; L46-P63 HydrophobicContact CD2-CB 3.42Å; L46-P63 VanDerWaalsContact CD2-CB 3.42Å; L46-P63 HydrophobicContact CD2-CG 3.71Å; P63-E65 PolarHBondContact O-N 3.32Å; P63-T66 VanDerWaalsContact O-CB 3.25Å; P63-T66 WeakPolarHBondContact O-CB 3.27Å; P63-T66 PolarHBondContact O-N 3.02Å; P63-T66 PolarHBondContact O-OG1 3.49Å; P63-L87 VanDerWaalsContact O-CD2 3.29Å; P63-L87 WeakPolarHBondContact O-CD2 3.01Å
64	P	90.7	Very high	93.8	Very high	77 Å²	77	56.1 Å²	56.1	50%	0.5	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-24.9	-174.6	26.5	-34.4	0	0	0	113.7	T66	P64-T66 PolarHBondContact O-N 3.49Å
65	E	90.8	Very high	93.9	Very high	81 Å²	81	55.9 Å²	55.9	38%	0.379	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	5.3	174.1	68.2	-88.5	-164.1	0	0	114.4	L46 P63 V67	L46-E65 HydrophobicContact CB-CG 3.96Å; L46-E65 WeakPolarHBondContact CB-O 3.36Å; L46-E65 HydrophobicContact CD2-CG 3.76Å; L46-E65 HydrophobicContact CG-CG 4.5Å; P63-E65 PolarHBondContact O-N 3.32Å; E65-V67 PolarHBondContact O-N 2.91Å
66	T	93.3	Very high	94.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	122.1	178.4	-60.3	0	0	0	0	111	V48 P63 P64 L68 L69 Q89 L90	V48-T66 HydrophobicContact CB-CG2 4.13Å; V48-T66 HydrophobicContact CG2-CG2 3.75Å; V48-T66 WeakPolarHBondContact CG2-OG1 3.47Å; P63-T66 VanDerWaalsContact O-CB 3.25Å; P63-T66 WeakPolarHBondContact O-CB 3.27Å; P63-T66 PolarHBondContact O-N 3.02Å; P63-T66 PolarHBondContact O-OG1 3.49Å; P64-T66 PolarHBondContact O-N 3.49Å; T66-L68 WeakPolarHBondContact CG2-O 3.34Å; T66-L69 HydrophobicContact CG2-CB 4.12Å; T66-Q89 CarbonylContact O-C 3.5Å; T66-L90 HydrophobicContact CG2-CD1 4.02Å; T66-L90 WeakPolarHBondContact O-CA 3.47Å; T66-L90 PolarHBondContact O-N 3.37Å
67	V	95.5	Very high	94.2	Very high	20 Å²	20	51.1 Å²	51.1	12%	0.121	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-38.9	178.4	-179.1	0	0	0	0	111.1	L46 E65 Q89 R91 V92	L46-V67 PolarHBondContact O-N 3.35Å; E65-V67 PolarHBondContact O-N 2.91Å; V67-Q89 HydrophobicContact CG2-CB 4.29Å; V67-R91 HydrophobicContact CG1-CB 4.16Å; V67-R91 HydrophobicContact CG1-CG 3.98Å; V67-R91 PolarHBondContact O-N 3.13Å; V67-V92 PolarHBondContact O-N 3.42Å
68	L	96.1	Very high	94.3	Very high	47 Å²	47	46.8 Å²	46.8	25%	0.246	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.4	-179.4	-50.7	176.4	0	0	0	108.5	L46 N47 V48 T66 Y70 V92	L46-L68 PolarHBondContact O-N 3.2Å; N47-L68 HydrophobicContact CB-CB 4.31Å; N47-L68 HydrophobicContact CB-CD1 4.33Å; V48-L68 PolarHBondContact N-O 2.89Å; T66-L68 WeakPolarHBondContact CG2-O 3.34Å; L68-Y70 HydrophobicContact CB-CE2 3.84Å; L68-V92 HydrophobicContact CD2-CB 3.64Å; L68-V92 HydrophobicContact CD2-CG2 3.53Å
69	L	96.6	Very high	94.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	114.9	179.1	-178.9	55.2	0	0	0	110.2	V48 L62 T66 L71 F84 L87 L90 V92 L93 N94	V48-L69 HydrophobicContact CB-CD1 4.01Å; V48-L69 HydrophobicContact CG1-CD1 3.98Å; V48-L69 WeakPolarHBondContact O-CA 3.3Å; L62-L69 HydrophobicContact CD1-CD1 4.48Å; L62-L69 HydrophobicContact CD1-CD2 3.7Å; L62-L69 HydrophobicContact CD2-CD1 3.91Å; T66-L69 HydrophobicContact CG2-CB 4.12Å; L69-L71 HydrophobicContact CD1-CD1 4.12Å; L69-L71 HydrophobicContact CD1-CG 4.01Å; L69-L71 HydrophobicContact CD2-CD1 3.85Å; L69-L71 HydrophobicContact CG-CD1 3.85Å; L69-L71 HydrophobicContact CG-CG 4.09Å; L69-F84 HydrophobicContact CD2-CD1 4.37Å; L69-F84 HydrophobicContact CD2-CE1 3.96Å; L69-L87 HydrophobicContact CD2-CD1 4.17Å; L69-L90 HydrophobicContact CB-CD1 3.65Å; L69-V92 PolarHBondContact N-O 3.45Å; L69-L93 HydrophobicContact CB-CD1 4.15Å; L69-L93 HydrophobicContact CD2-CD1 3.87Å; L69-L93 HydrophobicContact CG-CD1 3.97Å; L69-L93 WeakPolarHBondContact O-CA 3.42Å; L69-N94 PolarHBondContact O-N 3.26Å
70	Y	97.4	Very high	94.5	Very high	70 Å²	70	47.5 Å²	47.5	28%	0.275	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	113.2	176.2	-58.7	-86.5	0	0	0	109.8	N47 V48 C50 L68 N94	N47-Y70 WeakPolarHBondContact OD1-CD2 3.44Å; N47-Y70 WeakPolarHBondContact OD1-CE2 3.24Å; V48-Y70 PolarHBondContact O-N 3.29Å; C50-Y70 WeakPolarHBondContact CA-O 2.98Å; C50-Y70 WeakPolarHBondContact CB-O 3.41Å; C50-Y70 PolarHBondContact N-O 3.23Å; L68-Y70 HydrophobicContact CB-CE2 3.84Å; Y70-N94 HydrophobicContact CD1-CB 3.77Å; Y70-N94 HydrophobicContact CE1-CB 4.37Å
71	L	97.2	Very high	94.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.227	C	C	.	.			trans	-122.3	19.6	178.4	-73.2	163.6	0	0	0	110.8	C50 L55 I58 L69 N74 I76 L93 N94 L95 N98	C50-L71 HydrophobicContact CB-CD2 3.72Å; L55-L71 HydrophobicContact CD1-CD2 3.65Å; I58-L71 HydrophobicContact CG1-CD1 4.39Å; I58-L71 HydrophobicContact CG2-CD1 4.03Å; L69-L71 HydrophobicContact CD1-CD1 4.12Å; L69-L71 HydrophobicContact CD1-CG 4.01Å; L69-L71 HydrophobicContact CD2-CD1 3.85Å; L69-L71 HydrophobicContact CG-CD1 3.85Å; L69-L71 HydrophobicContact CG-CG 4.09Å; L71-N74 PolarHBondContact O-ND2 3.43Å; L71-I76 HydrophobicContact CB-CD1 4.23Å; L71-I76 HydrophobicContact CD2-CD1 4.46Å; L71-L93 HydrophobicContact CD1-CD1 4.46Å; L71-N94 CarbonylContact C-O 3.52Å; L71-N94 WeakPolarHBondContact CA-O 3.28Å; L71-N94 PolarHBondContact N-O 3.38Å; L71-L95 HydrophobicContact CB-CD2 3.71Å; L71-L95 HydrophobicContact CD1-CD2 3.88Å; L71-L95 HydrophobicContact CG-CD2 4.46Å; L71-N98 PolarHBondContact O-ND2 3.43Å
72	D	98	Very high	95	Very high	28 Å²	28	39.3 Å²	39.3	15%	0.15	22%	0.215	C	C	.	.			trans	-69.3	158.7	-176.5	67.1	-79.4	0	0	0	113	S51 N52 N74 N94 S96	S51-D72 VanDerWaalsContact CA-O 3.3Å; S51-D72 WeakPolarHBondContact CA-O 3.45Å; S51-D72 WeakPolarHBondContact CB-OD1 3.29Å; S51-D72 PolarHBondContact OG-OD1 3.48Å; N52-D72 PolarHBondContact N-O 3.48Å; N52-D72 VanDerWaalsContact N-O 3.13Å; D72-N74 VanDerWaalsContact C-N 3.3Å; D72-N74 PolarHBondContact O-N 2.89Å; D72-N74 PolarHBondContact O-ND2 3.37Å; D72-N94 PolarHBondContact N-O 2.9Å; D72-S96 WeakPolarHBondContact CA-O 3.39Å; D72-S96 WeakPolarHBondContact CB-O 3.44Å
73	S	97.8	Very high	95.2	Very high	41 Å²	41	39.9 Å²	39.9	29%	0.287	22%	0.218	S	C	.	.	S	Bend	trans	59	39.5	176.6	-47.1	0	0	0	0	112.9	N52 S96 K97	N52-S73 VanDerWaalsContact CA-O 3.3Å; N52-S73 WeakPolarHBondContact CA-O 3.44Å; S73-S96 PolarHBondContact N-O 3.44Å; S73-K97 VanDerWaalsContact CA-O 3.26Å; S73-K97 WeakPolarHBondContact CA-O 3.47Å; S73-K97 PolarHBondContact N-O 3.48Å
74	N	97.5	Very high	95.4	Very high	11 Å²	11	39.4 Å²	39.4	6%	0.059	22%	0.215	C	C	.	.	S	Bend	trans	-114	-168.2	176.4	-79.1	-63.6	0	0	0	110.7	C50 A53 N54 L55 L71 D72 I76 N98	C50-N74 PolarHBondContact O-ND2 3.29Å; A53-N74 PolarHBondContact N-OD1 2.86Å; N54-N74 PolarHBondContact N-OD1 3.36Å; L55-N74 HydrophobicContact CB-CB 4.11Å; L55-N74 PolarHBondContact N-OD1 2.89Å; L71-N74 PolarHBondContact O-ND2 3.43Å; D72-N74 VanDerWaalsContact C-N 3.3Å; D72-N74 PolarHBondContact O-N 2.89Å; D72-N74 PolarHBondContact O-ND2 3.37Å; N74-I76 HydrophobicContact CB-CD1 4.3Å; N74-I76 HydrophobicContact CB-CG1 4.15Å; N74-N98 VanDerWaalsContact CA-OD1 3.25Å; N74-N98 WeakPolarHBondContact CA-OD1 3.27Å; N74-N98 WeakPolarHBondContact CB-OD1 3.25Å; N74-N98 PolarHBondContact N-OD1 3.34Å; N74-N98 PolarHBondContact O-OD1 2.91Å
75	Q	97.5	Very high	95.5	Very high	101 Å²	101	40.3 Å²	40.3	47%	0.472	21%	0.211	S	C	.	.			trans	-116.6	31.5	-178.3	-59.4	173.3	33.1	0	0	111.2	N54 L55 N98	N54-Q75 PolarHBondContact OD1-NE2 3.33Å; L55-Q75 CarbonylContact O-C 3.58Å; L55-Q75 VanDerWaalsContact O-C 3.24Å; L55-Q75 VanDerWaalsContact O-CA 3.29Å; L55-Q75 WeakPolarHBondContact O-CA 3.3Å; L55-Q75 PolarHBondContact O-N 3.49Å; Q75-N98 PolarHBondContact N-OD1 3.34Å
76	I	97.8	Very high	95.5	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.217	C	C	.	.			trans	-73.3	131.4	-178.2	-57.1	170.4	0	0	0	109.2	L55 K56 I58 L71 N74 S78 L95 N98 G99 I100	L55-I76 HydrophobicContact CB-CG1 4.43Å; L55-I76 PolarHBondContact O-N 3.47Å; K56-I76 WeakPolarHBondContact O-CA 3.26Å; I58-I76 HydrophobicContact CG1-CD1 4.02Å; I58-I76 HydrophobicContact CG1-CG2 4.07Å; L71-I76 HydrophobicContact CB-CD1 4.23Å; L71-I76 HydrophobicContact CD2-CD1 4.46Å; N74-I76 HydrophobicContact CB-CD1 4.3Å; N74-I76 HydrophobicContact CB-CG1 4.15Å; I76-S78 WeakPolarHBondContact CG2-O 3.28Å; I76-L95 HydrophobicContact CD1-CD2 4.08Å; I76-N98 HydrophobicContact CB-CB 4.37Å; I76-N98 WeakPolarHBondContact CB-OD1 3.25Å; I76-N98 WeakPolarHBondContact CG1-OD1 3.32Å; I76-N98 PolarHBondContact N-OD1 3.42Å; I76-G99 CarbonylContact O-C 3.58Å; I76-G99 WeakPolarHBondContact O-CA 3.05Å; I76-G99 PolarHBondContact O-N 3.41Å; I76-I100 HydrophobicContact CB-CG1 4.45Å; I76-I100 HydrophobicContact CG2-CG1 4.24Å; I76-I100 WeakPolarHBondContact O-CG1 3.34Å; I76-I100 PolarHBondContact O-N 3.22Å
77	T	97.3	Very high	95.6	Very high	74 Å²	74	41.3 Å²	41.3	45%	0.454	22%	0.219	S	C	.	.			trans	-109.3	-18.2	-175.2	58.7	0	0	0	0	114.6	G99 I100 E101	T77-G99 WeakPolarHBondContact CA-O 3.49Å; T77-I100 CarbonylContact O-C 3.06Å; T77-I100 WeakPolarHBondContact O-CA 3.29Å; T77-E101 PolarHBondContact O-N 2.85Å
78	S	96.6	Very high	95.5	Very high	49 Å²	49	45.7 Å²	45.7	34%	0.343	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	156.1	178.4	62.9	0	0	0	0	112.6	I76 F102	I76-S78 WeakPolarHBondContact CG2-O 3.28Å; S78-F102 VanDerWaalsContact CA-O 3.27Å; S78-F102 WeakPolarHBondContact CA-O 3.47Å
79	I	96.7	Very high	95.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	103.4	170.2	-48.6	178.2	0	0	0	108	I58 I83 F84 L95 I100 F102 I103 D104 A107 F108 L120	I58-I79 HydrophobicContact CD1-CB 4.46Å; I58-I79 HydrophobicContact CD1-CG1 4.38Å; I58-I79 HydrophobicContact CD1-CG2 3.99Å; I79-I83 HydrophobicContact CG2-CG2 3.95Å; I79-F84 HydrophobicContact CG2-CE2 3.85Å; I79-F84 HydrophobicContact CG2-CZ 4.47Å; I79-L95 HydrophobicContact CD1-CD1 3.69Å; I79-L95 HydrophobicContact CG1-CD1 4.37Å; I79-I100 HydrophobicContact CD1-CD1 4.18Å; I79-I100 HydrophobicContact CD1-CG2 4.49Å; I79-I100 HydrophobicContact CG1-CD1 4.13Å; I79-I100 HydrophobicContact CG1-CG2 4.14Å; I79-F102 PolarHBondContact N-O 3.15Å; I79-I103 HydrophobicContact CB-CG2 4.47Å; I79-I103 HydrophobicContact CD1-CD1 4.17Å; I79-I103 HydrophobicContact CD1-CG1 4.01Å; I79-I103 HydrophobicContact CG1-CG1 4.35Å; I79-D104 PolarHBondContact O-N 3.41Å; I79-D104 VanDerWaalsContact O-N 3.13Å; I79-A107 HydrophobicContact CB-CB 4.24Å; I79-A107 HydrophobicContact CG2-CB 3.72Å; I79-F108 HydrophobicContact CD1-CE1 4.41Å; I79-F108 HydrophobicContact CD1-CZ 3.89Å; I79-L120 HydrophobicContact CD1-CD2 3.7Å
80	P	94.5	Very high	95.3	Very high	49 Å²	49	48.7 Å²	48.7	32%	0.318	25%	0.25	S	S	.	.			trans	-72.5	158.3	-177.6	24.1	-26.4	0	0	0	112.2	E82 I83 D104	P80-E82 PolarHBondContact O-N 2.84Å; P80-I83 HydrophobicContact CG-CB 4.05Å; P80-I83 HydrophobicContact CG-CD1 4.4Å; P80-I83 HydrophobicContact CG-CG1 4.22Å; P80-I83 WeakPolarHBondContact O-CG2 3.35Å; P80-D104 WeakPolarHBondContact CA-OD2 3.3Å
81	N	92.7	Very high	95.3	Very high	74 Å²	74	51.5 Å²	51.5	40%	0.396	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	135.7	174.6	-77.3	-55.1	0	0	0	113	I83 D104 H106	N81-I83 PolarHBondContact O-N 2.81Å; N81-D104 HydrophobicContact CB-CB 4.33Å; N81-D104 VanDerWaalsContact CG-CB 3.46Å; N81-D104 PolarHBondContact N-OD2 2.83Å; N81-D104 PolarHBondContact ND2-OD2 3.24Å; N81-D104 VanDerWaalsContact OD1-CB 3.3Å; N81-D104 WeakPolarHBondContact OD1-CB 3.5Å; N81-H106 PolarHBondContact OD1-N 2.79Å
82	E	90.8	Very high	95.3	Very high	73 Å²	73	53 Å²	53	34%	0.341	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	19.4	170	-54.2	-168.6	164.7	0	0	115.4	P80 F84 K85 H106 K109	P80-E82 PolarHBondContact O-N 2.84Å; E82-F84 PolarHBondContact O-N 3.23Å; E82-K85 HydrophobicContact CB-CB 4.12Å; E82-K85 HydrophobicContact CB-CD 4.11Å; E82-K85 VanDerWaalsContact O-CB 3.29Å; E82-K85 WeakPolarHBondContact O-CB 3.3Å; E82-K85 VanDerWaalsContact O-CG 3.25Å; E82-K85 WeakPolarHBondContact O-CG 3.21Å; E82-K85 PolarHBondContact O-N 2.77Å; E82-K85 VanDerWaalsContact O-N 3.1Å; E82-H106 PolarHBondContact N-O 2.74Å; E82-H106 VanDerWaalsContact N-O 3.08Å; E82-K109 HydrophobicContact CG-CB 4.44Å; E82-K109 HydrophobicContact CG-CD 4.21Å; E82-K109 WeakPolarHBondContact OE1-CD 3.46Å; E82-K109 WeakPolarHBondContact OE1-CE 3.19Å; E82-K109 IonicContact OE1-NZ 2.72Å; E82-K109 PolarHBondContact OE1-NZ 2.79Å
83	I	94	Very high	95.2	Very high	33 Å²	33	51.6 Å²	51.6	17%	0.169	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-25.8	-178.5	-169.8	58.3	0	0	0	113.3	I58 R60 I79 P80 N81	I58-I83 HydrophobicContact CB-CG1 4.07Å; I58-I83 HydrophobicContact CD1-CG1 4.5Å; I58-I83 HydrophobicContact CD1-CG2 4.22Å; I58-I83 HydrophobicContact CG2-CG1 3.81Å; R60-I83 HydrophobicContact CG-CD1 3.99Å; I79-I83 HydrophobicContact CG2-CG2 3.95Å; P80-I83 HydrophobicContact CG-CB 4.05Å; P80-I83 HydrophobicContact CG-CD1 4.4Å; P80-I83 HydrophobicContact CG-CG1 4.22Å; P80-I83 WeakPolarHBondContact O-CG2 3.35Å; N81-I83 PolarHBondContact O-N 2.81Å
84	F	94.6	Very high	95.2	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	9.8	178.9	-53.1	-62	0	0	0	113.3	I58 L69 I79 E82 D86 L87 L93 L95 F108 V111	I58-F84 HydrophobicContact CD1-CE1 4.44Å; I58-F84 HydrophobicContact CD1-CE2 4.47Å; I58-F84 HydrophobicContact CD1-CZ 3.78Å; I58-F84 HydrophobicContact CG2-CE1 3.97Å; I58-F84 HydrophobicContact CG2-CZ 4.37Å; L69-F84 HydrophobicContact CD2-CD1 4.37Å; L69-F84 HydrophobicContact CD2-CE1 3.96Å; I79-F84 HydrophobicContact CG2-CE2 3.85Å; I79-F84 HydrophobicContact CG2-CZ 4.47Å; E82-F84 PolarHBondContact O-N 3.23Å; F84-D86 PolarHBondContact O-N 3.35Å; F84-D86 VanDerWaalsContact O-N 3.09Å; F84-L87 HydrophobicContact CB-CD1 4.38Å; F84-L87 HydrophobicContact CD1-CD1 3.85Å; F84-L87 PolarHBondContact O-N 2.8Å; F84-L93 HydrophobicContact CD2-CD2 4.08Å; F84-L93 HydrophobicContact CE1-CD1 4.19Å; F84-L93 HydrophobicContact CE1-CD2 4.13Å; F84-L93 HydrophobicContact CE2-CD2 3.53Å; F84-L93 HydrophobicContact CZ-CD1 4.09Å; F84-L93 HydrophobicContact CZ-CD2 3.54Å; F84-L93 HydrophobicContact CZ-CG 4.47Å; F84-L95 HydrophobicContact CZ-CD1 4.27Å; F84-F108 HydrophobicContact CD2-CD1 4.12Å; F84-F108 HydrophobicContact CD2-CE1 4.44Å; F84-F108 HydrophobicContact CE2-CD1 4.2Å; F84-F108 HydrophobicContact CE2-CE1 4.06Å; F84-V111 HydrophobicContact CB-CG1 3.83Å; F84-V111 HydrophobicContact CB-CG2 4.07Å; F84-V111 VanDerWaalsContact O-CG1 3.29Å; F84-V111 WeakPolarHBondContact O-CG1 3.38Å
