A0A077Z123_TRITR Loading...

TPR 12 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z123, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 153 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	50.7	Low	61.4	Low	193 Å²	193	118.5 Å²	118.5	95%	0.951	59%	0.59	S	S	*	*				0	-51.6	0	-79.8	-173	-168.2	0	0	112.9	R3 Q4 E5	M1-R3 VanDerWaalsContact C-N 3.3Å; M1-R3 PolarHBondContact O-N 3.47Å; M1-R3 VanDerWaalsContact O-N 3.14Å; M1-Q4 PolarHBondContact O-N 3.23Å; M1-E5 PolarHBondContact O-N 3.04Å
2	L	56.2	Low	63	Low	54 Å²	54	114.2 Å²	114.2	28%	0.283	56%	0.563	S	S	.	*	H	α-helix	trans	-58.3	-31.9	-174.5	-78.5	171.9	0	0	0	116.3	Q4 E5 A6 L16 L23	L2-Q4 PolarHBondContact O-N 2.96Å; L2-E5 PolarHBondContact O-N 2.64Å; L2-A6 VanDerWaalsContact O-CB 3.3Å; L2-A6 WeakPolarHBondContact O-CB 3.17Å; L2-A6 PolarHBondContact O-N 3.22Å; L2-L16 HydrophobicContact CD2-CD1 3.99Å; L2-L23 HydrophobicContact CD1-CD2 3.21Å
3	R	57.4	Low	64.6	Low	227 Å²	227	108.5 Å²	108.5	86%	0.857	54%	0.536	S	S	*	.	H	α-helix	trans	-63.8	-24.6	177	-160	-179.9	-95	178.6	-6.8	112.5	M1 N7	M1-R3 VanDerWaalsContact C-N 3.3Å; M1-R3 PolarHBondContact O-N 3.47Å; M1-R3 VanDerWaalsContact O-N 3.14Å; R3-N7 PolarHBondContact O-ND2 3.41Å
4	Q	53.8	Low	66	Low	147 Å²	147	106.8 Å²	106.8	69%	0.687	54%	0.535	S	S	*	.	H	α-helix	trans	-83.7	-39.7	173.6	-74.8	174.1	-25.5	0	0	111.7	M1 L2 N7 L8	M1-Q4 PolarHBondContact O-N 3.23Å; L2-Q4 PolarHBondContact O-N 2.96Å; Q4-N7 PolarHBondContact O-N 2.82Å; Q4-L8 WeakPolarHBondContact O-CG 3.48Å
5	E	54.5	Low	67.2	Low	78 Å²	78	107.7 Å²	107.7	36%	0.364	54%	0.536	S	S	.	.	H	α-helix	trans	-71.4	-33.7	179.1	-67.2	-177.6	158	0	0	113.2	M1 L2 N7 L8 L9	M1-E5 PolarHBondContact O-N 3.04Å; L2-E5 PolarHBondContact O-N 2.64Å; E5-N7 PolarHBondContact O-N 3.08Å; E5-L8 PolarHBondContact O-N 3.23Å; E5-L8 VanDerWaalsContact O-N 3.08Å; E5-L9 PolarHBondContact O-N 2.87Å; E5-L9 VanDerWaalsContact O-N 3.1Å
6	A	58.2	Low	68.4	Low	53 Å²	53	101.3 Å²	101.3	44%	0.438	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-23.9	176.7	0	0	0	0	0	113.2	L2	L2-A6 VanDerWaalsContact O-CB 3.3Å; L2-A6 WeakPolarHBondContact O-CB 3.17Å; L2-A6 PolarHBondContact O-N 3.22Å
7	N	61.1	Low	69.6	Low	142 Å²	142	96.2 Å²	96.2	76%	0.759	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-14.3	176.6	-72.2	-16.4	0	0	0	113.1	R3 Q4 E5	R3-N7 PolarHBondContact O-ND2 3.41Å; Q4-N7 PolarHBondContact O-N 2.82Å; E5-N7 PolarHBondContact O-N 3.08Å
8	L	67.1	Low	70.5	Confident	143 Å²	143	99.2 Å²	99.2	75%	0.749	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-23.7	-175.7	-68.7	169	0	0	0	112.8	Q4 E5	Q4-L8 WeakPolarHBondContact O-CG 3.48Å; E5-L8 PolarHBondContact O-N 3.23Å; E5-L8 VanDerWaalsContact O-N 3.08Å
9	L	68.8	Low	71.5	Confident	64 Å²	64	96.7 Å²	96.7	34%	0.335	48%	0.476	S	S	.	.	S	Bend	trans	-121.4	138.9	-175.3	-61.2	174.7	0	0	0	110.3	E5 N13	E5-L9 PolarHBondContact O-N 2.87Å; E5-L9 VanDerWaalsContact O-N 3.1Å; L9-N13 HydrophobicContact CB-CB 3.92Å
10	H	74	Confident	72.4	Confident	129 Å²	129	93.6 Å²	93.6	60%	0.597	46%	0.459	S	S	*	.			trans	-52.7	142.3	172.9	-166.4	-97.6	0	0	0	109.8	Y12 N13	H10-Y12 AromaticContact CE1-CD2 3.55Å; H10-Y12 AromaticContact ND1-CD2 3.71Å; H10-Y12 PolarHBondContact O-N 3.36Å; H10-N13 WeakPolarHBondContact O-CB 3.3Å; H10-N13 PolarHBondContact O-N 3.22Å
11	P	73.6	Confident	73.3	Confident	73 Å²	73	91.2 Å²	91.2	47%	0.474	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-20.8	-176.2	17.7	-31.2	0	0	0	114.3
