A0A077ZAU5_TRITR Loading...

Mito morph reg domain containing protein

Plays a role in mitochondrial morphogenesis.

AlphaFold DB , UniProt , Accession A0A077ZAU5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 184 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	39	Very low	36.6	Very low	244 Å²	244	151.7 Å²	151.7	100%	1.202	84%	0.84	S	S	*	*				0	105.6	0	-124.7	89.5	162	0	0	108.1
2	A	38.4	Very low	36.3	Very low	103 Å²	103	146.9 Å²	146.9	85%	0.851	83%	0.825	S	S	*	*			trans	24.7	135.9	145.1	0	0	0	0	0	118.5
3	A	40.2	Very low	35.9	Very low	91 Å²	91	143.4 Å²	143.4	75%	0.752	82%	0.816	S	S	*	*			cis	-171.5	134.6	23.5	0	0	0	0	0	107
4	N	43.3	Very low	35.7	Very low	137 Å²	137	141.1 Å²	141.1	73%	0.733	81%	0.813	S	S	*	*				105.9	70.3	98.9	-170.4	41.6	0	0	0	113.5
5	D	42.7	Very low	35.8	Very low	160 Å²	160	136.4 Å²	136.4	86%	0.856	79%	0.792	S	S	*	*			trans	-88.6	81	158.9	-76.7	-37.9	0	0	0	108.9
6	N	37.4	Very low	36.2	Very low	142 Å²	142	133.4 Å²	133.4	76%	0.759	78%	0.781	S	S	*	*			trans	-160.3	69.4	171.2	-96.6	-24.3	0	0	0	111.2
7	N	36.8	Very low	36.9	Very low	158 Å²	158	130.5 Å²	130.5	85%	0.845	77%	0.767	S	S	*	*			trans	-126.7	58.6	161.6	-156.9	16	0	0	0	110.6
8	R	29.1	Very low	37.4	Very low	248 Å²	248	129.3 Å²	129.3	94%	0.936	76%	0.761	S	S	*	*			trans	-118.5	71.7	173.4	-158.7	176.3	-168	163.4	2.7	108.1
9	S	30.8	Very low	37.9	Very low	83 Å²	83	129.2 Å²	129.2	58%	0.58	76%	0.755	S	S	*	*			trans	-143.6	107.3	171.5	48.1	0	0	0	0	110.8
10	N	29.7	Very low	38.5	Very low	153 Å²	153	125.5 Å²	125.5	82%	0.818	74%	0.737	S	S	*	*			trans	64.3	69.9	136.4	-56.4	-11.3	0	0	0	117.3	S12	N10-S12 VanDerWaalsContact C-N 3.32Å; N10-S12 PolarHBondContact O-N 2.91Å
11	V	35.4	Very low	39.3	Very low	150 Å²	150	125.5 Å²	125.5	91%	0.909	74%	0.741	S	S	*	*			trans	-83	92.2	144	177.5	0	0	0	0	106.3	S13	V11-S13 PolarHBondContact O-N 2.86Å; V11-S13 VanDerWaalsContact O-N 3.17Å
12	S	32.9	Very low	40.9	Very low	94 Å²	94	119.8 Å²	119.8	66%	0.657	71%	0.711	S	S	*	*			trans	-56.1	110.3	173.9	44.6	0	0	0	0	110.5	N10 S14	N10-S12 VanDerWaalsContact C-N 3.32Å; N10-S12 PolarHBondContact O-N 2.91Å; S12-S14 PolarHBondContact O-N 3.34Å
13	S	31.3	Very low	42.4	Very low	101 Å²	101	115.8 Å²	115.8	71%	0.706	68%	0.675	S	S	*	*			trans	22.7	92.9	140.4	53.6	0	0	0	0	115.2	V11 S15	V11-S13 PolarHBondContact O-N 2.86Å; V11-S13 VanDerWaalsContact O-N 3.17Å; S13-S15 PolarHBondContact O-N 3.21Å
14	S	32.8	Very low	44.2	Very low	111 Å²	111	114.1 Å²	114.1	78%	0.776	65%	0.653	S	S	*	*			trans	-59.5	94.1	152.2	52.3	0	0	0	0	107.6	S12 S16	S12-S14 PolarHBondContact O-N 3.34Å; S14-S16 PolarHBondContact O-N 2.91Å
15	S	37.1	Very low	45.8	Very low	71 Å²	71	109.2 Å²	109.2	50%	0.497	63%	0.626	S	S	.	*			trans	-67.6	85.4	167.9	48.3	0	0	0	0	107.9	S13	S13-S15 PolarHBondContact O-N 3.21Å
16	S	43.1	Very low	47.5	Very low	89 Å²	89	101.6 Å²	101.6	62%	0.622	59%	0.586	S	S	*	*			trans	-51.4	138.5	156.4	-52.3	0	0	0	0	107.5	S14 V18	S14-S16 PolarHBondContact O-N 2.91Å; S16-V18 PolarHBondContact O-N 3.24Å; S16-V18 VanDerWaalsContact O-N 3.11Å
17	P	46.7	Very low	49.2	Very low	84 Å²	84	96.6 Å²	96.6	55%	0.545	56%	0.559	S	S	.	*			trans	-53	127.2	172.5	22.6	-30.9	0	0	0	106.9	I19	P17-I19 HydrophobicContact CB-CG1 4.11Å; P17-I19 HydrophobicContact CG-CD1 4.01Å; P17-I19 HydrophobicContact CG-CG1 4.02Å; P17-I19 WeakPolarHBondContact O-CG1 3.5Å; P17-I19 PolarHBondContact O-N 2.98Å
18	V	47.4	Very low	50.6	Low	108 Å²	108	92.3 Å²	92.3	66%	0.655	54%	0.536	S	S	*	.			trans	-69.7	82.6	174.4	178.7	0	0	0	0	106	S16 S20	S16-V18 PolarHBondContact O-N 3.24Å; S16-V18 VanDerWaalsContact O-N 3.11Å; V18-S20 PolarHBondContact O-N 3.26Å
19	I	46.2	Very low	51.9	Low	127 Å²	127	84.8 Å²	84.8	65%	0.651	51%	0.514	S	S	*	.			trans	-75.4	81.8	176.4	-58.9	162.9	0	0	0	105.9	P17	P17-I19 HydrophobicContact CB-CG1 4.11Å; P17-I19 HydrophobicContact CG-CD1 4.01Å; P17-I19 HydrophobicContact CG-CG1 4.02Å; P17-I19 WeakPolarHBondContact O-CG1 3.5Å; P17-I19 PolarHBondContact O-N 2.98Å
20	S	50.7	Low	52.9	Low	56 Å²	56	88.3 Å²	88.3	39%	0.392	52%	0.519	S	S	.	.			trans	-66.6	130.4	139.7	-60.4	0	0	0	0	104.8	V18 Q22 I23	V18-S20 PolarHBondContact O-N 3.26Å; S20-Q22 PolarHBondContact O-N 3.27Å; S20-I23 PolarHBondContact O-N 3.33Å
21	P	55	Low	54	Low	125 Å²	125	86.8 Å²	86.8	81%	0.812	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	4.5	-171.7	21.9	-32.8	0	0	0	115.2
22	Q	71.2	Confident	54.9	Low	125 Å²	125	90.2 Å²	90.2	58%	0.584	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	-10.5	179.4	-64.9	-175.1	23.7	0	0	113.8	S20 P54 I55	S20-Q22 PolarHBondContact O-N 3.27Å; Q22-P54 HydrophobicContact CB-CG 3.78Å; Q22-P54 HydrophobicContact CG-CG 4.1Å; Q22-P54 WeakPolarHBondContact O-CG 3.21Å; Q22-I55 WeakPolarHBondContact O-CB 3.15Å; Q22-I55 PolarHBondContact O-N 3.17Å; Q22-I55 VanDerWaalsContact O-N 3.11Å
23	I	71.7	Confident	56.1	Low	19 Å²	19	91.3 Å²	91.3	10%	0.097	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	119.4	-170.7	-50.3	168.4	0	0	0	109.7	S20 I25 I55 V57 L140	S20-I23 PolarHBondContact O-N 3.33Å; I23-I25 HydrophobicContact CG2-CG1 4.47Å; I23-I55 WeakPolarHBondContact CA-O 3.49Å; I23-I55 HydrophobicContact CG1-CB 4.26Å; I23-I55 HydrophobicContact CG1-CD1 4.3Å; I23-I55 HydrophobicContact CG2-CG2 4.3Å; I23-V57 HydrophobicContact CG2-CG2 4.11Å; I23-L140 HydrophobicContact CD1-CB 4.26Å; I23-L140 HydrophobicContact CD1-CD2 3.53Å; I23-L140 HydrophobicContact CD1-CG 4.39Å; I23-L140 HydrophobicContact CG1-CD2 4.31Å
24	I	76.5	Confident	57.5	Low	55 Å²	55	92.9 Å²	92.9	28%	0.282	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	131.5	170.8	-63.7	-168	0	0	0	108.8	I26 A48 C53 I55 I56 V57	I24-I26 HydrophobicContact CG2-CG1 4.41Å; I24-A48 HydrophobicContact CD1-CB 4.18Å; I24-A48 HydrophobicContact CG2-CB 4.29Å; I24-C53 HydrophobicContact CD1-CB 4.13Å; I24-C53 WeakPolarHBondContact CD1-SG 3.14Å; I24-C53 HydrophobicContact CG1-CB 4.33Å; I24-I55 PolarHBondContact N-O 2.92Å; I24-I56 CarbonylContact O-C 3.58Å; I24-I56 WeakPolarHBondContact O-CA 3.07Å; I24-V57 PolarHBondContact O-N 2.95Å
25	I	76.5	Confident	58.9	Low	34 Å²	34	94.4 Å²	94.4	17%	0.174	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.8	175.1	-54.3	171.7	0	0	0	107.6	I23 V57 E59 L142	I23-I25 HydrophobicContact CG2-CG1 4.47Å; I25-V57 WeakPolarHBondContact CA-O 3.03Å; I25-V57 HydrophobicContact CG1-CB 4.27Å; I25-E59 HydrophobicContact CG2-CG 3.93Å; I25-L142 HydrophobicContact CD1-CD2 3.71Å; I25-L142 HydrophobicContact CG1-CD2 4.2Å
26	I	79.6	Confident	60.2	Low	0 Å²	0	97.2 Å²	97.2	0%	0	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	113	174.4	-55.8	-178.8	0	0	0	106.6	I24 A41 Q44 L45 I56 V57 I58 E59 P60	I24-I26 HydrophobicContact CG2-CG1 4.41Å; I26-A41 HydrophobicContact CG2-CB 4.01Å; I26-Q44 HydrophobicContact CG2-CB 4.25Å; I26-L45 HydrophobicContact CD1-CB 3.54Å; I26-L45 HydrophobicContact CD1-CD1 3.65Å; I26-L45 HydrophobicContact CD1-CG 4.18Å; I26-I56 HydrophobicContact CD1-CG2 3.84Å; I26-I56 HydrophobicContact CG1-CG2 4.27Å; I26-V57 PolarHBondContact N-O 3.34Å; I26-I58 HydrophobicContact CD1-CG1 4.46Å; I26-E59 WeakPolarHBondContact O-CB 3.42Å; I26-E59 PolarHBondContact O-N 2.91Å; I26-P60 WeakPolarHBondContact O-CD 3.42Å
27	D	73.8	Confident	61.4	Low	38 Å²	38	93.6 Å²	93.6	20%	0.203	49%	0.489	C	S	.	.			trans	-124.3	148.2	-176.4	-177.6	-12	0	0	0	109	I29 R146	D27-I29 HydrophobicContact CB-CD1 3.93Å; D27-I29 HydrophobicContact CB-CG1 3.66Å; D27-I29 PolarHBondContact O-N 2.93Å; D27-I29 WeakPolarHBondContact OD1-CG1 3.45Å; D27-I29 WeakPolarHBondContact OD2-CD1 3.47Å; D27-I29 WeakPolarHBondContact OD2-CG1 3.5Å; D27-R146 IonicContact OD2-NH1 3.63Å; D27-R146 IonicContact OD2-NH2 3.87Å
28	D	65	Low	62.6	Low	68 Å²	68	91.8 Å²	91.8	36%	0.364	48%	0.479	S	S	.	.			trans	-92.5	61.5	178.1	-132.6	13.1	0	0	0	109.6	F30 D37 P60	D28-F30 PolarHBondContact O-N 3.11Å; D28-D37 WeakPolarHBondContact OD1-CB 3.34Å; D28-P60 HydrophobicContact CB-CG 4.35Å
29	I	57.5	Low	64.1	Low	90 Å²	90	92.2 Å²	92.2	46%	0.462	47%	0.472	S	S	.	.			trans	-70.4	-0.8	-165.9	-60.5	178.3	0	0	0	114.2	D27	D27-I29 HydrophobicContact CB-CD1 3.93Å; D27-I29 HydrophobicContact CB-CG1 3.66Å; D27-I29 PolarHBondContact O-N 2.93Å; D27-I29 WeakPolarHBondContact OD1-CG1 3.45Å; D27-I29 WeakPolarHBondContact OD2-CD1 3.47Å; D27-I29 WeakPolarHBondContact OD2-CG1 3.5Å
30	F	51.1	Low	65.8	Low	156 Å²	156	88.9 Å²	88.9	68%	0.684	46%	0.455	S	S	*	.			trans	-134.7	102	175	-76.4	-80.6	0	0	0	112.2	D28 R32	D28-F30 PolarHBondContact O-N 3.11Å; F30-R32 PolarHBondContact O-N 2.67Å
31	P	53.2	Low	67.2	Low	122 Å²	122	86.2 Å²	86.2	79%	0.792	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	63.9	178.7	34.7	-34.2	0	0	0	109.9
32	R	54.3	Low	68.6	Low	222 Å²	222	84.3 Å²	84.3	84%	0.838	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	-24.4	-179.2	-147.4	171.7	-173.5	-176.2	0.6	113.3	F30 D37	F30-R32 PolarHBondContact O-N 2.67Å; R32-D37 PolarHBondContact N-OD2 3.02Å
33	D	57.2	Low	69.2	Low	117 Å²	117	81.6 Å²	81.6	63%	0.626	41%	0.41	S	S	*	.			trans	-159.2	103.2	171.7	-87	-45.7	0	0	0	110.4	N35 F36 D37	D33-N35 PolarHBondContact O-N 2.73Å; D33-F36 HydrophobicContact CB-CB 4.25Å; D33-F36 PolarHBondContact O-N 3.11Å; D33-D37 PolarHBondContact N-OD2 2.74Å; D33-D37 VanDerWaalsContact N-OD2 3.08Å; D33-D37 VanDerWaalsContact O-CG 3.22Å; D33-D37 PolarHBondContact O-N 3.26Å; D33-D37 VanDerWaalsContact O-N 3.16Å
34	N	60.2	Low	69.8	Low	133 Å²	133	85.1 Å²	85.1	71%	0.711	43%	0.426	S	S	*	.	H	α-helix	trans	-44.4	-30.1	-173.4	-65.6	-16.6	0	0	0	115.9	S38	N34-S38 PolarHBondContact O-OG 3.49Å
35	N	62.9	Low	70.3	Confident	144 Å²	144	82.8 Å²	82.8	77%	0.77	41%	0.414	S	S	*	.	H	α-helix	trans	-83.2	-33.9	179.4	-70.8	-2.2	0	0	0	113.6	D33 S38	D33-N35 PolarHBondContact O-N 2.73Å; N35-S38 PolarHBondContact O-OG 3.01Å
36	F	63.9	Low	70.7	Confident	130 Å²	130	84.5 Å²	84.5	57%	0.57	42%	0.424	S	S	*	.	H	α-helix	trans	-76.9	-34.4	179	-167.6	-106.1	0	0	0	110.7	D33 F39 N40	D33-F36 HydrophobicContact CB-CB 4.25Å; D33-F36 PolarHBondContact O-N 3.11Å; F36-F39 PolarHBondContact O-N 2.9Å; F36-N40 WeakPolarHBondContact CD1-ND2 3.45Å; F36-N40 WeakPolarHBondContact CE1-ND2 3.22Å; F36-N40 PolarHBondContact O-N 2.69Å; F36-N40 PolarHBondContact O-ND2 2.97Å
37	D	68.2	Low	71.1	Confident	12 Å²	12	90.4 Å²	90.4	6%	0.064	45%	0.45	C	S	.	.	H	α-helix	trans	-66.7	-46.7	-177.5	-58.3	-25.8	0	0	0	110.8	D28 R32 D33 F39 N40 A41	D28-D37 WeakPolarHBondContact OD1-CB 3.34Å; R32-D37 PolarHBondContact N-OD2 3.02Å; D33-D37 PolarHBondContact N-OD2 2.74Å; D33-D37 VanDerWaalsContact N-OD2 3.08Å; D33-D37 VanDerWaalsContact O-CG 3.22Å; D33-D37 PolarHBondContact O-N 3.26Å; D33-D37 VanDerWaalsContact O-N 3.16Å; D37-F39 VanDerWaalsContact C-N 3.33Å; D37-F39 PolarHBondContact O-N 3.31Å; D37-N40 PolarHBondContact O-N 3.07Å; D37-N40 VanDerWaalsContact O-N 3.14Å; D37-A41 PolarHBondContact O-N 3.49Å
38	S	72	Confident	71.7	Confident	46 Å²	46	88.8 Å²	88.8	32%	0.322	44%	0.441	S	S	.	.	H	α-helix	trans	-64.9	-31.5	175.4	39.5	0	0	0	0	113.9	N34 N35 M42	N34-S38 PolarHBondContact O-OG 3.49Å; N35-S38 PolarHBondContact O-OG 3.01Å; S38-M42 PolarHBondContact O-N 2.92Å; S38-M42 VanDerWaalsContact O-N 3.1Å
39	F	79.6	Confident	72.7	Confident	117 Å²	117	85.7 Å²	85.7	51%	0.513	43%	0.425	S	S	.	.	H	α-helix	trans	-67.6	-44.1	172	-177.9	-99.3	0	0	0	111.7	F36 D37 A41 M42 V43	F36-F39 PolarHBondContact O-N 2.9Å; D37-F39 VanDerWaalsContact C-N 3.33Å; D37-F39 PolarHBondContact O-N 3.31Å; F39-A41 VanDerWaalsContact C-N 3.34Å; F39-A41 PolarHBondContact O-N 2.85Å; F39-M42 WeakPolarHBondContact O-CB 3.45Å; F39-M42 PolarHBondContact O-N 3.39Å; F39-V43 HydrophobicContact CD1-CG2 4.11Å; F39-V43 HydrophobicContact CE1-CG2 3.7Å; F39-V43 HydrophobicContact CE2-CG2 4.42Å; F39-V43 HydrophobicContact CZ-CG2 3.87Å; F39-V43 WeakPolarHBondContact O-CG2 3.21Å; F39-V43 PolarHBondContact O-N 2.87Å
40	N	81	Confident	74	Confident	57 Å²	57	88.4 Å²	88.4	31%	0.305	44%	0.436	S	S	.	.	H	α-helix	trans	-64.1	-39.4	177.9	-70	-34.5	0	0	0	112.2	F36 D37 M42 V43 Q44	F36-N40 WeakPolarHBondContact CD1-ND2 3.45Å; F36-N40 WeakPolarHBondContact CE1-ND2 3.22Å; F36-N40 PolarHBondContact O-N 2.69Å; F36-N40 PolarHBondContact O-ND2 2.97Å; D37-N40 PolarHBondContact O-N 3.07Å; D37-N40 VanDerWaalsContact O-N 3.14Å; N40-M42 VanDerWaalsContact C-N 3.32Å; N40-V43 PolarHBondContact O-N 3.25Å; N40-Q44 WeakPolarHBondContact O-CG 3.22Å; N40-Q44 PolarHBondContact O-N 2.88Å