85	K	92.6	Very high	95.3	Very high	95 Å²	95	50.4 Å²	50.4	41%	0.413	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-33.5	-168	69.7	-177	-176.5	176.5	0	114.3	E82 H88 K109	E82-K85 HydrophobicContact CB-CB 4.12Å; E82-K85 HydrophobicContact CB-CD 4.11Å; E82-K85 VanDerWaalsContact O-CB 3.29Å; E82-K85 WeakPolarHBondContact O-CB 3.3Å; E82-K85 VanDerWaalsContact O-CG 3.25Å; E82-K85 WeakPolarHBondContact O-CG 3.21Å; E82-K85 PolarHBondContact O-N 2.77Å; E82-K85 VanDerWaalsContact O-N 3.1Å; K85-H88 PolarHBondContact O-CE1 3.42Å; K85-H88 PolarHBondContact O-ND1 2.81Å; K85-K109 WeakPolarHBondContact CA-O 3.12Å
86	D	91.9	Very high	95.3	Very high	97 Å²	97	46.1 Å²	46.1	52%	0.519	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-6.6	-175.2	-58.1	-48.1	0	0	0	112.3	F84 H88	F84-D86 PolarHBondContact O-N 3.35Å; F84-D86 VanDerWaalsContact O-N 3.09Å; D86-H88 VanDerWaalsContact C-N 3.28Å; D86-H88 PolarHBondContact O-N 3.04Å; D86-H88 VanDerWaalsContact O-N 3.11Å
87	L	94.1	Very high	95.3	Very high	6 Å²	6	52.1 Å²	52.1	3%	0.031	26%	0.26	C	S	.	.			trans	-89.2	54.8	-177.5	-53.3	-174.7	0	0	0	111.8	L62 P63 L69 F84 Q89 L90 V111	L62-L87 HydrophobicContact CB-CD1 4.33Å; L62-L87 HydrophobicContact CB-CD2 3.97Å; L62-L87 HydrophobicContact CD1-CD1 4.04Å; P63-L87 VanDerWaalsContact O-CD2 3.29Å; P63-L87 WeakPolarHBondContact O-CD2 3.01Å; L69-L87 HydrophobicContact CD2-CD1 4.17Å; F84-L87 HydrophobicContact CB-CD1 4.38Å; F84-L87 HydrophobicContact CD1-CD1 3.85Å; F84-L87 PolarHBondContact O-N 2.8Å; L87-Q89 PolarHBondContact O-N 3.39Å; L87-L90 HydrophobicContact CB-CB 4.04Å; L87-L90 HydrophobicContact CD1-CD2 4.26Å; L87-L90 WeakPolarHBondContact O-CB 3.36Å; L87-L90 PolarHBondContact O-N 2.01Å; L87-V111 HydrophobicContact CB-CG1 4.22Å; L87-V111 WeakPolarHBondContact O-CG1 3.36Å
88	H	93.1	Very high	95.3	Very high	112 Å²	112	49.2 Å²	49.2	52%	0.519	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.5	-171.7	-58.1	-54.6	0	0	0	114.5	K85 D86 T114	K85-H88 PolarHBondContact O-CE1 3.42Å; K85-H88 PolarHBondContact O-ND1 2.81Å; D86-H88 VanDerWaalsContact C-N 3.28Å; D86-H88 PolarHBondContact O-N 3.04Å; D86-H88 VanDerWaalsContact O-N 3.11Å; H88-T114 WeakPolarHBondContact O-CB 3.27Å; H88-T114 WeakPolarHBondContact O-CG2 3.4Å; H88-T114 PolarHBondContact O-OG1 3.34Å
89	Q	94.2	Very high	95.4	Very high	110 Å²	110	47.5 Å²	47.5	51%	0.514	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	0.7	179.3	-60.3	-170.3	-10.9	0	0	113.8	T66 V67 L87 R91	T66-Q89 CarbonylContact O-C 3.5Å; V67-Q89 HydrophobicContact CG2-CB 4.29Å; L87-Q89 PolarHBondContact O-N 3.39Å; Q89-R91 PolarHBondContact O-N 3.26Å
90	L	96.3	Very high	95.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.232	C	C	.	.			trans	-65.2	123.4	-174.4	-168.2	70.2	0	0	0	111.3	T66 L69 L87 L93 V111 T114 L115	T66-L90 HydrophobicContact CG2-CD1 4.02Å; T66-L90 WeakPolarHBondContact O-CA 3.47Å; T66-L90 PolarHBondContact O-N 3.37Å; L69-L90 HydrophobicContact CB-CD1 3.65Å; L87-L90 HydrophobicContact CB-CB 4.04Å; L87-L90 HydrophobicContact CD1-CD2 4.26Å; L87-L90 WeakPolarHBondContact O-CB 3.36Å; L87-L90 PolarHBondContact O-N 2.01Å; L90-L93 HydrophobicContact CD2-CB 4.22Å; L90-L93 HydrophobicContact CD2-CD2 4.47Å; L90-V111 HydrophobicContact CB-CG1 4.08Å; L90-V111 HydrophobicContact CD2-CG1 4.19Å; L90-T114 CarbonylContact O-C 3.42Å; L90-T114 VanDerWaalsContact O-C 3.24Å; L90-T114 PolarHBondContact O-OG1 2.99Å; L90-L115 HydrophobicContact CD2-CD1 3.96Å; L90-L115 HydrophobicContact CG-CD1 3.88Å; L90-L115 WeakPolarHBondContact O-CA 3.3Å; L90-L115 PolarHBondContact O-N 3.35Å
91	R	96	Very high	95.5	Very high	129 Å²	129	48.8 Å²	48.8	49%	0.487	23%	0.233	S	C	.	.			trans	-111.4	-35.1	179.4	-66.2	-177.1	-176.7	-154.7	-0.3	112.6	V67 Q89 Q116 T117	V67-R91 HydrophobicContact CG1-CB 4.16Å; V67-R91 HydrophobicContact CG1-CG 3.98Å; V67-R91 PolarHBondContact O-N 3.13Å; Q89-R91 PolarHBondContact O-N 3.26Å; R91-Q116 HydrophobicContact CB-CG 4.21Å; R91-Q116 HydrophobicContact CG-CG 4.41Å; R91-Q116 WeakPolarHBondContact O-CA 3.25Å; R91-Q116 WeakPolarHBondContact O-CB 3.36Å; R91-Q116 PolarHBondContact O-N 3.44Å; R91-T117 PolarHBondContact O-N 3.35Å
92	V	96.6	Very high	95.6	Very high	30 Å²	30	51.7 Å²	51.7	18%	0.182	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	126.3	-178.5	-179.1	0	0	0	0	109.3	V67 L68 L69 T117	V67-V92 PolarHBondContact O-N 3.42Å; L68-V92 HydrophobicContact CD2-CB 3.64Å; L68-V92 HydrophobicContact CD2-CG2 3.53Å; L69-V92 PolarHBondContact N-O 3.45Å; V92-T117 WeakPolarHBondContact CA-O 3.45Å
93	L	97.6	Very high	95.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	114.7	173.3	177	55.1	0	0	0	109.1	L69 L71 F84 L90 L95 F108 L115 T117 L118 D119	L69-L93 HydrophobicContact CB-CD1 4.15Å; L69-L93 HydrophobicContact CD2-CD1 3.87Å; L69-L93 HydrophobicContact CG-CD1 3.97Å; L69-L93 WeakPolarHBondContact O-CA 3.42Å; L71-L93 HydrophobicContact CD1-CD1 4.46Å; F84-L93 HydrophobicContact CD2-CD2 4.08Å; F84-L93 HydrophobicContact CE1-CD1 4.19Å; F84-L93 HydrophobicContact CE1-CD2 4.13Å; F84-L93 HydrophobicContact CE2-CD2 3.53Å; F84-L93 HydrophobicContact CZ-CD1 4.09Å; F84-L93 HydrophobicContact CZ-CD2 3.54Å; F84-L93 HydrophobicContact CZ-CG 4.47Å; L90-L93 HydrophobicContact CD2-CB 4.22Å; L90-L93 HydrophobicContact CD2-CD2 4.47Å; L93-L95 HydrophobicContact CD1-CD1 4.08Å; L93-L95 HydrophobicContact CD1-CG 4.02Å; L93-L95 HydrophobicContact CD2-CD1 3.91Å; L93-L95 HydrophobicContact CG-CD1 3.94Å; L93-L95 HydrophobicContact CG-CG 4.21Å; L93-F108 HydrophobicContact CD2-CD1 4.28Å; L93-F108 HydrophobicContact CD2-CE1 3.88Å; L93-L115 HydrophobicContact CB-CD1 3.86Å; L93-L115 HydrophobicContact CB-CD2 4.41Å; L93-T117 PolarHBondContact N-O 3.07Å; L93-L118 HydrophobicContact CB-CD1 4.1Å; L93-L118 HydrophobicContact CD2-CD1 3.84Å; L93-L118 HydrophobicContact CG-CD1 3.91Å; L93-L118 WeakPolarHBondContact O-CA 3.39Å; L93-D119 PolarHBondContact O-N 2.96Å
94	N	97.9	Very high	95.8	Very high	27 Å²	27	50.3 Å²	50.3	14%	0.144	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	112.9	175.1	-172	-4.5	0	0	0	110.2	L69 Y70 L71 D72 S96	L69-N94 PolarHBondContact O-N 3.26Å; Y70-N94 HydrophobicContact CD1-CB 3.77Å; Y70-N94 HydrophobicContact CE1-CB 4.37Å; L71-N94 CarbonylContact C-O 3.52Å; L71-N94 WeakPolarHBondContact CA-O 3.28Å; L71-N94 PolarHBondContact N-O 3.38Å; D72-N94 PolarHBondContact N-O 2.9Å; N94-S96 VanDerWaalsContact OD1-CB 3.3Å; N94-S96 WeakPolarHBondContact OD1-CB 3.22Å; N94-S96 PolarHBondContact OD1-N 3.45Å; N94-S96 PolarHBondContact OD1-OG 3.1Å
95	L	98	Very high	95.6	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.253	C	S	.	.			trans	-119.6	17.9	176	-76.4	162.2	0	0	0	111	I58 L71 I76 I79 F84 L93 N98 I100 D119 L120 N123	I58-L95 HydrophobicContact CD1-CD2 4.43Å; I58-L95 HydrophobicContact CG1-CD2 4.47Å; L71-L95 HydrophobicContact CB-CD2 3.71Å; L71-L95 HydrophobicContact CD1-CD2 3.88Å; L71-L95 HydrophobicContact CG-CD2 4.46Å; I76-L95 HydrophobicContact CD1-CD2 4.08Å; I79-L95 HydrophobicContact CD1-CD1 3.69Å; I79-L95 HydrophobicContact CG1-CD1 4.37Å; F84-L95 HydrophobicContact CZ-CD1 4.27Å; L93-L95 HydrophobicContact CD1-CD1 4.08Å; L93-L95 HydrophobicContact CD1-CG 4.02Å; L93-L95 HydrophobicContact CD2-CD1 3.91Å; L93-L95 HydrophobicContact CG-CD1 3.94Å; L93-L95 HydrophobicContact CG-CG 4.21Å; L95-N98 PolarHBondContact O-ND2 3.08Å; L95-I100 HydrophobicContact CB-CD1 3.95Å; L95-I100 HydrophobicContact CD2-CD1 4.32Å; L95-D119 CarbonylContact C-O 3.54Å; L95-D119 WeakPolarHBondContact CA-O 3.33Å; L95-D119 PolarHBondContact N-O 3.49Å; L95-L120 HydrophobicContact CB-CD2 3.91Å; L95-L120 HydrophobicContact CD1-CD2 4.01Å; L95-N123 PolarHBondContact O-ND2 3.31Å
96	S	97.9	Very high	95.6	Very high	11 Å²	11	52.5 Å²	52.5	8%	0.077	25%	0.249	C	C	.	.			trans	-63.8	159	-179.4	62.9	0	0	0	0	112.6	D72 S73 N94 N98 D119 S121	D72-S96 WeakPolarHBondContact CA-O 3.39Å; D72-S96 WeakPolarHBondContact CB-O 3.44Å; S73-S96 PolarHBondContact N-O 3.44Å; N94-S96 VanDerWaalsContact OD1-CB 3.3Å; N94-S96 WeakPolarHBondContact OD1-CB 3.22Å; N94-S96 PolarHBondContact OD1-N 3.45Å; N94-S96 PolarHBondContact OD1-OG 3.1Å; S96-N98 VanDerWaalsContact C-N 3.27Å; S96-N98 PolarHBondContact O-N 3.33Å; S96-N98 PolarHBondContact O-ND2 2.94Å; S96-N98 VanDerWaalsContact O-ND2 3.14Å; S96-D119 PolarHBondContact N-O 3.28Å; S96-S121 CarbonylContact C-O 3.17Å; S96-S121 WeakPolarHBondContact CA-O 3.38Å; S96-S121 WeakPolarHBondContact CB-O 3.42Å
97	K	97.8	Very high	95.6	Very high	125 Å²	125	47.9 Å²	47.9	54%	0.543	23%	0.225	S	C	.	.	S	Bend	trans	55.1	42.2	177.1	-59	178.3	179.6	177.1	0	113.1	S73 S121 D122	S73-K97 VanDerWaalsContact CA-O 3.26Å; S73-K97 WeakPolarHBondContact CA-O 3.47Å; S73-K97 PolarHBondContact N-O 3.48Å; K97-S121 PolarHBondContact N-O 3.25Å; K97-D122 WeakPolarHBondContact CA-O 3.47Å; K97-D122 HydrophobicContact CG-CB 3.81Å; K97-D122 PolarHBondContact N-O 2.94Å
98	N	98.3	Very high	95.6	Very high	14 Å²	14	47.8 Å²	47.8	8%	0.075	22%	0.224	C	C	.	.	S	Bend	trans	-110.4	-169.9	172.2	-86.3	-83.9	0	0	0	109.7	L71 N74 Q75 I76 L95 S96 I100 D122 N123	L71-N98 PolarHBondContact O-ND2 3.43Å; N74-N98 VanDerWaalsContact CA-OD1 3.25Å; N74-N98 WeakPolarHBondContact CA-OD1 3.27Å; N74-N98 WeakPolarHBondContact CB-OD1 3.25Å; N74-N98 PolarHBondContact N-OD1 3.34Å; N74-N98 PolarHBondContact O-OD1 2.91Å; Q75-N98 PolarHBondContact N-OD1 3.34Å; I76-N98 HydrophobicContact CB-CB 4.37Å; I76-N98 WeakPolarHBondContact CB-OD1 3.25Å; I76-N98 WeakPolarHBondContact CG1-OD1 3.32Å; I76-N98 PolarHBondContact N-OD1 3.42Å; L95-N98 PolarHBondContact O-ND2 3.08Å; S96-N98 VanDerWaalsContact C-N 3.27Å; S96-N98 PolarHBondContact O-N 3.33Å; S96-N98 PolarHBondContact O-ND2 2.94Å; S96-N98 VanDerWaalsContact O-ND2 3.14Å; N98-I100 HydrophobicContact CB-CD1 4.11Å; N98-I100 HydrophobicContact CB-CG1 3.96Å; N98-D122 PolarHBondContact N-O 3.49Å; N98-N123 VanDerWaalsContact CA-OD1 3.25Å; N98-N123 WeakPolarHBondContact CA-OD1 3.03Å; N98-N123 WeakPolarHBondContact CB-OD1 2.89Å; N98-N123 PolarHBondContact N-OD1 2.9Å; N98-N123 PolarHBondContact O-OD1 3.03Å
99	G	97.6	Very high	95.5	Very high	13 Å²	13	47.6 Å²	47.6	13%	0.134	22%	0.222	C	C	.	.			trans	-107.5	28.6	174.5	0	0	0	0	0	112.7	I76 T77 E101	I76-G99 CarbonylContact O-C 3.58Å; I76-G99 WeakPolarHBondContact O-CA 3.05Å; I76-G99 PolarHBondContact O-N 3.41Å; T77-G99 WeakPolarHBondContact CA-O 3.49Å; G99-E101 PolarHBondContact O-N 3.48Å
100	I	98.3	Very high	95.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.215	C	C	.	.			trans	-67.2	122.7	-168.9	-61.1	165.3	0	0	0	109.6	I76 T77 I79 L95 N98 I103 L120 N123 R124 I125	I76-I100 HydrophobicContact CB-CG1 4.45Å; I76-I100 HydrophobicContact CG2-CG1 4.24Å; I76-I100 WeakPolarHBondContact O-CG1 3.34Å; I76-I100 PolarHBondContact O-N 3.22Å; T77-I100 CarbonylContact O-C 3.06Å; T77-I100 WeakPolarHBondContact O-CA 3.29Å; I79-I100 HydrophobicContact CD1-CD1 4.18Å; I79-I100 HydrophobicContact CD1-CG2 4.49Å; I79-I100 HydrophobicContact CG1-CD1 4.13Å; I79-I100 HydrophobicContact CG1-CG2 4.14Å; L95-I100 HydrophobicContact CB-CD1 3.95Å; L95-I100 HydrophobicContact CD2-CD1 4.32Å; N98-I100 HydrophobicContact CB-CD1 4.11Å; N98-I100 HydrophobicContact CB-CG1 3.96Å; I100-I103 HydrophobicContact CG2-CG1 4.17Å; I100-L120 HydrophobicContact CD1-CD2 4.26Å; I100-N123 HydrophobicContact CB-CB 4.22Å; I100-N123 WeakPolarHBondContact CB-OD1 3.31Å; I100-N123 WeakPolarHBondContact CG1-OD1 3.33Å; I100-N123 PolarHBondContact N-OD1 3.44Å; I100-R124 CarbonylContact O-C 3.58Å; I100-R124 VanDerWaalsContact O-CA 3.28Å; I100-R124 WeakPolarHBondContact O-CA 3.3Å; I100-R124 PolarHBondContact O-N 3.33Å; I100-I125 HydrophobicContact CB-CG1 4.39Å; I100-I125 HydrophobicContact CG2-CD1 4.41Å; I100-I125 HydrophobicContact CG2-CG1 4.09Å; I100-I125 VanDerWaalsContact O-CG1 3.29Å; I100-I125 WeakPolarHBondContact O-CG1 3.4Å; I100-I125 PolarHBondContact O-N 2.98Å
101	E	96.3	Very high	95.2	Very high	76 Å²	76	44.1 Å²	44.1	36%	0.355	22%	0.215	S	C	.	.			trans	-108.6	-34.9	177.4	-70.1	177.8	-170.1	0	0	111.3	T77 G99 R124	T77-E101 PolarHBondContact O-N 2.85Å; G99-E101 PolarHBondContact O-N 3.48Å; E101-R124 HydrophobicContact CG-CB 3.73Å
102	F	94.6	Very high	94.9	Very high	134 Å²	134	38.7 Å²	38.7	59%	0.588	20%	0.198	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.1	-172.9	-56.3	-79.3	0	0	0	112.3	S78 I79	S78-F102 VanDerWaalsContact CA-O 3.27Å; S78-F102 WeakPolarHBondContact CA-O 3.47Å; I79-F102 PolarHBondContact N-O 3.15Å
103	I	95.3	Very high	94.6	Very high	10 Å²	10	45 Å²	45	5%	0.051	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	118	171.2	-56.7	179.7	0	0	0	107.4	I79 I100 A107 F108 L120 I125 V128 A132 F133	I79-I103 HydrophobicContact CB-CG2 4.47Å; I79-I103 HydrophobicContact CD1-CD1 4.17Å; I79-I103 HydrophobicContact CD1-CG1 4.01Å; I79-I103 HydrophobicContact CG1-CG1 4.35Å; I100-I103 HydrophobicContact CG2-CG1 4.17Å; I103-A107 HydrophobicContact CG2-CB 3.65Å; I103-F108 HydrophobicContact CG2-CE2 4.01Å; I103-L120 HydrophobicContact CD1-CD1 3.82Å; I103-L120 HydrophobicContact CD1-CD2 4.5Å; I103-I125 HydrophobicContact CD1-CD1 3.78Å; I103-I125 HydrophobicContact CD1-CG1 4.49Å; I103-V128 HydrophobicContact CD1-CG1 4.23Å; I103-A132 HydrophobicContact CG2-CB 4.06Å; I103-F133 HydrophobicContact CD1-CZ 3.99Å
104	D	93.7	Very high	94.4	Very high	68 Å²	68	47.6 Å²	47.6	36%	0.364	24%	0.241	S	C	.	.			trans	-69.4	161.2	-179.6	-83.3	-22.5	0	0	0	112.8	I79 P80 N81 H106 A107	I79-D104 PolarHBondContact O-N 3.41Å; I79-D104 VanDerWaalsContact O-N 3.13Å; P80-D104 WeakPolarHBondContact CA-OD2 3.3Å; N81-D104 HydrophobicContact CB-CB 4.33Å; N81-D104 VanDerWaalsContact CG-CB 3.46Å; N81-D104 PolarHBondContact N-OD2 2.83Å; N81-D104 PolarHBondContact ND2-OD2 3.24Å; N81-D104 VanDerWaalsContact OD1-CB 3.3Å; N81-D104 WeakPolarHBondContact OD1-CB 3.5Å; D104-H106 PolarHBondContact O-N 2.9Å; D104-H106 VanDerWaalsContact O-N 3.1Å; D104-A107 WeakPolarHBondContact O-CB 2.83Å; D104-A107 PolarHBondContact O-N 2.91Å