12	Y	80.4	Confident	75.2	Confident	67 Å²	67	88 Å²	88	26%	0.263	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	1.2	175.7	-68.1	-92	0	0	0	113.2	H10 V14 I17 C46 F49 Y50	H10-Y12 AromaticContact CE1-CD2 3.55Å; H10-Y12 AromaticContact ND1-CD2 3.71Å; H10-Y12 PolarHBondContact O-N 3.36Å; Y12-V14 PolarHBondContact O-N 3.14Å; Y12-V14 VanDerWaalsContact O-N 3.15Å; Y12-I17 VanDerWaalsContact O-CD1 3.29Å; Y12-I17 WeakPolarHBondContact O-CD1 3.29Å; Y12-C46 HydrophobicContact CD1-CB 4.25Å; Y12-C46 HydrophobicContact CE1-CB 4.45Å; Y12-F49 HydrophobicContact CD1-CB 3.51Å; Y12-F49 AromaticContact CD1-CD1 3.77Å; Y12-F49 HydrophobicContact CD1-CD1 3.77Å; Y12-F49 HydrophobicContact CD1-CD2 4.22Å; Y12-F49 AromaticContact CD1-CG 3.56Å; Y12-F49 HydrophobicContact CD1-CG 3.56Å; Y12-F49 HydrophobicContact CE1-CB 3.48Å; Y12-F49 VanDerWaalsContact CE1-CB 3.48Å; Y12-F49 HydrophobicContact CE1-CD1 4.44Å; Y12-F49 HydrophobicContact CE1-CD2 4.12Å; Y12-F49 AromaticContact CE1-CG 3.77Å; Y12-F49 HydrophobicContact CE1-CG 3.77Å; Y12-F49 HydrophobicContact CG-CD1 4.28Å; Y12-F49 HydrophobicContact CG-CG 4.38Å; Y12-Y50 HydrophobicContact CD1-CE2 4.34Å; Y12-Y50 WeakPolarHBondContact O-CE2 3.44Å; Y12-Y50 PolarHBondContact O-OH 3.03Å
13	N	83.7	Confident	76.9	Confident	40 Å²	40	88.3 Å²	88.3	21%	0.214	43%	0.429	C	S	.	.			trans	-56.2	126.3	-179.4	-175.8	-71.5	0	0	0	111.7	L9 H10 H15 L16 I17	L9-N13 HydrophobicContact CB-CB 3.92Å; H10-N13 WeakPolarHBondContact O-CB 3.3Å; H10-N13 PolarHBondContact O-N 3.22Å; N13-H15 PolarHBondContact O-N 3.08Å; N13-H15 WeakPolarHBondContact OD1-CA 3.49Å; N13-H15 VanDerWaalsContact OD1-CB 3.3Å; N13-H15 WeakPolarHBondContact OD1-CB 3.5Å; N13-H15 PolarHBondContact OD1-N 3.32Å; N13-L16 HydrophobicContact CB-CB 4.09Å; N13-L16 WeakPolarHBondContact O-CA 3.35Å; N13-L16 WeakPolarHBondContact O-CB 3.35Å; N13-L16 PolarHBondContact O-N 3.44Å; N13-L16 PolarHBondContact OD1-N 3.33Å; N13-I17 WeakPolarHBondContact O-CG1 3.33Å; N13-I17 PolarHBondContact O-N 3.33Å
14	V	84.7	Confident	78.5	Confident	85 Å²	85	77.5 Å²	77.5	52%	0.515	39%	0.388	S	S	.	.	H	α-helix	trans	-58.2	-34.3	-174.6	-178.4	0	0	0	0	112.4	Y12 R18 Y50	Y12-V14 PolarHBondContact O-N 3.14Å; Y12-V14 VanDerWaalsContact O-N 3.15Å; V14-R18 WeakPolarHBondContact O-CB 3.46Å; V14-R18 PolarHBondContact O-N 3.35Å; V14-Y50 HydrophobicContact CG2-CD1 4.22Å; V14-Y50 HydrophobicContact CG2-CE1 3.88Å; V14-Y50 HydrophobicContact CG2-CE2 4.4Å
15	H	84.2	Confident	80.2	Confident	120 Å²	120	75 Å²	75	56%	0.556	38%	0.376	S	S	*	.	H	α-helix	trans	-70.9	-37.4	176	-56.2	-61	0	0	0	112.1	N13 R18 T19	N13-H15 PolarHBondContact O-N 3.08Å; N13-H15 WeakPolarHBondContact OD1-CA 3.49Å; N13-H15 VanDerWaalsContact OD1-CB 3.3Å; N13-H15 WeakPolarHBondContact OD1-CB 3.5Å; N13-H15 PolarHBondContact OD1-N 3.32Å; H15-R18 PolarHBondContact O-N 3.05Å; H15-T19 WeakPolarHBondContact O-CB 3.48Å; H15-T19 VanDerWaalsContact O-CG2 3.29Å; H15-T19 WeakPolarHBondContact O-CG2 3.38Å; H15-T19 PolarHBondContact O-N 3.35Å; H15-T19 PolarHBondContact O-OG1 3.15Å
16	L	85.5	Confident	82	Confident	6 Å²	6	73.4 Å²	73.4	3%	0.031	38%	0.376	C	S	.	.	H	α-helix	trans	-66.2	-41.7	174.5	-175.7	63.9	0	0	0	111.4	L2 N13 T19 K20	L2-L16 HydrophobicContact CD2-CD1 3.99Å; N13-L16 HydrophobicContact CB-CB 4.09Å; N13-L16 WeakPolarHBondContact O-CA 3.35Å; N13-L16 WeakPolarHBondContact O-CB 3.35Å; N13-L16 PolarHBondContact O-N 3.44Å; N13-L16 PolarHBondContact OD1-N 3.33Å; L16-T19 WeakPolarHBondContact CA-OG1 3.43Å; L16-T19 PolarHBondContact O-N 2.97Å; L16-T19 PolarHBondContact O-OG1 3.17Å; L16-K20 WeakPolarHBondContact O-CB 3.34Å; L16-K20 WeakPolarHBondContact O-CG 3.26Å; L16-K20 PolarHBondContact O-N 2.86Å
17	I	88.4	Confident	83.6	Confident	15 Å²	15	71 Å²	71	8%	0.077	36%	0.356	C	S	.	.	H	α-helix	trans	-60	-48.4	174.5	-63.9	170.3	0	0	0	109.9	Y12 N13 T19 K20 F21 L43 C46 L47 Y50	Y12-I17 VanDerWaalsContact O-CD1 3.29Å; Y12-I17 WeakPolarHBondContact O-CD1 3.29Å; N13-I17 WeakPolarHBondContact O-CG1 3.33Å; N13-I17 PolarHBondContact O-N 3.33Å; I17-T19 PolarHBondContact O-N 3.15Å; I17-K20 PolarHBondContact O-N 3.34Å; I17-F21 PolarHBondContact O-N 3.4Å; I17-L43 HydrophobicContact CB-CD2 4.24Å; I17-L43 HydrophobicContact CG2-CD2 3.61Å; I17-L43 VanDerWaalsContact O-CD2 3.23Å; I17-L43 WeakPolarHBondContact O-CD2 3.29Å; I17-C46 HydrophobicContact CD1-CB 3.61Å; I17-C46 HydrophobicContact CG1-CB 3.73Å; I17-L47 HydrophobicContact CG2-CD2 3.92Å; I17-L47 HydrophobicContact CG2-CG 4.48Å; I17-Y50 HydrophobicContact CD1-CD2 3.68Å; I17-Y50 HydrophobicContact CD1-CE2 3.56Å