41	A	81.6	Confident	75.6	Confident	1 Å²	1	86.5 Å²	86.5	1%	0.008	43%	0.429	C	S	.	.	H	α-helix	trans	-63.2	-39	174.4	0	0	0	0	0	111.8	I26 D37 F39 Q44 L45 P60 L63	I26-A41 HydrophobicContact CG2-CB 4.01Å; D37-A41 PolarHBondContact O-N 3.49Å; F39-A41 VanDerWaalsContact C-N 3.34Å; F39-A41 PolarHBondContact O-N 2.85Å; A41-Q44 PolarHBondContact O-N 2.81Å; A41-L45 WeakPolarHBondContact O-CB 3.34Å; A41-L45 PolarHBondContact O-N 3.04Å; A41-P60 HydrophobicContact CB-CG 4.1Å; A41-L63 HydrophobicContact CB-CD2 3.87Å
42	M	83.5	Confident	77.1	Confident	84 Å²	84	87.8 Å²	87.8	41%	0.414	42%	0.422	S	S	.	.	H	α-helix	trans	-64.9	-43.3	174.6	-168.4	-176.8	115.5	0	0	111.9	S38 F39 N40 Q44 L45 D46 L63	S38-M42 PolarHBondContact O-N 2.92Å; S38-M42 VanDerWaalsContact O-N 3.1Å; F39-M42 WeakPolarHBondContact O-CB 3.45Å; F39-M42 PolarHBondContact O-N 3.39Å; N40-M42 VanDerWaalsContact C-N 3.32Å; M42-Q44 VanDerWaalsContact C-N 3.34Å; M42-Q44 PolarHBondContact O-N 2.81Å; M42-L45 WeakPolarHBondContact O-CB 3.42Å; M42-L45 PolarHBondContact O-N 2.83Å; M42-L45 VanDerWaalsContact O-N 3.12Å; M42-D46 PolarHBondContact O-N 3.33Å; M42-L63 HydrophobicContact CB-CD1 4.06Å; M42-L63 HydrophobicContact CG-CD1 4.23Å
43	V	84.2	Confident	78.4	Confident	69 Å²	69	77.9 Å²	77.9	42%	0.418	39%	0.386	S	S	.	.	H	α-helix	trans	-63.9	-39.6	176.9	172.5	0	0	0	0	111.5	F39 N40 L45 K47	F39-V43 HydrophobicContact CD1-CG2 4.11Å; F39-V43 HydrophobicContact CE1-CG2 3.7Å; F39-V43 HydrophobicContact CE2-CG2 4.42Å; F39-V43 HydrophobicContact CZ-CG2 3.87Å; F39-V43 WeakPolarHBondContact O-CG2 3.21Å; F39-V43 PolarHBondContact O-N 2.87Å; N40-V43 PolarHBondContact O-N 3.25Å; V43-L45 VanDerWaalsContact C-N 3.3Å; V43-L45 PolarHBondContact O-N 3.38Å; V43-K47 WeakPolarHBondContact O-CB 3.46Å; V43-K47 PolarHBondContact O-N 3.19Å
44	Q	84.7	Confident	79.5	Confident	92 Å²	92	74.8 Å²	74.8	43%	0.43	37%	0.373	S	S	.	.	H	α-helix	trans	-63.8	-37.5	173.4	-74.8	178.4	58.7	0	0	111.8	I26 N40 A41 M42 A48	I26-Q44 HydrophobicContact CG2-CB 4.25Å; N40-Q44 WeakPolarHBondContact O-CG 3.22Å; N40-Q44 PolarHBondContact O-N 2.88Å; A41-Q44 PolarHBondContact O-N 2.81Å; M42-Q44 VanDerWaalsContact C-N 3.34Å; M42-Q44 PolarHBondContact O-N 2.81Å; Q44-A48 WeakPolarHBondContact O-CB 3.5Å; Q44-A48 PolarHBondContact O-N 3.24Å
45	L	86.1	Confident	80.6	Confident	6 Å²	6	69.7 Å²	69.7	3%	0.031	35%	0.345	C	S	.	.	H	α-helix	trans	-65.8	-51.2	176.3	-179.8	59.1	0	0	0	111.3	I26 A41 M42 V43 K47 A48 L49 I56 I58 L63 T67 L153	I26-L45 HydrophobicContact CD1-CB 3.54Å; I26-L45 HydrophobicContact CD1-CD1 3.65Å; I26-L45 HydrophobicContact CD1-CG 4.18Å; A41-L45 WeakPolarHBondContact O-CB 3.34Å; A41-L45 PolarHBondContact O-N 3.04Å; M42-L45 WeakPolarHBondContact O-CB 3.42Å; M42-L45 PolarHBondContact O-N 2.83Å; M42-L45 VanDerWaalsContact O-N 3.12Å; V43-L45 VanDerWaalsContact C-N 3.3Å; V43-L45 PolarHBondContact O-N 3.38Å; L45-K47 PolarHBondContact O-N 3.09Å; L45-A48 PolarHBondContact O-N 3.13Å; L45-A48 VanDerWaalsContact O-N 3.12Å; L45-L49 HydrophobicContact CD1-CD1 4.09Å; L45-L49 HydrophobicContact CD1-CD2 4.47Å; L45-L49 HydrophobicContact CD1-CG 4.05Å; L45-L49 HydrophobicContact CG-CD1 3.88Å; L45-L49 HydrophobicContact CG-CG 4.32Å; L45-L49 WeakPolarHBondContact O-CB 3.49Å; L45-L49 WeakPolarHBondContact O-CG 3.3Å; L45-L49 PolarHBondContact O-N 3.35Å; L45-I56 HydrophobicContact CD1-CG2 3.96Å; L45-I58 HydrophobicContact CD1-CD1 3.78Å; L45-I58 HydrophobicContact CD1-CG1 4.13Å; L45-I58 HydrophobicContact CD2-CD1 3.77Å; L45-I58 HydrophobicContact CG-CD1 4.44Å; L45-L63 HydrophobicContact CB-CD2 4.32Å; L45-L63 HydrophobicContact CD2-CD1 4.46Å; L45-L63 HydrophobicContact CD2-CD2 4.03Å; L45-L63 HydrophobicContact CD2-CG 4.14Å; L45-T67 HydrophobicContact CD2-CG2 4.41Å; L45-L153 HydrophobicContact CD1-CD1 4.19Å
46	D	86.1	Confident	81.5	Confident	71 Å²	71	62.8 Å²	62.8	38%	0.38	31%	0.308	S	S	.	.	H	α-helix	trans	-55.5	-43.6	176.9	-79.8	-14.2	0	0	0	111	M42 L49 E50	M42-D46 PolarHBondContact O-N 3.33Å; D46-L49 PolarHBondContact O-N 3.38Å; D46-E50 WeakPolarHBondContact O-CG 3.45Å; D46-E50 PolarHBondContact O-N 2.98Å
47	K	87	Confident	82.4	Confident	124 Å²	124	56.6 Å²	56.6	54%	0.539	28%	0.281	S	S	.	.	H	α-helix	trans	-62.9	-46.3	176.1	-173.8	178.5	175.9	-175.8	0	112.8	V43 L45 L49 E50 E51	V43-K47 WeakPolarHBondContact O-CB 3.46Å; V43-K47 PolarHBondContact O-N 3.19Å; L45-K47 PolarHBondContact O-N 3.09Å; K47-L49 VanDerWaalsContact C-N 3.26Å; K47-L49 PolarHBondContact O-N 3.35Å; K47-E50 PolarHBondContact O-N 3.37Å; K47-E51 WeakPolarHBondContact CE-OE1 3.34Å; K47-E51 WeakPolarHBondContact O-CG 3.22Å; K47-E51 PolarHBondContact O-N 3.27Å
48	A	85.5	Confident	83.1	Confident	3 Å²	3	56 Å²	56	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-34.2	178.2	0	0	0	0	0	112	I24 Q44 L45 K52 C53 I56	I24-A48 HydrophobicContact CD1-CB 4.18Å; I24-A48 HydrophobicContact CG2-CB 4.29Å; Q44-A48 WeakPolarHBondContact O-CB 3.5Å; Q44-A48 PolarHBondContact O-N 3.24Å; L45-A48 PolarHBondContact O-N 3.13Å; L45-A48 VanDerWaalsContact O-N 3.12Å; A48-K52 PolarHBondContact O-N 3.48Å; A48-C53 PolarHBondContact O-N 3.38Å; A48-C53 PolarHBondContact O-SG 3.32Å; A48-C53 VanDerWaalsContact O-SG 3.38Å; A48-I56 HydrophobicContact CB-CD1 3.84Å; A48-I56 HydrophobicContact CB-CG1 4.22Å; A48-I56 HydrophobicContact CB-CG2 4.5Å
49	L	86.3	Confident	83.3	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-68.9	-42.4	175.1	-67.5	168.1	0	0	0	111.8	L45 D46 K47 E51 K52 I56 P124 C125 Y128	L45-L49 HydrophobicContact CD1-CD1 4.09Å; L45-L49 HydrophobicContact CD1-CD2 4.47Å; L45-L49 HydrophobicContact CD1-CG 4.05Å; L45-L49 HydrophobicContact CG-CD1 3.88Å; L45-L49 HydrophobicContact CG-CG 4.32Å; L45-L49 WeakPolarHBondContact O-CB 3.49Å; L45-L49 WeakPolarHBondContact O-CG 3.3Å; L45-L49 PolarHBondContact O-N 3.35Å; D46-L49 PolarHBondContact O-N 3.38Å; K47-L49 VanDerWaalsContact C-N 3.26Å; K47-L49 PolarHBondContact O-N 3.35Å; L49-E51 VanDerWaalsContact C-N 3.34Å; L49-K52 PolarHBondContact O-N 3.12Å; L49-K52 VanDerWaalsContact O-N 3.13Å; L49-I56 HydrophobicContact CD2-CD1 3.83Å; L49-I56 HydrophobicContact CG-CD1 4.23Å; L49-P124 HydrophobicContact CB-CB 3.74Å; L49-C125 WeakPolarHBondContact CD1-SG 3.19Å; L49-Y128 HydrophobicContact CB-CE2 4.48Å; L49-Y128 HydrophobicContact CD2-CD1 4.43Å; L49-Y128 HydrophobicContact CD2-CD2 3.42Å; L49-Y128 VanDerWaalsContact CD2-CD2 3.42Å; L49-Y128 HydrophobicContact CD2-CE1 4.26Å; L49-Y128 HydrophobicContact CD2-CE2 3.23Å; L49-Y128 HydrophobicContact CD2-CG 4.02Å; L49-Y128 HydrophobicContact CG-CE2 4.44Å
50	E	85.5	Confident	83.3	Confident	148 Å²	148	50.4 Å²	50.4	69%	0.692	25%	0.25	S	C	*	.	H	α-helix	trans	-61.8	-39.9	174.7	-77.8	-176	177.3	0	0	112.3	D46 K47 K52	D46-E50 WeakPolarHBondContact O-CG 3.45Å; D46-E50 PolarHBondContact O-N 2.98Å; K47-E50 PolarHBondContact O-N 3.37Å; E50-K52 PolarHBondContact O-N 2.75Å
51	E	85.4	Confident	83.1	Confident	116 Å²	116	54 Å²	54	54%	0.542	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-4.9	176.1	-71.1	179.9	-174	0	0	113.4	K47 L49 C53	K47-E51 WeakPolarHBondContact CE-OE1 3.34Å; K47-E51 WeakPolarHBondContact O-CG 3.22Å; K47-E51 PolarHBondContact O-N 3.27Å; L49-E51 VanDerWaalsContact C-N 3.34Å; E51-C53 VanDerWaalsContact C-N 3.3Å; E51-C53 PolarHBondContact O-N 3.39Å
52	K	83.6	Confident	83	Confident	149 Å²	149	58.2 Å²	58.2	65%	0.648	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	42.1	179.5	-62	179.1	-176.4	170.3	0	113.2	A48 L49 E50 Y128	A48-K52 PolarHBondContact O-N 3.48Å; L49-K52 PolarHBondContact O-N 3.12Å; L49-K52 VanDerWaalsContact O-N 3.13Å; E50-K52 PolarHBondContact O-N 2.75Å; K52-Y128 WeakPolarHBondContact CA-OH 3.29Å
53	C	81.3	Confident	83	Confident	13 Å²	13	54.8 Å²	54.8	9%	0.088	27%	0.272	C	S	.	.			trans	-60.5	136	-179.9	-59.9	0	0	0	0	110.7	I24 A48 E51 I55 I56 Y128	I24-C53 HydrophobicContact CD1-CB 4.13Å; I24-C53 WeakPolarHBondContact CD1-SG 3.14Å; I24-C53 HydrophobicContact CG1-CB 4.33Å; A48-C53 PolarHBondContact O-N 3.38Å; A48-C53 PolarHBondContact O-SG 3.32Å; A48-C53 VanDerWaalsContact O-SG 3.38Å; E51-C53 VanDerWaalsContact C-N 3.3Å; E51-C53 PolarHBondContact O-N 3.39Å; C53-I55 VanDerWaalsContact C-N 3.33Å; C53-I55 PolarHBondContact O-N 2.87Å; C53-I56 HydrophobicContact CB-CD1 4.38Å; C53-I56 HydrophobicContact CB-CG1 3.96Å; C53-Y128 PolarHBondContact N-OH 2.96Å; C53-Y128 VanDerWaalsContact O-CE1 3.22Å; C53-Y128 WeakPolarHBondContact O-CE1 2.79Å; C53-Y128 PolarHBondContact O-OH 3.32Å
54	P	81.7	Confident	83	Confident	53 Å²	53	51.5 Å²	51.5	34%	0.344	25%	0.252	S	S	.	.	S	Bend	trans	-69.1	-32.4	-173.2	19.8	-24.9	0	0	0	112.8	Q22 V154 H155	Q22-P54 HydrophobicContact CB-CG 3.78Å; Q22-P54 HydrophobicContact CG-CG 4.1Å; Q22-P54 WeakPolarHBondContact O-CG 3.21Å; P54-V154 WeakPolarHBondContact O-CA 3.34Å; P54-H155 PolarHBondContact O-N 3.31Å
55	I	81.8	Confident	83	Confident	25 Å²	25	51.8 Å²	51.8	13%	0.128	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	125.5	177.3	-54.3	177.5	0	0	0	109.1	Q22 I23 I24 C53 V57 L140 V152 L153	Q22-I55 WeakPolarHBondContact O-CB 3.15Å; Q22-I55 PolarHBondContact O-N 3.17Å; Q22-I55 VanDerWaalsContact O-N 3.11Å; I23-I55 WeakPolarHBondContact CA-O 3.49Å; I23-I55 HydrophobicContact CG1-CB 4.26Å; I23-I55 HydrophobicContact CG1-CD1 4.3Å; I23-I55 HydrophobicContact CG2-CG2 4.3Å; I24-I55 PolarHBondContact N-O 2.92Å; C53-I55 VanDerWaalsContact C-N 3.33Å; C53-I55 PolarHBondContact O-N 2.87Å; I55-V57 HydrophobicContact CG2-CG2 4.4Å; I55-L140 HydrophobicContact CD1-CD1 4.13Å; I55-L140 HydrophobicContact CD1-CD2 3.82Å; I55-L140 HydrophobicContact CG2-CD1 4.28Å; I55-V152 HydrophobicContact CG2-CG1 3.9Å; I55-L153 WeakPolarHBondContact CA-O 3.45Å
56	I	83.5	Confident	83	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.5	175	-54.8	169.6	0	0	0	108	I24 I26 L45 A48 L49 C53 I58 Y128 L153	I24-I56 CarbonylContact O-C 3.58Å; I24-I56 WeakPolarHBondContact O-CA 3.07Å; I26-I56 HydrophobicContact CD1-CG2 3.84Å; I26-I56 HydrophobicContact CG1-CG2 4.27Å; L45-I56 HydrophobicContact CD1-CG2 3.96Å; A48-I56 HydrophobicContact CB-CD1 3.84Å; A48-I56 HydrophobicContact CB-CG1 4.22Å; A48-I56 HydrophobicContact CB-CG2 4.5Å; L49-I56 HydrophobicContact CD2-CD1 3.83Å; L49-I56 HydrophobicContact CG-CD1 4.23Å; C53-I56 HydrophobicContact CB-CD1 4.38Å; C53-I56 HydrophobicContact CB-CG1 3.96Å; I56-I58 HydrophobicContact CG2-CG1 4.31Å; I56-Y128 HydrophobicContact CD1-CD1 4.31Å; I56-Y128 HydrophobicContact CD1-CE1 3.59Å; I56-Y128 HydrophobicContact CG1-CE1 4.17Å; I56-L153 HydrophobicContact CB-CB 4.2Å; I56-L153 PolarHBondContact N-O 3.49Å; I56-L153 PolarHBondContact O-N 3.12Å
57	V	81.2	Confident	83.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.7	177.5	-179	0	0	0	0	108.1	I23 I24 I25 I26 I55 E59 L142 A150 V152	I23-V57 HydrophobicContact CG2-CG2 4.11Å; I24-V57 PolarHBondContact O-N 2.95Å; I25-V57 WeakPolarHBondContact CA-O 3.03Å; I25-V57 HydrophobicContact CG1-CB 4.27Å; I26-V57 PolarHBondContact N-O 3.34Å; I55-V57 HydrophobicContact CG2-CG2 4.4Å; V57-E59 HydrophobicContact CG1-CG 4.48Å; V57-L142 HydrophobicContact CG1-CD2 4.19Å; V57-L142 HydrophobicContact CG2-CD1 4.06Å; V57-L142 HydrophobicContact CG2-CD2 4.42Å; V57-A150 HydrophobicContact CG1-CB 3.73Å; V57-V152 HydrophobicContact CG1-CG2 4.24Å; V57-V152 HydrophobicContact CG2-CG1 4.42Å; V57-V152 HydrophobicContact CG2-CG2 4.05Å
58	I	82.9	Confident	83	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	107.3	178.4	-55.4	172.2	0	0	0	108.2	I26 L45 I56 L63 T67 A150 V151 L153	I26-I58 HydrophobicContact CD1-CG1 4.46Å; L45-I58 HydrophobicContact CD1-CD1 3.78Å; L45-I58 HydrophobicContact CD1-CG1 4.13Å; L45-I58 HydrophobicContact CD2-CD1 3.77Å; L45-I58 HydrophobicContact CG-CD1 4.44Å; I56-I58 HydrophobicContact CG2-CG1 4.31Å; I58-L63 HydrophobicContact CG2-CB 4.14Å; I58-L63 HydrophobicContact CG2-CD2 4.07Å; I58-L63 HydrophobicContact CG2-CG 4.25Å; I58-T67 HydrophobicContact CD1-CG2 4.28Å; I58-A150 CarbonylContact O-C 3.56Å; I58-A150 VanDerWaalsContact O-CA 3.23Å; I58-A150 WeakPolarHBondContact O-CA 3.44Å; I58-V151 HydrophobicContact CB-CB 4.36Å; I58-V151 HydrophobicContact CD1-CG1 4.41Å; I58-V151 PolarHBondContact N-O 3.17Å; I58-V151 PolarHBondContact O-N 3Å; I58-L153 HydrophobicContact CD1-CD1 3.53Å; I58-L153 HydrophobicContact CD1-CG 4.28Å; I58-L153 HydrophobicContact CG1-CD1 4.33Å