105	E	90.7	Very high	94.3	Very high	66 Å²	66	46.5 Å²	46.5	31%	0.308	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-34.4	-175.2	-174.9	170.7	-162.3	0	0	114.9	H129 N131 A132	E105-H129 VanDerWaalsContact CG-ND1 3.33Å; E105-H129 WeakPolarHBondContact CG-ND1 3.45Å; E105-H129 IonicContact OE1-CE1 3.63Å; E105-H129 PolarHBondContact OE1-CE1 3.26Å; E105-H129 IonicContact OE1-ND1 3.65Å; E105-H129 IonicContact OE2-CE1 3.04Å; E105-N131 HydrophobicContact CG-CB 3.72Å; E105-N131 CarbonylContact O-C 3.59Å; E105-N131 PolarHBondContact OE1-ND2 3.37Å; E105-A132 VanDerWaalsContact O-CA 3.32Å; E105-A132 WeakPolarHBondContact O-CA 3.27Å; E105-A132 PolarHBondContact O-N 3.05Å
106	H	90.8	Very high	94	Very high	74 Å²	74	51.6 Å²	51.6	34%	0.343	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	31.1	-175.4	-56.7	100	0	0	0	112	N81 E82 D104 F108 K109	N81-H106 PolarHBondContact OD1-N 2.79Å; E82-H106 PolarHBondContact N-O 2.74Å; E82-H106 VanDerWaalsContact N-O 3.08Å; D104-H106 PolarHBondContact O-N 2.9Å; D104-H106 VanDerWaalsContact O-N 3.1Å; H106-F108 VanDerWaalsContact C-N 3.28Å; H106-F108 PolarHBondContact O-N 3.13Å; H106-K109 HydrophobicContact CB-CB 4.12Å; H106-K109 HydrophobicContact CB-CD 4.23Å; H106-K109 WeakPolarHBondContact O-CB 3.42Å; H106-K109 PolarHBondContact O-N 3.19Å
107	A	92.8	Very high	93.8	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-41	-178.5	0	0	0	0	0	113.5	I79 I103 D104	I79-A107 HydrophobicContact CB-CB 4.24Å; I79-A107 HydrophobicContact CG2-CB 3.72Å; I103-A107 HydrophobicContact CG2-CB 3.65Å; D104-A107 WeakPolarHBondContact O-CB 2.83Å; D104-A107 PolarHBondContact O-N 2.91Å
108	F	93.1	Very high	93.6	Very high	5 Å²	5	47.3 Å²	47.3	2%	0.022	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	14.4	-177	-54.2	-69.6	0	0	0	114.2	I79 F84 L93 I103 H106 G110 V111 A112 L118 L120 A132 F133	I79-F108 HydrophobicContact CD1-CE1 4.41Å; I79-F108 HydrophobicContact CD1-CZ 3.89Å; F84-F108 HydrophobicContact CD2-CD1 4.12Å; F84-F108 HydrophobicContact CD2-CE1 4.44Å; F84-F108 HydrophobicContact CE2-CD1 4.2Å; F84-F108 HydrophobicContact CE2-CE1 4.06Å; L93-F108 HydrophobicContact CD2-CD1 4.28Å; L93-F108 HydrophobicContact CD2-CE1 3.88Å; I103-F108 HydrophobicContact CG2-CE2 4.01Å; H106-F108 VanDerWaalsContact C-N 3.28Å; H106-F108 PolarHBondContact O-N 3.13Å; F108-G110 PolarHBondContact O-N 3.5Å; F108-V111 HydrophobicContact CB-CG2 4.14Å; F108-V111 VanDerWaalsContact O-CG2 3.31Å; F108-V111 WeakPolarHBondContact O-CG2 3.44Å; F108-V111 PolarHBondContact O-N 3.5Å; F108-A112 PolarHBondContact O-N 3.4Å; F108-A112 VanDerWaalsContact O-N 3.11Å; F108-L118 HydrophobicContact CD1-CD2 4.4Å; F108-L118 HydrophobicContact CD2-CD2 4.46Å; F108-L118 HydrophobicContact CE1-CD1 3.82Å; F108-L118 HydrophobicContact CE1-CD2 3.87Å; F108-L118 HydrophobicContact CE2-CD2 3.95Å; F108-L118 HydrophobicContact CZ-CD1 4.1Å; F108-L118 HydrophobicContact CZ-CD2 3.63Å; F108-L120 HydrophobicContact CZ-CD1 4.26Å; F108-A132 WeakPolarHBondContact CD2-O 3.32Å; F108-F133 HydrophobicContact CD2-CD1 4.01Å; F108-F133 HydrophobicContact CD2-CE1 4.18Å; F108-F133 AromaticContact CE2-CD1 3.83Å; F108-F133 HydrophobicContact CE2-CD1 3.83Å; F108-F133 AromaticContact CE2-CE1 3.51Å; F108-F133 HydrophobicContact CE2-CE1 3.51Å; F108-F133 HydrophobicContact CE2-CZ 4.27Å; F108-F133 HydrophobicContact CZ-CE1 4.27Å
109	K	91.4	Very high	93.4	Very high	108 Å²	108	47.3 Å²	47.3	47%	0.47	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	137.4	174.8	-174.5	175.8	169.5	-162.7	0	109.9	E82 K85 H106 V111	E82-K109 HydrophobicContact CG-CB 4.44Å; E82-K109 HydrophobicContact CG-CD 4.21Å; E82-K109 WeakPolarHBondContact OE1-CD 3.46Å; E82-K109 WeakPolarHBondContact OE1-CE 3.19Å; E82-K109 IonicContact OE1-NZ 2.72Å; E82-K109 PolarHBondContact OE1-NZ 2.79Å; K85-K109 WeakPolarHBondContact CA-O 3.12Å; H106-K109 HydrophobicContact CB-CB 4.12Å; H106-K109 HydrophobicContact CB-CD 4.23Å; H106-K109 WeakPolarHBondContact O-CB 3.42Å; H106-K109 PolarHBondContact O-N 3.19Å; K109-V111 VanDerWaalsContact C-N 3.33Å
110	G	90.4	Very high	93.3	Very high	37 Å²	37	46.7 Å²	46.7	38%	0.381	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.5	-21.2	-175.1	0	0	0	0	0	114.7	F108	F108-G110 PolarHBondContact O-N 3.5Å
111	V	94.1	Very high	93.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-4.7	176.1	-58.7	0	0	0	0	113.9	F84 L87 L90 F108 K109 E113 T114 L115	F84-V111 HydrophobicContact CB-CG1 3.83Å; F84-V111 HydrophobicContact CB-CG2 4.07Å; F84-V111 VanDerWaalsContact O-CG1 3.29Å; F84-V111 WeakPolarHBondContact O-CG1 3.38Å; L87-V111 HydrophobicContact CB-CG1 4.22Å; L87-V111 WeakPolarHBondContact O-CG1 3.36Å; L90-V111 HydrophobicContact CB-CG1 4.08Å; L90-V111 HydrophobicContact CD2-CG1 4.19Å; F108-V111 HydrophobicContact CB-CG2 4.14Å; F108-V111 VanDerWaalsContact O-CG2 3.31Å; F108-V111 WeakPolarHBondContact O-CG2 3.44Å; F108-V111 PolarHBondContact O-N 3.5Å; K109-V111 VanDerWaalsContact C-N 3.33Å; V111-E113 PolarHBondContact O-N 2.95Å; V111-E113 VanDerWaalsContact O-N 3.09Å; V111-T114 PolarHBondContact O-N 3.08Å; V111-T114 VanDerWaalsContact O-N 3.16Å; V111-T114 PolarHBondContact O-OG1 2.98Å; V111-L115 WeakPolarHBondContact O-CB 3.06Å; V111-L115 PolarHBondContact O-N 3.25Å
112	A	90.6	Very high	93.2	Very high	14 Å²	14	46.9 Å²	46.9	12%	0.116	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-31.6	-174.3	0	0	0	0	0	114.8	F108 L136 K137	F108-A112 PolarHBondContact O-N 3.4Å; F108-A112 VanDerWaalsContact O-N 3.11Å; A112-L136 HydrophobicContact CB-CD1 4.38Å; A112-K137 PolarHBondContact O-N 3.18Å
113	E	90.1	Very high	93.3	Very high	164 Å²	164	41 Å²	41	77%	0.766	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-29.6	-179.4	-61.3	-170.7	166	0	0	113.8	V111	V111-E113 PolarHBondContact O-N 2.95Å; V111-E113 VanDerWaalsContact O-N 3.09Å
114	T	93.8	Very high	93.4	Very high	53 Å²	53	47.8 Å²	47.8	33%	0.325	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-27	-173.3	51.8	0	0	0	0	112.4	H88 L90 V111 Q116	H88-T114 WeakPolarHBondContact O-CB 3.27Å; H88-T114 WeakPolarHBondContact O-CG2 3.4Å; H88-T114 PolarHBondContact O-OG1 3.34Å; L90-T114 CarbonylContact O-C 3.42Å; L90-T114 VanDerWaalsContact O-C 3.24Å; L90-T114 PolarHBondContact O-OG1 2.99Å; V111-T114 PolarHBondContact O-N 3.08Å; V111-T114 VanDerWaalsContact O-N 3.16Å; V111-T114 PolarHBondContact O-OG1 2.98Å; T114-Q116 PolarHBondContact O-N 3.24Å
115	L	93.8	Very high	93.5	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.021	22%	0.224	C	C	.	.			trans	-67.5	128.7	179.9	-160.8	73	0	0	0	110.7	L90 L93 V111 L118 L136 A138	L90-L115 HydrophobicContact CD2-CD1 3.96Å; L90-L115 HydrophobicContact CG-CD1 3.88Å; L90-L115 WeakPolarHBondContact O-CA 3.3Å; L90-L115 PolarHBondContact O-N 3.35Å; L93-L115 HydrophobicContact CB-CD1 3.86Å; L93-L115 HydrophobicContact CB-CD2 4.41Å; V111-L115 WeakPolarHBondContact O-CB 3.06Å; V111-L115 PolarHBondContact O-N 3.25Å; L115-L118 HydrophobicContact CD2-CB 3.87Å; L115-L118 HydrophobicContact CD2-CD1 4.42Å; L115-L136 HydrophobicContact CB-CD1 4.24Å; L115-L136 HydrophobicContact CD2-CD1 4.03Å; L115-A138 HydrophobicContact CB-CB 4.08Å; L115-A138 HydrophobicContact CD2-CB 4.06Å; L115-A138 HydrophobicContact CG-CB 3.99Å; L115-A138 WeakPolarHBondContact O-CA 3.49Å; L115-A138 VanDerWaalsContact O-CB 3.27Å; L115-A138 WeakPolarHBondContact O-CB 3.45Å
116	Q	93	Very high	93.6	Very high	108 Å²	108	46.6 Å²	46.6	51%	0.505	23%	0.233	S	C	.	.			trans	-105.3	-35.8	-178.8	-59.9	-178.1	-16.2	0	0	111.3	R91 T114 R139	R91-Q116 HydrophobicContact CB-CG 4.21Å; R91-Q116 HydrophobicContact CG-CG 4.41Å; R91-Q116 WeakPolarHBondContact O-CA 3.25Å; R91-Q116 WeakPolarHBondContact O-CB 3.36Å; R91-Q116 PolarHBondContact O-N 3.44Å; T114-Q116 PolarHBondContact O-N 3.24Å; Q116-R139 PolarHBondContact O-N 3.42Å
117	T	92.9	Very high	93.7	Very high	45 Å²	45	46.3 Å²	46.3	28%	0.276	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	129.8	-179.8	-60.5	0	0	0	0	110.3	R91 V92 L93 R139	R91-T117 PolarHBondContact O-N 3.35Å; V92-T117 WeakPolarHBondContact CA-O 3.45Å; L93-T117 PolarHBondContact N-O 3.07Å; T117-R139 WeakPolarHBondContact CA-O 3.41Å
118	L	94.1	Very high	93.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	122.8	173.9	173.4	59.4	0	0	0	108.5	L93 F108 L115 L120 F133 L136 A138 R139 A140 R141	L93-L118 HydrophobicContact CB-CD1 4.1Å; L93-L118 HydrophobicContact CD2-CD1 3.84Å; L93-L118 HydrophobicContact CG-CD1 3.91Å; L93-L118 WeakPolarHBondContact O-CA 3.39Å; F108-L118 HydrophobicContact CD1-CD2 4.4Å; F108-L118 HydrophobicContact CD2-CD2 4.46Å; F108-L118 HydrophobicContact CE1-CD1 3.82Å; F108-L118 HydrophobicContact CE1-CD2 3.87Å; F108-L118 HydrophobicContact CE2-CD2 3.95Å; F108-L118 HydrophobicContact CZ-CD1 4.1Å; F108-L118 HydrophobicContact CZ-CD2 3.63Å; L115-L118 HydrophobicContact CD2-CB 3.87Å; L115-L118 HydrophobicContact CD2-CD1 4.42Å; L118-L120 HydrophobicContact CD1-CD1 4.4Å; L118-L120 HydrophobicContact CD1-CD2 4.4Å; L118-L120 HydrophobicContact CD1-CG 4.05Å; L118-L120 HydrophobicContact CD2-CD1 3.88Å; L118-L120 HydrophobicContact CD2-CG 4.37Å; L118-L120 HydrophobicContact CG-CD1 4.1Å; L118-L120 HydrophobicContact CG-CG 4.05Å; L118-F133 HydrophobicContact CD2-CD1 4.22Å; L118-F133 HydrophobicContact CD2-CE1 3.81Å; L118-L136 HydrophobicContact CD2-CD2 3.75Å; L118-A138 HydrophobicContact CB-CB 4.48Å; L118-R139 PolarHBondContact N-O 3.24Å; L118-A140 HydrophobicContact CB-CB 4.45Å; L118-A140 CarbonylContact O-C 3.24Å; L118-A140 VanDerWaalsContact O-CA 3.26Å; L118-A140 WeakPolarHBondContact O-CA 3.32Å; L118-R141 PolarHBondContact O-N 3.35Å
119	D	95.1	Very high	93.5	Very high	15 Å²	15	50.2 Å²	50.2	8%	0.08	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	114.3	174.7	-154.2	-30.3	0	0	0	110.8	L93 L95 S96 S121 R141	L93-D119 PolarHBondContact O-N 2.96Å; L95-D119 CarbonylContact C-O 3.54Å; L95-D119 WeakPolarHBondContact CA-O 3.33Å; L95-D119 PolarHBondContact N-O 3.49Å; S96-D119 PolarHBondContact N-O 3.28Å; D119-S121 VanDerWaalsContact OD1-CB 3.27Å; D119-S121 WeakPolarHBondContact OD1-CB 3.41Å; D119-S121 PolarHBondContact OD1-N 2.93Å; D119-S121 PolarHBondContact OD1-OG 3.35Å; D119-R141 WeakPolarHBondContact OD2-CD 3.26Å; D119-R141 IonicContact OD2-NH1 3.51Å
120	L	95.3	Very high	93.3	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.26	C	S	.	.			trans	-119.5	14.9	175.9	-67.1	168	0	0	0	110.9	I79 L95 I100 I103 F108 L118 N123 I125 F133 R141 I142 N145	I79-L120 HydrophobicContact CD1-CD2 3.7Å; L95-L120 HydrophobicContact CB-CD2 3.91Å; L95-L120 HydrophobicContact CD1-CD2 4.01Å; I100-L120 HydrophobicContact CD1-CD2 4.26Å; I103-L120 HydrophobicContact CD1-CD1 3.82Å; I103-L120 HydrophobicContact CD1-CD2 4.5Å; F108-L120 HydrophobicContact CZ-CD1 4.26Å; L118-L120 HydrophobicContact CD1-CD1 4.4Å; L118-L120 HydrophobicContact CD1-CD2 4.4Å; L118-L120 HydrophobicContact CD1-CG 4.05Å; L118-L120 HydrophobicContact CD2-CD1 3.88Å; L118-L120 HydrophobicContact CD2-CG 4.37Å; L118-L120 HydrophobicContact CG-CD1 4.1Å; L118-L120 HydrophobicContact CG-CG 4.05Å; L120-N123 PolarHBondContact O-ND2 3.29Å; L120-I125 HydrophobicContact CB-CD1 4.19Å; L120-F133 HydrophobicContact CD1-CE1 3.79Å; L120-F133 HydrophobicContact CD1-CZ 3.85Å; L120-R141 CarbonylContact C-O 3.24Å; L120-R141 WeakPolarHBondContact CA-O 3.27Å; L120-R141 PolarHBondContact N-O 3.03Å; L120-I142 HydrophobicContact CB-CG2 4.28Å; L120-I142 HydrophobicContact CD1-CG2 4.29Å; L120-N145 PolarHBondContact O-ND2 2.97Å
121	S	94.8	Very high	93.1	Very high	17 Å²	17	51 Å²	51	12%	0.119	25%	0.253	C	S	.	.			trans	-65.1	156.8	-179.3	60.2	0	0	0	0	112.8	S96 K97 D119 N123 R141 A143	S96-S121 CarbonylContact C-O 3.17Å; S96-S121 WeakPolarHBondContact CA-O 3.38Å; S96-S121 WeakPolarHBondContact CB-O 3.42Å; K97-S121 PolarHBondContact N-O 3.25Å; D119-S121 VanDerWaalsContact OD1-CB 3.27Å; D119-S121 WeakPolarHBondContact OD1-CB 3.41Å; D119-S121 PolarHBondContact OD1-N 2.93Å; D119-S121 PolarHBondContact OD1-OG 3.35Å; S121-N123 PolarHBondContact O-N 3.04Å; S121-N123 PolarHBondContact O-ND2 3.03Å; S121-R141 PolarHBondContact N-O 2.92Å; S121-A143 VanDerWaalsContact CA-O 3.25Å; S121-A143 WeakPolarHBondContact CA-O 3.42Å
122	D	96.1	Very high	92.7	Very high	63 Å²	63	51.1 Å²	51.1	34%	0.337	25%	0.254	S	S	.	.	S	Bend	trans	56.8	49.3	178.4	-57.3	-55.8	0	0	0	112.5	K97 N98 A143 N144	K97-D122 WeakPolarHBondContact CA-O 3.47Å; K97-D122 HydrophobicContact CG-CB 3.81Å; K97-D122 PolarHBondContact N-O 2.94Å; N98-D122 PolarHBondContact N-O 3.49Å; D122-A143 PolarHBondContact N-O 3.18Å; D122-N144 WeakPolarHBondContact CA-O 3.46Å; D122-N144 PolarHBondContact N-O 2.85Å; D122-N144 WeakPolarHBondContact OD1-CB 3.09Å; D122-N144 PolarHBondContact OD1-ND2 3.05Å
123	N	97.7	Very high	92.6	Very high	10 Å²	10	50.7 Å²	50.7	5%	0.053	25%	0.25	C	C	.	.	S	Bend	trans	-121	-166.7	175.8	-86.3	-76.1	0	0	0	110.3	L95 N98 I100 L120 S121 I125 N144 N145	L95-N123 PolarHBondContact O-ND2 3.31Å; N98-N123 VanDerWaalsContact CA-OD1 3.25Å; N98-N123 WeakPolarHBondContact CA-OD1 3.03Å; N98-N123 WeakPolarHBondContact CB-OD1 2.89Å; N98-N123 PolarHBondContact N-OD1 2.9Å; N98-N123 PolarHBondContact O-OD1 3.03Å; I100-N123 HydrophobicContact CB-CB 4.22Å; I100-N123 WeakPolarHBondContact CB-OD1 3.31Å; I100-N123 WeakPolarHBondContact CG1-OD1 3.33Å; I100-N123 PolarHBondContact N-OD1 3.44Å; L120-N123 PolarHBondContact O-ND2 3.29Å; S121-N123 PolarHBondContact O-N 3.04Å; S121-N123 PolarHBondContact O-ND2 3.03Å; N123-I125 HydrophobicContact CB-CD1 4.23Å; N123-I125 HydrophobicContact CB-CG1 4.16Å; N123-N144 PolarHBondContact N-O 3.23Å; N123-N145 VanDerWaalsContact CA-OD1 3.22Å; N123-N145 WeakPolarHBondContact CA-OD1 3.3Å; N123-N145 WeakPolarHBondContact CB-OD1 3.5Å; N123-N145 PolarHBondContact N-OD1 3.43Å; N123-N145 PolarHBondContact O-OD1 3.46Å
124	R	97.2	Very high	92.2	Very high	153 Å²	153	47 Å²	47	58%	0.577	24%	0.236	S	C	*	.			trans	-117	25.5	-178.3	-62.6	-173.3	-179.9	-146.1	-0.3	112.8	I100 E101 Q126 N145	I100-R124 CarbonylContact O-C 3.58Å; I100-R124 VanDerWaalsContact O-CA 3.28Å; I100-R124 WeakPolarHBondContact O-CA 3.3Å; I100-R124 PolarHBondContact O-N 3.33Å; E101-R124 HydrophobicContact CG-CB 3.73Å; R124-Q126 PolarHBondContact O-N 2.99Å; R124-N145 PolarHBondContact N-OD1 2.8Å