18	R	86.7	Confident	84.9	Confident	149 Å²	149	65.8 Å²	65.8	56%	0.562	33%	0.328	S	S	*	.	H	α-helix	trans	-63.1	-43.3	-179.4	-172.1	177.5	70.6	149.7	1.5	112.4	V14 H15 F21 F22	V14-R18 WeakPolarHBondContact O-CB 3.46Å; V14-R18 PolarHBondContact O-N 3.35Å; H15-R18 PolarHBondContact O-N 3.05Å; R18-F21 PolarHBondContact O-N 3.27Å; R18-F22 HydrophobicContact CG-CD2 3.89Å; R18-F22 HydrophobicContact CG-CE2 3.48Å; R18-F22 VanDerWaalsContact CG-CE2 3.48Å; R18-F22 HydrophobicContact CG-CZ 4.47Å; R18-F22 WeakPolarHBondContact O-CD2 3.31Å; R18-F22 PolarHBondContact O-N 2.96Å; R18-F22 VanDerWaalsContact O-N 3.09Å
19	T	88.8	Confident	85.9	Confident	53 Å²	53	65.7 Å²	65.7	33%	0.325	32%	0.323	S	S	.	.	H	α-helix	trans	-66.4	-42.3	177.8	49.6	0	0	0	0	111.9	H15 L16 I17 F21 F22 L23	H15-T19 WeakPolarHBondContact O-CB 3.48Å; H15-T19 VanDerWaalsContact O-CG2 3.29Å; H15-T19 WeakPolarHBondContact O-CG2 3.38Å; H15-T19 PolarHBondContact O-N 3.35Å; H15-T19 PolarHBondContact O-OG1 3.15Å; L16-T19 WeakPolarHBondContact CA-OG1 3.43Å; L16-T19 PolarHBondContact O-N 2.97Å; L16-T19 PolarHBondContact O-OG1 3.17Å; I17-T19 PolarHBondContact O-N 3.15Å; T19-F21 VanDerWaalsContact C-N 3.32Å; T19-F21 PolarHBondContact O-N 3.05Å; T19-F22 PolarHBondContact O-N 2.78Å; T19-L23 WeakPolarHBondContact O-CB 3.11Å; T19-L23 PolarHBondContact O-N 2.94Å
20	K	90.3	Very high	87	Confident	34 Å²	34	67.8 Å²	67.8	15%	0.148	34%	0.335	C	S	.	.	H	α-helix	trans	-59.2	-41.1	172.4	-78.7	-173.8	-179.3	-163.7	0	112.2	L16 I17 L23 A24 L39 L43	L16-K20 WeakPolarHBondContact O-CB 3.34Å; L16-K20 WeakPolarHBondContact O-CG 3.26Å; L16-K20 PolarHBondContact O-N 2.86Å; I17-K20 PolarHBondContact O-N 3.34Å; K20-L23 PolarHBondContact O-N 3.28Å; K20-A24 WeakPolarHBondContact O-CB 3.47Å; K20-A24 PolarHBondContact O-N 3.12Å; K20-L39 HydrophobicContact CG-CD2 4.49Å; K20-L43 HydrophobicContact CB-CD1 4.37Å; K20-L43 HydrophobicContact CB-CD2 3.8Å; K20-L43 HydrophobicContact CB-CG 4.2Å
21	F	90.3	Very high	87.8	Confident	44 Å²	44	65.2 Å²	65.2	19%	0.193	33%	0.331	C	S	.	.	H	α-helix	trans	-61.7	-47.6	176.8	-179.1	-89.6	0	0	0	111.9	I17 R18 T19 L23 A24 H25 Y40 L43 V60	I17-F21 PolarHBondContact O-N 3.4Å; R18-F21 PolarHBondContact O-N 3.27Å; T19-F21 VanDerWaalsContact C-N 3.32Å; T19-F21 PolarHBondContact O-N 3.05Å; F21-L23 VanDerWaalsContact C-N 3.32Å; F21-L23 PolarHBondContact O-N 2.95Å; F21-A24 WeakPolarHBondContact O-CB 3.37Å; F21-A24 PolarHBondContact O-N 3.48Å; F21-H25 PolarHBondContact O-N 3.33Å; F21-H25 VanDerWaalsContact O-N 3.08Å; F21-Y40 HydrophobicContact CD2-CE1 4.08Å; F21-Y40 AromaticContact CE2-CE1 3.93Å; F21-Y40 HydrophobicContact CE2-CE1 3.93Å; F21-L43 VanDerWaalsContact CA-CD1 3.49Å; F21-L43 HydrophobicContact CB-CD1 3.86Å; F21-L43 HydrophobicContact CD2-CD1 4.17Å; F21-V60 HydrophobicContact CE2-CG1 4.01Å; F21-V60 HydrophobicContact CZ-CG1 3.63Å
22	F	91.4	Very high	88.6	Confident	126 Å²	126	68.2 Å²	68.2	55%	0.553	33%	0.333	S	S	*	.	H	α-helix	trans	-65.5	-35.7	176.3	-72.3	-57.5	0	0	0	112.9	R18 T19 H25 A26	R18-F22 HydrophobicContact CG-CD2 3.89Å; R18-F22 HydrophobicContact CG-CE2 3.48Å; R18-F22 VanDerWaalsContact CG-CE2 3.48Å; R18-F22 HydrophobicContact CG-CZ 4.47Å; R18-F22 WeakPolarHBondContact O-CD2 3.31Å; R18-F22 PolarHBondContact O-N 2.96Å; R18-F22 VanDerWaalsContact O-N 3.09Å; T19-F22 PolarHBondContact O-N 2.78Å; F22-H25 PolarHBondContact O-N 3.47Å; F22-A26 WeakPolarHBondContact O-CB 3.35Å; F22-A26 PolarHBondContact O-N 3.43Å