59	E	77.2	Confident	83.3	Confident	31 Å²	31	55.8 Å²	55.8	15%	0.145	27%	0.269	C	S	.	.			trans	-79.8	-36.5	176.2	-60.4	-169.7	159.4	0	0	114.1	I25 I26 V57 K61 R146 A150	I25-E59 HydrophobicContact CG2-CG 3.93Å; I26-E59 WeakPolarHBondContact O-CB 3.42Å; I26-E59 PolarHBondContact O-N 2.91Å; V57-E59 HydrophobicContact CG1-CG 4.48Å; E59-K61 PolarHBondContact O-N 2.9Å; E59-R146 VanDerWaalsContact CD-NH1 3.27Å; E59-R146 VanDerWaalsContact OE1-CD 3.3Å; E59-R146 WeakPolarHBondContact OE1-CD 3.37Å; E59-R146 IonicContact OE1-CZ 3.59Å; E59-R146 IonicContact OE1-NE 3.8Å; E59-R146 IonicContact OE1-NH1 2.74Å; E59-R146 PolarHBondContact OE1-NH1 2.97Å; E59-R146 IonicContact OE2-CZ 3.82Å; E59-R146 IonicContact OE2-NH1 3.02Å; E59-R146 PolarHBondContact OE2-NH1 3.42Å; E59-A150 HydrophobicContact CG-CB 4.32Å
60	P	78.3	Confident	83.3	Confident	14 Å²	14	63 Å²	63	9%	0.091	30%	0.296	C	S	.	.			trans	-61.6	110.2	176.7	-20.6	28.8	0	0	0	110.7	I26 D28 A41 T62 L63 G64	I26-P60 WeakPolarHBondContact O-CD 3.42Å; D28-P60 HydrophobicContact CB-CG 4.35Å; A41-P60 HydrophobicContact CB-CG 4.1Å; P60-T62 VanDerWaalsContact C-N 3.26Å; P60-T62 PolarHBondContact O-N 3.26Å; P60-L63 HydrophobicContact CB-CB 4.09Å; P60-L63 PolarHBondContact O-N 2.84Å; P60-G64 PolarHBondContact O-N 3.04Å
61	K	76.9	Confident	83.5	Confident	131 Å²	131	56.5 Å²	56.5	57%	0.57	27%	0.266	S	S	*	.	H	α-helix	trans	-54.1	-42.9	-177	-75.9	-169.8	177.3	-175.1	0	112.7	E59 G64 E65 S149	E59-K61 PolarHBondContact O-N 2.9Å; K61-G64 PolarHBondContact O-N 2.99Å; K61-E65 WeakPolarHBondContact O-CB 3.2Å; K61-E65 WeakPolarHBondContact O-CG 3.45Å; K61-E65 PolarHBondContact O-N 2.92Å; K61-S149 WeakPolarHBondContact CE-OG 3.49Å; K61-S149 WeakPolarHBondContact CG-OG 3.31Å
62	T	81.2	Confident	83.7	Confident	91 Å²	91	57.2 Å²	57.2	56%	0.558	27%	0.269	S	S	*	.	H	α-helix	trans	-62.6	-46.6	-178	50.1	0	0	0	0	111.5	P60 Q66	P60-T62 VanDerWaalsContact C-N 3.26Å; P60-T62 PolarHBondContact O-N 3.26Å; T62-Q66 WeakPolarHBondContact O-CB 3.38Å; T62-Q66 VanDerWaalsContact O-CG 3.24Å; T62-Q66 WeakPolarHBondContact O-CG 3.23Å; T62-Q66 PolarHBondContact O-N 3.2Å
63	L	83	Confident	84.1	Confident	11 Å²	11	53.8 Å²	53.8	6%	0.058	26%	0.257	C	S	.	.	H	α-helix	trans	-68.1	-42.9	178.2	-170.9	70.2	0	0	0	111.4	A41 M42 L45 I58 P60 Q66 T67	A41-L63 HydrophobicContact CB-CD2 3.87Å; M42-L63 HydrophobicContact CB-CD1 4.06Å; M42-L63 HydrophobicContact CG-CD1 4.23Å; L45-L63 HydrophobicContact CB-CD2 4.32Å; L45-L63 HydrophobicContact CD2-CD1 4.46Å; L45-L63 HydrophobicContact CD2-CD2 4.03Å; L45-L63 HydrophobicContact CD2-CG 4.14Å; I58-L63 HydrophobicContact CG2-CB 4.14Å; I58-L63 HydrophobicContact CG2-CD2 4.07Å; I58-L63 HydrophobicContact CG2-CG 4.25Å; P60-L63 HydrophobicContact CB-CB 4.09Å; P60-L63 PolarHBondContact O-N 2.84Å; L63-Q66 PolarHBondContact O-N 3.34Å; L63-T67 WeakPolarHBondContact O-CB 3.43Å; L63-T67 PolarHBondContact O-N 2.91Å; L63-T67 PolarHBondContact O-OG1 3.49Å
64	G	83.2	Confident	84.5	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-60.1	-46	176.7	0	0	0	0	0	112	P60 K61 T67 S68	P60-G64 PolarHBondContact O-N 3.04Å; K61-G64 PolarHBondContact O-N 2.99Å; G64-T67 PolarHBondContact O-N 3.4Å; G64-S68 WeakPolarHBondContact O-CB 3.4Å; G64-S68 PolarHBondContact O-N 2.97Å
65	E	85.2	Confident	84.8	Confident	99 Å²	99	52.6 Å²	52.6	46%	0.463	25%	0.247	S	C	.	.	H	α-helix	trans	-63.7	-43.5	176.1	-79.2	-173.2	-158.2	0	0	112.4	K61 S68 R69	K61-E65 WeakPolarHBondContact O-CB 3.2Å; K61-E65 WeakPolarHBondContact O-CG 3.45Å; K61-E65 PolarHBondContact O-N 2.92Å; E65-S68 PolarHBondContact O-N 3.32Å; E65-R69 VanDerWaalsContact O-CG 3.27Å; E65-R69 WeakPolarHBondContact O-CG 3.33Å; E65-R69 PolarHBondContact O-N 2.99Å; E65-R69 IonicContact OE2-NH2 3.11Å; E65-R69 PolarHBondContact OE2-NH2 2.9Å; E65-R69 VanDerWaalsContact OE2-NH2 3.11Å
66	Q	85.9	Confident	85.3	Confident	105 Å²	105	56.6 Å²	56.6	49%	0.491	27%	0.266	S	S	.	.	H	α-helix	trans	-61.2	-47	176.9	-74.4	174.3	14.4	0	0	111.1	T62 L63 S68 R69 W70	T62-Q66 WeakPolarHBondContact O-CB 3.38Å; T62-Q66 VanDerWaalsContact O-CG 3.24Å; T62-Q66 WeakPolarHBondContact O-CG 3.23Å; T62-Q66 PolarHBondContact O-N 3.2Å; L63-Q66 PolarHBondContact O-N 3.34Å; Q66-S68 VanDerWaalsContact C-N 3.33Å; Q66-S68 PolarHBondContact O-N 3.11Å; Q66-R69 PolarHBondContact O-N 3.23Å; Q66-W70 PolarHBondContact O-N 3.49Å
67	T	87.5	Confident	85.7	Confident	10 Å²	10	58 Å²	58	6%	0.061	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-42.8	177.7	-52.3	0	0	0	0	111.1	L45 I58 L63 G64 R69 W70 I71 L153	L45-T67 HydrophobicContact CD2-CG2 4.41Å; I58-T67 HydrophobicContact CD1-CG2 4.28Å; L63-T67 WeakPolarHBondContact O-CB 3.43Å; L63-T67 PolarHBondContact O-N 2.91Å; L63-T67 PolarHBondContact O-OG1 3.49Å; G64-T67 PolarHBondContact O-N 3.4Å; T67-R69 PolarHBondContact O-N 3.22Å; T67-W70 PolarHBondContact O-N 2.94Å; T67-I71 HydrophobicContact CG2-CD1 4.11Å; T67-I71 WeakPolarHBondContact O-CG1 3.42Å; T67-I71 PolarHBondContact O-N 3.38Å; T67-L153 HydrophobicContact CG2-CD1 4.08Å; T67-L153 HydrophobicContact CG2-CD2 4.46Å
68	S	86.7	Confident	86.1	Confident	30 Å²	30	58.9 Å²	58.9	21%	0.21	28%	0.278	C	S	.	.	H	α-helix	trans	-58.9	-45	174.5	-179.1	0	0	0	0	112	G64 E65 Q66 I71 E72 L130	G64-S68 WeakPolarHBondContact O-CB 3.4Å; G64-S68 PolarHBondContact O-N 2.97Å; E65-S68 PolarHBondContact O-N 3.32Å; Q66-S68 VanDerWaalsContact C-N 3.33Å; Q66-S68 PolarHBondContact O-N 3.11Å; S68-I71 PolarHBondContact O-N 3.44Å; S68-E72 WeakPolarHBondContact O-CB 3.44Å; S68-E72 PolarHBondContact O-N 3.05Å; S68-L130 WeakPolarHBondContact OG-CD2 3.44Å
69	R	90	Very high	86.5	Confident	143 Å²	143	67 Å²	67	54%	0.54	31%	0.308	S	S	.	.	H	α-helix	trans	-64.1	-42	178.5	-71.6	173.1	-164.4	-174.4	9.4	111.8	E65 Q66 T67 E72 I73	E65-R69 VanDerWaalsContact O-CG 3.27Å; E65-R69 WeakPolarHBondContact O-CG 3.33Å; E65-R69 PolarHBondContact O-N 2.99Å; E65-R69 IonicContact OE2-NH2 3.11Å; E65-R69 PolarHBondContact OE2-NH2 2.9Å; E65-R69 VanDerWaalsContact OE2-NH2 3.11Å; Q66-R69 PolarHBondContact O-N 3.23Å; T67-R69 PolarHBondContact O-N 3.22Å; R69-E72 WeakPolarHBondContact O-CB 3.33Å; R69-E72 PolarHBondContact O-N 3.27Å; R69-I73 VanDerWaalsContact O-CG1 3.31Å; R69-I73 WeakPolarHBondContact O-CG1 3.4Å; R69-I73 PolarHBondContact O-N 2.75Å
70	W	88.1	Confident	87.3	Confident	155 Å²	155	67.4 Å²	67.4	59%	0.587	32%	0.315	S	S	*	.	H	α-helix	trans	-59.4	-47.3	174.8	-81.5	118	0	0	0	111.4	Q66 T67 E72 I73 G74 W120	Q66-W70 PolarHBondContact O-N 3.49Å; T67-W70 PolarHBondContact O-N 2.94Å; W70-E72 VanDerWaalsContact C-N 3.28Å; W70-E72 PolarHBondContact O-N 3.21Å; W70-I73 HydrophobicContact CE3-CD1 4.47Å; W70-I73 PolarHBondContact O-N 3.13Å; W70-G74 PolarHBondContact O-N 3.29Å; W70-W120 VanDerWaalsContact C-CZ3 3.45Å; W70-W120 HydrophobicContact CB-CH2 3.82Å; W70-W120 HydrophobicContact CB-CZ3 3.74Å; W70-W120 HydrophobicContact CE3-CZ3 4.26Å; W70-W120 WeakPolarHBondContact O-CH2 3.47Å; W70-W120 WeakPolarHBondContact O-CZ3 3.31Å
71	I	88.4	Confident	88	Confident	11 Å²	11	66.8 Å²	66.8	6%	0.056	31%	0.311	C	S	.	.	H	α-helix	trans	-59.3	-40.4	174.9	-67.8	167.6	0	0	0	111.4	T67 S68 G74 N75 W120 L153	T67-I71 HydrophobicContact CG2-CD1 4.11Å; T67-I71 WeakPolarHBondContact O-CG1 3.42Å; T67-I71 PolarHBondContact O-N 3.38Å; S68-I71 PolarHBondContact O-N 3.44Å; I71-G74 PolarHBondContact O-N 3.01Å; I71-N75 WeakPolarHBondContact O-CB 3.36Å; I71-N75 VanDerWaalsContact O-CG 3.22Å; I71-N75 PolarHBondContact O-N 3.46Å; I71-N75 PolarHBondContact O-ND2 3.23Å; I71-N75 VanDerWaalsContact O-ND2 3.12Å; I71-W120 VanDerWaalsContact CA-CZ2 3.47Å; I71-W120 HydrophobicContact CB-CH2 4.43Å; I71-W120 HydrophobicContact CB-CZ2 4.23Å; I71-W120 HydrophobicContact CG1-CH2 4.01Å; I71-W120 HydrophobicContact CG1-CZ2 3.9Å; I71-W120 VanDerWaalsContact N-CH2 3.34Å; I71-L153 HydrophobicContact CD1-CD2 3.42Å; I71-L153 VanDerWaalsContact CD1-CD2 3.42Å
72	E	90.2	Very high	88.8	Confident	131 Å²	131	61.6 Å²	61.6	61%	0.612	29%	0.29	S	S	*	.	H	α-helix	trans	-64.6	-44.1	177.1	-169.2	172.8	-168.6	0	0	112.4	S68 R69 W70 G74 N75 M76	S68-E72 WeakPolarHBondContact O-CB 3.44Å; S68-E72 PolarHBondContact O-N 3.05Å; R69-E72 WeakPolarHBondContact O-CB 3.33Å; R69-E72 PolarHBondContact O-N 3.27Å; W70-E72 VanDerWaalsContact C-N 3.28Å; W70-E72 PolarHBondContact O-N 3.21Å; E72-G74 PolarHBondContact O-N 2.87Å; E72-N75 CarbonylContact O-C 3.53Å; E72-N75 WeakPolarHBondContact O-CB 3.25Å; E72-N75 PolarHBondContact O-N 3.49Å; E72-N75 VanDerWaalsContact O-N 3.14Å; E72-M76 WeakPolarHBondContact O-CB 3.18Å; E72-M76 PolarHBondContact O-N 3.23Å
73	I	91.4	Very high	89.5	Confident	77 Å²	77	63 Å²	63	40%	0.395	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-45.3	175.5	-68.6	164.2	0	0	0	110.5	R69 W70 N75 M76 L77	R69-I73 VanDerWaalsContact O-CG1 3.31Å; R69-I73 WeakPolarHBondContact O-CG1 3.4Å; R69-I73 PolarHBondContact O-N 2.75Å; W70-I73 HydrophobicContact CE3-CD1 4.47Å; W70-I73 PolarHBondContact O-N 3.13Å; I73-N75 VanDerWaalsContact C-N 3.29Å; I73-N75 PolarHBondContact O-N 2.75Å; I73-M76 WeakPolarHBondContact O-CB 3.45Å; I73-M76 PolarHBondContact O-N 3.12Å; I73-L77 HydrophobicContact CG2-CD1 4.36Å; I73-L77 PolarHBondContact O-N 3.35Å
74	G	89.4	Confident	90.1	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59	-41.4	174.4	0	0	0	0	0	112.5	W70 I71 E72 L77 H78 Y116	W70-G74 PolarHBondContact O-N 3.29Å; I71-G74 PolarHBondContact O-N 3.01Å; E72-G74 PolarHBondContact O-N 2.87Å; G74-L77 PolarHBondContact O-N 3.43Å; G74-H78 PolarHBondContact O-N 2.96Å; G74-Y116 WeakPolarHBondContact O-CD2 3.37Å; G74-Y116 WeakPolarHBondContact O-CE2 3.46Å
75	N	89.7	Confident	90.6	Very high	41 Å²	41	64.9 Å²	64.9	22%	0.219	30%	0.303	C	S	.	.	H	α-helix	trans	-66.6	-38.8	175.8	-75.3	-35.3	0	0	0	112.9	I71 E72 I73 H78 R79 R161	I71-N75 WeakPolarHBondContact O-CB 3.36Å; I71-N75 VanDerWaalsContact O-CG 3.22Å; I71-N75 PolarHBondContact O-N 3.46Å; I71-N75 PolarHBondContact O-ND2 3.23Å; I71-N75 VanDerWaalsContact O-ND2 3.12Å; E72-N75 CarbonylContact O-C 3.53Å; E72-N75 WeakPolarHBondContact O-CB 3.25Å; E72-N75 PolarHBondContact O-N 3.49Å; E72-N75 VanDerWaalsContact O-N 3.14Å; I73-N75 VanDerWaalsContact C-N 3.29Å; I73-N75 PolarHBondContact O-N 2.75Å; N75-H78 PolarHBondContact O-N 3.38Å; N75-R79 WeakPolarHBondContact O-CB 3.07Å; N75-R79 WeakPolarHBondContact O-CG 3.4Å; N75-R79 PolarHBondContact O-N 3.46Å; N75-R161 VanDerWaalsContact OD1-CZ 3.23Å; N75-R161 PolarHBondContact OD1-NH1 2.83Å; N75-R161 PolarHBondContact OD1-NH2 2.93Å
76	M	91.3	Very high	91	Very high	108 Å²	108	63.8 Å²	63.8	53%	0.532	30%	0.3	S	S	.	.	H	α-helix	trans	-61.7	-47.8	175	-174.6	-168.7	72	0	0	110.5	E72 I73 H78 R79 S80	E72-M76 WeakPolarHBondContact O-CB 3.18Å; E72-M76 PolarHBondContact O-N 3.23Å; I73-M76 WeakPolarHBondContact O-CB 3.45Å; I73-M76 PolarHBondContact O-N 3.12Å; M76-H78 VanDerWaalsContact C-N 3.33Å; M76-H78 PolarHBondContact O-N 2.94Å; M76-R79 PolarHBondContact O-N 2.96Å; M76-S80 VanDerWaalsContact O-CB 3.32Å; M76-S80 WeakPolarHBondContact O-CB 3.46Å; M76-S80 PolarHBondContact O-N 3.21Å; M76-S80 PolarHBondContact O-OG 2.96Å
77	L	91	Very high	91.4	Very high	31 Å²	31	60.2 Å²	60.2	16%	0.162	29%	0.292	C	S	.	.	H	α-helix	trans	-56.1	-45.5	177.3	-82.3	162.5	0	0	0	112.4	I73 G74 S81 C112 F115 Y116	I73-L77 HydrophobicContact CG2-CD1 4.36Å; I73-L77 PolarHBondContact O-N 3.35Å; G74-L77 PolarHBondContact O-N 3.43Å; L77-S81 VanDerWaalsContact O-CB 3.31Å; L77-S81 WeakPolarHBondContact O-CB 3.32Å; L77-S81 PolarHBondContact O-N 3.14Å; L77-C112 HydrophobicContact CD2-CB 4.46Å; L77-F115 HydrophobicContact CD2-CB 3.92Å; L77-Y116 HydrophobicContact CB-CD2 4.07Å
78	H	90.7	Very high	91.6	Very high	18 Å²	18	59.8 Å²	59.8	8%	0.083	29%	0.289	C	S	.	.	H	α-helix	trans	-61.2	-51.1	176	176.1	-86.6	0	0	0	111.7	G74 N75 M76 S81 V82 Y116 R161 Q165	G74-H78 PolarHBondContact O-N 2.96Å; N75-H78 PolarHBondContact O-N 3.38Å; M76-H78 VanDerWaalsContact C-N 3.33Å; M76-H78 PolarHBondContact O-N 2.94Å; H78-S81 PolarHBondContact O-N 3.04Å; H78-V82 WeakPolarHBondContact O-CG2 3.39Å; H78-V82 PolarHBondContact O-N 3.45Å; H78-Y116 HydrophobicContact CB-CD2 4.15Å; H78-Y116 HydrophobicContact CB-CE2 3.93Å; H78-R161 PolarHBondContact CE1-NE 3.3Å; H78-R161 PolarHBondContact ND1-NE 2.97Å; H78-R161 PolarHBondContact ND1-NH2 3.1Å; H78-R161 WeakPolarHBondContact NE2-CG 3.47Å; H78-R161 PolarHBondContact NE2-O 3.03Å; H78-Q165 PolarHBondContact CD2-OE1 3.2Å
79	R	91.6	Very high	91.9	Very high	169 Å²	169	59.9 Å²	59.9	64%	0.638	29%	0.287	S	S	*	.	H	α-helix	trans	-62.5	-44.9	-179.2	-73.3	176.6	-177.6	175.9	2.5	112	N75 M76 S81 V82 L83	N75-R79 WeakPolarHBondContact O-CB 3.07Å; N75-R79 WeakPolarHBondContact O-CG 3.4Å; N75-R79 PolarHBondContact O-N 3.46Å; M76-R79 PolarHBondContact O-N 2.96Å; R79-S81 PolarHBondContact O-N 2.82Å; R79-V82 PolarHBondContact O-N 3.44Å; R79-L83 WeakPolarHBondContact O-CB 3.45Å; R79-L83 WeakPolarHBondContact O-CG 3.32Å; R79-L83 PolarHBondContact O-N 2.77Å