125	I	95.8	Very high	91.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.25	C	S	.	.			trans	-71.7	124.3	-175	-51.8	162.3	0	0	0	109.2	I100 I103 L120 N123 V128 N145 P146 W147	I100-I125 HydrophobicContact CB-CG1 4.39Å; I100-I125 HydrophobicContact CG2-CD1 4.41Å; I100-I125 HydrophobicContact CG2-CG1 4.09Å; I100-I125 VanDerWaalsContact O-CG1 3.29Å; I100-I125 WeakPolarHBondContact O-CG1 3.4Å; I100-I125 PolarHBondContact O-N 2.98Å; I103-I125 HydrophobicContact CD1-CD1 3.78Å; I103-I125 HydrophobicContact CD1-CG1 4.49Å; L120-I125 HydrophobicContact CB-CD1 4.19Å; N123-I125 HydrophobicContact CB-CD1 4.23Å; N123-I125 HydrophobicContact CB-CG1 4.16Å; I125-V128 HydrophobicContact CG2-CG1 3.8Å; I125-N145 HydrophobicContact CB-CB 4.34Å; I125-N145 WeakPolarHBondContact CB-OD1 3.4Å; I125-N145 WeakPolarHBondContact CG1-OD1 3.29Å; I125-N145 PolarHBondContact N-OD1 2.58Å; I125-P146 CarbonylContact O-C 3.59Å; I125-P146 VanDerWaalsContact O-CD 3.32Å; I125-P146 WeakPolarHBondContact O-CD 3.32Å; I125-W147 HydrophobicContact CB-CH2 3.8Å; I125-W147 HydrophobicContact CB-CZ2 4.19Å; I125-W147 HydrophobicContact CB-CZ3 4.15Å; I125-W147 HydrophobicContact CD1-CH2 4.26Å; I125-W147 HydrophobicContact CD1-CZ2 4.48Å; I125-W147 HydrophobicContact CG2-CE3 4.32Å; I125-W147 HydrophobicContact CG2-CH2 3.38Å; I125-W147 HydrophobicContact CG2-CZ2 4.26Å; I125-W147 HydrophobicContact CG2-CZ3 3.43Å; I125-W147 VanDerWaalsContact CG2-CZ3 3.43Å
126	Q	93.6	Very high	91.3	Very high	109 Å²	109	50.6 Å²	50.6	51%	0.509	25%	0.253	S	S	.	.			trans	-99.7	-46.6	176.5	-63.8	-178.3	39.2	0	0	111.2	R124 P146 W147 H148	R124-Q126 PolarHBondContact O-N 2.99Å; Q126-P146 WeakPolarHBondContact CA-O 3.39Å; Q126-P146 HydrophobicContact CG-CB 4.45Å; Q126-P146 HydrophobicContact CG-CG 3.96Å; Q126-W147 CarbonylContact O-C 3.5Å; Q126-W147 WeakPolarHBondContact O-CA 3.33Å; Q126-H148 PolarHBondContact O-N 3.38Å
127	S	91.2	Very high	90.9	Very high	67 Å²	67	53 Å²	53	47%	0.469	26%	0.262	S	S	.	.			trans	-141.8	161.6	179.9	60.6	0	0	0	0	110.1
128	V	91.4	Very high	90.6	Very high	10 Å²	10	51.2 Å²	51.2	6%	0.061	25%	0.252	C	S	.	.			trans	-133.7	145.9	-178.2	-74.5	0	0	0	0	109.2	I103 I125 F133 W147 T152 L153 V156	I103-V128 HydrophobicContact CD1-CG1 4.23Å; I125-V128 HydrophobicContact CG2-CG1 3.8Å; V128-F133 HydrophobicContact CB-CE2 4Å; V128-F133 HydrophobicContact CG1-CE2 3.8Å; V128-F133 HydrophobicContact CG1-CZ 4.38Å; V128-F133 HydrophobicContact CG2-CE2 4.18Å; V128-W147 HydrophobicContact CG1-CH2 3.94Å; V128-W147 HydrophobicContact CG1-CZ3 3.76Å; V128-W147 HydrophobicContact CG2-CZ3 4.23Å; V128-T152 WeakPolarHBondContact O-CG2 3.35Å; V128-L153 HydrophobicContact CG2-CD1 4Å; V128-V156 HydrophobicContact CG2-CB 4.31Å; V128-V156 HydrophobicContact CG2-CG1 3.97Å; V128-V156 HydrophobicContact CG2-CG2 4.22Å
129	H	90.6	Very high	90.4	Very high	77 Å²	77	55.1 Å²	55.1	36%	0.356	27%	0.266	S	S	.	.			trans	-66.3	145.3	175.3	-164.7	-94.4	0	0	0	110.4	E105 N131 A132	E105-H129 VanDerWaalsContact CG-ND1 3.33Å; E105-H129 WeakPolarHBondContact CG-ND1 3.45Å; E105-H129 IonicContact OE1-CE1 3.63Å; E105-H129 PolarHBondContact OE1-CE1 3.26Å; E105-H129 IonicContact OE1-ND1 3.65Å; E105-H129 IonicContact OE2-CE1 3.04Å; H129-N131 PolarHBondContact ND1-N 3.21Å; H129-N131 PolarHBondContact O-N 2.84Å; H129-A132 HydrophobicContact CB-CB 4.23Å; H129-A132 VanDerWaalsContact O-CB 3.29Å; H129-A132 WeakPolarHBondContact O-CB 3.03Å; H129-A132 PolarHBondContact O-N 3.49Å
130	K	86.8	Confident	90.1	Very high	115 Å²	115	54.5 Å²	54.5	50%	0.5	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-30	-180	63.2	179.1	-177.8	-176.9	0	114	T152	K130-T152 HydrophobicContact CB-CG2 4.18Å
131	N	86.9	Confident	89.9	Confident	46 Å²	46	61.1 Å²	61.1	25%	0.246	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-0.5	-177.8	-60.2	-31.9	0	0	0	113.5	E105 H129 F133 N134	E105-N131 HydrophobicContact CG-CB 3.72Å; E105-N131 CarbonylContact O-C 3.59Å; E105-N131 PolarHBondContact OE1-ND2 3.37Å; H129-N131 PolarHBondContact ND1-N 3.21Å; H129-N131 PolarHBondContact O-N 2.84Å; N131-F133 PolarHBondContact O-N 3.35Å; N131-F133 VanDerWaalsContact O-N 3.16Å; N131-N134 HydrophobicContact CB-CB 4.19Å; N131-N134 WeakPolarHBondContact O-CB 3.37Å; N131-N134 PolarHBondContact O-N 3.45Å
132	A	86.6	Confident	89.7	Confident	3 Å²	3	60.5 Å²	60.5	3%	0.025	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-38.9	-177.4	0	0	0	0	0	112.5	I103 E105 F108 H129	I103-A132 HydrophobicContact CG2-CB 4.06Å; E105-A132 VanDerWaalsContact O-CA 3.32Å; E105-A132 WeakPolarHBondContact O-CA 3.27Å; E105-A132 PolarHBondContact O-N 3.05Å; F108-A132 WeakPolarHBondContact CD2-O 3.32Å; H129-A132 HydrophobicContact CB-CB 4.23Å; H129-A132 VanDerWaalsContact O-CB 3.29Å; H129-A132 WeakPolarHBondContact O-CB 3.03Å; H129-A132 PolarHBondContact O-N 3.49Å
133	F	87.2	Confident	89.4	Confident	5 Å²	5	58.5 Å²	58.5	2%	0.022	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	22.5	177.9	-55.4	-83.5	0	0	0	112.7	I103 F108 L118 L120 V128 N131 N135 L136 V156 M160	I103-F133 HydrophobicContact CD1-CZ 3.99Å; F108-F133 HydrophobicContact CD2-CD1 4.01Å; F108-F133 HydrophobicContact CD2-CE1 4.18Å; F108-F133 AromaticContact CE2-CD1 3.83Å; F108-F133 HydrophobicContact CE2-CD1 3.83Å; F108-F133 AromaticContact CE2-CE1 3.51Å; F108-F133 HydrophobicContact CE2-CE1 3.51Å; F108-F133 HydrophobicContact CE2-CZ 4.27Å; F108-F133 HydrophobicContact CZ-CE1 4.27Å; L118-F133 HydrophobicContact CD2-CD1 4.22Å; L118-F133 HydrophobicContact CD2-CE1 3.81Å; L120-F133 HydrophobicContact CD1-CE1 3.79Å; L120-F133 HydrophobicContact CD1-CZ 3.85Å; V128-F133 HydrophobicContact CB-CE2 4Å; V128-F133 HydrophobicContact CG1-CE2 3.8Å; V128-F133 HydrophobicContact CG1-CZ 4.38Å; V128-F133 HydrophobicContact CG2-CE2 4.18Å; N131-F133 PolarHBondContact O-N 3.35Å; N131-F133 VanDerWaalsContact O-N 3.16Å; F133-N135 PolarHBondContact O-N 2.82Å; F133-L136 HydrophobicContact CB-CB 4.31Å; F133-L136 HydrophobicContact CB-CD2 4.4Å; F133-L136 HydrophobicContact CD1-CD2 3.67Å; F133-L136 VanDerWaalsContact O-CB 3.28Å; F133-L136 WeakPolarHBondContact O-CB 3.03Å; F133-L136 PolarHBondContact O-N 3.23Å; F133-L136 VanDerWaalsContact O-N 3.08Å; F133-V156 HydrophobicContact CD2-CG1 3.53Å; F133-V156 HydrophobicContact CE2-CG1 4.15Å; F133-V156 HydrophobicContact CG-CG1 4.41Å; F133-M160 HydrophobicContact CB-CG 4.15Å; F133-M160 HydrophobicContact CB-SD 3.75Å; F133-M160 HydrophobicContact CD1-SD 3.9Å; F133-M160 HydrophobicContact CD2-CE 4.47Å; F133-M160 HydrophobicContact CD2-SD 4.05Å; F133-M160 HydrophobicContact CG-SD 3.62Å
134	N	83.1	Confident	89.1	Confident	87 Å²	87	63.1 Å²	63.1	47%	0.465	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	131.9	-176.7	-168.8	20.3	0	0	0	111	N131 L136	N131-N134 HydrophobicContact CB-CB 4.19Å; N131-N134 WeakPolarHBondContact O-CB 3.37Å; N131-N134 PolarHBondContact O-N 3.45Å; N134-L136 PolarHBondContact O-N 3.26Å
135	N	81.2	Confident	89	Confident	118 Å²	118	56.4 Å²	56.4	63%	0.631	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	11.6	-176.3	-57.1	-45.1	0	0	0	115.8	F133 K137	F133-N135 PolarHBondContact O-N 2.82Å; N135-K137 PolarHBondContact O-N 3.4Å
136	L	85.9	Confident	88.9	Confident	15 Å²	15	58.5 Å²	58.5	8%	0.079	29%	0.289	C	S	.	.			trans	-74	116.7	177.9	-173.9	67.2	0	0	0	110	A112 L115 L118 F133 N134 A138	A112-L136 HydrophobicContact CB-CD1 4.38Å; L115-L136 HydrophobicContact CB-CD1 4.24Å; L115-L136 HydrophobicContact CD2-CD1 4.03Å; L118-L136 HydrophobicContact CD2-CD2 3.75Å; F133-L136 HydrophobicContact CB-CB 4.31Å; F133-L136 HydrophobicContact CB-CD2 4.4Å; F133-L136 HydrophobicContact CD1-CD2 3.67Å; F133-L136 VanDerWaalsContact O-CB 3.28Å; F133-L136 WeakPolarHBondContact O-CB 3.03Å; F133-L136 PolarHBondContact O-N 3.23Å; F133-L136 VanDerWaalsContact O-N 3.08Å; N134-L136 PolarHBondContact O-N 3.26Å; L136-A138 HydrophobicContact CD1-CB 3.85Å; L136-A138 HydrophobicContact CD2-CB 4.29Å; L136-A138 HydrophobicContact CG-CB 3.92Å
137	K	85.3	Confident	88.8	Confident	158 Å²	158	53.4 Å²	53.4	69%	0.687	27%	0.265	S	S	*	.			trans	-94.1	-5.9	178.1	-61.9	-179.9	-174.9	171	0	113.5	A112 N135	A112-K137 PolarHBondContact O-N 3.18Å; N135-K137 PolarHBondContact O-N 3.4Å
138	A	87.9	Confident	88.8	Confident	8 Å²	8	53 Å²	53	7%	0.066	26%	0.256	C	S	.	.	S	Bend	trans	-61.1	150.4	-178.2	0	0	0	0	0	112.2	L115 L118 L136 A140	L115-A138 HydrophobicContact CB-CB 4.08Å; L115-A138 HydrophobicContact CD2-CB 4.06Å; L115-A138 HydrophobicContact CG-CB 3.99Å; L115-A138 WeakPolarHBondContact O-CA 3.49Å; L115-A138 VanDerWaalsContact O-CB 3.27Å; L115-A138 WeakPolarHBondContact O-CB 3.45Å; L118-A138 HydrophobicContact CB-CB 4.48Å; L136-A138 HydrophobicContact CD1-CB 3.85Å; L136-A138 HydrophobicContact CD2-CB 4.29Å; L136-A138 HydrophobicContact CG-CB 3.92Å; A138-A140 PolarHBondContact O-N 2.77Å; A138-A140 VanDerWaalsContact O-N 3.11Å
139	R	88.6	Confident	88.6	Confident	82 Å²	82	52.5 Å²	52.5	31%	0.309	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	102	163.5	-166	-175	-144.7	86.7	-9.2	108.3	Q116 T117 L118 E165	Q116-R139 PolarHBondContact O-N 3.42Å; T117-R139 WeakPolarHBondContact CA-O 3.41Å; L118-R139 PolarHBondContact N-O 3.24Å; R139-E165 IonicContact CZ-OE2 3.06Å; R139-E165 IonicContact NE-OE2 3.9Å; R139-E165 IonicContact NH2-OE1 3.7Å; R139-E165 PolarHBondContact NH2-OE1 3.23Å; R139-E165 IonicContact NH2-OE2 3.17Å; R139-E165 PolarHBondContact NH2-OE2 2.66Å
140	A	89.1	Confident	88.4	Confident	2 Å²	2	50.3 Å²	50.3	2%	0.017	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	139.7	176.1	0	0	0	0	0	110.8	L118 A138 I142 M160 T166	L118-A140 HydrophobicContact CB-CB 4.45Å; L118-A140 CarbonylContact O-C 3.24Å; L118-A140 VanDerWaalsContact O-CA 3.26Å; L118-A140 WeakPolarHBondContact O-CA 3.32Å; A138-A140 PolarHBondContact O-N 2.77Å; A138-A140 VanDerWaalsContact O-N 3.11Å; A140-I142 HydrophobicContact CB-CG2 4.3Å; A140-M160 HydrophobicContact CB-SD 4.26Å; A140-T166 HydrophobicContact CB-CG2 4.23Å; A140-T166 VanDerWaalsContact O-CB 3.31Å; A140-T166 WeakPolarHBondContact O-CB 3.31Å; A140-T166 WeakPolarHBondContact O-CG2 3.46Å; A140-T166 PolarHBondContact O-OG1 3.34Å
141	R	90.9	Very high	88.3	Confident	139 Å²	139	46.6 Å²	46.6	53%	0.525	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	114.9	168.4	-67.1	178.3	177.7	170.8	-0.5	107.4	L118 D119 L120 S121	L118-R141 PolarHBondContact O-N 3.35Å; D119-R141 WeakPolarHBondContact OD2-CD 3.26Å; D119-R141 IonicContact OD2-NH1 3.51Å; L120-R141 CarbonylContact C-O 3.24Å; L120-R141 WeakPolarHBondContact CA-O 3.27Å; L120-R141 PolarHBondContact N-O 3.03Å; S121-R141 PolarHBondContact N-O 2.92Å
142	I	90.3	Very high	88.4	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.015	24%	0.235	C	C	.	.			trans	-129.5	15	-170.7	58.5	169.7	0	0	0	112	L120 A140 N145 W147 L157 M160 T166 V170	L120-I142 HydrophobicContact CB-CG2 4.28Å; L120-I142 HydrophobicContact CD1-CG2 4.29Å; A140-I142 HydrophobicContact CB-CG2 4.3Å; I142-N145 PolarHBondContact O-ND2 3.28Å; I142-W147 HydrophobicContact CB-CZ2 3.83Å; I142-W147 HydrophobicContact CD1-CZ2 4.41Å; I142-W147 PolarHBondContact O-NE1 3.04Å; I142-L157 HydrophobicContact CD1-CD2 3.43Å; I142-L157 VanDerWaalsContact CD1-CD2 3.43Å; I142-M160 HydrophobicContact CD1-CE 4.06Å; I142-T166 HydrophobicContact CD1-CG2 4.05Å; I142-T166 HydrophobicContact CG1-CG2 3.8Å; I142-V170 HydrophobicContact CD1-CG2 3.65Å; I142-V170 HydrophobicContact CG1-CG2 3.83Å
143	A	89.4	Confident	88.4	Confident	21 Å²	21	46.8 Å²	46.8	17%	0.174	24%	0.235	C	C	.	.			trans	-64.6	168.6	178.5	0	0	0	0	0	111.7	S121 D122 N145 N169	S121-A143 VanDerWaalsContact CA-O 3.25Å; S121-A143 WeakPolarHBondContact CA-O 3.42Å; D122-A143 PolarHBondContact N-O 3.18Å; A143-N145 VanDerWaalsContact C-N 3.34Å; A143-N145 PolarHBondContact O-N 2.99Å; A143-N145 PolarHBondContact O-ND2 3.27Å; A143-N169 HydrophobicContact CB-CB 3.95Å
144	N	92.3	Very high	88.3	Confident	108 Å²	108	46.6 Å²	46.6	58%	0.578	23%	0.234	S	C	*	.	S	Bend	trans	53.7	47.4	175.9	-57.3	-17.1	0	0	0	113.7	D122 N123	D122-N144 WeakPolarHBondContact CA-O 3.46Å; D122-N144 PolarHBondContact N-O 2.85Å; D122-N144 WeakPolarHBondContact OD1-CB 3.09Å; D122-N144 PolarHBondContact OD1-ND2 3.05Å; N123-N144 PolarHBondContact N-O 3.23Å
145	N	94.3	Very high	88.3	Confident	12 Å²	12	47 Å²	47	6%	0.064	23%	0.233	C	C	.	.	S	Bend	trans	-128.4	148.7	172.6	-84.5	-87.3	0	0	0	108.6	L120 N123 R124 I125 I142 A143 W147	L120-N145 PolarHBondContact O-ND2 2.97Å; N123-N145 VanDerWaalsContact CA-OD1 3.22Å; N123-N145 WeakPolarHBondContact CA-OD1 3.3Å; N123-N145 WeakPolarHBondContact CB-OD1 3.5Å; N123-N145 PolarHBondContact N-OD1 3.43Å; N123-N145 PolarHBondContact O-OD1 3.46Å; R124-N145 PolarHBondContact N-OD1 2.8Å; I125-N145 HydrophobicContact CB-CB 4.34Å; I125-N145 WeakPolarHBondContact CB-OD1 3.4Å; I125-N145 WeakPolarHBondContact CG1-OD1 3.29Å; I125-N145 PolarHBondContact N-OD1 2.58Å; I142-N145 PolarHBondContact O-ND2 3.28Å; A143-N145 VanDerWaalsContact C-N 3.34Å; A143-N145 PolarHBondContact O-N 2.99Å; A143-N145 PolarHBondContact O-ND2 3.27Å; N145-W147 HydrophobicContact CB-CD2 4.26Å; N145-W147 HydrophobicContact CB-CG 4.38Å; N145-W147 HydrophobicContact CB-CZ2 3.84Å; N145-W147 VanDerWaalsContact O-CD1 3.26Å; N145-W147 PolarHBondContact O-N 2.8Å
146	P	93.9	Very high	88.5	Confident	43 Å²	43	41.4 Å²	41.4	28%	0.279	20%	0.203	S	C	.	.			trans	-75.7	57.1	-179	33.7	-37.8	0	0	0	112.7	I125 Q126 H148 K173	I125-P146 CarbonylContact O-C 3.59Å; I125-P146 VanDerWaalsContact O-CD 3.32Å; I125-P146 WeakPolarHBondContact O-CD 3.32Å; Q126-P146 WeakPolarHBondContact CA-O 3.39Å; Q126-P146 HydrophobicContact CG-CB 4.45Å; Q126-P146 HydrophobicContact CG-CG 3.96Å; P146-H148 PolarHBondContact O-N 3.49Å; P146-K173 HydrophobicContact CB-CB 4.25Å; P146-K173 HydrophobicContact CB-CG 4.29Å