23	L	91.8	Very high	89.1	Confident	59 Å²	59	68.5 Å²	68.5	31%	0.309	33%	0.334	S	S	.	.	H	α-helix	trans	-65.1	-41.3	174.1	-177.3	64.3	0	0	0	111.5	L2 T19 K20 F21 H25 A26 A27 L39	L2-L23 HydrophobicContact CD1-CD2 3.21Å; T19-L23 WeakPolarHBondContact O-CB 3.11Å; T19-L23 PolarHBondContact O-N 2.94Å; K20-L23 PolarHBondContact O-N 3.28Å; F21-L23 VanDerWaalsContact C-N 3.32Å; F21-L23 PolarHBondContact O-N 2.95Å; L23-H25 VanDerWaalsContact C-N 3.31Å; L23-H25 PolarHBondContact O-N 2.88Å; L23-A26 PolarHBondContact O-N 3.45Å; L23-A27 WeakPolarHBondContact O-CB 3.29Å; L23-A27 PolarHBondContact O-N 2.97Å; L23-L39 HydrophobicContact CB-CD1 4.14Å; L23-L39 HydrophobicContact CD2-CD1 3.77Å; L23-L39 HydrophobicContact CD2-CD2 4.27Å; L23-L39 HydrophobicContact CG-CD1 3.64Å
24	A	91.4	Very high	89.4	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-59.4	-44.9	176.4	0	0	0	0	0	110.9	K20 F21 A27 M28 L39 Y40	K20-A24 WeakPolarHBondContact O-CB 3.47Å; K20-A24 PolarHBondContact O-N 3.12Å; F21-A24 WeakPolarHBondContact O-CB 3.37Å; F21-A24 PolarHBondContact O-N 3.48Å; A24-A27 PolarHBondContact O-N 3.35Å; A24-M28 WeakPolarHBondContact O-CG 3.34Å; A24-M28 PolarHBondContact O-N 3.09Å; A24-L39 HydrophobicContact CB-CB 3.68Å; A24-L39 HydrophobicContact CB-CD1 4.23Å; A24-Y40 HydrophobicContact CB-CD1 4.02Å; A24-Y40 HydrophobicContact CB-CD2 3.89Å; A24-Y40 HydrophobicContact CB-CE1 3.8Å; A24-Y40 HydrophobicContact CB-CE2 3.65Å; A24-Y40 HydrophobicContact CB-CG 4.07Å
25	H	89.9	Confident	89.7	Confident	95 Å²	95	71.5 Å²	71.5	44%	0.44	35%	0.345	S	S	.	.	H	α-helix	trans	-62.2	-45.2	174.9	-169.4	-84.9	0	0	0	112.2	F21 F22 L23 A27 M28 E29	F21-H25 PolarHBondContact O-N 3.33Å; F21-H25 VanDerWaalsContact O-N 3.08Å; F22-H25 PolarHBondContact O-N 3.47Å; L23-H25 VanDerWaalsContact C-N 3.31Å; L23-H25 PolarHBondContact O-N 2.88Å; H25-A27 VanDerWaalsContact C-N 3.33Å; H25-A27 PolarHBondContact O-N 3.17Å; H25-M28 WeakPolarHBondContact O-CB 3.49Å; H25-M28 PolarHBondContact O-N 3.32Å; H25-E29 IonicContact CE1-OE1 2.92Å; H25-E29 PolarHBondContact O-N 3.19Å; H25-E29 VanDerWaalsContact O-N 3.17Å
26	A	92.3	Very high	90.1	Very high	44 Å²	44	65.8 Å²	65.8	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-63.3	-37.8	176.2	0	0	0	0	0	112.5	F22 L23 M28 E29 L30	F22-A26 WeakPolarHBondContact O-CB 3.35Å; F22-A26 PolarHBondContact O-N 3.43Å; L23-A26 PolarHBondContact O-N 3.45Å; A26-M28 VanDerWaalsContact C-N 3.34Å; A26-E29 PolarHBondContact O-N 3.29Å; A26-L30 WeakPolarHBondContact O-CG 3.45Å; A26-L30 PolarHBondContact O-N 3.1Å
27	A	91.6	Very high	90.3	Very high	2 Å²	2	66.5 Å²	66.5	2%	0.017	32%	0.322	C	S	.	.	H	α-helix	trans	-65.7	-35.7	175.7	0	0	0	0	0	111.9	L23 A24 H25 L30 S31 R32 E35 A36	L23-A27 WeakPolarHBondContact O-CB 3.29Å; L23-A27 PolarHBondContact O-N 2.97Å; A24-A27 PolarHBondContact O-N 3.35Å; H25-A27 VanDerWaalsContact C-N 3.33Å; H25-A27 PolarHBondContact O-N 3.17Å; A27-L30 PolarHBondContact O-N 2.98Å; A27-S31 PolarHBondContact O-N 3.07Å; A27-R32 HydrophobicContact CB-CB 4.3Å; A27-R32 PolarHBondContact O-N 3.15Å; A27-E35 HydrophobicContact CB-CG 4.43Å; A27-A36 HydrophobicContact CB-CB 3.85Å
28	M	87.8	Confident	90.5	Very high	33 Å²	33	69.7 Å²	69.7	16%	0.163	34%	0.339	C	S	.	.	H	α-helix	trans	-60	-49.4	171.5	-70.3	178.6	70.3	0	0	111.9	A24 H25 A26 L30 S31 A36 Y40 N67 L68	A24-M28 WeakPolarHBondContact O-CG 3.34Å; A24-M28 PolarHBondContact O-N 3.09Å; H25-M28 WeakPolarHBondContact O-CB 3.49Å; H25-M28 PolarHBondContact O-N 3.32Å; A26-M28 VanDerWaalsContact C-N 3.34Å; M28-L30 VanDerWaalsContact C-N 3.26Å; M28-L30 PolarHBondContact O-N 2.95Å; M28-S31 WeakPolarHBondContact O-CA 3.47Å; M28-S31 PolarHBondContact O-N 3.11Å; M28-A36 HydrophobicContact CG-CB 3.75Å; M28-Y40 HydrophobicContact CG-CE2 4.04Å; M28-Y40 HydrophobicContact SD-CE2 3.41Å; M28-Y40 WeakPolarHBondContact SD-CE2 3.21Å; M28-Y40 PolarHBondContact SD-OH 2.91Å; M28-N67 HydrophobicContact CE-CB 3.77Å; M28-L68 HydrophobicContact CE-CD2 4.41Å; M28-L68 HydrophobicContact CE-CG 4.22Å; M28-L68 HydrophobicContact CG-CD1 4.32Å; M28-L68 HydrophobicContact CG-CD2 3.76Å; M28-L68 HydrophobicContact CG-CG 4.1Å; M28-L68 HydrophobicContact SD-CG 4.32Å