80	S	94	Very high	92.1	Very high	41 Å²	41	57.9 Å²	57.9	29%	0.287	29%	0.286	S	S	.	.	H	α-helix	trans	-61.6	-43.9	177.9	-64.9	0	0	0	0	111.5	M76 V82 L83 L84	M76-S80 VanDerWaalsContact O-CB 3.32Å; M76-S80 WeakPolarHBondContact O-CB 3.46Å; M76-S80 PolarHBondContact O-N 3.21Å; M76-S80 PolarHBondContact O-OG 2.96Å; S80-V82 VanDerWaalsContact C-N 3.35Å; S80-V82 PolarHBondContact O-N 3.35Å; S80-L83 PolarHBondContact O-N 3.43Å; S80-L84 VanDerWaalsContact O-CB 3.29Å; S80-L84 WeakPolarHBondContact O-CB 3.46Å; S80-L84 WeakPolarHBondContact O-CD1 3.18Å; S80-L84 WeakPolarHBondContact O-CG 3.09Å; S80-L84 PolarHBondContact O-N 3.33Å
81	S	93.1	Very high	92.2	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-41.1	176.5	-177.2	0	0	0	0	112.2	L77 H78 R79 S85 A109 Q165 V169	L77-S81 VanDerWaalsContact O-CB 3.31Å; L77-S81 WeakPolarHBondContact O-CB 3.32Å; L77-S81 PolarHBondContact O-N 3.14Å; H78-S81 PolarHBondContact O-N 3.04Å; R79-S81 PolarHBondContact O-N 2.82Å; S81-S85 WeakPolarHBondContact O-CB 3.43Å; S81-S85 PolarHBondContact O-N 3.12Å; S81-S85 PolarHBondContact O-OG 3.33Å; S81-A109 PolarHBondContact OG-O 2.99Å; S81-A109 VanDerWaalsContact OG-O 3.07Å; S81-Q165 PolarHBondContact OG-NE2 3.32Å; S81-V169 WeakPolarHBondContact OG-CG2 3.39Å
82	V	94	Very high	92.3	Very high	23 Å²	23	50.6 Å²	50.6	14%	0.139	26%	0.26	C	S	.	.	H	α-helix	trans	-63.9	-49.3	175.3	168.9	0	0	0	0	111.3	H78 R79 S80 L84 S85 I86 F164 Q165 L168	H78-V82 WeakPolarHBondContact O-CG2 3.39Å; H78-V82 PolarHBondContact O-N 3.45Å; R79-V82 PolarHBondContact O-N 3.44Å; S80-V82 VanDerWaalsContact C-N 3.35Å; S80-V82 PolarHBondContact O-N 3.35Å; V82-L84 PolarHBondContact O-N 3.16Å; V82-S85 PolarHBondContact O-N 2.87Å; V82-I86 HydrophobicContact CG1-CD1 3.88Å; V82-I86 WeakPolarHBondContact O-CG1 3.36Å; V82-I86 PolarHBondContact O-N 3.08Å; V82-F164 HydrophobicContact CG1-CE1 4.44Å; V82-F164 HydrophobicContact CG2-CE1 4.42Å; V82-Q165 HydrophobicContact CG2-CB 4.42Å; V82-Q165 HydrophobicContact CG2-CG 4.23Å; V82-L168 HydrophobicContact CB-CD2 4.13Å; V82-L168 HydrophobicContact CG1-CD2 3.72Å; V82-L168 HydrophobicContact CG2-CD2 4.19Å
83	L	95.4	Very high	92.3	Very high	120 Å²	120	50.3 Å²	50.3	63%	0.628	26%	0.257	S	S	*	.	H	α-helix	trans	-61.9	-44.3	179.9	-73.5	171.3	0	0	0	112	R79 S80 S85 I86 G87	R79-L83 WeakPolarHBondContact O-CB 3.45Å; R79-L83 WeakPolarHBondContact O-CG 3.32Å; R79-L83 PolarHBondContact O-N 2.77Å; S80-L83 PolarHBondContact O-N 3.43Å; L83-S85 VanDerWaalsContact C-N 3.33Å; L83-S85 PolarHBondContact O-N 2.89Å; L83-I86 PolarHBondContact O-N 3.33Å; L83-G87 PolarHBondContact O-N 3.34Å
84	L	95.1	Very high	92.2	Very high	51 Å²	51	50.3 Å²	50.3	27%	0.267	26%	0.264	S	S	.	.	H	α-helix	trans	-65.7	-36.4	177.3	-70.9	167.6	0	0	0	112	S80 V82 G87 S88 A108 A109	S80-L84 VanDerWaalsContact O-CB 3.29Å; S80-L84 WeakPolarHBondContact O-CB 3.46Å; S80-L84 WeakPolarHBondContact O-CD1 3.18Å; S80-L84 WeakPolarHBondContact O-CG 3.09Å; S80-L84 PolarHBondContact O-N 3.33Å; V82-L84 PolarHBondContact O-N 3.16Å; L84-G87 PolarHBondContact O-N 2.92Å; L84-S88 VanDerWaalsContact O-CB 3.32Å; L84-S88 WeakPolarHBondContact O-CB 3.37Å; L84-S88 PolarHBondContact O-N 2.87Å; L84-A108 HydrophobicContact CD1-CB 3.85Å; L84-A108 HydrophobicContact CD2-CB 4.4Å; L84-A109 HydrophobicContact CB-CB 3.64Å
85	S	93	Very high	92.2	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.7	-46.4	175.9	-58.2	0	0	0	0	111.5	S81 V82 L83 S88 I89 V169	S81-S85 WeakPolarHBondContact O-CB 3.43Å; S81-S85 PolarHBondContact O-N 3.12Å; S81-S85 PolarHBondContact O-OG 3.33Å; V82-S85 PolarHBondContact O-N 2.87Å; L83-S85 VanDerWaalsContact C-N 3.33Å; L83-S85 PolarHBondContact O-N 2.89Å; S85-S88 PolarHBondContact O-N 3.44Å; S85-I89 VanDerWaalsContact O-CG1 3.31Å; S85-I89 WeakPolarHBondContact O-CG1 3.4Å; S85-I89 PolarHBondContact O-N 3.36Å; S85-V169 WeakPolarHBondContact OG-CG2 3.33Å
86	I	94.7	Very high	91.8	Very high	75 Å²	75	58.9 Å²	58.9	39%	0.385	30%	0.303	S	S	.	.	H	α-helix	trans	-62.8	-45.4	175.6	-65.2	167.2	0	0	0	110.1	V82 L83 S88 I89 L90 L168	V82-I86 HydrophobicContact CG1-CD1 3.88Å; V82-I86 WeakPolarHBondContact O-CG1 3.36Å; V82-I86 PolarHBondContact O-N 3.08Å; L83-I86 PolarHBondContact O-N 3.33Å; I86-S88 VanDerWaalsContact C-N 3.28Å; I86-S88 PolarHBondContact O-N 2.83Å; I86-I89 PolarHBondContact O-N 2.81Å; I86-L90 HydrophobicContact CG2-CD1 3.98Å; I86-L90 HydrophobicContact CG2-CG 4.38Å; I86-L90 WeakPolarHBondContact O-CG 3.27Å; I86-L90 PolarHBondContact O-N 3.03Å; I86-L168 HydrophobicContact CD1-CD2 4.42Å; I86-L168 HydrophobicContact CG1-CD1 4.46Å; I86-L168 HydrophobicContact CG1-CD2 4.06Å
87	G	93.5	Very high	91.4	Very high	31 Å²	31	63.5 Å²	63.5	32%	0.32	32%	0.32	S	S	.	.	H	α-helix	trans	-58.9	-39.7	176.8	0	0	0	0	0	112.4	L83 L84 L90 A91	L83-G87 PolarHBondContact O-N 3.34Å; L84-G87 PolarHBondContact O-N 2.92Å; G87-L90 PolarHBondContact O-N 3.19Å; G87-A91 VanDerWaalsContact O-CB 3.25Å; G87-A91 WeakPolarHBondContact O-CB 3.24Å; G87-A91 PolarHBondContact O-N 3.26Å
88	S	92.1	Very high	91.3	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-64.6	-46	175.4	-174.1	0	0	0	0	111.8	L84 S85 I86 L90 A91 V92 W102 T105 C106 V176	L84-S88 VanDerWaalsContact O-CB 3.32Å; L84-S88 WeakPolarHBondContact O-CB 3.37Å; L84-S88 PolarHBondContact O-N 2.87Å; S85-S88 PolarHBondContact O-N 3.44Å; I86-S88 VanDerWaalsContact C-N 3.28Å; I86-S88 PolarHBondContact O-N 2.83Å; S88-L90 PolarHBondContact O-N 3.48Å; S88-A91 PolarHBondContact O-N 2.67Å; S88-V92 WeakPolarHBondContact O-CG2 3.15Å; S88-V92 PolarHBondContact O-N 3.11Å; S88-W102 PolarHBondContact OG-O 3Å; S88-T105 WeakPolarHBondContact CA-OG1 3.48Å; S88-T105 WeakPolarHBondContact CB-OG1 3.36Å; S88-C106 WeakPolarHBondContact OG-CB 3.34Å; S88-V176 WeakPolarHBondContact OG-CG2 3.4Å
89	I	93.2	Very high	91	Very high	33 Å²	33	65.8 Å²	65.8	17%	0.169	34%	0.342	C	S	.	.	H	α-helix	trans	-57.8	-49.7	175.8	-66.3	168.8	0	0	0	110.4	S85 I86 A91 V92 F93 L168 V171 A172 L175	S85-I89 VanDerWaalsContact O-CG1 3.31Å; S85-I89 WeakPolarHBondContact O-CG1 3.4Å; S85-I89 PolarHBondContact O-N 3.36Å; I86-I89 PolarHBondContact O-N 2.81Å; I89-A91 VanDerWaalsContact C-N 3.32Å; I89-A91 PolarHBondContact O-N 3.42Å; I89-V92 WeakPolarHBondContact O-CB 3.36Å; I89-V92 PolarHBondContact O-N 3.43Å; I89-F93 HydrophobicContact CG2-CD2 4.11Å; I89-F93 HydrophobicContact CG2-CE2 3.86Å; I89-F93 WeakPolarHBondContact O-CD2 3.31Å; I89-F93 PolarHBondContact O-N 2.87Å; I89-L168 HydrophobicContact CD1-CD1 4.28Å; I89-V171 HydrophobicContact CD1-CG1 4.44Å; I89-A172 HydrophobicContact CD1-CB 4.07Å; I89-A172 HydrophobicContact CG1-CB 3.8Å; I89-L175 HydrophobicContact CD1-CD1 4.43Å; I89-L175 HydrophobicContact CG1-CD1 3.95Å; I89-L175 HydrophobicContact CG2-CD1 4.04Å
90	L	93.3	Very high	90.9	Very high	100 Å²	100	66.3 Å²	66.3	52%	0.524	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-40.2	178.1	-69.5	173.5	0	0	0	112	I86 G87 S88 V92 F93 S94	I86-L90 HydrophobicContact CG2-CD1 3.98Å; I86-L90 HydrophobicContact CG2-CG 4.38Å; I86-L90 WeakPolarHBondContact O-CG 3.27Å; I86-L90 PolarHBondContact O-N 3.03Å; G87-L90 PolarHBondContact O-N 3.19Å; S88-L90 PolarHBondContact O-N 3.48Å; L90-V92 VanDerWaalsContact C-N 3.33Å; L90-V92 PolarHBondContact O-N 3.39Å; L90-F93 PolarHBondContact O-N 2.54Å; L90-S94 WeakPolarHBondContact O-CB 3.42Å; L90-S94 PolarHBondContact O-N 2.91Å; L90-S94 PolarHBondContact O-OG 3.08Å
91	A	91.1	Very high	90.6	Very high	11 Å²	11	68 Å²	68	9%	0.091	36%	0.358	C	S	.	.	H	α-helix	trans	-64.9	-35.9	178.1	0	0	0	0	0	112.5	G87 S88 I89 F93 Y95 V101 W102	G87-A91 VanDerWaalsContact O-CB 3.25Å; G87-A91 WeakPolarHBondContact O-CB 3.24Å; G87-A91 PolarHBondContact O-N 3.26Å; S88-A91 PolarHBondContact O-N 2.67Å; I89-A91 VanDerWaalsContact C-N 3.32Å; I89-A91 PolarHBondContact O-N 3.42Å; A91-F93 VanDerWaalsContact C-N 3.3Å; A91-F93 PolarHBondContact O-N 3.27Å; A91-Y95 CarbonylContact O-C 3.6Å; A91-Y95 WeakPolarHBondContact O-CA 3.21Å; A91-Y95 PolarHBondContact O-N 3.17Å; A91-V101 HydrophobicContact CB-CG1 4.47Å; A91-W102 HydrophobicContact CB-CB 3.88Å
92	V	90.2	Very high	90.5	Very high	2 Å²	2	68.6 Å²	68.6	1%	0.012	36%	0.36	C	S	.	.	H	α-helix	trans	-59.8	-40.7	174.3	169	0	0	0	0	111.3	S88 I89 L90 W102 V176 K179 F184	S88-V92 WeakPolarHBondContact O-CG2 3.15Å; S88-V92 PolarHBondContact O-N 3.11Å; I89-V92 WeakPolarHBondContact O-CB 3.36Å; I89-V92 PolarHBondContact O-N 3.43Å; L90-V92 VanDerWaalsContact C-N 3.33Å; L90-V92 PolarHBondContact O-N 3.39Å; V92-W102 HydrophobicContact CG2-CB 3.71Å; V92-W102 HydrophobicContact CG2-CD2 4.19Å; V92-W102 HydrophobicContact CG2-CG 3.9Å; V92-V176 HydrophobicContact CG2-CG2 3.72Å; V92-K179 HydrophobicContact CG1-CB 3.99Å; V92-K179 HydrophobicContact CG1-CD 4.13Å; V92-K179 HydrophobicContact CG1-CG 3.99Å; V92-F184 HydrophobicContact CG1-CE2 4.33Å; V92-F184 HydrophobicContact CG1-CZ 4.28Å
93	F	89.6	Confident	90.2	Very high	125 Å²	125	69.8 Å²	69.8	55%	0.548	37%	0.369	S	S	.	.	H	α-helix	trans	-83.5	-46.2	-178.2	-69.8	-69	0	0	0	113.6	I89 L90 A91	I89-F93 HydrophobicContact CG2-CD2 4.11Å; I89-F93 HydrophobicContact CG2-CE2 3.86Å; I89-F93 WeakPolarHBondContact O-CD2 3.31Å; I89-F93 PolarHBondContact O-N 2.87Å; L90-F93 PolarHBondContact O-N 2.54Å; A91-F93 VanDerWaalsContact C-N 3.3Å; A91-F93 PolarHBondContact O-N 3.27Å
94	S	91.1	Very high	90.1	Very high	78 Å²	78	67.8 Å²	67.8	55%	0.545	37%	0.365	S	S	.	.	H	α-helix	trans	-78.5	-31.9	-174.9	-60.3	0	0	0	0	113	L90	L90-S94 WeakPolarHBondContact O-CB 3.42Å; L90-S94 PolarHBondContact O-N 2.91Å; L90-S94 PolarHBondContact O-OG 3.08Å
95	Y	87.7	Confident	89.9	Confident	159 Å²	159	66.9 Å²	66.9	62%	0.624	36%	0.362	S	S	*	.			trans	-131.9	63.3	-175.5	-56.8	-76.2	0	0	0	111.8	A91 K97 A98	A91-Y95 CarbonylContact O-C 3.6Å; A91-Y95 WeakPolarHBondContact O-CA 3.21Å; A91-Y95 PolarHBondContact O-N 3.17Å; Y95-K97 PolarHBondContact O-N 3.28Å; Y95-K97 VanDerWaalsContact O-N 3.13Å; Y95-A98 WeakPolarHBondContact O-CB 3.39Å; Y95-A98 PolarHBondContact O-N 3.01Å
96	P	82.2	Confident	89.9	Confident	62 Å²	62	67.4 Å²	67.4	40%	0.403	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-30.5	-171.9	23.5	-33.9	0	0	0	113.2	A98 W102	P96-A98 VanDerWaalsContact C-N 3.3Å; P96-A98 PolarHBondContact O-N 3.07Å; P96-W102 PolarHBondContact O-NE1 3.14Å
97	K	83.6	Confident	89.8	Confident	205 Å²	205	66.8 Å²	66.8	89%	0.891	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-17.5	178.5	-62	-177	-178.9	178.5	0	113.4	Y95 S99	Y95-K97 PolarHBondContact O-N 3.28Å; Y95-K97 VanDerWaalsContact O-N 3.13Å; K97-S99 VanDerWaalsContact C-N 3.33Å; K97-S99 PolarHBondContact O-N 3.06Å; K97-S99 VanDerWaalsContact O-N 3.12Å
98	A	87.7	Confident	89.8	Confident	34 Å²	34	66.9 Å²	66.9	28%	0.281	37%	0.366	S	S	.	.			trans	-89.8	61.3	-174.3	0	0	0	0	0	112.1	Y95 P96 K100 V101 W102	Y95-A98 WeakPolarHBondContact O-CB 3.39Å; Y95-A98 PolarHBondContact O-N 3.01Å; P96-A98 VanDerWaalsContact C-N 3.3Å; P96-A98 PolarHBondContact O-N 3.07Å; A98-K100 PolarHBondContact O-N 3.22Å; A98-K100 VanDerWaalsContact O-N 3.13Å; A98-V101 HydrophobicContact CB-CB 4.16Å; A98-V101 HydrophobicContact CB-CG2 3.97Å; A98-V101 WeakPolarHBondContact O-CB 3.4Å; A98-V101 PolarHBondContact O-N 3.35Å; A98-W102 VanDerWaalsContact O-CD1 3.24Å; A98-W102 PolarHBondContact O-N 3.44Å
99	S	84.6	Confident	89.9	Confident	62 Å²	62	66.9 Å²	66.9	43%	0.434	37%	0.366	S	S	.	.	H	α-helix	trans	-54.5	-36.5	-173.3	63.4	0	0	0	0	115.3	K97 V101 S103	K97-S99 VanDerWaalsContact C-N 3.33Å; K97-S99 PolarHBondContact O-N 3.06Å; K97-S99 VanDerWaalsContact O-N 3.12Å; S99-V101 VanDerWaalsContact C-N 3.3Å; S99-V101 PolarHBondContact O-N 2.98Å; S99-S103 WeakPolarHBondContact O-CB 3.39Å; S99-S103 PolarHBondContact O-N 2.93Å
100	K	89.4	Confident	89.9	Confident	180 Å²	180	66.8 Å²	66.8	78%	0.783	37%	0.37	S	S	*	.	H	α-helix	trans	-63.1	-36	176.7	-62.6	-177.1	-177.2	179.5	0	112.3	A98 S104	A98-K100 PolarHBondContact O-N 3.22Å; A98-K100 VanDerWaalsContact O-N 3.13Å; K100-S104 WeakPolarHBondContact O-CB 3.48Å; K100-S104 PolarHBondContact O-N 3.4Å