147	W	91.8	Very high	88.3	Confident	2 Å²	2	41 Å²	41	1%	0.008	20%	0.201	C	C	.	.			trans	-57.2	131.4	-173.6	-66.8	108.3	0	0	0	113.5	I125 Q126 V128 I142 N145 L153 V170 K173 T174	I125-W147 HydrophobicContact CB-CH2 3.8Å; I125-W147 HydrophobicContact CB-CZ2 4.19Å; I125-W147 HydrophobicContact CB-CZ3 4.15Å; I125-W147 HydrophobicContact CD1-CH2 4.26Å; I125-W147 HydrophobicContact CD1-CZ2 4.48Å; I125-W147 HydrophobicContact CG2-CE3 4.32Å; I125-W147 HydrophobicContact CG2-CH2 3.38Å; I125-W147 HydrophobicContact CG2-CZ2 4.26Å; I125-W147 HydrophobicContact CG2-CZ3 3.43Å; I125-W147 VanDerWaalsContact CG2-CZ3 3.43Å; Q126-W147 CarbonylContact O-C 3.5Å; Q126-W147 WeakPolarHBondContact O-CA 3.33Å; V128-W147 HydrophobicContact CG1-CH2 3.94Å; V128-W147 HydrophobicContact CG1-CZ3 3.76Å; V128-W147 HydrophobicContact CG2-CZ3 4.23Å; I142-W147 HydrophobicContact CB-CZ2 3.83Å; I142-W147 HydrophobicContact CD1-CZ2 4.41Å; I142-W147 PolarHBondContact O-NE1 3.04Å; N145-W147 HydrophobicContact CB-CD2 4.26Å; N145-W147 HydrophobicContact CB-CG 4.38Å; N145-W147 HydrophobicContact CB-CZ2 3.84Å; N145-W147 VanDerWaalsContact O-CD1 3.26Å; N145-W147 PolarHBondContact O-N 2.8Å; W147-L153 HydrophobicContact CB-CD2 4.13Å; W147-L153 HydrophobicContact CD2-CD1 4.44Å; W147-L153 HydrophobicContact CD2-CD2 4.47Å; W147-L153 HydrophobicContact CE3-CD1 3.77Å; W147-L153 HydrophobicContact CE3-CD2 4.2Å; W147-L153 HydrophobicContact CG-CD2 4.47Å; W147-L153 HydrophobicContact CZ3-CD1 3.95Å; W147-V170 HydrophobicContact CB-CG1 4.32Å; W147-V170 HydrophobicContact CG-CG1 3.9Å; W147-K173 PolarHBondContact O-N 3.41Å; W147-T174 PolarHBondContact O-N 2.84Å
148	H	90.4	Very high	88	Confident	58 Å²	58	40 Å²	40	27%	0.269	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	109.8	163.7	-175.3	72.8	0	0	0	108.5	Q126 P146 D150 T174	Q126-H148 PolarHBondContact O-N 3.38Å; P146-H148 PolarHBondContact O-N 3.49Å; H148-D150 PolarHBondContact O-N 2.95Å; H148-T174 CarbonylContact C-O 3.45Å; H148-T174 WeakPolarHBondContact CA-O 3.41Å; H148-T174 PolarHBondContact ND1-OG1 3.32Å
149	C	87.9	Confident	87.5	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	105.3	-176.5	-68.3	0	0	0	0	111.3	L153 C172 T174 S175 V176 F185 L194	C149-L153 HydrophobicContact CB-CD2 4.44Å; C149-C172 HydrophobicContact CB-CB 3.75Å; C149-C172 WeakPolarHBondContact CB-SG 3.17Å; C149-C172 WeakPolarHBondContact SG-CA 3.31Å; C149-C172 WeakPolarHBondContact SG-CB 3.15Å; C149-C172 CovalentContact SG-SG 2.01Å; C149-C172 PolarHBondContact SG-SG 3.26Å; C149-T174 PolarHBondContact N-O 3.05Å; C149-S175 VanDerWaalsContact O-CA 3.3Å; C149-S175 WeakPolarHBondContact O-CA 3.28Å; C149-S175 WeakPolarHBondContact O-CB 3.45Å; C149-S175 PolarHBondContact O-OG 3.05Å; C149-V176 PolarHBondContact O-N 2.02Å; C149-F185 HydrophobicContact CB-CD2 4.25Å; C149-F185 HydrophobicContact CB-CE2 4.44Å; C149-L194 VanDerWaalsContact O-CD2 3.29Å; C149-L194 WeakPolarHBondContact O-CD2 3.49Å
150	D	86.5	Confident	86.8	Confident	32 Å²	32	40.3 Å²	40.3	17%	0.171	21%	0.205	C	C	.	.	S	Bend	trans	-128.5	-174.6	176.5	66.3	10.4	0	0	0	111.2	H148 T152 L153 Q154 V176	H148-D150 PolarHBondContact O-N 2.95Å; D150-T152 VanDerWaalsContact C-N 3.29Å; D150-T152 PolarHBondContact O-N 3.07Å; D150-T152 WeakPolarHBondContact OD1-CA 3.38Å; D150-T152 WeakPolarHBondContact OD1-CB 3.43Å; D150-T152 PolarHBondContact OD1-N 2.84Å; D150-L153 PolarHBondContact OD1-N 3.13Å; D150-Q154 PolarHBondContact O-N 3.06Å; D150-V176 HydrophobicContact CB-CG2 3.71Å
151	C	85.6	Confident	85.3	Confident	37 Å²	37	42.1 Å²	42.1	25%	0.25	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-32.4	176.1	172.3	0	0	0	0	112.8	Q154 Q155 C195	C151-Q154 WeakPolarHBondContact O-CB 3.47Å; C151-Q154 PolarHBondContact O-N 3.28Å; C151-Q155 WeakPolarHBondContact O-CG 2.99Å; C151-Q155 PolarHBondContact O-N 2.6Å; C151-Q155 PolarHBondContact SG-NE2 2.9Å; C151-Q155 VanDerWaalsContact SG-NE2 3.44Å; C151-C195 WeakPolarHBondContact CA-SG 3.49Å; C151-C195 HydrophobicContact CB-CB 3.95Å; C151-C195 WeakPolarHBondContact CB-SG 3.33Å; C151-C195 PolarHBondContact O-SG 2.85Å; C151-C195 WeakPolarHBondContact SG-CA 3.41Å; C151-C195 WeakPolarHBondContact SG-CB 3.36Å; C151-C195 CovalentContact SG-SG 2.04Å; C151-C195 PolarHBondContact SG-SG 2.91Å
152	T	88.1	Confident	83.5	Confident	50 Å²	50	40.9 Å²	40.9	31%	0.307	23%	0.233	S	C	.	.	H	α-helix	trans	-67	-47	-179.2	-61.1	0	0	0	0	110.7	V128 K130 D150 Q154 Q155 V156	V128-T152 WeakPolarHBondContact O-CG2 3.35Å; K130-T152 HydrophobicContact CB-CG2 4.18Å; D150-T152 VanDerWaalsContact C-N 3.29Å; D150-T152 PolarHBondContact O-N 3.07Å; D150-T152 WeakPolarHBondContact OD1-CA 3.38Å; D150-T152 WeakPolarHBondContact OD1-CB 3.43Å; D150-T152 PolarHBondContact OD1-N 2.84Å; T152-Q154 VanDerWaalsContact C-N 3.27Å; T152-Q154 PolarHBondContact O-N 2.95Å; T152-Q155 PolarHBondContact O-N 3.44Å; T152-V156 WeakPolarHBondContact O-CG2 3.4Å; T152-V156 PolarHBondContact O-N 2.67Å
153	L	87.2	Confident	81.8	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-60	-39.6	174.8	-173.2	64.3	0	0	0	111.1	V128 W147 C149 D150 Q155 V156 L157 F185	V128-L153 HydrophobicContact CG2-CD1 4Å; W147-L153 HydrophobicContact CB-CD2 4.13Å; W147-L153 HydrophobicContact CD2-CD1 4.44Å; W147-L153 HydrophobicContact CD2-CD2 4.47Å; W147-L153 HydrophobicContact CE3-CD1 3.77Å; W147-L153 HydrophobicContact CE3-CD2 4.2Å; W147-L153 HydrophobicContact CG-CD2 4.47Å; W147-L153 HydrophobicContact CZ3-CD1 3.95Å; C149-L153 HydrophobicContact CB-CD2 4.44Å; D150-L153 PolarHBondContact OD1-N 3.13Å; L153-Q155 PolarHBondContact O-N 3.14Å; L153-V156 PolarHBondContact O-N 2.99Å; L153-L157 HydrophobicContact CD1-CD1 4.24Å; L153-L157 HydrophobicContact CD1-CG 4.18Å; L153-L157 HydrophobicContact CD2-CD1 4.4Å; L153-L157 HydrophobicContact CG-CD1 3.87Å; L153-L157 HydrophobicContact CG-CG 4.22Å; L153-L157 WeakPolarHBondContact O-CB 3.32Å; L153-L157 VanDerWaalsContact O-CG 3.27Å; L153-L157 WeakPolarHBondContact O-CG 3.4Å; L153-L157 PolarHBondContact O-N 3.06Å; L153-F185 HydrophobicContact CD2-CD2 4.3Å; L153-F185 HydrophobicContact CD2-CE2 4.42Å; L153-F185 HydrophobicContact CG-CE2 4.49Å
154	Q	83.8	Confident	80.1	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.4	-43.2	175.5	-171.4	-179.6	11.1	0	0	113.2	D150 C151 T152 R158 F185 D193 C195	D150-Q154 PolarHBondContact O-N 3.06Å; C151-Q154 WeakPolarHBondContact O-CB 3.47Å; C151-Q154 PolarHBondContact O-N 3.28Å; T152-Q154 VanDerWaalsContact C-N 3.27Å; T152-Q154 PolarHBondContact O-N 2.95Å; Q154-R158 VanDerWaalsContact NE2-CZ 3.31Å; Q154-R158 WeakPolarHBondContact O-CB 3.03Å; Q154-R158 VanDerWaalsContact O-CG 3.3Å; Q154-R158 WeakPolarHBondContact O-CG 3.45Å; Q154-R158 PolarHBondContact O-N 2.8Å; Q154-F185 VanDerWaalsContact CA-CZ 3.42Å; Q154-F185 HydrophobicContact CB-CE2 4.34Å; Q154-F185 HydrophobicContact CB-CZ 3.61Å; Q154-F185 HydrophobicContact CG-CE1 4.44Å; Q154-F185 HydrophobicContact CG-CZ 3.81Å; Q154-D193 PolarHBondContact NE2-OD1 2.98Å; Q154-C195 PolarHBondContact OE1-SG 3.36Å; Q154-C195 VanDerWaalsContact OE1-SG 3.41Å
155	Q	84.6	Confident	78.6	Confident	95 Å²	95	49.5 Å²	49.5	44%	0.444	27%	0.267	S	S	.	.	H	α-helix	trans	-66.3	-43.8	177.1	-70.4	175.5	7.2	0	0	111.7	C151 T152 L153 R158 S159	C151-Q155 WeakPolarHBondContact O-CG 2.99Å; C151-Q155 PolarHBondContact O-N 2.6Å; C151-Q155 PolarHBondContact SG-NE2 2.9Å; C151-Q155 VanDerWaalsContact SG-NE2 3.44Å; T152-Q155 PolarHBondContact O-N 3.44Å; L153-Q155 PolarHBondContact O-N 3.14Å; Q155-R158 PolarHBondContact O-N 2.78Å; Q155-S159 PolarHBondContact O-N 3.31Å; Q155-S159 PolarHBondContact O-OG 2.85Å
156	V	84.9	Confident	77.1	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-64.2	-43.8	179.1	170.6	0	0	0	0	111.3	V128 F133 T152 L153 R158 S159 M160	V128-V156 HydrophobicContact CG2-CB 4.31Å; V128-V156 HydrophobicContact CG2-CG1 3.97Å; V128-V156 HydrophobicContact CG2-CG2 4.22Å; F133-V156 HydrophobicContact CD2-CG1 3.53Å; F133-V156 HydrophobicContact CE2-CG1 4.15Å; F133-V156 HydrophobicContact CG-CG1 4.41Å; T152-V156 WeakPolarHBondContact O-CG2 3.4Å; T152-V156 PolarHBondContact O-N 2.67Å; L153-V156 PolarHBondContact O-N 2.99Å; V156-R158 PolarHBondContact O-N 2.74Å; V156-S159 PolarHBondContact O-N 3.03Å; V156-S159 PolarHBondContact O-OG 3.43Å; V156-M160 HydrophobicContact CG1-CE 3.74Å; V156-M160 HydrophobicContact CG1-SD 4.41Å; V156-M160 WeakPolarHBondContact O-CG 3.37Å; V156-M160 PolarHBondContact O-N 3.19Å; V156-M160 VanDerWaalsContact O-N 3.07Å
157	L	82	Confident	75.6	Confident	7 Å²	7	48.2 Å²	48.2	4%	0.037	26%	0.26	C	S	.	.	H	α-helix	trans	-66.8	-37.9	177.2	-67.7	176.6	0	0	0	111.8	I142 L153 M160 A161 V170 F185	I142-L157 HydrophobicContact CD1-CD2 3.43Å; I142-L157 VanDerWaalsContact CD1-CD2 3.43Å; L153-L157 HydrophobicContact CD1-CD1 4.24Å; L153-L157 HydrophobicContact CD1-CG 4.18Å; L153-L157 HydrophobicContact CD2-CD1 4.4Å; L153-L157 HydrophobicContact CG-CD1 3.87Å; L153-L157 HydrophobicContact CG-CG 4.22Å; L153-L157 WeakPolarHBondContact O-CB 3.32Å; L153-L157 VanDerWaalsContact O-CG 3.27Å; L153-L157 WeakPolarHBondContact O-CG 3.4Å; L153-L157 PolarHBondContact O-N 3.06Å; L157-M160 HydrophobicContact CD2-CE 3.73Å; L157-M160 CarbonylContact O-C 3.07Å; L157-M160 PolarHBondContact O-N 3.39Å; L157-A161 WeakPolarHBondContact O-CB 3.46Å; L157-A161 PolarHBondContact O-N 3.3Å; L157-V170 HydrophobicContact CD1-CG1 4.32Å; L157-V170 HydrophobicContact CD1-CG2 4.37Å; L157-V170 HydrophobicContact CD2-CG2 4.16Å; L157-F185 HydrophobicContact CB-CE1 4.23Å; L157-F185 HydrophobicContact CD1-CB 4.34Å; L157-F185 HydrophobicContact CD1-CD1 3.29Å; L157-F185 HydrophobicContact CD1-CD2 3.93Å; L157-F185 HydrophobicContact CD1-CE1 3.51Å; L157-F185 HydrophobicContact CD1-CE2 4.12Å; L157-F185 HydrophobicContact CD1-CG 3.55Å; L157-F185 HydrophobicContact CD1-CZ 3.94Å; L157-F185 HydrophobicContact CG-CE1 4.48Å
158	R	78.9	Confident	74.2	Confident	138 Å²	138	52.3 Å²	52.3	52%	0.521	28%	0.282	S	S	.	.	H	α-helix	trans	-63.4	-41.3	173.5	-79.4	177.9	179	160.9	0	112.2	Q154 Q155 V156 M160 A161 D193	Q154-R158 VanDerWaalsContact NE2-CZ 3.31Å; Q154-R158 WeakPolarHBondContact O-CB 3.03Å; Q154-R158 VanDerWaalsContact O-CG 3.3Å; Q154-R158 WeakPolarHBondContact O-CG 3.45Å; Q154-R158 PolarHBondContact O-N 2.8Å; Q155-R158 PolarHBondContact O-N 2.78Å; V156-R158 PolarHBondContact O-N 2.74Å; R158-M160 VanDerWaalsContact C-N 3.29Å; R158-M160 PolarHBondContact O-N 3.04Å; R158-A161 WeakPolarHBondContact O-CB 3.33Å; R158-A161 PolarHBondContact O-N 3.37Å; R158-D193 IonicContact CZ-OD1 2.68Å; R158-D193 IonicContact NH1-OD1 3.51Å; R158-D193 IonicContact NH2-OD1 3.51Å; R158-D193 PolarHBondContact NH2-OD1 3.34Å
159	S	77.4	Confident	73.5	Confident	77 Å²	77	54.3 Å²	54.3	54%	0.538	30%	0.295	S	S	.	.	H	α-helix	trans	-68	-30.2	177.7	67.2	0	0	0	0	112.4	Q155 V156	Q155-S159 PolarHBondContact O-N 3.31Å; Q155-S159 PolarHBondContact O-OG 2.85Å; V156-S159 PolarHBondContact O-N 3.03Å; V156-S159 PolarHBondContact O-OG 3.43Å
160	M	72.9	Confident	73.4	Confident	18 Å²	18	54.3 Å²	54.3	9%	0.089	30%	0.295	C	S	.	.	H	α-helix	trans	-83.5	-11.9	173.6	-65	-170.7	-58.4	0	0	114.2	F133 A140 I142 V156 L157 R158 S162 N163	F133-M160 HydrophobicContact CB-CG 4.15Å; F133-M160 HydrophobicContact CB-SD 3.75Å; F133-M160 HydrophobicContact CD1-SD 3.9Å; F133-M160 HydrophobicContact CD2-CE 4.47Å; F133-M160 HydrophobicContact CD2-SD 4.05Å; F133-M160 HydrophobicContact CG-SD 3.62Å; A140-M160 HydrophobicContact CB-SD 4.26Å; I142-M160 HydrophobicContact CD1-CE 4.06Å; V156-M160 HydrophobicContact CG1-CE 3.74Å; V156-M160 HydrophobicContact CG1-SD 4.41Å; V156-M160 WeakPolarHBondContact O-CG 3.37Å; V156-M160 PolarHBondContact O-N 3.19Å; V156-M160 VanDerWaalsContact O-N 3.07Å; L157-M160 HydrophobicContact CD2-CE 3.73Å; L157-M160 CarbonylContact O-C 3.07Å; L157-M160 PolarHBondContact O-N 3.39Å; R158-M160 VanDerWaalsContact C-N 3.29Å; R158-M160 PolarHBondContact O-N 3.04Å; M160-S162 PolarHBondContact O-N 3.49Å; M160-N163 PolarHBondContact O-N 2.04Å
161	A	57.4	Low	73.4	Confident	40 Å²	40	57.4 Å²	57.4	33%	0.331	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	5	-169.8	0	0	0	0	0	116	L157 R158 N163 H164	L157-A161 WeakPolarHBondContact O-CB 3.46Å; L157-A161 PolarHBondContact O-N 3.3Å; R158-A161 WeakPolarHBondContact O-CB 3.33Å; R158-A161 PolarHBondContact O-N 3.37Å; A161-N163 PolarHBondContact O-N 3.41Å; A161-N163 VanDerWaalsContact O-N 3.11Å; A161-H164 PolarHBondContact O-ND1 3.33Å
162	S	54.2	Low	73.5	Confident	114 Å²	114	55.6 Å²	55.6	80%	0.797	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-16.5	165.4	-172.5	0	0	0	0	112.4	M160	M160-S162 PolarHBondContact O-N 3.49Å
163	N	54.4	Low	73.5	Confident	39 Å²	39	60.1 Å²	60.1	21%	0.209	31%	0.314	C	S	.	.	S	Bend	trans	-116.7	90.5	171.3	-68.4	-49.7	0	0	0	109.6	M160 A161 E165 T166	M160-N163 PolarHBondContact O-N 2.04Å; A161-N163 PolarHBondContact O-N 3.41Å; A161-N163 VanDerWaalsContact O-N 3.11Å; N163-E165 PolarHBondContact O-N 3.44Å; N163-T166 PolarHBondContact O-N 3.5Å
164	H	53.3	Low	73.4	Confident	160 Å²	160	62.9 Å²	62.9	74%	0.741	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-11.2	-174.4	-97.8	41.8	0	0	0	116.8	A161 N168	A161-H164 PolarHBondContact O-ND1 3.33Å; H164-N168 PolarHBondContact O-ND2 3.04Å
165	E	60.3	Low	73.4	Confident	113 Å²	113	63.3 Å²	63.3	53%	0.528	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-24.6	-178.3	-75.3	173.8	-153.8	0	0	114.6	R139 N163	R139-E165 IonicContact CZ-OE2 3.06Å; R139-E165 IonicContact NE-OE2 3.9Å; R139-E165 IonicContact NH2-OE1 3.7Å; R139-E165 PolarHBondContact NH2-OE1 3.23Å; R139-E165 IonicContact NH2-OE2 3.17Å; R139-E165 PolarHBondContact NH2-OE2 2.66Å; N163-E165 PolarHBondContact O-N 3.44Å
166	T	64.2	Low	73	Confident	15 Å²	15	63 Å²	63	9%	0.092	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-37.2	-172.3	-58.2	0	0	0	0	112.8	A140 I142 N163	A140-T166 HydrophobicContact CB-CG2 4.23Å; A140-T166 VanDerWaalsContact O-CB 3.31Å; A140-T166 WeakPolarHBondContact O-CB 3.31Å; A140-T166 WeakPolarHBondContact O-CG2 3.46Å; A140-T166 PolarHBondContact O-OG1 3.34Å; I142-T166 HydrophobicContact CD1-CG2 4.05Å; I142-T166 HydrophobicContact CG1-CG2 3.8Å; N163-T166 PolarHBondContact O-N 3.5Å