29	E	89.3	Confident	90.7	Very high	141 Å²	141	63.3 Å²	63.3	66%	0.659	32%	0.316	S	S	*	.	H	α-helix	trans	-62.2	-34.5	179.5	-66.7	-59.4	137.6	0	0	112.1	H25 A26 S31	H25-E29 IonicContact CE1-OE1 2.92Å; H25-E29 PolarHBondContact O-N 3.19Å; H25-E29 VanDerWaalsContact O-N 3.17Å; A26-E29 PolarHBondContact O-N 3.29Å; E29-S31 PolarHBondContact O-N 3.28Å
30	L	92	Very high	90.9	Very high	109 Å²	109	61 Å²	61	57%	0.571	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	9.5	174.4	-65.5	175.4	0	0	0	113.8	A26 A27 M28 R32	A26-L30 WeakPolarHBondContact O-CG 3.45Å; A26-L30 PolarHBondContact O-N 3.1Å; A27-L30 PolarHBondContact O-N 2.98Å; M28-L30 VanDerWaalsContact C-N 3.26Å; M28-L30 PolarHBondContact O-N 2.95Å; L30-R32 HydrophobicContact CB-CG 4.23Å; L30-R32 PolarHBondContact O-N 3.08Å; L30-R32 VanDerWaalsContact O-N 3.15Å
31	S	90.1	Very high	91	Very high	75 Å²	75	64.7 Å²	64.7	52%	0.524	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	23.1	-177.7	-57.3	0	0	0	0	114.6	A27 M28 E29 Y33	A27-S31 PolarHBondContact O-N 3.07Å; M28-S31 WeakPolarHBondContact O-CA 3.47Å; M28-S31 PolarHBondContact O-N 3.11Å; E29-S31 PolarHBondContact O-N 3.28Å; S31-Y33 VanDerWaalsContact C-N 3.3Å; S31-Y33 PolarHBondContact O-N 2.94Å
32	R	91.1	Very high	90.9	Very high	135 Å²	135	66.1 Å²	66.1	51%	0.509	33%	0.326	S	S	.	.			trans	-90	67.4	175.3	-60.2	-177.2	-171.1	171	1.7	109.8	A27 L30 D34 E35 A36	A27-R32 HydrophobicContact CB-CB 4.3Å; A27-R32 PolarHBondContact O-N 3.15Å; L30-R32 HydrophobicContact CB-CG 4.23Å; L30-R32 PolarHBondContact O-N 3.08Å; L30-R32 VanDerWaalsContact O-N 3.15Å; R32-D34 VanDerWaalsContact C-N 3.33Å; R32-D34 PolarHBondContact O-N 2.89Å; R32-E35 HydrophobicContact CB-CB 4.19Å; R32-E35 WeakPolarHBondContact CD-OE2 3.47Å; R32-E35 IonicContact NH1-OE2 3.64Å; R32-E35 PolarHBondContact O-N 3.33Å; R32-A36 WeakPolarHBondContact O-CB 3.38Å; R32-A36 PolarHBondContact O-N 2.8Å
33	Y	90.7	Very high	90.8	Very high	73 Å²	73	60.1 Å²	60.1	29%	0.286	30%	0.3	S	S	.	.	H	α-helix	trans	-62.7	-36.3	-169.1	-56.9	-51	0	0	0	113.9	S31 L37 L68 K71	S31-Y33 VanDerWaalsContact C-N 3.3Å; S31-Y33 PolarHBondContact O-N 2.94Å; Y33-L37 VanDerWaalsContact O-CB 3.31Å; Y33-L37 WeakPolarHBondContact O-CB 3.24Å; Y33-L37 PolarHBondContact O-N 3.33Å; Y33-L68 HydrophobicContact CD1-CD2 3.55Å; Y33-L68 HydrophobicContact CG-CD2 4.19Å; Y33-K71 HydrophobicContact CD1-CB 4.33Å; Y33-K71 HydrophobicContact CD1-CG 4.47Å; Y33-K71 HydrophobicContact CD2-CB 4.44Å; Y33-K71 HydrophobicContact CE1-CB 4.09Å; Y33-K71 HydrophobicContact CE1-CG 3.89Å; Y33-K71 HydrophobicContact CE2-CB 4.22Å; Y33-K71 HydrophobicContact CG-CB 4.48Å
34	D	90.1	Very high	90.7	Very high	109 Å²	109	58.9 Å²	58.9	58%	0.583	29%	0.294	S	S	*	.	H	α-helix	trans	-70	-42.4	179.3	-65.5	-44.3	0	0	0	112.4	R32 L37 D38 K72	R32-D34 VanDerWaalsContact C-N 3.33Å; R32-D34 PolarHBondContact O-N 2.89Å; D34-L37 PolarHBondContact O-N 3.46Å; D34-D38 PolarHBondContact O-N 3.08Å; D34-D38 VanDerWaalsContact O-N 3.09Å; D34-K72 IonicContact OD1-NZ 2.78Å; D34-K72 PolarHBondContact OD1-NZ 2.88Å
35	E	90.4	Very high	90.6	Very high	80 Å²	80	62.2 Å²	62.2	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-62.8	-44.8	175.3	-176.2	-179.9	-175.6	0	0	110.7	A27 R32 L37 D38 L39	A27-E35 HydrophobicContact CB-CG 4.43Å; R32-E35 HydrophobicContact CB-CB 4.19Å; R32-E35 WeakPolarHBondContact CD-OE2 3.47Å; R32-E35 IonicContact NH1-OE2 3.64Å; R32-E35 PolarHBondContact O-N 3.33Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 3.44Å; E35-D38 PolarHBondContact O-N 3.41Å; E35-L39 HydrophobicContact CG-CD1 4.22Å; E35-L39 VanDerWaalsContact O-CG 3.29Å; E35-L39 WeakPolarHBondContact O-CG 3.38Å; E35-L39 PolarHBondContact O-N 3.32Å; E35-L39 VanDerWaalsContact O-N 3.08Å