101	V	88.8	Confident	89.9	Confident	78 Å²	78	66.1 Å²	66.1	47%	0.473	37%	0.366	S	S	.	.	H	α-helix	trans	-73.6	-53	-174.9	179.2	0	0	0	0	110.8	A91 A98 S99 S103 S104 T105	A91-V101 HydrophobicContact CB-CG1 4.47Å; A98-V101 HydrophobicContact CB-CB 4.16Å; A98-V101 HydrophobicContact CB-CG2 3.97Å; A98-V101 WeakPolarHBondContact O-CB 3.4Å; A98-V101 PolarHBondContact O-N 3.35Å; S99-V101 VanDerWaalsContact C-N 3.3Å; S99-V101 PolarHBondContact O-N 2.98Å; V101-S103 VanDerWaalsContact C-N 3.32Å; V101-S103 PolarHBondContact O-N 3.21Å; V101-S104 PolarHBondContact O-N 2.8Å; V101-T105 WeakPolarHBondContact O-CG2 3.17Å; V101-T105 PolarHBondContact O-N 3.18Å; V101-T105 PolarHBondContact O-OG1 3.47Å
102	W	89.8	Confident	89.9	Confident	11 Å²	11	66.8 Å²	66.8	4%	0.042	37%	0.369	C	S	.	.	H	α-helix	trans	-67.9	-33.3	178.9	49.4	-106.5	0	0	0	112.3	S88 A91 V92 P96 A98 T105 C106 V176 K179 R180	S88-W102 PolarHBondContact OG-O 3Å; A91-W102 HydrophobicContact CB-CB 3.88Å; V92-W102 HydrophobicContact CG2-CB 3.71Å; V92-W102 HydrophobicContact CG2-CD2 4.19Å; V92-W102 HydrophobicContact CG2-CG 3.9Å; P96-W102 PolarHBondContact O-NE1 3.14Å; A98-W102 VanDerWaalsContact O-CD1 3.24Å; A98-W102 PolarHBondContact O-N 3.44Å; W102-T105 WeakPolarHBondContact CA-OG1 3.17Å; W102-T105 PolarHBondContact O-OG1 3.44Å; W102-C106 WeakPolarHBondContact O-CB 3.42Å; W102-C106 PolarHBondContact O-N 2.98Å; W102-C106 VanDerWaalsContact O-N 3.12Å; W102-V176 HydrophobicContact CE3-CB 4.19Å; W102-V176 HydrophobicContact CE3-CG1 3.67Å; W102-V176 HydrophobicContact CE3-CG2 3.98Å; W102-V176 HydrophobicContact CZ3-CB 4.41Å; W102-V176 HydrophobicContact CZ3-CG1 3.68Å; W102-V176 WeakPolarHBondContact CZ3-O 3.4Å; W102-K179 HydrophobicContact CZ2-CG 4.16Å; W102-R180 HydrophobicContact CH2-CB 3.81Å; W102-R180 HydrophobicContact CH2-CG 4.27Å; W102-R180 HydrophobicContact CZ3-CB 4.22Å
103	S	89	Confident	90	Very high	48 Å²	48	68 Å²	68	34%	0.336	38%	0.376	S	S	.	.	H	α-helix	trans	-69.1	-43.3	174.4	-175.3	0	0	0	0	112.4	S99 V101 C106 S107	S99-S103 WeakPolarHBondContact O-CB 3.39Å; S99-S103 PolarHBondContact O-N 2.93Å; V101-S103 VanDerWaalsContact C-N 3.32Å; V101-S103 PolarHBondContact O-N 3.21Å; S103-C106 PolarHBondContact O-N 2.89Å; S103-S107 PolarHBondContact O-N 3.35Å; S103-S107 PolarHBondContact O-OG 3.46Å; S103-S107 VanDerWaalsContact O-OG 3.08Å
104	S	93.4	Very high	90.2	Very high	78 Å²	78	66.3 Å²	66.3	55%	0.545	37%	0.372	S	S	.	.	H	α-helix	trans	-65	-44.1	-179.8	174.6	0	0	0	0	111.7	K100 V101 C106 S107 A108	K100-S104 WeakPolarHBondContact O-CB 3.48Å; K100-S104 PolarHBondContact O-N 3.4Å; V101-S104 PolarHBondContact O-N 2.8Å; S104-C106 VanDerWaalsContact C-N 3.35Å; S104-C106 PolarHBondContact O-N 3.22Å; S104-S107 PolarHBondContact O-N 3.32Å; S104-A108 WeakPolarHBondContact O-CB 3.49Å; S104-A108 PolarHBondContact O-N 2.79Å
105	T	91	Very high	90.2	Very high	33 Å²	33	68.9 Å²	68.9	20%	0.202	37%	0.374	C	S	.	.	H	α-helix	trans	-63.4	-39.7	176.8	48.4	0	0	0	0	112	S88 V101 W102 A108 A109	S88-T105 WeakPolarHBondContact CA-OG1 3.48Å; S88-T105 WeakPolarHBondContact CB-OG1 3.36Å; V101-T105 WeakPolarHBondContact O-CG2 3.17Å; V101-T105 PolarHBondContact O-N 3.18Å; V101-T105 PolarHBondContact O-OG1 3.47Å; W102-T105 WeakPolarHBondContact CA-OG1 3.17Å; W102-T105 PolarHBondContact O-OG1 3.44Å; T105-A108 PolarHBondContact O-N 3.45Å; T105-A109 WeakPolarHBondContact O-CB 3.46Å; T105-A109 PolarHBondContact O-N 3.3Å
106	C	91.7	Very high	90.3	Very high	10 Å²	10	61.5 Å²	61.5	7%	0.068	35%	0.345	C	S	.	.	H	α-helix	trans	-63.6	-46.5	174	-167.6	0	0	0	0	112.2	S88 W102 S103 S104 A108 A109 A110 V176	S88-C106 WeakPolarHBondContact OG-CB 3.34Å; W102-C106 WeakPolarHBondContact O-CB 3.42Å; W102-C106 PolarHBondContact O-N 2.98Å; W102-C106 VanDerWaalsContact O-N 3.12Å; S103-C106 PolarHBondContact O-N 2.89Å; S104-C106 VanDerWaalsContact C-N 3.35Å; S104-C106 PolarHBondContact O-N 3.22Å; C106-A108 VanDerWaalsContact C-N 3.34Å; C106-A108 PolarHBondContact O-N 3.2Å; C106-A109 WeakPolarHBondContact O-CB 3.31Å; C106-A109 PolarHBondContact O-N 2.88Å; C106-A110 PolarHBondContact O-N 3.33Å; C106-V176 HydrophobicContact CB-CG1 4.27Å; C106-V176 HydrophobicContact CB-CG2 3.97Å
107	S	93.2	Very high	90.5	Very high	62 Å²	62	64 Å²	64	43%	0.434	35%	0.346	S	S	.	.	H	α-helix	trans	-62.7	-42.1	178	-63.2	0	0	0	0	111.6	S103 S104 A109 A110 I111	S103-S107 PolarHBondContact O-N 3.35Å; S103-S107 PolarHBondContact O-OG 3.46Å; S103-S107 VanDerWaalsContact O-OG 3.08Å; S104-S107 PolarHBondContact O-N 3.32Å; S107-A109 VanDerWaalsContact C-N 3.35Å; S107-A109 PolarHBondContact O-N 2.96Å; S107-A110 PolarHBondContact O-N 2.9Å; S107-I111 VanDerWaalsContact O-CG1 3.3Å; S107-I111 WeakPolarHBondContact O-CG1 3.41Å; S107-I111 PolarHBondContact O-N 3.18Å
108	A	94.3	Very high	90.7	Very high	33 Å²	33	60.9 Å²	60.9	27%	0.273	33%	0.333	S	S	.	.	H	α-helix	trans	-61.9	-42.3	175.1	0	0	0	0	0	111.6	L84 S104 T105 C106 A110 I111 C112	L84-A108 HydrophobicContact CD1-CB 3.85Å; L84-A108 HydrophobicContact CD2-CB 4.4Å; S104-A108 WeakPolarHBondContact O-CB 3.49Å; S104-A108 PolarHBondContact O-N 2.79Å; T105-A108 PolarHBondContact O-N 3.45Å; C106-A108 VanDerWaalsContact C-N 3.34Å; C106-A108 PolarHBondContact O-N 3.2Å; A108-A110 VanDerWaalsContact C-N 3.32Å; A108-A110 PolarHBondContact O-N 2.93Å; A108-I111 PolarHBondContact O-N 2.91Å; A108-C112 PolarHBondContact O-N 3.04Å; A108-C112 PolarHBondContact O-SG 3.41Å
109	A	92.8	Very high	90.6	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.008	34%	0.343	C	S	.	.	H	α-helix	trans	-59.8	-42	175.3	0	0	0	0	0	112.3	S81 L84 T105 C106 S107 L113	S81-A109 PolarHBondContact OG-O 2.99Å; S81-A109 VanDerWaalsContact OG-O 3.07Å; L84-A109 HydrophobicContact CB-CB 3.64Å; T105-A109 WeakPolarHBondContact O-CB 3.46Å; T105-A109 PolarHBondContact O-N 3.3Å; C106-A109 WeakPolarHBondContact O-CB 3.31Å; C106-A109 PolarHBondContact O-N 2.88Å; S107-A109 VanDerWaalsContact C-N 3.35Å; S107-A109 PolarHBondContact O-N 2.96Å; A109-L113 WeakPolarHBondContact O-CB 3.49Å; A109-L113 PolarHBondContact O-N 3.35Å
110	A	92.5	Very high	90.6	Very high	30 Å²	30	59.4 Å²	59.4	25%	0.248	33%	0.326	C	S	.	.	H	α-helix	trans	-66.6	-42.8	177	0	0	0	0	0	111.8	C106 S107 A108 C112 L113 L114	C106-A110 PolarHBondContact O-N 3.33Å; S107-A110 PolarHBondContact O-N 2.9Å; A108-A110 VanDerWaalsContact C-N 3.32Å; A108-A110 PolarHBondContact O-N 2.93Å; A110-C112 PolarHBondContact O-N 2.66Å; A110-L113 WeakPolarHBondContact O-CB 3.37Å; A110-L113 PolarHBondContact O-N 3.05Å; A110-L113 VanDerWaalsContact O-N 3.17Å; A110-L114 VanDerWaalsContact O-CG 3.27Å; A110-L114 WeakPolarHBondContact O-CG 3.37Å; A110-L114 PolarHBondContact O-N 3.15Å
111	I	94.8	Very high	90.3	Very high	87 Å²	87	51.5 Å²	51.5	45%	0.446	29%	0.293	S	S	.	.	H	α-helix	trans	-61.1	-45.9	175.6	-68.9	164.6	0	0	0	110.8	S107 A108 L113 L114 F115	S107-I111 VanDerWaalsContact O-CG1 3.3Å; S107-I111 WeakPolarHBondContact O-CG1 3.41Å; S107-I111 PolarHBondContact O-N 3.18Å; A108-I111 PolarHBondContact O-N 2.91Å; I111-L113 VanDerWaalsContact C-N 3.29Å; I111-L113 PolarHBondContact O-N 3.43Å; I111-L114 PolarHBondContact O-N 2.93Å; I111-L114 VanDerWaalsContact O-N 3.16Å; I111-F115 HydrophobicContact CG2-CD2 3.62Å; I111-F115 HydrophobicContact CG2-CE2 3.51Å; I111-F115 WeakPolarHBondContact O-CD2 3.3Å; I111-F115 PolarHBondContact O-N 3.26Å
112	C	91.2	Very high	89.9	Confident	24 Å²	24	52.2 Å²	52.2	16%	0.162	30%	0.301	C	S	.	.	H	α-helix	trans	-61	-38.7	174.8	-71.2	0	0	0	0	112.2	L77 A108 A110 Y116	L77-C112 HydrophobicContact CD2-CB 4.46Å; A108-C112 PolarHBondContact O-N 3.04Å; A108-C112 PolarHBondContact O-SG 3.41Å; A110-C112 PolarHBondContact O-N 2.66Å; C112-Y116 VanDerWaalsContact O-CB 3.29Å; C112-Y116 WeakPolarHBondContact O-CB 3.44Å; C112-Y116 PolarHBondContact O-N 2.75Å
113	L	92.1	Very high	89.6	Confident	27 Å²	27	54.2 Å²	54.2	14%	0.141	31%	0.313	C	S	.	.	H	α-helix	trans	-63.2	-42.7	174.3	175.8	65.9	0	0	0	111.5	A109 A110 I111 Y116 W117 Q165 R166 V169	A109-L113 WeakPolarHBondContact O-CB 3.49Å; A109-L113 PolarHBondContact O-N 3.35Å; A110-L113 WeakPolarHBondContact O-CB 3.37Å; A110-L113 PolarHBondContact O-N 3.05Å; A110-L113 VanDerWaalsContact O-N 3.17Å; I111-L113 VanDerWaalsContact C-N 3.29Å; I111-L113 PolarHBondContact O-N 3.43Å; L113-Y116 PolarHBondContact O-N 2.83Å; L113-W117 WeakPolarHBondContact O-CB 3.4Å; L113-W117 PolarHBondContact O-N 2.98Å; L113-Q165 HydrophobicContact CD1-CG 4.06Å; L113-R166 HydrophobicContact CD1-CG 3.95Å; L113-R166 HydrophobicContact CD2-CG 4.44Å; L113-V169 HydrophobicContact CB-CG2 4.28Å; L113-V169 HydrophobicContact CD2-CB 3.9Å; L113-V169 HydrophobicContact CD2-CG1 3.78Å; L113-V169 HydrophobicContact CD2-CG2 4.05Å
114	L	92.7	Very high	89.2	Confident	90 Å²	90	54.5 Å²	54.5	47%	0.471	31%	0.314	S	S	.	.	H	α-helix	trans	-66	-46	179.6	-68.1	168.9	0	0	0	111.2	A110 I111 Y116 W117 F118	A110-L114 VanDerWaalsContact O-CG 3.27Å; A110-L114 WeakPolarHBondContact O-CG 3.37Å; A110-L114 PolarHBondContact O-N 3.15Å; I111-L114 PolarHBondContact O-N 2.93Å; I111-L114 VanDerWaalsContact O-N 3.16Å; L114-Y116 VanDerWaalsContact C-N 3.31Å; L114-Y116 PolarHBondContact O-N 2.69Å; L114-W117 PolarHBondContact O-N 3.48Å; L114-F118 HydrophobicContact CB-CD2 4.3Å; L114-F118 HydrophobicContact CD2-CD2 4.47Å; L114-F118 HydrophobicContact CD2-CE2 3.88Å; L114-F118 VanDerWaalsContact O-CD2 3.29Å; L114-F118 WeakPolarHBondContact O-CD2 3.19Å; L114-F118 PolarHBondContact O-N 3.37Å
115	F	91.4	Very high	88.6	Confident	133 Å²	133	51.4 Å²	51.4	58%	0.583	29%	0.292	S	S	*	.	H	α-helix	trans	-62.1	-40.1	174.4	-81.7	-58.8	0	0	0	112.3	L77 I111 W117 G119 W120	L77-F115 HydrophobicContact CD2-CB 3.92Å; I111-F115 HydrophobicContact CG2-CD2 3.62Å; I111-F115 HydrophobicContact CG2-CE2 3.51Å; I111-F115 WeakPolarHBondContact O-CD2 3.3Å; I111-F115 PolarHBondContact O-N 3.26Å; F115-W117 VanDerWaalsContact C-N 3.27Å; F115-W117 PolarHBondContact O-N 2.92Å; F115-G119 WeakPolarHBondContact O-CA 3.35Å; F115-G119 PolarHBondContact O-N 3.41Å; F115-W120 PolarHBondContact O-N 2.99Å
116	Y	89.3	Confident	88.1	Confident	4 Å²	4	50 Å²	50	2%	0.016	28%	0.284	C	S	.	.	I	π-helix	trans	-61.6	-39.5	172.5	-176	-90.2	0	0	0	111.1	G74 L77 H78 C112 L113 L114 W120 S121 R162	G74-Y116 WeakPolarHBondContact O-CD2 3.37Å; G74-Y116 WeakPolarHBondContact O-CE2 3.46Å; L77-Y116 HydrophobicContact CB-CD2 4.07Å; H78-Y116 HydrophobicContact CB-CD2 4.15Å; H78-Y116 HydrophobicContact CB-CE2 3.93Å; C112-Y116 VanDerWaalsContact O-CB 3.29Å; C112-Y116 WeakPolarHBondContact O-CB 3.44Å; C112-Y116 PolarHBondContact O-N 2.75Å; L113-Y116 PolarHBondContact O-N 2.83Å; L114-Y116 VanDerWaalsContact C-N 3.31Å; L114-Y116 PolarHBondContact O-N 2.69Å; Y116-W120 HydrophobicContact CD2-CB 4.06Å; Y116-W120 HydrophobicContact CD2-CG 4.31Å; Y116-W120 HydrophobicContact CE2-CB 4.27Å; Y116-W120 AromaticContact CE2-CD1 3.38Å; Y116-W120 HydrophobicContact CE2-CG 4.09Å; Y116-W120 AromaticContact CZ-CD1 3.82Å; Y116-W120 CarbonylContact O-C 3.33Å; Y116-W120 WeakPolarHBondContact O-CB 3.48Å; Y116-W120 PolarHBondContact O-N 3.07Å; Y116-W120 VanDerWaalsContact O-N 3.15Å; Y116-S121 WeakPolarHBondContact O-CB 3.44Å; Y116-S121 PolarHBondContact O-N 2.86Å; Y116-R162 HydrophobicContact CE1-CG 4Å
117	W	87.6	Confident	87.7	Confident	114 Å²	114	51.8 Å²	51.8	43%	0.432	29%	0.291	S	S	.	.	I	π-helix	trans	-74.6	-50.9	-176.2	-154.9	51.6	0	0	0	113	L113 L114 F115 S121	L113-W117 WeakPolarHBondContact O-CB 3.4Å; L113-W117 PolarHBondContact O-N 2.98Å; L114-W117 PolarHBondContact O-N 3.48Å; F115-W117 VanDerWaalsContact C-N 3.27Å; F115-W117 PolarHBondContact O-N 2.92Å; W117-S121 WeakPolarHBondContact CA-OG 3.32Å; W117-S121 PolarHBondContact NE1-OG 3.21Å; W117-S121 WeakPolarHBondContact O-CB 3.29Å; W117-S121 PolarHBondContact O-OG 3.48Å
118	F	88	Confident	87.2	Confident	139 Å²	139	49.3 Å²	49.3	61%	0.61	27%	0.272	S	S	*	.	I	π-helix	trans	-76.4	-37.7	-178.3	-71	-68	0	0	0	113.1	L114	L114-F118 HydrophobicContact CB-CD2 4.3Å; L114-F118 HydrophobicContact CD2-CD2 4.47Å; L114-F118 HydrophobicContact CD2-CE2 3.88Å; L114-F118 VanDerWaalsContact O-CD2 3.29Å; L114-F118 WeakPolarHBondContact O-CD2 3.19Å; L114-F118 PolarHBondContact O-N 3.37Å
119	G	84.9	Confident	86.6	Confident	49 Å²	49	54.8 Å²	54.8	51%	0.505	29%	0.286	S	S	.	.	I	π-helix	trans	-86.4	-62.9	-178.7	0	0	0	0	0	111.9	F115	F115-G119 WeakPolarHBondContact O-CA 3.35Å; F115-G119 PolarHBondContact O-N 3.41Å