167	A	61.3	Low	72.4	Confident	14 Å²	14	64.8 Å²	64.8	12%	0.116	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-75.4	-25.2	-179.2	0	0	0	0	0	113.2	N169 V170 L186	A167-N169 PolarHBondContact O-N 3.34Å; A167-V170 PolarHBondContact O-N 2.95Å; A167-L186 HydrophobicContact CB-CG 4.43Å
168	N	63.9	Low	71.7	Confident	87 Å²	87	71.3 Å²	71.3	47%	0.465	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-62.3	-29.1	-177.5	-70.5	-16.4	0	0	0	113	H164 L186	H164-N168 PolarHBondContact O-ND2 3.04Å; N168-L186 HydrophobicContact CB-CD1 4.48Å; N168-L186 WeakPolarHBondContact OD1-CD1 3.48Å
169	N	74.8	Confident	71.2	Confident	101 Å²	101	72 Å²	72	54%	0.54	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-104.6	10.2	-171.8	-61.9	-30.1	0	0	0	113.4	A143 A167	A143-N169 HydrophobicContact CB-CB 3.95Å; A167-N169 PolarHBondContact O-N 3.34Å
170	V	85.5	Confident	70.7	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	37%	0.368	C	S	.	.			trans	-85.7	115.8	173.9	179.6	0	0	0	0	108.4	I142 W147 L157 A167 P184 F185	I142-V170 HydrophobicContact CD1-CG2 3.65Å; I142-V170 HydrophobicContact CG1-CG2 3.83Å; W147-V170 HydrophobicContact CB-CG1 4.32Å; W147-V170 HydrophobicContact CG-CG1 3.9Å; L157-V170 HydrophobicContact CD1-CG1 4.32Å; L157-V170 HydrophobicContact CD1-CG2 4.37Å; L157-V170 HydrophobicContact CD2-CG2 4.16Å; A167-V170 PolarHBondContact O-N 2.95Å; V170-P184 WeakPolarHBondContact O-CA 3.45Å; V170-F185 HydrophobicContact CB-CB 3.95Å; V170-F185 HydrophobicContact CG1-CB 3.93Å; V170-F185 PolarHBondContact O-N 2.67Å
171	I	86.7	Confident	70.9	Confident	96 Å²	96	70.3 Å²	70.3	49%	0.492	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-107.4	126.2	175.1	-57.5	173.6	0	0	0	107.9	K173	I171-K173 PolarHBondContact O-N 2.68Å
172	C	87.6	Confident	71.7	Confident	0 Å²	0	71 Å²	71	0%	0	40%	0.395	C	S	.	.			trans	-71.1	121.8	178.4	-60.1	0	0	0	0	109.8	C149 H180 G182 R183	C149-C172 HydrophobicContact CB-CB 3.75Å; C149-C172 WeakPolarHBondContact CB-SG 3.17Å; C149-C172 WeakPolarHBondContact SG-CA 3.31Å; C149-C172 WeakPolarHBondContact SG-CB 3.15Å; C149-C172 CovalentContact SG-SG 2.01Å; C149-C172 PolarHBondContact SG-SG 3.26Å; C172-H180 WeakPolarHBondContact CB-O 3.39Å; C172-G182 WeakPolarHBondContact O-CA 3.25Å; C172-G182 PolarHBondContact O-N 2.8Å; C172-R183 PolarHBondContact N-O 3.06Å
173	K	88.5	Confident	72.6	Confident	145 Å²	145	71.7 Å²	71.7	63%	0.63	38%	0.38	S	S	*	.	S	Bend	trans	-81.5	-41	170.3	-176.8	60.3	177.8	-179.3	0	111.1	P146 W147 I171	P146-K173 HydrophobicContact CB-CB 4.25Å; P146-K173 HydrophobicContact CB-CG 4.29Å; W147-K173 PolarHBondContact O-N 3.41Å; I171-K173 PolarHBondContact O-N 2.68Å
174	T	85.2	Confident	73.7	Confident	61 Å²	61	72.3 Å²	72.3	37%	0.374	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	161.4	173.7	56.1	0	0	0	0	108.7	W147 H148 C149	W147-T174 PolarHBondContact O-N 2.84Å; H148-T174 CarbonylContact C-O 3.45Å; H148-T174 WeakPolarHBondContact CA-O 3.41Å; H148-T174 PolarHBondContact ND1-OG1 3.32Å; C149-T174 PolarHBondContact N-O 3.05Å
175	S	82.8	Confident	74.7	Confident	8 Å²	8	65 Å²	65	6%	0.056	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	159.6	176.6	-178.7	0	0	0	0	110.4	C149 L177	C149-S175 VanDerWaalsContact O-CA 3.3Å; C149-S175 WeakPolarHBondContact O-CA 3.28Å; C149-S175 WeakPolarHBondContact O-CB 3.45Å; C149-S175 PolarHBondContact O-OG 3.05Å; S175-L177 WeakPolarHBondContact CB-O 3.27Å; S175-L177 PolarHBondContact O-N 3.28Å; S175-L177 PolarHBondContact OG-N 2.76Å
176	V	76.9	Confident	75	Confident	89 Å²	89	62.2 Å²	62.2	54%	0.539	34%	0.34	S	S	.	.	S	Bend	trans	-58.4	-28.6	170.8	-179.7	0	0	0	0	111.7	C149 D150	C149-V176 PolarHBondContact O-N 2.02Å; D150-V176 HydrophobicContact CB-CG2 3.71Å
177	L	72.1	Confident	75	Confident	38 Å²	38	65.7 Å²	65.7	20%	0.199	36%	0.358	C	S	.	.	S	Bend	trans	-106.7	114.9	167.3	-69.2	77.1	0	0	0	108.2	S175 E179 H180 L197	S175-L177 WeakPolarHBondContact CB-O 3.27Å; S175-L177 PolarHBondContact O-N 3.28Å; S175-L177 PolarHBondContact OG-N 2.76Å; L177-E179 PolarHBondContact O-N 3.25Å; L177-H180 WeakPolarHBondContact CB-ND1 3.45Å; L177-H180 PolarHBondContact O-N 3.1Å; L177-L197 HydrophobicContact CD1-CD1 3.64Å; L177-L197 HydrophobicContact CD1-CD2 3.16Å; L177-L197 HydrophobicContact CD1-CG 3.92Å; L177-L197 HydrophobicContact CD2-CD1 3.92Å; L177-L197 HydrophobicContact CD2-CD2 4.01Å; L177-L197 HydrophobicContact CD2-CG 4.48Å; L177-L197 HydrophobicContact CG-CD1 4.29Å; L177-L197 HydrophobicContact CG-CD2 3.62Å
178	D	67.6	Low	74.9	Confident	145 Å²	145	65 Å²	65	78%	0.775	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-53.9	-26.4	-179.3	-66.2	-46.3	0	0	0	113.2	H180 A181	D178-H180 PolarHBondContact O-N 2.77Å; D178-A181 PolarHBondContact O-N 3.13Å
179	E	67.9	Low	74.7	Confident	151 Å²	151	61.5 Å²	61.5	71%	0.706	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-63.8	-18.4	177.1	-62.1	-173	163.3	0	0	114.8	L177 R183	L177-E179 PolarHBondContact O-N 3.25Å; E179-R183 PolarHBondContact O-NE 2.91Å
180	H	68.2	Low	74.1	Confident	12 Å²	12	62.8 Å²	62.8	6%	0.056	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-99.8	-1.4	-176.7	-63.7	88.1	0	0	0	113.5	C172 L177 D178 G182 R183 A188	C172-H180 WeakPolarHBondContact CB-O 3.39Å; L177-H180 WeakPolarHBondContact CB-ND1 3.45Å; L177-H180 PolarHBondContact O-N 3.1Å; D178-H180 PolarHBondContact O-N 2.77Å; H180-G182 PolarHBondContact O-N 2.93Å; H180-R183 PolarHBondContact O-N 3.17Å; H180-A188 HydrophobicContact CB-CB 4.01Å; H180-A188 WeakPolarHBondContact CD2-CA 3.23Å; H180-A188 WeakPolarHBondContact CD2-CB 3.29Å
181	A	75.5	Confident	72.7	Confident	48 Å²	48	68.8 Å²	68.8	40%	0.397	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	131.3	171.4	0	0	0	0	0	110.7	D178 R183	D178-A181 PolarHBondContact O-N 3.13Å; A181-R183 VanDerWaalsContact C-N 3.32Å; A181-R183 PolarHBondContact O-N 2.85Å
182	G	74.2	Confident	71.4	Confident	56 Å²	56	65.1 Å²	65.1	58%	0.577	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-1.2	-178.6	0	0	0	0	0	115.5	C172 H180	C172-G182 WeakPolarHBondContact O-CA 3.25Å; C172-G182 PolarHBondContact O-N 2.8Å; H180-G182 PolarHBondContact O-N 2.93Å
183	R	74.2	Confident	70.6	Confident	128 Å²	128	67.8 Å²	67.8	48%	0.483	37%	0.373	S	S	.	.	S	Bend	trans	-96.9	152.8	179.1	-63.9	-173	-178.8	-165	2.4	112	C172 E179 H180 A181	C172-R183 PolarHBondContact N-O 3.06Å; E179-R183 PolarHBondContact O-NE 2.91Å; H180-R183 PolarHBondContact O-N 3.17Å; A181-R183 VanDerWaalsContact C-N 3.32Å; A181-R183 PolarHBondContact O-N 2.85Å
184	P	76.3	Confident	69.9	Low	52 Å²	52	61.3 Å²	61.3	34%	0.338	35%	0.345	S	S	.	.	B	Isolated β-bridge	trans	-58.5	139.9	168.1	-21.8	32.9	0	0	0	111.1	V170 L186 N187 A188	V170-P184 WeakPolarHBondContact O-CA 3.45Å; P184-L186 VanDerWaalsContact C-N 3.27Å; P184-L186 PolarHBondContact O-N 2.89Å; P184-N187 PolarHBondContact O-N 3.16Å; P184-A188 PolarHBondContact O-N 2.96Å
185	F	74.6	Confident	69.4	Low	7 Å²	7	60 Å²	60	3%	0.031	34%	0.338	C	S	.	.	H	α-helix	trans	-57.4	-37.7	-176.7	179.7	-94.4	0	0	0	112.9	C149 L153 Q154 L157 V170 N187 A188 A189	C149-F185 HydrophobicContact CB-CD2 4.25Å; C149-F185 HydrophobicContact CB-CE2 4.44Å; L153-F185 HydrophobicContact CD2-CD2 4.3Å; L153-F185 HydrophobicContact CD2-CE2 4.42Å; L153-F185 HydrophobicContact CG-CE2 4.49Å; Q154-F185 VanDerWaalsContact CA-CZ 3.42Å; Q154-F185 HydrophobicContact CB-CE2 4.34Å; Q154-F185 HydrophobicContact CB-CZ 3.61Å; Q154-F185 HydrophobicContact CG-CE1 4.44Å; Q154-F185 HydrophobicContact CG-CZ 3.81Å; L157-F185 HydrophobicContact CB-CE1 4.23Å; L157-F185 HydrophobicContact CD1-CB 4.34Å; L157-F185 HydrophobicContact CD1-CD1 3.29Å; L157-F185 HydrophobicContact CD1-CD2 3.93Å; L157-F185 HydrophobicContact CD1-CE1 3.51Å; L157-F185 HydrophobicContact CD1-CE2 4.12Å; L157-F185 HydrophobicContact CD1-CG 3.55Å; L157-F185 HydrophobicContact CD1-CZ 3.94Å; L157-F185 HydrophobicContact CG-CE1 4.48Å; V170-F185 HydrophobicContact CB-CB 3.95Å; V170-F185 HydrophobicContact CG1-CB 3.93Å; V170-F185 PolarHBondContact O-N 2.67Å; F185-N187 VanDerWaalsContact C-N 3.32Å; F185-N187 PolarHBondContact O-N 3.39Å; F185-A188 CarbonylContact O-C 3.6Å; F185-A188 WeakPolarHBondContact O-CB 3.29Å; F185-A188 PolarHBondContact O-N 3.32Å; F185-A188 VanDerWaalsContact O-N 3.13Å; F185-A189 HydrophobicContact CD1-CB 4.07Å; F185-A189 HydrophobicContact CE1-CB 3.49Å; F185-A189 VanDerWaalsContact CE1-CB 3.49Å; F185-A189 HydrophobicContact CZ-CB 3.75Å; F185-A189 WeakPolarHBondContact O-CB 3.49Å; F185-A189 PolarHBondContact O-N 3.01Å
186	L	67.4	Low	69	Low	54 Å²	54	63.2 Å²	63.2	28%	0.283	36%	0.355	S	S	.	.	H	α-helix	trans	-63.4	-35.1	-179.3	-79.7	168.4	0	0	0	113.8	A167 N168 P184 A188 A189 N190	A167-L186 HydrophobicContact CB-CG 4.43Å; N168-L186 HydrophobicContact CB-CD1 4.48Å; N168-L186 WeakPolarHBondContact OD1-CD1 3.48Å; P184-L186 VanDerWaalsContact C-N 3.27Å; P184-L186 PolarHBondContact O-N 2.89Å; L186-A188 VanDerWaalsContact C-N 3.35Å; L186-A189 PolarHBondContact O-N 3.11Å; L186-N190 VanDerWaalsContact O-CB 3.24Å; L186-N190 WeakPolarHBondContact O-CB 3.25Å; L186-N190 VanDerWaalsContact O-CG 3.23Å; L186-N190 PolarHBondContact O-N 2.98Å; L186-N190 PolarHBondContact O-ND2 2.99Å
187	N	63.6	Low	68.5	Low	87 Å²	87	61 Å²	61	47%	0.465	34%	0.339	S	S	.	.	H	α-helix	trans	-68.1	-42.2	175.1	-65.9	-4.4	0	0	0	109.5	P184 F185 A189 D191	P184-N187 PolarHBondContact O-N 3.16Å; F185-N187 VanDerWaalsContact C-N 3.32Å; F185-N187 PolarHBondContact O-N 3.39Å; N187-A189 PolarHBondContact O-N 3.07Å; N187-D191 VanDerWaalsContact O-CB 3.28Å; N187-D191 WeakPolarHBondContact O-CB 3.45Å; N187-D191 PolarHBondContact O-N 3.46Å
188	A	59.1	Low	67.8	Low	0 Å²	0	63.1 Å²	63.1	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-63.1	-42	175.7	0	0	0	0	0	113	H180 P184 F185 L186 A192	H180-A188 HydrophobicContact CB-CB 4.01Å; H180-A188 WeakPolarHBondContact CD2-CA 3.23Å; H180-A188 WeakPolarHBondContact CD2-CB 3.29Å; P184-A188 PolarHBondContact O-N 2.96Å; F185-A188 CarbonylContact O-C 3.6Å; F185-A188 WeakPolarHBondContact O-CB 3.29Å; F185-A188 PolarHBondContact O-N 3.32Å; F185-A188 VanDerWaalsContact O-N 3.13Å; L186-A188 VanDerWaalsContact C-N 3.35Å; A188-A192 PolarHBondContact O-N 2.83Å; A188-A192 VanDerWaalsContact O-N 3.08Å
189	A	61	Low	67.3	Low	13 Å²	13	62.8 Å²	62.8	11%	0.107	35%	0.347	C	S	.	.	H	α-helix	trans	-77.8	-23.5	-177.1	0	0	0	0	0	114.2	F185 L186 N187	F185-A189 HydrophobicContact CD1-CB 4.07Å; F185-A189 HydrophobicContact CE1-CB 3.49Å; F185-A189 VanDerWaalsContact CE1-CB 3.49Å; F185-A189 HydrophobicContact CZ-CB 3.75Å; F185-A189 WeakPolarHBondContact O-CB 3.49Å; F185-A189 PolarHBondContact O-N 3.01Å; L186-A189 PolarHBondContact O-N 3.11Å; N187-A189 PolarHBondContact O-N 3.07Å
190	N	60.9	Low	66.8	Low	129 Å²	129	61.8 Å²	61.8	69%	0.69	34%	0.341	S	S	*	.	H	α-helix	trans	-88.4	-36.8	175.2	-72.6	-17.5	0	0	0	112.3	L186	L186-N190 VanDerWaalsContact O-CB 3.24Å; L186-N190 WeakPolarHBondContact O-CB 3.25Å; L186-N190 VanDerWaalsContact O-CG 3.23Å; L186-N190 PolarHBondContact O-N 2.98Å; L186-N190 PolarHBondContact O-ND2 2.99Å
191	D	57.3	Low	66.4	Low	126 Å²	126	65.2 Å²	65.2	67%	0.674	36%	0.363	S	S	*	.	H	α-helix	trans	-79.1	-29.5	179.3	-75.9	-19.3	0	0	0	112.4	N187	N187-D191 VanDerWaalsContact O-CB 3.28Å; N187-D191 WeakPolarHBondContact O-CB 3.45Å; N187-D191 PolarHBondContact O-N 3.46Å
192	A	58.8	Low	65.7	Low	18 Å²	18	66.9 Å²	66.9	15%	0.149	37%	0.368	C	S	.	.			trans	-140.7	123.7	177	0	0	0	0	0	110.3	A188 L194 L197	A188-A192 PolarHBondContact O-N 2.83Å; A188-A192 VanDerWaalsContact O-N 3.08Å; A192-L194 WeakPolarHBondContact O-CD1 3.41Å; A192-L194 PolarHBondContact O-N 2.87Å; A192-L197 HydrophobicContact CB-CD1 4.27Å
193	D	70.5	Confident	65.4	Low	57 Å²	57	68.5 Å²	68.5	31%	0.305	36%	0.363	S	S	.	.			trans	-73.5	94.8	167.8	-163.6	21.5	0	0	0	108	Q154 R158 C195 N196 L197	Q154-D193 PolarHBondContact NE2-OD1 2.98Å; R158-D193 IonicContact CZ-OD1 2.68Å; R158-D193 IonicContact NH1-OD1 3.51Å; R158-D193 IonicContact NH2-OD1 3.51Å; R158-D193 PolarHBondContact NH2-OD1 3.34Å; D193-C195 PolarHBondContact O-N 3.35Å; D193-N196 HydrophobicContact CB-CB 4.24Å; D193-N196 PolarHBondContact O-N 3.49Å; D193-N196 PolarHBondContact OD2-ND2 2.93Å; D193-L197 PolarHBondContact O-N 3.23Å
194	L	73.6	Confident	65.6	Low	9 Å²	9	69.2 Å²	69.2	5%	0.047	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-29.3	-175.3	-71.6	89	0	0	0	111.7	C149 A192 N196	C149-L194 VanDerWaalsContact O-CD2 3.29Å; C149-L194 WeakPolarHBondContact O-CD2 3.49Å; A192-L194 WeakPolarHBondContact O-CD1 3.41Å; A192-L194 PolarHBondContact O-N 2.87Å; L194-N196 VanDerWaalsContact C-N 3.34Å; L194-N196 PolarHBondContact O-N 3.11Å
195	C	75.7	Confident	65.6	Low	33 Å²	33	69.6 Å²	69.6	22%	0.223	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-22	175.2	-67.6	0	0	0	0	115.4	C151 Q154 D193	C151-C195 WeakPolarHBondContact CA-SG 3.49Å; C151-C195 HydrophobicContact CB-CB 3.95Å; C151-C195 WeakPolarHBondContact CB-SG 3.33Å; C151-C195 PolarHBondContact O-SG 2.85Å; C151-C195 WeakPolarHBondContact SG-CA 3.41Å; C151-C195 WeakPolarHBondContact SG-CB 3.36Å; C151-C195 CovalentContact SG-SG 2.04Å; C151-C195 PolarHBondContact SG-SG 2.91Å; Q154-C195 PolarHBondContact OE1-SG 3.36Å; Q154-C195 VanDerWaalsContact OE1-SG 3.41Å; D193-C195 PolarHBondContact O-N 3.35Å
196	N	73.3	Confident	65.8	Low	76 Å²	76	75.1 Å²	75.1	41%	0.406	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-4.4	179.3	-81.2	-41.9	0	0	0	113.4	D193 L194 K199 K200	D193-N196 HydrophobicContact CB-CB 4.24Å; D193-N196 PolarHBondContact O-N 3.49Å; D193-N196 PolarHBondContact OD2-ND2 2.93Å; L194-N196 VanDerWaalsContact C-N 3.34Å; L194-N196 PolarHBondContact O-N 3.11Å; N196-K199 PolarHBondContact O-N 3.39Å; N196-K200 PolarHBondContact O-N 3.47Å
197	L	65.9	Low	66.6	Low	41 Å²	41	76.2 Å²	76.2	22%	0.215	41%	0.407	C	S	.	.	H	α-helix	trans	-52.2	-46.8	175.8	-126.9	93.4	0	0	0	115.3	L177 A192 D193 K199 K200 T201	L177-L197 HydrophobicContact CD1-CD1 3.64Å; L177-L197 HydrophobicContact CD1-CD2 3.16Å; L177-L197 HydrophobicContact CD1-CG 3.92Å; L177-L197 HydrophobicContact CD2-CD1 3.92Å; L177-L197 HydrophobicContact CD2-CD2 4.01Å; L177-L197 HydrophobicContact CD2-CG 4.48Å; L177-L197 HydrophobicContact CG-CD1 4.29Å; L177-L197 HydrophobicContact CG-CD2 3.62Å; A192-L197 HydrophobicContact CB-CD1 4.27Å; D193-L197 PolarHBondContact O-N 3.23Å; L197-K199 PolarHBondContact O-N 3.44Å; L197-K200 PolarHBondContact O-N 3.02Å; L197-K200 VanDerWaalsContact O-N 3.13Å; L197-T201 PolarHBondContact O-N 2.04Å; L197-T201 PolarHBondContact O-OG1 3.35Å