36	A	91.5	Very high	90.5	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-41.2	177	0	0	0	0	0	112	A27 M28 R32 L39 Y40 L68	A27-A36 HydrophobicContact CB-CB 3.85Å; M28-A36 HydrophobicContact CG-CB 3.75Å; R32-A36 WeakPolarHBondContact O-CB 3.38Å; R32-A36 PolarHBondContact O-N 2.8Å; A36-L39 PolarHBondContact O-N 3.26Å; A36-Y40 WeakPolarHBondContact O-CD2 3.45Å; A36-Y40 PolarHBondContact O-N 3.23Å; A36-L68 HydrophobicContact CB-CD1 3.68Å; A36-L68 HydrophobicContact CB-CD2 3.91Å; A36-L68 HydrophobicContact CB-CG 4.41Å
37	L	91	Very high	90.3	Very high	21 Å²	21	56.8 Å²	56.8	11%	0.11	28%	0.284	C	S	.	.	H	α-helix	trans	-64.5	-45.9	-178.9	-175.5	63.2	0	0	0	111.3	Y33 D34 E35 L39 Y40 Q41 V65 L68	Y33-L37 VanDerWaalsContact O-CB 3.31Å; Y33-L37 WeakPolarHBondContact O-CB 3.24Å; Y33-L37 PolarHBondContact O-N 3.33Å; D34-L37 PolarHBondContact O-N 3.46Å; E35-L37 VanDerWaalsContact C-N 3.33Å; E35-L37 PolarHBondContact O-N 3.44Å; L37-L39 VanDerWaalsContact C-N 3.34Å; L37-L39 PolarHBondContact O-N 3.43Å; L37-Y40 PolarHBondContact O-N 3.44Å; L37-Q41 WeakPolarHBondContact O-CB 3.42Å; L37-Q41 VanDerWaalsContact O-CG 3.29Å; L37-Q41 WeakPolarHBondContact O-CG 3.33Å; L37-Q41 PolarHBondContact O-N 3.17Å; L37-V65 HydrophobicContact CD1-CG1 3.94Å; L37-L68 HydrophobicContact CB-CD1 4.03Å; L37-L68 HydrophobicContact CD1-CB 4.47Å; L37-L68 HydrophobicContact CD1-CD1 4.32Å
38	D	91.7	Very high	90.1	Very high	82 Å²	82	62.8 Å²	62.8	44%	0.439	31%	0.31	S	S	.	.	H	α-helix	trans	-59.2	-45.1	175.6	177.5	47	0	0	0	111.3	D34 E35 Y40 Q41 Q42	D34-D38 PolarHBondContact O-N 3.08Å; D34-D38 VanDerWaalsContact O-N 3.09Å; E35-D38 PolarHBondContact O-N 3.41Å; D38-Y40 PolarHBondContact O-N 3Å; D38-Q41 PolarHBondContact O-N 3.32Å; D38-Q42 WeakPolarHBondContact O-CG 3.47Å; D38-Q42 PolarHBondContact O-N 3.47Å; D38-Q42 PolarHBondContact OD1-NE2 3.39Å; D38-Q42 PolarHBondContact OD2-NE2 3.46Å
39	L	92.3	Very high	90.1	Very high	14 Å²	14	67.6 Å²	67.6	7%	0.073	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-44.3	177.3	-70.3	168.7	0	0	0	112.5	K20 L23 A24 E35 A36 L37 Q42 L43	K20-L39 HydrophobicContact CG-CD2 4.49Å; L23-L39 HydrophobicContact CB-CD1 4.14Å; L23-L39 HydrophobicContact CD2-CD1 3.77Å; L23-L39 HydrophobicContact CD2-CD2 4.27Å; L23-L39 HydrophobicContact CG-CD1 3.64Å; A24-L39 HydrophobicContact CB-CB 3.68Å; A24-L39 HydrophobicContact CB-CD1 4.23Å; E35-L39 HydrophobicContact CG-CD1 4.22Å; E35-L39 VanDerWaalsContact O-CG 3.29Å; E35-L39 WeakPolarHBondContact O-CG 3.38Å; E35-L39 PolarHBondContact O-N 3.32Å; E35-L39 VanDerWaalsContact O-N 3.08Å; A36-L39 PolarHBondContact O-N 3.26Å; L37-L39 VanDerWaalsContact C-N 3.34Å; L37-L39 PolarHBondContact O-N 3.43Å; L39-Q42 PolarHBondContact O-N 3.12Å; L39-L43 WeakPolarHBondContact O-CD1 2.84Å; L39-L43 VanDerWaalsContact O-CG 3.26Å; L39-L43 WeakPolarHBondContact O-CG 3.41Å; L39-L43 PolarHBondContact O-N 2.7Å; L39-L43 VanDerWaalsContact O-N 3.15Å
40	Y	92.7	Very high	89.8	Confident	5 Å²	5	66.2 Å²	66.2	2%	0.02	32%	0.32	C	S	.	.	H	α-helix	trans	-66	-38.6	176.6	-76.5	-62	0	0	0	112.8	F21 A24 M28 A36 L37 D38 L43 L44 N61 V65 L68	F21-Y40 HydrophobicContact CD2-CE1 4.08Å; F21-Y40 AromaticContact CE2-CE1 3.93Å; F21-Y40 HydrophobicContact CE2-CE1 3.93Å; A24-Y40 HydrophobicContact CB-CD1 4.02Å; A24-Y40 HydrophobicContact CB-CD2 3.89Å; A24-Y40 HydrophobicContact CB-CE1 3.8Å; A24-Y40 HydrophobicContact CB-CE2 3.65Å; A24-Y40 HydrophobicContact CB-CG 4.07Å; M28-Y40 HydrophobicContact CG-CE2 4.04Å; M28-Y40 HydrophobicContact SD-CE2 3.41Å; M28-Y40 WeakPolarHBondContact SD-CE2 3.21Å; M28-Y40 PolarHBondContact SD-OH 2.91Å; A36-Y40 WeakPolarHBondContact O-CD2 3.45Å; A36-Y40 PolarHBondContact O-N 3.23Å; L37-Y40 PolarHBondContact O-N 3.44Å; D38-Y40 PolarHBondContact O-N 3Å; Y40-L43 HydrophobicContact CD1-CD1 4.29Å; Y40-L43 WeakPolarHBondContact O-CB 3.29Å; Y40-L43 PolarHBondContact O-N 3.15Å; Y40-L44 PolarHBondContact O-N 3.48Å; Y40-N61 PolarHBondContact O-ND2 3.23Å; Y40-N61 VanDerWaalsContact O-ND2 3.09Å; Y40-V65 HydrophobicContact CG-CG2 4.26Å; Y40-L68 HydrophobicContact CD2-CD1 3.56Å; Y40-L68 HydrophobicContact CE2-CD1 3.88Å