120	W	83.9	Confident	85.9	Confident	16 Å²	16	57 Å²	57	6%	0.061	30%	0.297	C	S	.	.	I	π-helix	trans	-85.4	-38.4	-168.2	-167.8	-104.7	0	0	0	113.9	W70 I71 F115 Y116 S122 D123 C125 S126	W70-W120 VanDerWaalsContact C-CZ3 3.45Å; W70-W120 HydrophobicContact CB-CH2 3.82Å; W70-W120 HydrophobicContact CB-CZ3 3.74Å; W70-W120 HydrophobicContact CE3-CZ3 4.26Å; W70-W120 WeakPolarHBondContact O-CH2 3.47Å; W70-W120 WeakPolarHBondContact O-CZ3 3.31Å; I71-W120 VanDerWaalsContact CA-CZ2 3.47Å; I71-W120 HydrophobicContact CB-CH2 4.43Å; I71-W120 HydrophobicContact CB-CZ2 4.23Å; I71-W120 HydrophobicContact CG1-CH2 4.01Å; I71-W120 HydrophobicContact CG1-CZ2 3.9Å; I71-W120 VanDerWaalsContact N-CH2 3.34Å; F115-W120 PolarHBondContact O-N 2.99Å; Y116-W120 HydrophobicContact CD2-CB 4.06Å; Y116-W120 HydrophobicContact CD2-CG 4.31Å; Y116-W120 HydrophobicContact CE2-CB 4.27Å; Y116-W120 AromaticContact CE2-CD1 3.38Å; Y116-W120 HydrophobicContact CE2-CG 4.09Å; Y116-W120 AromaticContact CZ-CD1 3.82Å; Y116-W120 CarbonylContact O-C 3.33Å; Y116-W120 WeakPolarHBondContact O-CB 3.48Å; Y116-W120 PolarHBondContact O-N 3.07Å; Y116-W120 VanDerWaalsContact O-N 3.15Å; W120-S122 PolarHBondContact O-N 3.49Å; W120-D123 VanDerWaalsContact O-CB 3.31Å; W120-D123 WeakPolarHBondContact O-CB 3.4Å; W120-D123 PolarHBondContact O-N 2.83Å; W120-C125 HydrophobicContact CH2-CB 4.13Å; W120-C125 HydrophobicContact CZ2-CB 4.37Å; W120-S126 WeakPolarHBondContact O-CB 3.29Å; W120-S126 PolarHBondContact O-OG 3.05Å
121	S	84.5	Confident	85	Confident	15 Å²	15	58 Å²	58	11%	0.105	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-18.5	-168.7	92.8	0	0	0	0	113.9	Y116 W117 R162	Y116-S121 WeakPolarHBondContact O-CB 3.44Å; Y116-S121 PolarHBondContact O-N 2.86Å; W117-S121 WeakPolarHBondContact CA-OG 3.32Å; W117-S121 PolarHBondContact NE1-OG 3.21Å; W117-S121 WeakPolarHBondContact O-CB 3.29Å; W117-S121 PolarHBondContact O-OG 3.48Å; S121-R162 PolarHBondContact O-NH1 2.95Å
122	S	80.3	Confident	83.5	Confident	92 Å²	92	59.2 Å²	59.2	64%	0.643	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-20.4	172	-52.5	0	0	0	0	112.4	W120	W120-S122 PolarHBondContact O-N 3.49Å
123	D	83.2	Confident	82.1	Confident	53 Å²	53	62.5 Å²	62.5	28%	0.283	32%	0.324	S	S	.	.	S	Bend	trans	-75.2	127.1	-177.8	-167	-52.9	0	0	0	110.3	W120 C125 S126	W120-D123 VanDerWaalsContact O-CB 3.31Å; W120-D123 WeakPolarHBondContact O-CB 3.4Å; W120-D123 PolarHBondContact O-N 2.83Å; D123-C125 PolarHBondContact O-N 3.26Å; D123-C125 WeakPolarHBondContact OD1-CA 3.38Å; D123-C125 WeakPolarHBondContact OD1-CB 3.48Å; D123-C125 PolarHBondContact OD1-N 3.44Å; D123-C125 PolarHBondContact OD1-SG 3.27Å; D123-S126 WeakPolarHBondContact O-CB 3.36Å; D123-S126 PolarHBondContact O-N 3.36Å; D123-S126 PolarHBondContact O-OG 2.99Å
124	P	80.4	Confident	80.4	Confident	54 Å²	54	65.3 Å²	65.3	35%	0.351	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-53.6	-33.7	174.7	-27.5	36.6	0	0	0	114	L49 S126 H127 Y128	L49-P124 HydrophobicContact CB-CB 3.74Å; P124-S126 PolarHBondContact O-N 2.89Å; P124-S126 VanDerWaalsContact O-N 3.13Å; P124-H127 PolarHBondContact O-N 3.49Å; P124-Y128 WeakPolarHBondContact O-CD2 3.32Å
125	C	81.2	Confident	78.8	Confident	13 Å²	13	67.6 Å²	67.6	9%	0.088	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-59	-25.1	176.7	-62.6	0	0	0	0	112.6	L49 W120 D123 H127 Y128	L49-C125 WeakPolarHBondContact CD1-SG 3.19Å; W120-C125 HydrophobicContact CH2-CB 4.13Å; W120-C125 HydrophobicContact CZ2-CB 4.37Å; D123-C125 PolarHBondContact O-N 3.26Å; D123-C125 WeakPolarHBondContact OD1-CA 3.38Å; D123-C125 WeakPolarHBondContact OD1-CB 3.48Å; D123-C125 PolarHBondContact OD1-N 3.44Å; D123-C125 PolarHBondContact OD1-SG 3.27Å; C125-H127 PolarHBondContact O-N 3.35Å; C125-Y128 PolarHBondContact O-N 3.36Å
126	S	81.3	Confident	77.3	Confident	5 Å²	5	67.4 Å²	67.4	4%	0.035	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-69.1	-3.2	-177.5	70.6	0	0	0	0	114.8	W120 D123 P124 R162	W120-S126 WeakPolarHBondContact O-CB 3.29Å; W120-S126 PolarHBondContact O-OG 3.05Å; D123-S126 WeakPolarHBondContact O-CB 3.36Å; D123-S126 PolarHBondContact O-N 3.36Å; D123-S126 PolarHBondContact O-OG 2.99Å; P124-S126 PolarHBondContact O-N 2.89Å; P124-S126 VanDerWaalsContact O-N 3.13Å; S126-R162 PolarHBondContact O-NH2 3.48Å; S126-R162 VanDerWaalsContact O-NH2 3.17Å; S126-R162 PolarHBondContact OG-NH2 3.3Å
127	H	83.4	Confident	75.7	Confident	47 Å²	47	67.5 Å²	67.5	22%	0.218	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-100.6	0.8	171.3	-67.7	-72.5	0	0	0	113	P124 C125 R156 D158 R162	P124-H127 PolarHBondContact O-N 3.49Å; C125-H127 PolarHBondContact O-N 3.35Å; H127-R156 PolarHBondContact O-N 3.23Å; H127-D158 WeakPolarHBondContact CA-OD2 3.47Å; H127-R162 PolarHBondContact CE1-NH2 3.03Å; H127-R162 PolarHBondContact NE2-NH2 2.82Å
128	Y	82.3	Confident	74.1	Confident	9 Å²	9	64.5 Å²	64.5	4%	0.035	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	142.2	-176.5	-67.6	-96.9	0	0	0	110.6	L49 K52 C53 I56 P124 C125 L153 V154 H155	L49-Y128 HydrophobicContact CB-CE2 4.48Å; L49-Y128 HydrophobicContact CD2-CD1 4.43Å; L49-Y128 HydrophobicContact CD2-CD2 3.42Å; L49-Y128 VanDerWaalsContact CD2-CD2 3.42Å; L49-Y128 HydrophobicContact CD2-CE1 4.26Å; L49-Y128 HydrophobicContact CD2-CE2 3.23Å; L49-Y128 HydrophobicContact CD2-CG 4.02Å; L49-Y128 HydrophobicContact CG-CE2 4.44Å; K52-Y128 WeakPolarHBondContact CA-OH 3.29Å; C53-Y128 PolarHBondContact N-OH 2.96Å; C53-Y128 VanDerWaalsContact O-CE1 3.22Å; C53-Y128 WeakPolarHBondContact O-CE1 2.79Å; C53-Y128 PolarHBondContact O-OH 3.32Å; I56-Y128 HydrophobicContact CD1-CD1 4.31Å; I56-Y128 HydrophobicContact CD1-CE1 3.59Å; I56-Y128 HydrophobicContact CG1-CE1 4.17Å; P124-Y128 WeakPolarHBondContact O-CD2 3.32Å; C125-Y128 PolarHBondContact O-N 3.36Å; Y128-L153 HydrophobicContact CD1-CB 3.92Å; Y128-L153 HydrophobicContact CG-CB 4.36Å; Y128-V154 WeakPolarHBondContact CA-O 3.16Å; Y128-H155 HydrophobicContact CD1-CB 4.08Å; Y128-H155 HydrophobicContact CE1-CB 3.71Å; Y128-H155 AromaticContact CZ-CD2 3.77Å
129	R	80.5	Confident	72.7	Confident	149 Å²	149	66.7 Å²	66.7	56%	0.562	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.1	137.7	173.8	-169.1	171.9	-178.3	146.2	-4.1	109.5	E131 L153 V154	R129-E131 PolarHBondContact O-N 3.03Å; R129-L153 WeakPolarHBondContact O-CA 3.43Å; R129-V154 PolarHBondContact N-O 2.92Å; R129-V154 PolarHBondContact O-N 2.96Å
130	L	78.3	Confident	71.5	Confident	46 Å²	46	66.9 Å²	66.9	24%	0.241	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	113.2	168.6	-162.2	80.7	0	0	0	108.8	S68 T132 V151	S68-L130 WeakPolarHBondContact OG-CD2 3.44Å; L130-T132 HydrophobicContact CD2-CG2 3.81Å; L130-T132 HydrophobicContact CG-CG2 4.23Å; L130-V151 HydrophobicContact CD1-CB 4.33Å; L130-V151 HydrophobicContact CD1-CG1 3.25Å; L130-V151 HydrophobicContact CD1-CG2 4.36Å
131	E	73.4	Confident	70.3	Confident	53 Å²	53	75 Å²	75	25%	0.248	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	100	173.8	-142.8	94.9	-164.4	0	0	107.4	R129 K136 V137 V152 V154	R129-E131 PolarHBondContact O-N 3.03Å; E131-K136 IonicContact OE1-NZ 3.95Å; E131-V137 HydrophobicContact CB-CG2 4.47Å; E131-V152 PolarHBondContact N-O 2.93Å; E131-V154 HydrophobicContact CB-CG2 4.03Å; E131-V154 HydrophobicContact CG-CG2 4.25Å; E131-V154 WeakPolarHBondContact OE2-CB 3.39Å; E131-V154 VanDerWaalsContact OE2-CG2 3.22Å; E131-V154 WeakPolarHBondContact OE2-CG2 3.4Å
132	T	63.8	Low	69	Low	112 Å²	112	75.3 Å²	75.3	69%	0.687	39%	0.388	S	S	*	.			trans	-87.2	-10.5	177.4	43.4	0	0	0	0	113.4	L130 L134	L130-T132 HydrophobicContact CD2-CG2 3.81Å; L130-T132 HydrophobicContact CG-CG2 4.23Å; T132-L134 PolarHBondContact O-N 2.97Å
133	D	62.4	Low	68	Low	93 Å²	93	73.1 Å²	73.1	50%	0.497	38%	0.38	S	S	.	.			trans	-74.7	91.3	178.6	-101.2	-24.6	0	0	0	110.2	D135 K136 V137	D133-D135 PolarHBondContact O-N 3.32Å; D133-K136 HydrophobicContact CB-CB 4.43Å; D133-K136 HydrophobicContact CB-CG 4.44Å; D133-K136 PolarHBondContact O-N 3.32Å; D133-V137 WeakPolarHBondContact O-CG2 3.38Å; D133-V137 PolarHBondContact O-N 3.49Å
134	L	56.8	Low	66.7	Low	86 Å²	86	78.8 Å²	78.8	45%	0.45	41%	0.405	S	S	.	.	H	α-helix	trans	-50.7	-30.7	175.5	-71.7	167	0	0	0	112.2	T132 K136 V137 A138 L147	T132-L134 PolarHBondContact O-N 2.97Å; L134-K136 PolarHBondContact O-N 2.89Å; L134-V137 CarbonylContact O-C 3.53Å; L134-V137 PolarHBondContact O-N 3.45Å; L134-A138 WeakPolarHBondContact O-CA 3.39Å; L134-A138 WeakPolarHBondContact O-CB 3.3Å; L134-A138 PolarHBondContact O-N 3.39Å; L134-L147 HydrophobicContact CD2-CB 4.04Å
135	D	57.5	Low	65.4	Low	137 Å²	137	81.5 Å²	81.5	73%	0.733	43%	0.426	S	S	*	.	H	α-helix	trans	-67.5	-35.4	179.1	-68.3	-27.5	0	0	0	113.3	D133 V137	D133-D135 PolarHBondContact O-N 3.32Å; D135-V137 VanDerWaalsContact C-N 3.34Å
136	K	60.4	Low	64.2	Low	130 Å²	130	86 Å²	86	57%	0.565	44%	0.441	S	S	*	.	H	α-helix	trans	-73.5	-32.6	174.9	-76.8	-170.9	177.7	177.1	0	111.7	E131 D133 L134 K139	E131-K136 IonicContact OE1-NZ 3.95Å; D133-K136 HydrophobicContact CB-CB 4.43Å; D133-K136 HydrophobicContact CB-CG 4.44Å; D133-K136 PolarHBondContact O-N 3.32Å; L134-K136 PolarHBondContact O-N 2.89Å; K136-K139 WeakPolarHBondContact O-CB 3.29Å
137	V	56.8	Low	63	Low	5 Å²	5	86.3 Å²	86.3	3%	0.03	44%	0.442	C	S	.	.	H	α-helix	trans	-83.5	-29.9	-179.3	-163	0	0	0	0	111.6	E131 D133 L134 D135 K139 L140 L147 V152	E131-V137 HydrophobicContact CB-CG2 4.47Å; D133-V137 WeakPolarHBondContact O-CG2 3.38Å; D133-V137 PolarHBondContact O-N 3.49Å; L134-V137 CarbonylContact O-C 3.53Å; L134-V137 PolarHBondContact O-N 3.45Å; D135-V137 VanDerWaalsContact C-N 3.34Å; V137-K139 PolarHBondContact O-N 3.38Å; V137-L140 HydrophobicContact CB-CD1 4.46Å; V137-L140 HydrophobicContact CG1-CD1 3.82Å; V137-L140 WeakPolarHBondContact O-CB 3.32Å; V137-L140 PolarHBondContact O-N 2.75Å; V137-L147 HydrophobicContact CB-CD2 3.68Å; V137-L147 HydrophobicContact CG1-CD2 3.11Å; V137-V152 HydrophobicContact CG1-CB 4.21Å; V137-V152 HydrophobicContact CG1-CG1 4.16Å; V137-V152 HydrophobicContact CG1-CG2 3.5Å; V137-V152 HydrophobicContact CG2-CB 4.2Å; V137-V152 HydrophobicContact CG2-CG1 4.27Å; V137-V152 HydrophobicContact CG2-CG2 4.23Å
138	A	52.7	Low	61.7	Low	51 Å²	51	92.8 Å²	92.8	42%	0.421	47%	0.469	S	S	.	.	H	α-helix	trans	-61.5	-27.7	172.7	0	0	0	0	0	112	L134 L140 E141 L147	L134-A138 WeakPolarHBondContact O-CA 3.39Å; L134-A138 WeakPolarHBondContact O-CB 3.3Å; L134-A138 PolarHBondContact O-N 3.39Å; A138-L140 PolarHBondContact O-N 2.87Å; A138-E141 PolarHBondContact O-N 3.49Å; A138-L147 HydrophobicContact CB-CD1 4.25Å
139	K	58.1	Low	60.6	Low	185 Å²	185	94.5 Å²	94.5	80%	0.804	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-12.5	172.5	-143.6	176.4	-172.9	179.8	0	113.7	K136 V137 E141	K136-K139 WeakPolarHBondContact O-CB 3.29Å; V137-K139 PolarHBondContact O-N 3.38Å; K139-E141 VanDerWaalsContact C-N 3.29Å
140	L	60.8	Low	60	Low	54 Å²	54	88.1 Å²	88.1	28%	0.283	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	11	176.8	-61.6	160.5	0	0	0	112.8	I23 I55 V137 A138 L142	I23-L140 HydrophobicContact CD1-CB 4.26Å; I23-L140 HydrophobicContact CD1-CD2 3.53Å; I23-L140 HydrophobicContact CD1-CG 4.39Å; I23-L140 HydrophobicContact CG1-CD2 4.31Å; I55-L140 HydrophobicContact CD1-CD1 4.13Å; I55-L140 HydrophobicContact CD1-CD2 3.82Å; I55-L140 HydrophobicContact CG2-CD1 4.28Å; V137-L140 HydrophobicContact CB-CD1 4.46Å; V137-L140 HydrophobicContact CG1-CD1 3.82Å; V137-L140 WeakPolarHBondContact O-CB 3.32Å; V137-L140 PolarHBondContact O-N 2.75Å; A138-L140 PolarHBondContact O-N 2.87Å; L140-L142 HydrophobicContact CB-CD1 3.75Å; L140-L142 HydrophobicContact CD1-CD1 4.45Å; L140-L142 PolarHBondContact O-N 3.37Å
141	E	58	Low	59.8	Low	187 Å²	187	87.3 Å²	87.3	87%	0.874	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	16	178.1	-58	-172.1	151	0	0	115	A138 K139 G143	A138-E141 PolarHBondContact O-N 3.49Å; K139-E141 VanDerWaalsContact C-N 3.29Å; E141-G143 PolarHBondContact O-N 3.42Å
142	L	58.3	Low	60	Low	20 Å²	20	85 Å²	85	11%	0.105	45%	0.448	C	S	.	.			trans	-68.5	120.4	169	-78.4	126.7	0	0	0	107.7	I25 V57 L140 E144 L147	I25-L142 HydrophobicContact CD1-CD2 3.71Å; I25-L142 HydrophobicContact CG1-CD2 4.2Å; V57-L142 HydrophobicContact CG1-CD2 4.19Å; V57-L142 HydrophobicContact CG2-CD1 4.06Å; V57-L142 HydrophobicContact CG2-CD2 4.42Å; L140-L142 HydrophobicContact CB-CD1 3.75Å; L140-L142 HydrophobicContact CD1-CD1 4.45Å; L140-L142 PolarHBondContact O-N 3.37Å; L142-E144 PolarHBondContact O-N 2.89Å; L142-L147 HydrophobicContact CB-CD1 4.08Å; L142-L147 HydrophobicContact CB-CD2 4.02Å; L142-L147 HydrophobicContact CB-CG 3.84Å; L142-L147 WeakPolarHBondContact O-CD1 3.38Å