198	P	57.2	Low	67.8	Low	83 Å²	83	77.1 Å²	77.1	54%	0.539	42%	0.416	S	S	.	.	H	α-helix	trans	-65.1	-27.1	-178.4	21.7	-31.1	0	0	0	112.9	T201 T202	P198-T201 PolarHBondContact O-OG1 2.89Å; P198-T201 VanDerWaalsContact O-OG1 3.1Å; P198-T202 WeakPolarHBondContact O-CG2 3.34Å; P198-T202 PolarHBondContact O-N 2.71Å; P198-T202 PolarHBondContact O-OG1 2.91Å
199	K	57.3	Low	69.3	Low	138 Å²	138	81.6 Å²	81.6	60%	0.6	44%	0.443	S	S	*	.	H	α-helix	trans	-71.4	-39.5	174	-77.7	-177	178	176.9	0	112.1	N196 L197 T201 T202 D203	N196-K199 PolarHBondContact O-N 3.39Å; L197-K199 PolarHBondContact O-N 3.44Å; K199-T201 PolarHBondContact O-N 3.26Å; K199-T202 WeakPolarHBondContact CA-OG1 3.01Å; K199-T202 PolarHBondContact O-N 2.9Å; K199-T202 PolarHBondContact O-OG1 2.95Å; K199-D203 PolarHBondContact O-N 3.27Å; K199-D203 VanDerWaalsContact O-N 3.15Å
200	K	57.8	Low	70.7	Confident	131 Å²	131	84.8 Å²	84.8	57%	0.57	46%	0.457	S	S	*	.	H	α-helix	trans	-66.6	-39.9	-177	-150.5	-175.8	-179.9	178.4	0	111.2	N196 L197 D203 Y204	N196-K200 PolarHBondContact O-N 3.47Å; L197-K200 PolarHBondContact O-N 3.02Å; L197-K200 VanDerWaalsContact O-N 3.13Å; K200-D203 PolarHBondContact O-N 3.08Å; K200-Y204 HydrophobicContact CD-CE2 4.3Å; K200-Y204 HydrophobicContact CG-CD2 4.46Å; K200-Y204 HydrophobicContact CG-CE2 3.83Å; K200-Y204 WeakPolarHBondContact O-CD2 3.29Å; K200-Y204 PolarHBondContact O-N 3.21Å
201	T	60.2	Low	72.3	Confident	84 Å²	84	84.8 Å²	84.8	52%	0.515	45%	0.451	S	S	.	.	H	α-helix	trans	-68.9	-35.2	177.7	49.9	0	0	0	0	113.2	L197 P198 K199 A205	L197-T201 PolarHBondContact O-N 2.04Å; L197-T201 PolarHBondContact O-OG1 3.35Å; P198-T201 PolarHBondContact O-OG1 2.89Å; P198-T201 VanDerWaalsContact O-OG1 3.1Å; K199-T201 PolarHBondContact O-N 3.26Å; T201-A205 WeakPolarHBondContact O-CB 3.49Å; T201-A205 PolarHBondContact O-N 3.33Å; T201-A205 VanDerWaalsContact O-N 3.08Å
202	T	61.8	Low	74.1	Confident	82 Å²	82	80.5 Å²	80.5	50%	0.503	44%	0.437	S	S	.	.	H	α-helix	trans	-69.2	-36.5	176.4	48.7	0	0	0	0	112.4	P198 K199 A205 M206	P198-T202 WeakPolarHBondContact O-CG2 3.34Å; P198-T202 PolarHBondContact O-N 2.71Å; P198-T202 PolarHBondContact O-OG1 2.91Å; K199-T202 WeakPolarHBondContact CA-OG1 3.01Å; K199-T202 PolarHBondContact O-N 2.9Å; K199-T202 PolarHBondContact O-OG1 2.95Å; T202-A205 PolarHBondContact O-N 3.02Å; T202-M206 VanDerWaalsContact O-CB 3.27Å; T202-M206 WeakPolarHBondContact O-CB 3.22Å; T202-M206 PolarHBondContact O-N 2.86Å
203	D	67.9	Low	75.8	Confident	91 Å²	91	87.1 Å²	87.1	49%	0.487	46%	0.458	S	S	.	.	H	α-helix	trans	-63.3	-44.7	176.2	-76.3	-14.1	0	0	0	111.4	K199 K200 M206 L207	K199-D203 PolarHBondContact O-N 3.27Å; K199-D203 VanDerWaalsContact O-N 3.15Å; K200-D203 PolarHBondContact O-N 3.08Å; D203-M206 PolarHBondContact O-N 2.82Å; D203-L207 WeakPolarHBondContact O-CB 3.04Å; D203-L207 WeakPolarHBondContact O-CG 3.3Å; D203-L207 PolarHBondContact O-N 3.3Å
204	Y	77.3	Confident	77.1	Confident	143 Å²	143	88.8 Å²	88.8	56%	0.561	46%	0.462	S	S	*	.	H	α-helix	trans	-64.7	-44.8	176.1	-71	-64.4	0	0	0	112.6	K200 M206 L207 V208	K200-Y204 HydrophobicContact CD-CE2 4.3Å; K200-Y204 HydrophobicContact CG-CD2 4.46Å; K200-Y204 HydrophobicContact CG-CE2 3.83Å; K200-Y204 WeakPolarHBondContact O-CD2 3.29Å; K200-Y204 PolarHBondContact O-N 3.21Å; Y204-M206 VanDerWaalsContact C-N 3.34Å; Y204-M206 PolarHBondContact O-N 3.3Å; Y204-L207 PolarHBondContact O-N 3.06Å; Y204-V208 VanDerWaalsContact O-CG2 3.31Å; Y204-V208 WeakPolarHBondContact O-CG2 3.39Å; Y204-V208 PolarHBondContact O-N 3.08Å
205	A	77	Confident	78.1	Confident	59 Å²	59	92.3 Å²	92.3	49%	0.488	49%	0.485	S	S	.	.	H	α-helix	trans	-61.9	-43.4	178.5	0	0	0	0	0	111.4	T201 T202 V208 T209	T201-A205 WeakPolarHBondContact O-CB 3.49Å; T201-A205 PolarHBondContact O-N 3.33Å; T201-A205 VanDerWaalsContact O-N 3.08Å; T202-A205 PolarHBondContact O-N 3.02Å; A205-V208 PolarHBondContact O-N 3.31Å; A205-T209 WeakPolarHBondContact O-CG2 3.36Å; A205-T209 PolarHBondContact O-N 2.63Å; A205-T209 PolarHBondContact O-OG1 3.19Å
206	M	78.6	Confident	79.1	Confident	124 Å²	124	96.4 Å²	96.4	61%	0.611	50%	0.502	S	S	*	.	H	α-helix	trans	-64.1	-43.4	177.3	-164.3	-179.5	76.1	0	0	111.3	T202 D203 Y204 V208 T209 M210	T202-M206 VanDerWaalsContact O-CB 3.27Å; T202-M206 WeakPolarHBondContact O-CB 3.22Å; T202-M206 PolarHBondContact O-N 2.86Å; D203-M206 PolarHBondContact O-N 2.82Å; Y204-M206 VanDerWaalsContact C-N 3.34Å; Y204-M206 PolarHBondContact O-N 3.3Å; M206-V208 PolarHBondContact O-N 2.76Å; M206-T209 PolarHBondContact O-N 3.04Å; M206-T209 PolarHBondContact O-OG1 2.72Å; M206-M210 WeakPolarHBondContact O-CB 3.19Å; M206-M210 PolarHBondContact O-N 2.77Å
207	L	83.8	Confident	80.3	Confident	77 Å²	77	95 Å²	95	40%	0.403	50%	0.496	S	S	.	.	H	α-helix	trans	-60.9	-45.4	175.4	-74	170.2	0	0	0	112.2	D203 Y204 T209 M210 F211	D203-L207 WeakPolarHBondContact O-CB 3.04Å; D203-L207 WeakPolarHBondContact O-CG 3.3Å; D203-L207 PolarHBondContact O-N 3.3Å; Y204-L207 PolarHBondContact O-N 3.06Å; L207-T209 VanDerWaalsContact C-N 3.34Å; L207-T209 PolarHBondContact O-N 3.1Å; L207-M210 WeakPolarHBondContact O-CB 3.41Å; L207-M210 PolarHBondContact O-N 3.43Å; L207-F211 HydrophobicContact CD2-CE2 4.47Å; L207-F211 WeakPolarHBondContact O-CD2 3.27Å; L207-F211 PolarHBondContact O-N 3.3Å
208	V	88.9	Confident	81.7	Confident	106 Å²	106	98 Å²	98	64%	0.642	51%	0.511	S	S	*	.	H	α-helix	trans	-60.7	-43.7	177.7	171	0	0	0	0	111	Y204 A205 M206 M210 G212	Y204-V208 VanDerWaalsContact O-CG2 3.31Å; Y204-V208 WeakPolarHBondContact O-CG2 3.39Å; Y204-V208 PolarHBondContact O-N 3.08Å; A205-V208 PolarHBondContact O-N 3.31Å; M206-V208 PolarHBondContact O-N 2.76Å; V208-M210 VanDerWaalsContact C-N 3.35Å; V208-M210 PolarHBondContact O-N 3.08Å; V208-G212 PolarHBondContact O-N 3.24Å
209	T	89.9	Confident	83.6	Confident	94 Å²	94	97.6 Å²	97.6	58%	0.577	51%	0.51	S	S	*	.	H	α-helix	trans	-65.8	-37	176.4	60.4	0	0	0	0	112.7	A205 M206 L207 G212 W213	A205-T209 WeakPolarHBondContact O-CG2 3.36Å; A205-T209 PolarHBondContact O-N 2.63Å; A205-T209 PolarHBondContact O-OG1 3.19Å; M206-T209 PolarHBondContact O-N 3.04Å; M206-T209 PolarHBondContact O-OG1 2.72Å; L207-T209 VanDerWaalsContact C-N 3.34Å; L207-T209 PolarHBondContact O-N 3.1Å; T209-G212 PolarHBondContact O-N 3.32Å; T209-W213 WeakPolarHBondContact O-CB 3.45Å; T209-W213 PolarHBondContact O-N 2.99Å
210	M	90.4	Very high	85.5	Confident	80 Å²	80	97.4 Å²	97.4	39%	0.394	51%	0.507	S	S	.	.	H	α-helix	trans	-65.3	-49.4	177.3	-167.7	-160.9	80.8	0	0	111.2	M206 L207 V208 G212 W213 F214	M206-M210 WeakPolarHBondContact O-CB 3.19Å; M206-M210 PolarHBondContact O-N 2.77Å; L207-M210 WeakPolarHBondContact O-CB 3.41Å; L207-M210 PolarHBondContact O-N 3.43Å; V208-M210 VanDerWaalsContact C-N 3.35Å; V208-M210 PolarHBondContact O-N 3.08Å; M210-G212 VanDerWaalsContact C-N 3.34Å; M210-G212 PolarHBondContact O-N 3.31Å; M210-W213 PolarHBondContact O-N 2.98Å; M210-F214 HydrophobicContact CE-CD2 3.97Å; M210-F214 HydrophobicContact CE-CE2 3.77Å; M210-F214 HydrophobicContact CG-CD2 3.75Å; M210-F214 HydrophobicContact CG-CE2 3.46Å; M210-F214 VanDerWaalsContact CG-CE2 3.46Å; M210-F214 WeakPolarHBondContact O-CD2 3.42Å; M210-F214 PolarHBondContact O-N 2.84Å; M210-F214 HydrophobicContact SD-CD2 4.41Å; M210-F214 HydrophobicContact SD-CE2 3.81Å
211	F	94.7	Very high	87.3	Confident	129 Å²	129	94.8 Å²	94.8	57%	0.566	50%	0.502	S	S	*	.	H	α-helix	trans	-62.4	-41.6	175.7	-80.6	-70.6	0	0	0	111.5	L207 W213 F214 T215	L207-F211 HydrophobicContact CD2-CE2 4.47Å; L207-F211 WeakPolarHBondContact O-CD2 3.27Å; L207-F211 PolarHBondContact O-N 3.3Å; F211-W213 PolarHBondContact O-N 3.01Å; F211-F214 PolarHBondContact O-N 3.25Å; F211-T215 VanDerWaalsContact O-CG2 3.29Å; F211-T215 WeakPolarHBondContact O-CG2 3.23Å; F211-T215 PolarHBondContact O-N 3.39Å; F211-T215 PolarHBondContact O-OG1 2.89Å
212	G	94.8	Very high	89	Confident	36 Å²	36	94.5 Å²	94.5	37%	0.371	50%	0.499	S	S	.	.	H	α-helix	trans	-57.2	-47.6	173.8	0	0	0	0	0	112.2	V208 T209 M210 T215 M216	V208-G212 PolarHBondContact O-N 3.24Å; T209-G212 PolarHBondContact O-N 3.32Å; M210-G212 VanDerWaalsContact C-N 3.34Å; M210-G212 PolarHBondContact O-N 3.31Å; G212-T215 PolarHBondContact O-N 3.13Å; G212-T215 PolarHBondContact O-OG1 3.41Å; G212-M216 PolarHBondContact O-N 3.22Å
213	W	96.1	Very high	90.7	Very high	156 Å²	156	97.4 Å²	97.4	59%	0.591	50%	0.502	S	S	*	.	H	α-helix	trans	-63.9	-45.3	177.7	-170.3	78.8	0	0	0	112.4	T209 M210 F211 T215 M216 V217	T209-W213 WeakPolarHBondContact O-CB 3.45Å; T209-W213 PolarHBondContact O-N 2.99Å; M210-W213 PolarHBondContact O-N 2.98Å; F211-W213 PolarHBondContact O-N 3.01Å; W213-T215 PolarHBondContact O-N 3.39Å; W213-M216 PolarHBondContact O-N 3.34Å; W213-V217 HydrophobicContact CD2-CG2 3.86Å; W213-V217 HydrophobicContact CE3-CG2 4.07Å; W213-V217 HydrophobicContact CG-CG2 4.5Å; W213-V217 HydrophobicContact CH2-CG2 3.98Å; W213-V217 HydrophobicContact CZ2-CG2 3.74Å; W213-V217 HydrophobicContact CZ3-CG2 4.13Å; W213-V217 WeakPolarHBondContact O-CG2 3.29Å; W213-V217 PolarHBondContact O-N 3.24Å
214	F	96.3	Very high	92	Very high	92 Å²	92	99 Å²	99	40%	0.404	50%	0.502	S	S	.	.	H	α-helix	trans	-60.3	-43.7	176	-80.9	-60.6	0	0	0	112.3	M210 F211 M216 V217 I218	M210-F214 HydrophobicContact CE-CD2 3.97Å; M210-F214 HydrophobicContact CE-CE2 3.77Å; M210-F214 HydrophobicContact CG-CD2 3.75Å; M210-F214 HydrophobicContact CG-CE2 3.46Å; M210-F214 VanDerWaalsContact CG-CE2 3.46Å; M210-F214 WeakPolarHBondContact O-CD2 3.42Å; M210-F214 PolarHBondContact O-N 2.84Å; M210-F214 HydrophobicContact SD-CD2 4.41Å; M210-F214 HydrophobicContact SD-CE2 3.81Å; F211-F214 PolarHBondContact O-N 3.25Å; F214-M216 VanDerWaalsContact C-N 3.3Å; F214-M216 PolarHBondContact O-N 3.09Å; F214-V217 PolarHBondContact O-N 3.49Å; F214-I218 WeakPolarHBondContact O-CB 3.28Å; F214-I218 WeakPolarHBondContact O-CD1 3.48Å; F214-I218 WeakPolarHBondContact O-CG1 3.28Å; F214-I218 PolarHBondContact O-N 3.11Å
215	T	95.9	Very high	92.9	Very high	84 Å²	84	95.5 Å²	95.5	52%	0.515	50%	0.496	S	S	.	.	H	α-helix	trans	-62.7	-37.6	176.7	59.6	0	0	0	0	112.2	F211 G212 W213 S219	F211-T215 VanDerWaalsContact O-CG2 3.29Å; F211-T215 WeakPolarHBondContact O-CG2 3.23Å; F211-T215 PolarHBondContact O-N 3.39Å; F211-T215 PolarHBondContact O-OG1 2.89Å; G212-T215 PolarHBondContact O-N 3.13Å; G212-T215 PolarHBondContact O-OG1 3.41Å; W213-T215 PolarHBondContact O-N 3.39Å; T215-S219 VanDerWaalsContact O-CB 3.25Å; T215-S219 WeakPolarHBondContact O-CB 3.46Å; T215-S219 PolarHBondContact O-N 2.84Å; T215-S219 PolarHBondContact O-OG 3.31Å
216	M	96.6	Very high	93.6	Very high	118 Å²	118	100.4 Å²	100.4	58%	0.581	50%	0.502	S	S	*	.	H	α-helix	trans	-67.1	-45.9	176.4	-175.2	-97.6	162.2	0	0	111.8	G212 W213 F214 S219 Y220	G212-M216 PolarHBondContact O-N 3.22Å; W213-M216 PolarHBondContact O-N 3.34Å; F214-M216 VanDerWaalsContact C-N 3.3Å; F214-M216 PolarHBondContact O-N 3.09Å; M216-S219 PolarHBondContact O-N 3.16Å; M216-Y220 WeakPolarHBondContact O-CB 3.39Å; M216-Y220 PolarHBondContact O-N 3.11Å
217	V	97.3	Very high	94.3	Very high	48 Å²	48	97.3 Å²	97.3	29%	0.291	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-46.8	177.3	173	0	0	0	0	111.3	W213 F214 S219 Y220 V221	W213-V217 HydrophobicContact CD2-CG2 3.86Å; W213-V217 HydrophobicContact CE3-CG2 4.07Å; W213-V217 HydrophobicContact CG-CG2 4.5Å; W213-V217 HydrophobicContact CH2-CG2 3.98Å; W213-V217 HydrophobicContact CZ2-CG2 3.74Å; W213-V217 HydrophobicContact CZ3-CG2 4.13Å; W213-V217 WeakPolarHBondContact O-CG2 3.29Å; W213-V217 PolarHBondContact O-N 3.24Å; F214-V217 PolarHBondContact O-N 3.49Å; V217-S219 VanDerWaalsContact C-N 3.3Å; V217-S219 PolarHBondContact O-N 3.04Å; V217-Y220 PolarHBondContact O-N 2.9Å; V217-V221 HydrophobicContact CG1-CG2 4.43Å; V217-V221 WeakPolarHBondContact O-CG2 3.38Å; V217-V221 PolarHBondContact O-N 3.36Å
218	I	96.6	Very high	94.6	Very high	102 Å²	102	96.9 Å²	96.9	52%	0.523	48%	0.484	S	S	.	.	H	α-helix	trans	-60.8	-43.9	178.1	-68.5	165.8	0	0	0	109.9	F214 Y220 V221 V222	F214-I218 WeakPolarHBondContact O-CB 3.28Å; F214-I218 WeakPolarHBondContact O-CD1 3.48Å; F214-I218 WeakPolarHBondContact O-CG1 3.28Å; F214-I218 PolarHBondContact O-N 3.11Å; I218-Y220 PolarHBondContact O-N 2.81Å; I218-V221 PolarHBondContact O-N 2.86Å; I218-V222 HydrophobicContact CG2-CG2 4.35Å; I218-V222 WeakPolarHBondContact O-CB 3.47Å; I218-V222 VanDerWaalsContact O-CG2 3.28Å; I218-V222 WeakPolarHBondContact O-CG2 3.34Å; I218-V222 PolarHBondContact O-N 3.28Å
219	S	95.9	Very high	94.7	Very high	75 Å²	75	98 Å²	98	52%	0.524	48%	0.482	S	S	.	.	H	α-helix	trans	-62.1	-42.9	177.5	-60.5	0	0	0	0	112	T215 M216 V217 V222 Y223	T215-S219 VanDerWaalsContact O-CB 3.25Å; T215-S219 WeakPolarHBondContact O-CB 3.46Å; T215-S219 PolarHBondContact O-N 2.84Å; T215-S219 PolarHBondContact O-OG 3.31Å; M216-S219 PolarHBondContact O-N 3.16Å; V217-S219 VanDerWaalsContact C-N 3.3Å; V217-S219 PolarHBondContact O-N 3.04Å; S219-V222 PolarHBondContact O-N 3.09Å; S219-Y223 VanDerWaalsContact O-CB 3.28Å; S219-Y223 WeakPolarHBondContact O-CB 3.35Å; S219-Y223 PolarHBondContact O-N 3.32Å
220	Y	97	Very high	94.6	Very high	135 Å²	135	98.5 Å²	98.5	53%	0.529	48%	0.478	S	S	.	.	H	α-helix	trans	-62.6	-45	176.1	178.6	-96.8	0	0	0	112.3	M216 V217 I218 Y223 Y224	M216-Y220 WeakPolarHBondContact O-CB 3.39Å; M216-Y220 PolarHBondContact O-N 3.11Å; V217-Y220 PolarHBondContact O-N 2.9Å; I218-Y220 PolarHBondContact O-N 2.81Å; Y220-Y223 PolarHBondContact O-N 3.46Å; Y220-Y224 WeakPolarHBondContact O-CB 3.47Å; Y220-Y224 PolarHBondContact O-N 2.82Å