41	Q	90.9	Very high	89.6	Confident	112 Å²	112	62.8 Å²	62.8	52%	0.523	30%	0.303	S	S	.	.	H	α-helix	trans	-63.8	-41.4	176.5	-74.8	178.6	-7.3	0	0	111.7	L37 D38 L43 L44 P45	L37-Q41 WeakPolarHBondContact O-CB 3.42Å; L37-Q41 VanDerWaalsContact O-CG 3.29Å; L37-Q41 WeakPolarHBondContact O-CG 3.33Å; L37-Q41 PolarHBondContact O-N 3.17Å; D38-Q41 PolarHBondContact O-N 3.32Å; Q41-L43 VanDerWaalsContact C-N 3.26Å; Q41-L43 PolarHBondContact O-N 2.95Å; Q41-L44 PolarHBondContact O-N 3.45Å; Q41-P45 VanDerWaalsContact O-CD 3.24Å; Q41-P45 WeakPolarHBondContact O-CD 3.26Å
42	Q	89	Confident	89.4	Confident	73 Å²	73	64.6 Å²	64.6	34%	0.341	30%	0.303	S	S	.	.	H	α-helix	trans	-65.6	-28.1	175.1	-72.4	178.6	37.9	0	0	113.3	D38 L39 C46	D38-Q42 WeakPolarHBondContact O-CG 3.47Å; D38-Q42 PolarHBondContact O-N 3.47Å; D38-Q42 PolarHBondContact OD1-NE2 3.39Å; D38-Q42 PolarHBondContact OD2-NE2 3.46Å; L39-Q42 PolarHBondContact O-N 3.12Å; Q42-C46 PolarHBondContact O-SG 3.37Å
43	L	89.9	Confident	89.1	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-73.8	-31.3	179.7	-77	165.6	0	0	0	113	I17 K20 F21 L39 Y40 Q41 C46 L47 N61	I17-L43 HydrophobicContact CB-CD2 4.24Å; I17-L43 HydrophobicContact CG2-CD2 3.61Å; I17-L43 VanDerWaalsContact O-CD2 3.23Å; I17-L43 WeakPolarHBondContact O-CD2 3.29Å; K20-L43 HydrophobicContact CB-CD1 4.37Å; K20-L43 HydrophobicContact CB-CD2 3.8Å; K20-L43 HydrophobicContact CB-CG 4.2Å; F21-L43 VanDerWaalsContact CA-CD1 3.49Å; F21-L43 HydrophobicContact CB-CD1 3.86Å; F21-L43 HydrophobicContact CD2-CD1 4.17Å; L39-L43 WeakPolarHBondContact O-CD1 2.84Å; L39-L43 VanDerWaalsContact O-CG 3.26Å; L39-L43 WeakPolarHBondContact O-CG 3.41Å; L39-L43 PolarHBondContact O-N 2.7Å; L39-L43 VanDerWaalsContact O-N 3.15Å; Y40-L43 HydrophobicContact CD1-CD1 4.29Å; Y40-L43 WeakPolarHBondContact O-CB 3.29Å; Y40-L43 PolarHBondContact O-N 3.15Å; Q41-L43 VanDerWaalsContact C-N 3.26Å; Q41-L43 PolarHBondContact O-N 2.95Å; L43-C46 WeakPolarHBondContact O-CB 3.33Å; L43-C46 PolarHBondContact O-N 3.12Å; L43-C46 VanDerWaalsContact O-N 3.12Å; L43-L47 HydrophobicContact CB-CD1 4.39Å; L43-L47 WeakPolarHBondContact O-CG 3.39Å; L43-L47 PolarHBondContact O-N 2.78Å; L43-N61 WeakPolarHBondContact CB-ND2 3.49Å
44	L	89.3	Confident	88.8	Confident	33 Å²	33	60.9 Å²	60.9	17%	0.173	31%	0.308	C	S	.	.	H	α-helix	trans	-60.8	-46	-171.8	-173.1	68.2	0	0	0	113.5	Y40 Q41 C46 L47 K48 I58	Y40-L44 PolarHBondContact O-N 3.48Å; Q41-L44 PolarHBondContact O-N 3.45Å; L44-C46 VanDerWaalsContact C-N 3.31Å; L44-C46 PolarHBondContact O-N 3.41Å; L44-L47 PolarHBondContact O-N 2.84Å; L44-K48 HydrophobicContact CG-CD 4.48Å; L44-K48 WeakPolarHBondContact O-CG 3.28Å; L44-K48 PolarHBondContact O-N 3.38Å; L44-I58 HydrophobicContact CD1-CG2 3.95Å
45	P	88.2	Confident	88.7	Confident	69 Å²	69	58.1 Å²	58.1	45%	0.448	29%	0.291	S	S	.	.	H	α-helix	trans	-62.3	-37.7	173.7	-21.9	33.6	0	0	0	112.9	Q41 F49	Q41-P45 VanDerWaalsContact O-CD 3.24Å; Q41-P45 WeakPolarHBondContact O-CD 3.26Å; P45-F49 PolarHBondContact O-N 3.15Å
46	C	88.2	Confident	88.6	Confident	11 Å²	11	56 Å²	56	7%	0.074	28%	0.284	C	S	.	.	H	α-helix	trans	-66.3	-43.9	178.6	-60.1	0	0	0	0	111.5	Y12 I17 Q42 L43 L44 F49 Y50	Y12-C46 HydrophobicContact CD1-CB 4.25Å; Y12-C46 HydrophobicContact CE1-CB 4.45Å; I17-C46 HydrophobicContact CD1-CB 3.61Å; I17-C46 HydrophobicContact CG1-CB 3.73Å; Q42-C46 PolarHBondContact O-SG 3.37Å; L43-C46 WeakPolarHBondContact O-CB 3.33Å; L43-C46 PolarHBondContact O-N 3.12Å; L43-C46 VanDerWaalsContact O-N 3.12Å; L44-C46 VanDerWaalsContact C-N 3.31Å; L44-C46 PolarHBondContact O-N 3.41Å; C46-F49 WeakPolarHBondContact O-CB 3.46Å; C46-F49 PolarHBondContact O-N 3.22Å; C46-Y50 WeakPolarHBondContact O-CD2 3.46Å