143	G	58.5	Low	60.9	Low	46 Å²	46	79.7 Å²	79.7	47%	0.474	42%	0.416	S	S	.	.			trans	-48.9	134	-177	0	0	0	0	0	112.1	E141 S145 R146 L147	E141-G143 PolarHBondContact O-N 3.42Å; G143-S145 PolarHBondContact O-N 2.83Å; G143-R146 PolarHBondContact O-N 3.44Å; G143-L147 PolarHBondContact O-N 2.97Å
144	E	56.6	Low	61.8	Low	172 Å²	172	77.2 Å²	77.2	80%	0.804	40%	0.404	S	S	*	.	H	α-helix	trans	-49.6	-31.6	-169.1	-70.7	-171.6	154.6	0	0	114.5	L142	L142-E144 PolarHBondContact O-N 2.89Å
145	S	53.4	Low	63	Low	112 Å²	112	76 Å²	76	78%	0.783	40%	0.396	S	S	*	.	H	α-helix	trans	-71.3	-32.2	178.4	-53.9	0	0	0	0	113.9	G143	G143-S145 PolarHBondContact O-N 2.83Å
146	R	55.8	Low	64	Low	108 Å²	108	76.5 Å²	76.5	41%	0.408	39%	0.387	S	S	.	.	H	α-helix	trans	-73.5	-38.9	177.8	-75.1	-179.8	170.1	-122.1	0.6	111.1	D27 E59 G143 K148 S149 A150	D27-R146 IonicContact OD2-NH1 3.63Å; D27-R146 IonicContact OD2-NH2 3.87Å; E59-R146 VanDerWaalsContact CD-NH1 3.27Å; E59-R146 VanDerWaalsContact OE1-CD 3.3Å; E59-R146 WeakPolarHBondContact OE1-CD 3.37Å; E59-R146 IonicContact OE1-CZ 3.59Å; E59-R146 IonicContact OE1-NE 3.8Å; E59-R146 IonicContact OE1-NH1 2.74Å; E59-R146 PolarHBondContact OE1-NH1 2.97Å; E59-R146 IonicContact OE2-CZ 3.82Å; E59-R146 IonicContact OE2-NH1 3.02Å; E59-R146 PolarHBondContact OE2-NH1 3.42Å; G143-R146 PolarHBondContact O-N 3.44Å; R146-K148 PolarHBondContact O-N 2.96Å; R146-S149 PolarHBondContact O-N 3.26Å; R146-A150 VanDerWaalsContact O-CB 3.29Å; R146-A150 WeakPolarHBondContact O-CB 3.42Å; R146-A150 PolarHBondContact O-N 2.86Å
147	L	55.6	Low	64.7	Low	11 Å²	11	75.2 Å²	75.2	6%	0.058	39%	0.387	C	S	.	.	H	α-helix	trans	-62.6	-36.5	-179.4	-78	165.9	0	0	0	114.4	L134 V137 A138 L142 G143 S149 A150	L134-L147 HydrophobicContact CD2-CB 4.04Å; V137-L147 HydrophobicContact CB-CD2 3.68Å; V137-L147 HydrophobicContact CG1-CD2 3.11Å; A138-L147 HydrophobicContact CB-CD1 4.25Å; L142-L147 HydrophobicContact CB-CD1 4.08Å; L142-L147 HydrophobicContact CB-CD2 4.02Å; L142-L147 HydrophobicContact CB-CG 3.84Å; L142-L147 WeakPolarHBondContact O-CD1 3.38Å; G143-L147 PolarHBondContact O-N 2.97Å; L147-S149 PolarHBondContact O-N 3.16Å; L147-S149 VanDerWaalsContact O-N 3.09Å; L147-A150 PolarHBondContact O-N 3.39Å
148	K	56	Low	65.7	Low	182 Å²	182	76 Å²	76	79%	0.791	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-16.6	-175.7	-138.6	176.3	-170.8	176.2	0	113.6	R146	R146-K148 PolarHBondContact O-N 2.96Å
149	S	59.2	Low	67.1	Low	45 Å²	45	77 Å²	77	32%	0.315	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-18.5	-178.4	-175.9	0	0	0	0	113.2	K61 R146 L147	K61-S149 WeakPolarHBondContact CE-OG 3.49Å; K61-S149 WeakPolarHBondContact CG-OG 3.31Å; R146-S149 PolarHBondContact O-N 3.26Å; L147-S149 PolarHBondContact O-N 3.16Å; L147-S149 VanDerWaalsContact O-N 3.09Å
150	A	67	Low	68.3	Low	16 Å²	16	72.3 Å²	72.3	13%	0.132	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-92	136.1	-169.4	0	0	0	0	0	111.7	V57 I58 E59 R146 L147	V57-A150 HydrophobicContact CG1-CB 3.73Å; I58-A150 CarbonylContact O-C 3.56Å; I58-A150 VanDerWaalsContact O-CA 3.23Å; I58-A150 WeakPolarHBondContact O-CA 3.44Å; E59-A150 HydrophobicContact CG-CB 4.32Å; R146-A150 VanDerWaalsContact O-CB 3.29Å; R146-A150 WeakPolarHBondContact O-CB 3.42Å; R146-A150 PolarHBondContact O-N 2.86Å; L147-A150 PolarHBondContact O-N 3.39Å
151	V	73.7	Confident	69.4	Low	28 Å²	28	72.9 Å²	72.9	17%	0.17	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.2	172.9	159.3	0	0	0	0	108.4	I58 L130 L153	I58-V151 HydrophobicContact CB-CB 4.36Å; I58-V151 HydrophobicContact CD1-CG1 4.41Å; I58-V151 PolarHBondContact N-O 3.17Å; I58-V151 PolarHBondContact O-N 3Å; L130-V151 HydrophobicContact CD1-CB 4.33Å; L130-V151 HydrophobicContact CD1-CG1 3.25Å; L130-V151 HydrophobicContact CD1-CG2 4.36Å; V151-L153 HydrophobicContact CG1-CG 4.47Å
152	V	79	Confident	70.7	Confident	5 Å²	5	64.9 Å²	64.9	3%	0.03	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.3	178.8	-177.3	0	0	0	0	110.8	I55 V57 E131 V137 V154	I55-V152 HydrophobicContact CG2-CG1 3.9Å; V57-V152 HydrophobicContact CG1-CG2 4.24Å; V57-V152 HydrophobicContact CG2-CG1 4.42Å; V57-V152 HydrophobicContact CG2-CG2 4.05Å; E131-V152 PolarHBondContact N-O 2.93Å; V137-V152 HydrophobicContact CG1-CB 4.21Å; V137-V152 HydrophobicContact CG1-CG1 4.16Å; V137-V152 HydrophobicContact CG1-CG2 3.5Å; V137-V152 HydrophobicContact CG2-CB 4.2Å; V137-V152 HydrophobicContact CG2-CG1 4.27Å; V137-V152 HydrophobicContact CG2-CG2 4.23Å; V152-V154 HydrophobicContact CG1-CG2 4.34Å
153	L	82.3	Confident	72.2	Confident	1 Å²	1	71.9 Å²	71.9	1%	0.005	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	123.1	178	-66.4	171.5	0	0	0	108.9	L45 I55 I56 I58 T67 I71 Y128 R129 V151	L45-L153 HydrophobicContact CD1-CD1 4.19Å; I55-L153 WeakPolarHBondContact CA-O 3.45Å; I56-L153 HydrophobicContact CB-CB 4.2Å; I56-L153 PolarHBondContact N-O 3.49Å; I56-L153 PolarHBondContact O-N 3.12Å; I58-L153 HydrophobicContact CD1-CD1 3.53Å; I58-L153 HydrophobicContact CD1-CG 4.28Å; I58-L153 HydrophobicContact CG1-CD1 4.33Å; T67-L153 HydrophobicContact CG2-CD1 4.08Å; T67-L153 HydrophobicContact CG2-CD2 4.46Å; I71-L153 HydrophobicContact CD1-CD2 3.42Å; I71-L153 VanDerWaalsContact CD1-CD2 3.42Å; Y128-L153 HydrophobicContact CD1-CB 3.92Å; Y128-L153 HydrophobicContact CG-CB 4.36Å; R129-L153 WeakPolarHBondContact O-CA 3.43Å; V151-L153 HydrophobicContact CG1-CG 4.47Å
154	V	81.5	Confident	73.7	Confident	41 Å²	41	75.3 Å²	75.3	25%	0.248	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	127.7	175.2	179.7	0	0	0	0	109.3	P54 Y128 R129 E131 V152 R156	P54-V154 WeakPolarHBondContact O-CA 3.34Å; Y128-V154 WeakPolarHBondContact CA-O 3.16Å; R129-V154 PolarHBondContact N-O 2.92Å; R129-V154 PolarHBondContact O-N 2.96Å; E131-V154 HydrophobicContact CB-CG2 4.03Å; E131-V154 HydrophobicContact CG-CG2 4.25Å; E131-V154 WeakPolarHBondContact OE2-CB 3.39Å; E131-V154 VanDerWaalsContact OE2-CG2 3.22Å; E131-V154 WeakPolarHBondContact OE2-CG2 3.4Å; V152-V154 HydrophobicContact CG1-CG2 4.34Å; V154-R156 PolarHBondContact O-N 3.37Å
155	H	81.6	Confident	75.3	Confident	59 Å²	59	67.2 Å²	67.2	27%	0.273	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	125.6	178.4	-175.9	-65.8	0	0	0	110.2	P54 Y128	P54-H155 PolarHBondContact O-N 3.31Å; Y128-H155 HydrophobicContact CD1-CB 4.08Å; Y128-H155 HydrophobicContact CE1-CB 3.71Å; Y128-H155 AromaticContact CZ-CD2 3.77Å
156	R	77.9	Confident	77.1	Confident	149 Å²	149	66.8 Å²	66.8	56%	0.562	31%	0.307	S	S	*	.			trans	-135.9	144.4	175.3	-166.1	169.2	-177.7	174.8	0.4	111.3	H127 V154 D158	H127-R156 PolarHBondContact O-N 3.23Å; V154-R156 PolarHBondContact O-N 3.37Å; R156-D158 PolarHBondContact O-N 3.44Å; R156-D158 VanDerWaalsContact O-N 3.12Å
157	N	74.8	Confident	78.9	Confident	103 Å²	103	64.2 Å²	64.2	55%	0.551	31%	0.31	S	S	*	.			trans	-77.5	103.3	179.9	-133.7	-3.9	0	0	0	110.5	L159 P160	N157-L159 VanDerWaalsContact C-N 3.33Å; N157-L159 PolarHBondContact O-N 3.45Å; N157-P160 WeakPolarHBondContact O-CD 3.49Å
158	D	78.9	Confident	80.7	Confident	22 Å²	22	65.1 Å²	65.1	12%	0.118	31%	0.314	C	S	.	.			trans	-85	2.9	-177	-81.2	-59.2	0	0	0	115.4	H127 R156 P160 R161 R162	H127-D158 WeakPolarHBondContact CA-OD2 3.47Å; R156-D158 PolarHBondContact O-N 3.44Å; R156-D158 VanDerWaalsContact O-N 3.12Å; D158-P160 VanDerWaalsContact C-CD 3.49Å; D158-R161 PolarHBondContact O-N 3.45Å; D158-R162 WeakPolarHBondContact O-CG 3.45Å; D158-R162 PolarHBondContact O-N 3.3Å; D158-R162 VanDerWaalsContact O-N 3.11Å
159	L	81.2	Confident	82.4	Confident	72 Å²	72	56.8 Å²	56.8	38%	0.377	28%	0.279	S	S	.	.	H	α-helix	trans	-49.4	-49.2	176.8	-68.8	173.2	0	0	0	115.2	N157 R161 R162 R163	N157-L159 VanDerWaalsContact C-N 3.33Å; N157-L159 PolarHBondContact O-N 3.45Å; L159-R161 VanDerWaalsContact C-N 3.31Å; L159-R161 PolarHBondContact O-N 3.47Å; L159-R162 PolarHBondContact O-N 2.85Å; L159-R163 WeakPolarHBondContact O-CG 3.27Å; L159-R163 PolarHBondContact O-N 3.25Å
160	P	85	Confident	84.1	Confident	85 Å²	85	59 Å²	59	55%	0.552	29%	0.29	S	S	*	.	H	α-helix	trans	-63.7	-38.9	-177.9	23.6	-32.9	0	0	0	111.9	N157 D158 R162 R163 F164	N157-P160 WeakPolarHBondContact O-CD 3.49Å; D158-P160 VanDerWaalsContact C-CD 3.49Å; P160-R162 PolarHBondContact O-N 3.42Å; P160-R163 PolarHBondContact O-N 3.21Å; P160-F164 WeakPolarHBondContact O-CB 3.32Å; P160-F164 PolarHBondContact O-N 2.87Å
161	R	83.7	Confident	85.4	Confident	67 Å²	67	62 Å²	62	25%	0.253	31%	0.307	S	S	.	.	H	α-helix	trans	-64.3	-41.5	178.6	179	178.2	173.5	-163.7	0.8	112	N75 H78 D158 L159 Q165	N75-R161 VanDerWaalsContact OD1-CZ 3.23Å; N75-R161 PolarHBondContact OD1-NH1 2.83Å; N75-R161 PolarHBondContact OD1-NH2 2.93Å; H78-R161 PolarHBondContact CE1-NE 3.3Å; H78-R161 PolarHBondContact ND1-NE 2.97Å; H78-R161 PolarHBondContact ND1-NH2 3.1Å; H78-R161 WeakPolarHBondContact NE2-CG 3.47Å; H78-R161 PolarHBondContact NE2-O 3.03Å; D158-R161 PolarHBondContact O-N 3.45Å; L159-R161 VanDerWaalsContact C-N 3.31Å; L159-R161 PolarHBondContact O-N 3.47Å; R161-Q165 PolarHBondContact O-N 3.46Å
162	R	85.2	Confident	86.3	Confident	19 Å²	19	60.7 Å²	60.7	7%	0.072	30%	0.299	C	S	.	.	H	α-helix	trans	-67.6	-42.7	176.6	-63.7	-177	-167.6	-172	6.5	111.8	Y116 S121 S126 H127 D158 L159 P160 F164 Q165 R166	Y116-R162 HydrophobicContact CE1-CG 4Å; S121-R162 PolarHBondContact O-NH1 2.95Å; S126-R162 PolarHBondContact O-NH2 3.48Å; S126-R162 VanDerWaalsContact O-NH2 3.17Å; S126-R162 PolarHBondContact OG-NH2 3.3Å; H127-R162 PolarHBondContact CE1-NH2 3.03Å; H127-R162 PolarHBondContact NE2-NH2 2.82Å; D158-R162 WeakPolarHBondContact O-CG 3.45Å; D158-R162 PolarHBondContact O-N 3.3Å; D158-R162 VanDerWaalsContact O-N 3.11Å; L159-R162 PolarHBondContact O-N 2.85Å; P160-R162 PolarHBondContact O-N 3.42Å; R162-F164 VanDerWaalsContact C-N 3.33Å; R162-F164 PolarHBondContact O-N 3.46Å; R162-Q165 PolarHBondContact O-N 3.39Å; R162-R166 WeakPolarHBondContact O-CG 3.25Å; R162-R166 PolarHBondContact O-N 3.47Å; R162-R166 VanDerWaalsContact O-N 3.08Å
163	R	88.3	Confident	86.9	Confident	166 Å²	166	62 Å²	62	63%	0.626	31%	0.309	S	S	*	.	H	α-helix	trans	-60.8	-43.3	176.2	-74.4	179.5	-173	141.3	1.4	111.4	L159 P160 R166 A167	L159-R163 WeakPolarHBondContact O-CG 3.27Å; L159-R163 PolarHBondContact O-N 3.25Å; P160-R163 PolarHBondContact O-N 3.21Å; R163-R166 PolarHBondContact O-N 3.4Å; R163-A167 WeakPolarHBondContact O-CB 3.48Å; R163-A167 PolarHBondContact O-N 2.89Å
164	F	91.3	Very high	87.4	Confident	119 Å²	119	64 Å²	64	52%	0.522	33%	0.325	S	S	.	.	H	α-helix	trans	-59.8	-49.9	177.6	178.5	-99.6	0	0	0	112.2	V82 P160 R162 R166 A167 L168	V82-F164 HydrophobicContact CG1-CE1 4.44Å; V82-F164 HydrophobicContact CG2-CE1 4.42Å; P160-F164 WeakPolarHBondContact O-CB 3.32Å; P160-F164 PolarHBondContact O-N 2.87Å; R162-F164 VanDerWaalsContact C-N 3.33Å; R162-F164 PolarHBondContact O-N 3.46Å; F164-R166 PolarHBondContact O-N 2.86Å; F164-A167 PolarHBondContact O-N 3.31Å; F164-L168 HydrophobicContact CE1-CD2 4.29Å; F164-L168 WeakPolarHBondContact O-CB 3.41Å; F164-L168 PolarHBondContact O-N 2.92Å
165	Q	90.6	Very high	87.9	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-59	-46.2	178.2	-174.8	-167.9	-4.1	0	0	111.7	H78 S81 V82 L113 R161 R162 L168 V169	H78-Q165 PolarHBondContact CD2-OE1 3.2Å; S81-Q165 PolarHBondContact OG-NE2 3.32Å; V82-Q165 HydrophobicContact CG2-CB 4.42Å; V82-Q165 HydrophobicContact CG2-CG 4.23Å; L113-Q165 HydrophobicContact CD1-CG 4.06Å; R161-Q165 PolarHBondContact O-N 3.46Å; R162-Q165 PolarHBondContact O-N 3.39Å; Q165-L168 PolarHBondContact O-N 3.48Å; Q165-V169 WeakPolarHBondContact O-CG2 3.49Å; Q165-V169 PolarHBondContact O-N 2.91Å
166	R	91.6	Very high	88.3	Confident	103 Å²	103	61.4 Å²	61.4	39%	0.389	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-49.9	178.4	-72	-176.3	-160.3	169.9	14.3	111.5	L113 R162 R163 F164 L168 V169 T170	L113-R166 HydrophobicContact CD1-CG 3.95Å; L113-R166 HydrophobicContact CD2-CG 4.44Å; R162-R166 WeakPolarHBondContact O-CG 3.25Å; R162-R166 PolarHBondContact O-N 3.47Å; R162-R166 VanDerWaalsContact O-N 3.08Å; R163-R166 PolarHBondContact O-N 3.4Å; F164-R166 PolarHBondContact O-N 2.86Å; R166-L168 VanDerWaalsContact C-N 3.25Å; R166-L168 PolarHBondContact O-N 3.24Å; R166-V169 PolarHBondContact O-N 2.73Å; R166-T170 WeakPolarHBondContact O-CB 3.23Å; R166-T170 PolarHBondContact O-N 2.95Å; R166-T170 PolarHBondContact O-OG1 3.31Å