221	V	96.8	Very high	94.4	Very high	76 Å²	76	96.9 Å²	96.9	46%	0.461	47%	0.471	S	S	.	.	H	α-helix	trans	-64.1	-45.2	177.8	172.5	0	0	0	0	111	V217 I218 Y223 Y224 V225	V217-V221 HydrophobicContact CG1-CG2 4.43Å; V217-V221 WeakPolarHBondContact O-CG2 3.38Å; V217-V221 PolarHBondContact O-N 3.36Å; I218-V221 PolarHBondContact O-N 2.86Å; V221-Y223 VanDerWaalsContact C-N 3.34Å; V221-Y223 PolarHBondContact O-N 3.28Å; V221-Y224 PolarHBondContact O-N 3.43Å; V221-V225 HydrophobicContact CG1-CG2 4.38Å; V221-V225 VanDerWaalsContact O-CG2 3.31Å; V221-V225 WeakPolarHBondContact O-CG2 3.25Å; V221-V225 PolarHBondContact O-N 3.19Å
222	V	96.3	Very high	94	Very high	77 Å²	77	93.6 Å²	93.6	47%	0.467	47%	0.467	S	S	.	.	H	α-helix	trans	-61.3	-44.8	177.1	170.7	0	0	0	0	110.9	I218 S219 V225 R226	I218-V222 HydrophobicContact CG2-CG2 4.35Å; I218-V222 WeakPolarHBondContact O-CB 3.47Å; I218-V222 VanDerWaalsContact O-CG2 3.28Å; I218-V222 WeakPolarHBondContact O-CG2 3.34Å; I218-V222 PolarHBondContact O-N 3.28Å; S219-V222 PolarHBondContact O-N 3.09Å; V222-V225 PolarHBondContact O-N 3.17Å; V222-R226 HydrophobicContact CG1-CG 4.33Å; V222-R226 WeakPolarHBondContact O-CB 3.38Å; V222-R226 WeakPolarHBondContact O-CG 3.46Å; V222-R226 PolarHBondContact O-N 3.23Å
223	Y	96.5	Very high	93.6	Very high	144 Å²	144	100.4 Å²	100.4	57%	0.565	48%	0.482	S	S	*	.	H	α-helix	trans	-58.1	-49.6	174.9	172	-96.4	0	0	0	111.5	S219 Y220 V221 V225 R226 Q227	S219-Y223 VanDerWaalsContact O-CB 3.28Å; S219-Y223 WeakPolarHBondContact O-CB 3.35Å; S219-Y223 PolarHBondContact O-N 3.32Å; Y220-Y223 PolarHBondContact O-N 3.46Å; V221-Y223 VanDerWaalsContact C-N 3.34Å; V221-Y223 PolarHBondContact O-N 3.28Å; Y223-V225 PolarHBondContact O-N 2.84Å; Y223-R226 PolarHBondContact O-N 3.24Å; Y223-Q227 WeakPolarHBondContact O-CB 3.4Å; Y223-Q227 PolarHBondContact O-N 3.47Å
224	Y	95.4	Very high	93	Very high	124 Å²	124	100 Å²	100	49%	0.486	48%	0.48	S	S	.	.	H	α-helix	trans	-62.4	-41.8	-179.2	-176.3	-99.9	0	0	0	112.6	Y220 V221 Q227 N228	Y220-Y224 WeakPolarHBondContact O-CB 3.47Å; Y220-Y224 PolarHBondContact O-N 2.82Å; V221-Y224 PolarHBondContact O-N 3.43Å; Y224-Q227 PolarHBondContact O-N 3.29Å; Y224-N228 WeakPolarHBondContact CE1-ND2 3.33Å; Y224-N228 WeakPolarHBondContact O-CB 3.37Å; Y224-N228 PolarHBondContact O-N 3.28Å; Y224-N228 PolarHBondContact OH-ND2 3.47Å
225	V	95.4	Very high	92.4	Very high	70 Å²	70	101.7 Å²	101.7	42%	0.424	49%	0.489	S	S	.	.	H	α-helix	trans	-66.1	-44.9	176.5	172	0	0	0	0	111	V221 V222 Y223 Q227 N228 Q229	V221-V225 HydrophobicContact CG1-CG2 4.38Å; V221-V225 VanDerWaalsContact O-CG2 3.31Å; V221-V225 WeakPolarHBondContact O-CG2 3.25Å; V221-V225 PolarHBondContact O-N 3.19Å; V222-V225 PolarHBondContact O-N 3.17Å; Y223-V225 PolarHBondContact O-N 2.84Å; V225-Q227 VanDerWaalsContact C-N 3.34Å; V225-Q227 PolarHBondContact O-N 2.73Å; V225-N228 PolarHBondContact O-N 2.89Å; V225-Q229 HydrophobicContact CG1-CG 4.48Å; V225-Q229 WeakPolarHBondContact O-CB 3.46Å; V225-Q229 WeakPolarHBondContact O-CG 3.38Å; V225-Q229 PolarHBondContact O-N 3.38Å
226	R	92.6	Very high	91.7	Very high	162 Å²	162	102.5 Å²	102.5	61%	0.611	49%	0.49	S	S	*	.	H	α-helix	trans	-58.1	-48.1	175.8	-74.7	-104.9	-179	146	-0.4	111	V222 Y223 N228 Q229 E230	V222-R226 HydrophobicContact CG1-CG 4.33Å; V222-R226 WeakPolarHBondContact O-CB 3.38Å; V222-R226 WeakPolarHBondContact O-CG 3.46Å; V222-R226 PolarHBondContact O-N 3.23Å; Y223-R226 PolarHBondContact O-N 3.24Å; R226-N228 PolarHBondContact O-N 2.9Å; R226-Q229 PolarHBondContact O-N 2.89Å; R226-E230 WeakPolarHBondContact O-CG 3.31Å; R226-E230 PolarHBondContact O-N 3.28Å
227	Q	92.6	Very high	91	Very high	58 Å²	58	102.1 Å²	102.1	27%	0.271	49%	0.487	S	S	.	.	H	α-helix	trans	-58.4	-49	178.3	-174.2	64.5	34.2	0	0	111.6	Y223 Y224 V225 Q229 E230 D231	Y223-Q227 WeakPolarHBondContact O-CB 3.4Å; Y223-Q227 PolarHBondContact O-N 3.47Å; Y224-Q227 PolarHBondContact O-N 3.29Å; V225-Q227 VanDerWaalsContact C-N 3.34Å; V225-Q227 PolarHBondContact O-N 2.73Å; Q227-Q229 VanDerWaalsContact C-N 3.33Å; Q227-Q229 PolarHBondContact O-N 3.44Å; Q227-E230 PolarHBondContact O-N 3.4Å; Q227-D231 PolarHBondContact NE2-OD1 2.86Å; Q227-D231 PolarHBondContact O-N 3.32Å
228	N	90.9	Very high	90.1	Very high	69 Å²	69	107 Å²	107	37%	0.369	50%	0.501	S	S	.	.	H	α-helix	trans	-65	-35	178.8	-83.1	-25.5	0	0	0	112.9	Y224 V225 R226 A232	Y224-N228 WeakPolarHBondContact CE1-ND2 3.33Å; Y224-N228 WeakPolarHBondContact O-CB 3.37Å; Y224-N228 PolarHBondContact O-N 3.28Å; Y224-N228 PolarHBondContact OH-ND2 3.47Å; V225-N228 PolarHBondContact O-N 2.89Å; R226-N228 PolarHBondContact O-N 2.9Å; N228-A232 WeakPolarHBondContact O-CB 3.43Å; N228-A232 PolarHBondContact O-N 3.46Å
229	Q	90.5	Very high	89.1	Confident	128 Å²	128	107.6 Å²	107.6	60%	0.598	50%	0.504	S	S	*	.	H	α-helix	trans	-65.9	-40.9	174.3	-76.6	-177.7	-20.6	0	0	111.8	V225 R226 Q227 R233	V225-Q229 HydrophobicContact CG1-CG 4.48Å; V225-Q229 WeakPolarHBondContact O-CB 3.46Å; V225-Q229 WeakPolarHBondContact O-CG 3.38Å; V225-Q229 PolarHBondContact O-N 3.38Å; R226-Q229 PolarHBondContact O-N 2.89Å; Q227-Q229 VanDerWaalsContact C-N 3.33Å; Q227-Q229 PolarHBondContact O-N 3.44Å; Q229-R233 WeakPolarHBondContact O-CB 3.45Å; Q229-R233 PolarHBondContact O-N 2.89Å
230	E	89.2	Confident	88.2	Confident	106 Å²	106	111.7 Å²	111.7	50%	0.495	51%	0.513	S	S	.	.	H	α-helix	trans	-64.7	-42.7	175.5	-72.5	176.1	-166.9	0	0	111.7	R226 Q227 R233 R234	R226-E230 WeakPolarHBondContact O-CG 3.31Å; R226-E230 PolarHBondContact O-N 3.28Å; Q227-E230 PolarHBondContact O-N 3.4Å; E230-R233 PolarHBondContact O-N 3.39Å; E230-R234 WeakPolarHBondContact O-CG 3.46Å; E230-R234 PolarHBondContact O-N 2.89Å
231	D	85	Confident	87.3	Confident	45 Å²	45	109.3 Å²	109.3	24%	0.241	52%	0.516	C	S	.	.	H	α-helix	trans	-62.6	-48.5	176.4	-70.9	-10.1	0	0	0	111.4	Q227 R233 R234 H235	Q227-D231 PolarHBondContact NE2-OD1 2.86Å; Q227-D231 PolarHBondContact O-N 3.32Å; D231-R233 VanDerWaalsContact C-N 3.29Å; D231-R233 PolarHBondContact O-N 3.29Å; D231-R234 PolarHBondContact O-N 3.36Å; D231-R234 IonicContact OD1-CZ 3.91Å; D231-R234 IonicContact OD1-NE 2.6Å; D231-R234 IonicContact OD1-NH2 3.46Å; D231-R234 PolarHBondContact OD1-NH2 2.91Å; D231-H235 PolarHBondContact O-CD2 3.47Å; D231-H235 PolarHBondContact O-N 3.43Å
232	A	86.3	Confident	86.2	Confident	60 Å²	60	109.9 Å²	109.9	50%	0.496	52%	0.516	S	S	.	.	H	α-helix	trans	-59.7	-39.3	176.7	0	0	0	0	0	112.4	N228 H235 L236	N228-A232 WeakPolarHBondContact O-CB 3.43Å; N228-A232 PolarHBondContact O-N 3.46Å; A232-H235 PolarHBondContact O-N 3.05Å; A232-L236 PolarHBondContact O-N 2.83Å; A232-L236 VanDerWaalsContact O-N 3.1Å
233	R	87.6	Confident	84.8	Confident	179 Å²	179	112.1 Å²	112.1	68%	0.675	53%	0.532	S	S	*	.	H	α-helix	trans	-62.8	-46	176.5	-168.1	-178.9	-165.4	149.3	5.5	111.5	Q229 E230 D231 H235 L236 E237	Q229-R233 WeakPolarHBondContact O-CB 3.45Å; Q229-R233 PolarHBondContact O-N 2.89Å; E230-R233 PolarHBondContact O-N 3.39Å; D231-R233 VanDerWaalsContact C-N 3.29Å; D231-R233 PolarHBondContact O-N 3.29Å; R233-H235 PolarHBondContact O-N 3.22Å; R233-L236 PolarHBondContact O-N 3.05Å; R233-E237 IonicContact NE-OE1 3.79Å; R233-E237 PolarHBondContact O-N 2.87Å
234	R	82.9	Confident	83.1	Confident	148 Å²	148	110.7 Å²	110.7	56%	0.558	54%	0.543	S	S	*	.	H	α-helix	trans	-60.3	-42.8	176.9	-73.3	-170.2	-76.1	168.8	-10.7	112.1	E230 D231 L236 E237 Y238	E230-R234 WeakPolarHBondContact O-CG 3.46Å; E230-R234 PolarHBondContact O-N 2.89Å; D231-R234 PolarHBondContact O-N 3.36Å; D231-R234 IonicContact OD1-CZ 3.91Å; D231-R234 IonicContact OD1-NE 2.6Å; D231-R234 IonicContact OD1-NH2 3.46Å; D231-R234 PolarHBondContact OD1-NH2 2.91Å; R234-L236 VanDerWaalsContact C-N 3.32Å; R234-L236 PolarHBondContact O-N 2.95Å; R234-E237 PolarHBondContact O-N 3.4Å; R234-Y238 PolarHBondContact O-N 3.24Å
235	H	83.1	Confident	81.2	Confident	128 Å²	128	116.5 Å²	116.5	59%	0.593	56%	0.564	S	S	*	*	H	α-helix	trans	-62.2	-38.6	176.2	-76.3	-67.7	0	0	0	112.7	D231 A232 R233 Y238 L239	D231-H235 PolarHBondContact O-CD2 3.47Å; D231-H235 PolarHBondContact O-N 3.43Å; A232-H235 PolarHBondContact O-N 3.05Å; R233-H235 PolarHBondContact O-N 3.22Å; H235-Y238 PolarHBondContact O-N 2.86Å; H235-L239 WeakPolarHBondContact O-CG 3.43Å; H235-L239 PolarHBondContact O-N 2.73Å
236	L	81.3	Confident	78.8	Confident	100 Å²	100	122 Å²	122	52%	0.524	59%	0.585	S	S	.	*	H	α-helix	trans	-70.3	-36.6	179.6	-151.5	124	0	0	0	112.2	A232 R233 R234 L239 K240	A232-L236 PolarHBondContact O-N 2.83Å; A232-L236 VanDerWaalsContact O-N 3.1Å; R233-L236 PolarHBondContact O-N 3.05Å; R234-L236 VanDerWaalsContact C-N 3.32Å; R234-L236 PolarHBondContact O-N 2.95Å; L236-L239 PolarHBondContact O-N 3.09Å; L236-K240 HydrophobicContact CD2-CD 4.47Å; L236-K240 WeakPolarHBondContact O-CG 3.4Å; L236-K240 PolarHBondContact O-N 3.02Å; L236-K240 VanDerWaalsContact O-N 3.09Å
237	E	81.9	Confident	76.6	Confident	111 Å²	111	124.1 Å²	124.1	52%	0.519	60%	0.599	S	S	.	*	H	α-helix	trans	-66.3	-40.7	172.7	-72.8	173.8	-172.8	0	0	111.9	R233 R234 L239 K240 S241	R233-E237 IonicContact NE-OE1 3.79Å; R233-E237 PolarHBondContact O-N 2.87Å; R234-E237 PolarHBondContact O-N 3.4Å; E237-L239 PolarHBondContact O-N 3.39Å; E237-K240 PolarHBondContact O-N 3.44Å; E237-S241 PolarHBondContact O-N 2.95Å; E237-S241 VanDerWaalsContact O-N 3.13Å
238	Y	78.3	Confident	73.9	Confident	150 Å²	150	130.7 Å²	130.7	59%	0.588	63%	0.626	S	S	*	*	H	α-helix	trans	-58.8	-47.5	172.3	-178.8	-96.4	0	0	0	111.6	R234 H235 K240 S241	R234-Y238 PolarHBondContact O-N 3.24Å; H235-Y238 PolarHBondContact O-N 2.86Å; Y238-K240 VanDerWaalsContact C-N 3.29Å; Y238-K240 PolarHBondContact O-N 2.98Å; Y238-S241 PolarHBondContact O-N 2.98Å; Y238-S241 VanDerWaalsContact O-N 3.09Å; Y238-S241 PolarHBondContact O-OG 3.28Å
239	L	76.3	Confident	71.8	Confident	114 Å²	114	132.3 Å²	132.3	60%	0.597	64%	0.641	S	S	*	*	H	α-helix	trans	-61.4	-35.3	177.9	-72.9	171.6	0	0	0	112.9	H235 L236 E237 S241 L242	H235-L239 WeakPolarHBondContact O-CG 3.43Å; H235-L239 PolarHBondContact O-N 2.73Å; L236-L239 PolarHBondContact O-N 3.09Å; E237-L239 PolarHBondContact O-N 3.39Å; L239-S241 VanDerWaalsContact C-N 3.32Å; L239-L242 HydrophobicContact CD2-CD1 3.91Å; L239-L242 PolarHBondContact O-N 2.87Å
240	K	77.1	Confident	69.8	Low	161 Å²	161	133.7 Å²	133.7	70%	0.7	65%	0.652	S	S	*	*	H	α-helix	trans	-70.1	-26.2	175.4	-76	177	179.6	175.4	0	113.7	L236 E237 Y238 L242	L236-K240 HydrophobicContact CD2-CD 4.47Å; L236-K240 WeakPolarHBondContact O-CG 3.4Å; L236-K240 PolarHBondContact O-N 3.02Å; L236-K240 VanDerWaalsContact O-N 3.09Å; E237-K240 PolarHBondContact O-N 3.44Å; Y238-K240 VanDerWaalsContact C-N 3.29Å; Y238-K240 PolarHBondContact O-N 2.98Å; K240-L242 VanDerWaalsContact C-N 3.28Å
241	S	76.6	Confident	67.6	Low	86 Å²	86	138.1 Å²	138.1	60%	0.601	67%	0.673	S	S	*	*	H	α-helix	trans	-78	-12.2	178	74.4	0	0	0	0	113.7	E237 Y238 L239	E237-S241 PolarHBondContact O-N 2.95Å; E237-S241 VanDerWaalsContact O-N 3.13Å; Y238-S241 PolarHBondContact O-N 2.98Å; Y238-S241 VanDerWaalsContact O-N 3.09Å; Y238-S241 PolarHBondContact O-OG 3.28Å; L239-S241 VanDerWaalsContact C-N 3.32Å
242	L	75.5	Confident	65.7	Low	88 Å²	88	139.7 Å²	139.7	46%	0.461	69%	0.692	S	S	.	*	S	Bend	trans	-69.1	138.2	176.5	-71.6	162.7	0	0	0	110.4	L239 K240 S244	L239-L242 HydrophobicContact CD2-CD1 3.91Å; L239-L242 PolarHBondContact O-N 2.87Å; K240-L242 VanDerWaalsContact C-N 3.28Å; L242-S244 PolarHBondContact O-N 3.3Å
243	P	66.8	Low	63.7	Low	124 Å²	124	143.6 Å²	143.6	81%	0.805	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-63.5	125.5	-178.1	-5.8	15.1	0	0	0	111.1	R245	P243-R245 PolarHBondContact O-N 3.07Å
244	S	59.1	Low	61.5	Low	113 Å²	113	142.6 Å²	142.6	79%	0.79	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-66.8	120.9	172.1	177.6	0	0	0	0	110.1	L242 Q246	L242-S244 PolarHBondContact O-N 3.3Å; S244-Q246 PolarHBondContact O-N 3.18Å; S244-Q246 VanDerWaalsContact O-N 3.09Å
245	R	55.2	Low	60.1	Low	246 Å²	246	143.2 Å²	143.2	93%	0.928	73%	0.726	S	S	*	*			trans	-66.8	106	171.1	-119.9	-178.7	177.1	174	-1.3	108.2	P243 K247	P243-R245 PolarHBondContact O-N 3.07Å; R245-K247 PolarHBondContact O-N 3.41Å
246	Q	46.1	Very low	58.3	Low	186 Å²	186	142.5 Å²	142.5	87%	0.869	74%	0.735	S	S	*	*			trans	-55.6	123.9	170.6	-82.1	177.4	-27.3	0	0	109.9	S244 K248	S244-Q246 PolarHBondContact O-N 3.18Å; S244-Q246 VanDerWaalsContact O-N 3.09Å; Q246-K248 PolarHBondContact O-N 3.18Å
247	K	46.3	Very low	56.9	Low	206 Å²	206	143 Å²	143	90%	0.896	74%	0.743	S	S	*	*			trans	-70.9	115.1	170.5	-139.5	178.2	-175.8	-175.8	0	107.4	R245	R245-K247 PolarHBondContact O-N 3.41Å
248	K	36.3	Very low	55.1	Low	196 Å²	196	143.9 Å²	143.9	85%	0.852	76%	0.755	S	S	*	*			trans	-66.9	135.4	167.9	-99.2	-178.5	172.2	-176.5	0	108.9	Q246	Q246-K248 PolarHBondContact O-N 3.18Å
249	P	47.1	Very low	53.3	Low	104 Å²	104	146.6 Å²	146.6	68%	0.675	79%	0.787	S	S	*	*			trans	-76	153.5	163	30.4	-23.8	0	0	0	109.2
250	D	46.9	Very low	52.2	Low	156 Å²	156	148.3 Å²	148.3	83%	0.834	80%	0.796	S	S	*	*			trans	89.1	90.9	175.7	-47.9	-24.5	0	0	0	115.7
251	E	43.8	Very low	50.8	Low	199 Å²	199	147.6 Å²	147.6	93%	0.93	80%	0.802	S	S	*	*				-153.6	114.9	124.1	-139.4	163.1	179.5	0	0	108.7
252	A	45.1	Very low	49.4	Very low	78 Å²	78	151 Å²	151	65%	0.645	81%	0.813	S	S	*	*			trans	-83.6	159.8	175	0	0	0	0	0	110.6
253	D	44.6	Very low	47.9	Very low	143 Å²	143	154.7 Å²	154.7	77%	0.765	83%	0.833	S	S	*	*			trans	65.6	107.1	157.1	-55.9	-25.2	0	0	0	118.4
254	D	41	Very low	46.7	Very low	158 Å²	158	156.6 Å²	156.6	85%	0.845	84%	0.835	S	S	*	*				-163	107.7	102.1	-101.7	-24	0	0	0	111.1	S256	D254-S256 PolarHBondContact O-N 3.26Å
255	I	54.3	Low	45.9	Very low	161 Å²	161	159.5 Å²	159.5	83%	0.826	84%	0.838	S	S	*	*			trans	-75.5	112.4	154.3	-72.8	171.3	0	0	0	106
256	S	44.7	Very low	45.2	Very low	113 Å²	113	153.4 Å²	153.4	79%	0.79	83%	0.832	S	S	*	*			trans	-121.7	98.2	159.5	-160.2	0	0	0	0	108.9	D254	D254-S256 PolarHBondContact O-N 3.26Å
257	T	52.7	Low	45.1	Very low	111 Å²	111	150.8 Å²	150.8	68%	0.681	83%	0.829	S	S	*	*			trans	-53	146.5	150.5	44.5	0	0	0	0	110
258	V	43.3	Very low	45	Very low	128 Å²	128	146.3 Å²	146.3	78%	0.776	82%	0.823	S	S	*	*			trans	-175.6	116.6	132.9	145.8	0	0	0	0	110.1
259	V	40.6	Very low	45.8	Very low	208 Å²	208	141.7 Å²	141.7	100%	1.261	82%	0.821	S	S	*	*			trans	71.8	0	142.8	-176.2	0	0	0	0	119.2

Retrieved 259 of 259 residues in 177.2 ms (Link to these results)

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