167	A	93.4	Very high	88.9	Confident	55 Å²	55	59 Å²	59	46%	0.455	31%	0.309	S	S	.	.	H	α-helix	trans	-56	-43.5	179	0	0	0	0	0	111.3	R163 F164 T170 V171	R163-A167 WeakPolarHBondContact O-CB 3.48Å; R163-A167 PolarHBondContact O-N 2.89Å; F164-A167 PolarHBondContact O-N 3.31Å; A167-T170 PolarHBondContact O-N 3.49Å; A167-V171 VanDerWaalsContact O-CG2 3.3Å; A167-V171 WeakPolarHBondContact O-CG2 3.32Å; A167-V171 PolarHBondContact O-N 2.9Å
168	L	93	Very high	89.6	Confident	30 Å²	30	57.5 Å²	57.5	16%	0.157	30%	0.3	C	S	.	.	H	α-helix	trans	-65	-45.3	-179.9	-170.6	67	0	0	0	112.7	V82 I86 I89 F164 Q165 R166 T170 V171 A172	V82-L168 HydrophobicContact CB-CD2 4.13Å; V82-L168 HydrophobicContact CG1-CD2 3.72Å; V82-L168 HydrophobicContact CG2-CD2 4.19Å; I86-L168 HydrophobicContact CD1-CD2 4.42Å; I86-L168 HydrophobicContact CG1-CD1 4.46Å; I86-L168 HydrophobicContact CG1-CD2 4.06Å; I89-L168 HydrophobicContact CD1-CD1 4.28Å; F164-L168 HydrophobicContact CE1-CD2 4.29Å; F164-L168 WeakPolarHBondContact O-CB 3.41Å; F164-L168 PolarHBondContact O-N 2.92Å; Q165-L168 PolarHBondContact O-N 3.48Å; R166-L168 VanDerWaalsContact C-N 3.25Å; R166-L168 PolarHBondContact O-N 3.24Å; L168-T170 VanDerWaalsContact C-N 3.32Å; L168-T170 PolarHBondContact O-N 3.42Å; L168-V171 PolarHBondContact O-N 3.12Å; L168-A172 WeakPolarHBondContact O-CB 3.27Å; L168-A172 PolarHBondContact O-N 3.3Å
169	V	92	Very high	90	Very high	7 Å²	7	58 Å²	58	4%	0.042	30%	0.301	C	S	.	.	H	α-helix	trans	-63.6	-40.4	175.8	174.4	0	0	0	0	110.6	S81 S85 L113 Q165 R166 A172 S173	S81-V169 WeakPolarHBondContact OG-CG2 3.39Å; S85-V169 WeakPolarHBondContact OG-CG2 3.33Å; L113-V169 HydrophobicContact CB-CG2 4.28Å; L113-V169 HydrophobicContact CD2-CB 3.9Å; L113-V169 HydrophobicContact CD2-CG1 3.78Å; L113-V169 HydrophobicContact CD2-CG2 4.05Å; Q165-V169 WeakPolarHBondContact O-CG2 3.49Å; Q165-V169 PolarHBondContact O-N 2.91Å; R166-V169 PolarHBondContact O-N 2.73Å; V169-A172 PolarHBondContact O-N 3.01Å; V169-S173 VanDerWaalsContact O-CB 3.3Å; V169-S173 WeakPolarHBondContact O-CB 3.34Å; V169-S173 PolarHBondContact O-N 3.01Å; V169-S173 PolarHBondContact O-OG 3.47Å
170	T	93.2	Very high	90.3	Very high	91 Å²	91	64.3 Å²	64.3	56%	0.558	32%	0.32	S	S	*	.	H	α-helix	trans	-62.9	-45.5	176.8	-56.2	0	0	0	0	111.7	R166 A167 L168 S173 A174	R166-T170 WeakPolarHBondContact O-CB 3.23Å; R166-T170 PolarHBondContact O-N 2.95Å; R166-T170 PolarHBondContact O-OG1 3.31Å; A167-T170 PolarHBondContact O-N 3.49Å; L168-T170 VanDerWaalsContact C-N 3.32Å; L168-T170 PolarHBondContact O-N 3.42Å; T170-S173 PolarHBondContact O-N 3.01Å; T170-A174 WeakPolarHBondContact O-CB 3.45Å; T170-A174 PolarHBondContact O-N 3.06Å
171	V	94.8	Very high	90.4	Very high	78 Å²	78	66.4 Å²	66.4	47%	0.473	32%	0.324	S	S	.	.	H	α-helix	trans	-62.5	-46.1	176.3	170	0	0	0	0	111	I89 A167 L168 S173 A174 L175	I89-V171 HydrophobicContact CD1-CG1 4.44Å; A167-V171 VanDerWaalsContact O-CG2 3.3Å; A167-V171 WeakPolarHBondContact O-CG2 3.32Å; A167-V171 PolarHBondContact O-N 2.9Å; L168-V171 PolarHBondContact O-N 3.12Å; V171-S173 VanDerWaalsContact C-N 3.34Å; V171-S173 PolarHBondContact O-N 3.4Å; V171-A174 PolarHBondContact O-N 3.4Å; V171-L175 HydrophobicContact CG1-CD1 4Å; V171-L175 WeakPolarHBondContact O-CG 3.41Å; V171-L175 PolarHBondContact O-N 2.97Å
172	A	92.4	Very high	90.3	Very high	1 Å²	1	70 Å²	70	1%	0.008	35%	0.348	C	S	.	.	H	α-helix	trans	-59.3	-45.8	176.9	0	0	0	0	0	111.5	I89 L168 V169 A174 L175 V176	I89-A172 HydrophobicContact CD1-CB 4.07Å; I89-A172 HydrophobicContact CG1-CB 3.8Å; L168-A172 WeakPolarHBondContact O-CB 3.27Å; L168-A172 PolarHBondContact O-N 3.3Å; V169-A172 PolarHBondContact O-N 3.01Å; A172-A174 PolarHBondContact O-N 3.45Å; A172-L175 PolarHBondContact O-N 3.23Å; A172-V176 WeakPolarHBondContact O-CB 3.42Å; A172-V176 WeakPolarHBondContact O-CG2 3.3Å; A172-V176 PolarHBondContact O-N 3.47Å
173	S	92.3	Very high	89.9	Confident	34 Å²	34	74 Å²	74	24%	0.238	37%	0.37	C	S	.	.	H	α-helix	trans	-63	-43	178.5	-58.1	0	0	0	0	111.8	V169 T170 V171 V176 I177	V169-S173 VanDerWaalsContact O-CB 3.3Å; V169-S173 WeakPolarHBondContact O-CB 3.34Å; V169-S173 PolarHBondContact O-N 3.01Å; V169-S173 PolarHBondContact O-OG 3.47Å; T170-S173 PolarHBondContact O-N 3.01Å; V171-S173 VanDerWaalsContact C-N 3.34Å; V171-S173 PolarHBondContact O-N 3.4Å; S173-V176 PolarHBondContact O-N 2.83Å; S173-I177 WeakPolarHBondContact O-CB 3.4Å; S173-I177 WeakPolarHBondContact O-CD1 3.46Å; S173-I177 VanDerWaalsContact O-CG1 3.23Å; S173-I177 WeakPolarHBondContact O-CG1 3.37Å; S173-I177 PolarHBondContact O-N 3.12Å
174	A	93.5	Very high	89.1	Confident	43 Å²	43	71.4 Å²	71.4	36%	0.355	36%	0.364	S	S	.	.	H	α-helix	trans	-62.2	-45.5	176.5	0	0	0	0	0	111.5	T170 V171 A172 V176 I177 M178	T170-A174 WeakPolarHBondContact O-CB 3.45Å; T170-A174 PolarHBondContact O-N 3.06Å; V171-A174 PolarHBondContact O-N 3.4Å; A172-A174 PolarHBondContact O-N 3.45Å; A174-V176 VanDerWaalsContact C-N 3.35Å; A174-V176 PolarHBondContact O-N 2.88Å; A174-I177 PolarHBondContact O-N 3.31Å; A174-M178 WeakPolarHBondContact O-CB 3.36Å; A174-M178 VanDerWaalsContact O-CG 3.27Å; A174-M178 WeakPolarHBondContact O-CG 3.5Å; A174-M178 PolarHBondContact O-N 3.06Å
175	L	91.8	Very high	88.9	Confident	32 Å²	32	69.1 Å²	69.1	17%	0.168	36%	0.356	C	S	.	.	H	α-helix	trans	-61.3	-43.5	177.2	-74.1	168.9	0	0	0	112.1	I89 V171 A172 M178 K179	I89-L175 HydrophobicContact CD1-CD1 4.43Å; I89-L175 HydrophobicContact CG1-CD1 3.95Å; I89-L175 HydrophobicContact CG2-CD1 4.04Å; V171-L175 HydrophobicContact CG1-CD1 4Å; V171-L175 WeakPolarHBondContact O-CG 3.41Å; V171-L175 PolarHBondContact O-N 2.97Å; A172-L175 PolarHBondContact O-N 3.23Å; L175-M178 HydrophobicContact CD2-CE 3.8Å; L175-M178 HydrophobicContact CG-CE 4.34Å; L175-M178 PolarHBondContact O-N 3.26Å; L175-K179 WeakPolarHBondContact O-CB 3.15Å; L175-K179 PolarHBondContact O-N 2.88Å
176	V	90.2	Very high	88.9	Confident	13 Å²	13	72.6 Å²	72.6	8%	0.079	37%	0.374	C	S	.	.	H	α-helix	trans	-61.7	-44.5	176.3	158.2	0	0	0	0	111.7	S88 V92 W102 C106 A172 S173 A174 R180	S88-V176 WeakPolarHBondContact OG-CG2 3.4Å; V92-V176 HydrophobicContact CG2-CG2 3.72Å; W102-V176 HydrophobicContact CE3-CB 4.19Å; W102-V176 HydrophobicContact CE3-CG1 3.67Å; W102-V176 HydrophobicContact CE3-CG2 3.98Å; W102-V176 HydrophobicContact CZ3-CB 4.41Å; W102-V176 HydrophobicContact CZ3-CG1 3.68Å; W102-V176 WeakPolarHBondContact CZ3-O 3.4Å; C106-V176 HydrophobicContact CB-CG1 4.27Å; C106-V176 HydrophobicContact CB-CG2 3.97Å; A172-V176 WeakPolarHBondContact O-CB 3.42Å; A172-V176 WeakPolarHBondContact O-CG2 3.3Å; A172-V176 PolarHBondContact O-N 3.47Å; S173-V176 PolarHBondContact O-N 2.83Å; A174-V176 VanDerWaalsContact C-N 3.35Å; A174-V176 PolarHBondContact O-N 2.88Å; V176-R180 WeakPolarHBondContact O-CB 3.48Å; V176-R180 PolarHBondContact O-N 2.95Å
177	I	90	Very high	88.7	Confident	97 Å²	97	70.9 Å²	70.9	50%	0.497	37%	0.373	S	S	.	.	H	α-helix	trans	-66.1	-47.9	177.4	-68.6	165.1	0	0	0	110.7	S173 A174 K179 R180 M181	S173-I177 WeakPolarHBondContact O-CB 3.4Å; S173-I177 WeakPolarHBondContact O-CD1 3.46Å; S173-I177 VanDerWaalsContact O-CG1 3.23Å; S173-I177 WeakPolarHBondContact O-CG1 3.37Å; S173-I177 PolarHBondContact O-N 3.12Å; A174-I177 PolarHBondContact O-N 3.31Å; I177-K179 VanDerWaalsContact C-N 3.31Å; I177-K179 PolarHBondContact O-N 3.39Å; I177-R180 WeakPolarHBondContact O-CB 3.49Å; I177-R180 PolarHBondContact O-N 3.37Å; I177-R180 VanDerWaalsContact O-N 3.13Å; I177-M181 HydrophobicContact CG2-CG 4.41Å; I177-M181 HydrophobicContact CG2-SD 3.91Å; I177-M181 WeakPolarHBondContact O-CG 3.1Å; I177-M181 PolarHBondContact O-N 3.08Å
178	M	89.8	Confident	88.4	Confident	72 Å²	72	71.9 Å²	71.9	36%	0.355	37%	0.368	S	S	.	.	H	α-helix	trans	-60.4	-41.7	178.8	-72	-173.7	-62.7	0	0	111.6	A174 L175 M181 N182 I183 F184	A174-M178 WeakPolarHBondContact O-CB 3.36Å; A174-M178 VanDerWaalsContact O-CG 3.27Å; A174-M178 WeakPolarHBondContact O-CG 3.5Å; A174-M178 PolarHBondContact O-N 3.06Å; L175-M178 HydrophobicContact CD2-CE 3.8Å; L175-M178 HydrophobicContact CG-CE 4.34Å; L175-M178 PolarHBondContact O-N 3.26Å; M178-M181 CarbonylContact O-C 3.6Å; M178-M181 PolarHBondContact O-N 3.36Å; M178-N182 PolarHBondContact O-N 3.44Å; M178-I183 HydrophobicContact CB-CB 4.44Å; M178-I183 HydrophobicContact CB-CD1 4.46Å; M178-I183 HydrophobicContact CG-CD1 4.34Å; M178-I183 PolarHBondContact O-N 3.4Å; M178-I183 VanDerWaalsContact O-N 3.12Å; M178-F184 HydrophobicContact CB-CD1 4.38Å; M178-F184 HydrophobicContact CB-CE1 3.71Å
179	K	87.3	Confident	88.1	Confident	33 Å²	33	74.5 Å²	74.5	14%	0.143	38%	0.382	C	S	.	.	H	α-helix	trans	-63.8	-42.3	174.9	-168.7	72.4	-170.3	163.2	0	111.6	V92 W102 L175 I177 M181 N182 F184	V92-K179 HydrophobicContact CG1-CB 3.99Å; V92-K179 HydrophobicContact CG1-CD 4.13Å; V92-K179 HydrophobicContact CG1-CG 3.99Å; W102-K179 HydrophobicContact CZ2-CG 4.16Å; L175-K179 WeakPolarHBondContact O-CB 3.15Å; L175-K179 PolarHBondContact O-N 2.88Å; I177-K179 VanDerWaalsContact C-N 3.31Å; I177-K179 PolarHBondContact O-N 3.39Å; K179-M181 VanDerWaalsContact C-N 3.27Å; K179-M181 PolarHBondContact O-N 3.13Å; K179-N182 PolarHBondContact O-N 3.07Å; K179-F184 HydrophobicContact CB-CE1 4.47Å; K179-F184 HydrophobicContact CB-CE2 4.45Å; K179-F184 HydrophobicContact CB-CZ 3.97Å; K179-F184 HydrophobicContact CD-CD2 3.86Å; K179-F184 HydrophobicContact CD-CE2 3.41Å; K179-F184 VanDerWaalsContact CD-CE2 3.41Å; K179-F184 HydrophobicContact CD-CZ 3.81Å; K179-F184 PolarHBondContact NZ-O 3.13Å; K179-F184 PolarHBondContact NZ-OXT 2.92Å
180	R	86.1	Confident	87.9	Confident	204 Å²	204	79 Å²	79	77%	0.77	40%	0.404	S	S	*	.	H	α-helix	trans	-62.9	-34.4	176.3	-166.4	-178.8	-179	-161.4	0.3	112.4	W102 V176 I177 N182	W102-R180 HydrophobicContact CH2-CB 3.81Å; W102-R180 HydrophobicContact CH2-CG 4.27Å; W102-R180 HydrophobicContact CZ3-CB 4.22Å; V176-R180 WeakPolarHBondContact O-CB 3.48Å; V176-R180 PolarHBondContact O-N 2.95Å; I177-R180 WeakPolarHBondContact O-CB 3.49Å; I177-R180 PolarHBondContact O-N 3.37Å; I177-R180 VanDerWaalsContact O-N 3.13Å; R180-N182 PolarHBondContact O-N 3.13Å
181	M	88.9	Confident	87.5	Confident	129 Å²	129	78.1 Å²	78.1	64%	0.635	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	4.5	175.8	-68.2	-179.3	69.3	0	0	113.4	I177 M178 K179 I183	I177-M181 HydrophobicContact CG2-CG 4.41Å; I177-M181 HydrophobicContact CG2-SD 3.91Å; I177-M181 WeakPolarHBondContact O-CG 3.1Å; I177-M181 PolarHBondContact O-N 3.08Å; M178-M181 CarbonylContact O-C 3.6Å; M178-M181 PolarHBondContact O-N 3.36Å; K179-M181 VanDerWaalsContact C-N 3.27Å; K179-M181 PolarHBondContact O-N 3.13Å; M181-I183 HydrophobicContact CB-CD1 3.83Å; M181-I183 HydrophobicContact CB-CG1 3.89Å; M181-I183 HydrophobicContact CE-CD1 4.34Å; M181-I183 PolarHBondContact O-N 3.12Å; M181-I183 HydrophobicContact SD-CD1 4.32Å
182	N	80.6	Confident	86.9	Confident	142 Å²	142	78.2 Å²	78.2	76%	0.759	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	30.8	-179	-107.6	12	0	0	0	113.4	M178 K179 R180 F184	M178-N182 PolarHBondContact O-N 3.44Å; K179-N182 PolarHBondContact O-N 3.07Å; R180-N182 PolarHBondContact O-N 3.13Å; N182-F184 PolarHBondContact O-N 2.91Å
183	I	77	Confident	86.5	Confident	105 Å²	105	84.6 Å²	84.6	54%	0.538	42%	0.419	S	S	.	.			trans	-71.7	-14.4	177.9	-66	172.4	0	0	0	111	M178 M181	M178-I183 HydrophobicContact CB-CB 4.44Å; M178-I183 HydrophobicContact CB-CD1 4.46Å; M178-I183 HydrophobicContact CG-CD1 4.34Å; M178-I183 PolarHBondContact O-N 3.4Å; M178-I183 VanDerWaalsContact O-N 3.12Å; M181-I183 HydrophobicContact CB-CD1 3.83Å; M181-I183 HydrophobicContact CB-CG1 3.89Å; M181-I183 HydrophobicContact CE-CD1 4.34Å; M181-I183 PolarHBondContact O-N 3.12Å; M181-I183 HydrophobicContact SD-CD1 4.32Å
184	F	70.5	Confident	86	Confident	111 Å²	111	89.2 Å²	89.2	49%	0.487	44%	0.435	S	S	.	.			trans	-163.7	0	170.5	64	-87	0	0	0	110.9	V92 M178 K179 N182	V92-F184 HydrophobicContact CG1-CE2 4.33Å; V92-F184 HydrophobicContact CG1-CZ 4.28Å; M178-F184 HydrophobicContact CB-CD1 4.38Å; M178-F184 HydrophobicContact CB-CE1 3.71Å; K179-F184 HydrophobicContact CB-CE1 4.47Å; K179-F184 HydrophobicContact CB-CE2 4.45Å; K179-F184 HydrophobicContact CB-CZ 3.97Å; K179-F184 HydrophobicContact CD-CD2 3.86Å; K179-F184 HydrophobicContact CD-CE2 3.41Å; K179-F184 VanDerWaalsContact CD-CE2 3.41Å; K179-F184 HydrophobicContact CD-CZ 3.81Å; K179-F184 PolarHBondContact NZ-O 3.13Å; K179-F184 PolarHBondContact NZ-OXT 2.92Å; N182-F184 PolarHBondContact O-N 2.91Å

Retrieved 184 of 184 residues in 288.8 ms (Link to these results)

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