47	L	88	Confident	88.5	Confident	15 Å²	15	58.5 Å²	58.5	8%	0.079	30%	0.3	C	S	.	.	H	α-helix	trans	-63.4	-46.2	176.7	-69.2	172.4	0	0	0	111.2	I17 L43 L44 F49 Y50 V51 T57 I58 N61	I17-L47 HydrophobicContact CG2-CD2 3.92Å; I17-L47 HydrophobicContact CG2-CG 4.48Å; L43-L47 HydrophobicContact CB-CD1 4.39Å; L43-L47 WeakPolarHBondContact O-CG 3.39Å; L43-L47 PolarHBondContact O-N 2.78Å; L44-L47 PolarHBondContact O-N 2.84Å; L47-F49 PolarHBondContact O-N 3.09Å; L47-F49 VanDerWaalsContact O-N 3.08Å; L47-Y50 PolarHBondContact O-N 2.84Å; L47-V51 WeakPolarHBondContact O-CG2 3.33Å; L47-V51 PolarHBondContact O-N 3.43Å; L47-T57 HydrophobicContact CD1-CG2 4.16Å; L47-T57 HydrophobicContact CD2-CG2 3.56Å; L47-I58 HydrophobicContact CB-CG1 4.18Å; L47-N61 HydrophobicContact CD1-CB 3.79Å
48	K	87.8	Confident	88.6	Confident	128 Å²	128	57.7 Å²	57.7	56%	0.557	30%	0.296	S	S	*	.	H	α-helix	trans	-59.8	-20.5	177.6	-74.3	179.9	177.1	-174.9	0	114.1	L44 I58	L44-K48 HydrophobicContact CG-CD 4.48Å; L44-K48 WeakPolarHBondContact O-CG 3.28Å; L44-K48 PolarHBondContact O-N 3.38Å; K48-I58 HydrophobicContact CG-CD1 4.2Å
49	F	87.4	Confident	88.6	Confident	134 Å²	134	53.8 Å²	53.8	59%	0.588	28%	0.275	S	S	*	.	H	α-helix	trans	-78.2	-34.5	175.9	-177.7	-92.5	0	0	0	113	Y12 P45 C46 L47	Y12-F49 HydrophobicContact CD1-CB 3.51Å; Y12-F49 AromaticContact CD1-CD1 3.77Å; Y12-F49 HydrophobicContact CD1-CD1 3.77Å; Y12-F49 HydrophobicContact CD1-CD2 4.22Å; Y12-F49 AromaticContact CD1-CG 3.56Å; Y12-F49 HydrophobicContact CD1-CG 3.56Å; Y12-F49 HydrophobicContact CE1-CB 3.48Å; Y12-F49 VanDerWaalsContact CE1-CB 3.48Å; Y12-F49 HydrophobicContact CE1-CD1 4.44Å; Y12-F49 HydrophobicContact CE1-CD2 4.12Å; Y12-F49 AromaticContact CE1-CG 3.77Å; Y12-F49 HydrophobicContact CE1-CG 3.77Å; Y12-F49 HydrophobicContact CG-CD1 4.28Å; Y12-F49 HydrophobicContact CG-CG 4.38Å; P45-F49 PolarHBondContact O-N 3.15Å; C46-F49 WeakPolarHBondContact O-CB 3.46Å; C46-F49 PolarHBondContact O-N 3.22Å; L47-F49 PolarHBondContact O-N 3.09Å; L47-F49 VanDerWaalsContact O-N 3.08Å
50	Y	84.2	Confident	88.5	Confident	112 Å²	112	55.9 Å²	55.9	44%	0.439	29%	0.288	S	S	.	.	H	α-helix	trans	-94.2	-30.3	-176	-76	-75.1	0	0	0	114.4	Y12 V14 I17 C46 L47	Y12-Y50 HydrophobicContact CD1-CE2 4.34Å; Y12-Y50 WeakPolarHBondContact O-CE2 3.44Å; Y12-Y50 PolarHBondContact O-OH 3.03Å; V14-Y50 HydrophobicContact CG2-CD1 4.22Å; V14-Y50 HydrophobicContact CG2-CE1 3.88Å; V14-Y50 HydrophobicContact CG2-CE2 4.4Å; I17-Y50 HydrophobicContact CD1-CD2 3.68Å; I17-Y50 HydrophobicContact CD1-CE2 3.56Å; C46-Y50 WeakPolarHBondContact O-CD2 3.46Å; L47-Y50 PolarHBondContact O-N 2.84Å
51	V	86.6	Confident	88.5	Confident	37 Å²	37	55.8 Å²	55.8	22%	0.224	29%	0.288	C	S	.	.	S	Bend	trans	-128	151.4	-171.5	-62	0	0	0	0	111.2	L47 H55 I58	L47-V51 WeakPolarHBondContact O-CG2 3.33Å; L47-V51 PolarHBondContact O-N 3.43Å; V51-H55 HydrophobicContact CB-CB 3.53Å; V51-H55 VanDerWaalsContact CB-CG 3.48Å; V51-H55 HydrophobicContact CG1-CB 4.36Å; V51-H55 HydrophobicContact CG2-CB 3.47Å; V51-H55 VanDerWaalsContact CG2-CB 3.47Å; V51-I58 HydrophobicContact CG2-CD1 4.04Å; V51-I58 HydrophobicContact CG2-CG1 4.09Å
52	H	85.7	Confident	88.7	Confident	113 Å²	113	51.8 Å²	51.8	52%	0.523	27%	0.269	S	S	.	.			trans	-59.5	155.4	175.4	60.8	88.3	0	0	0	111	N54 H55 I58	H52-N54 PolarHBondContact CE1-O 3.34Å; H52-N54 VanDerWaalsContact ND1-C 3.31Å; H52-N54 PolarHBondContact ND1-N 3.46Å; H52-N54 PolarHBondContact O-N 2.9Å; H52-H55 PolarHBondContact CE1-N 3.44Å; H52-H55 PolarHBondContact ND1-N 2.92Å; H52-H55 AromaticContact NE2-CD2 3.79Å; H52-H55 VanDerWaalsContact O-CB 3.25Å; H52-H55 WeakPolarHBondContact O-CB 3.46Å; H52-H55 PolarHBondContact O-N 3.17Å; H52-I58 WeakPolarHBondContact O-CD1 3.41Å
53	A	85.2	Confident	88.9	Confident	70 Å²	70	49.4 Å²	49.4	58%	0.579	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-27.8	-175.1	0	0	0	0	0	114
54	N	85.1	Confident	89.1	Confident	60 Å²	60	49.6 Å²	49.6	32%	0.321	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	19.7	178.2	-57.9	-23	0	0	0	113.8	H52 H91 S92	H52-N54 PolarHBondContact CE1-O 3.34Å; H52-N54 VanDerWaalsContact ND1-C 3.31Å; H52-N54 PolarHBondContact ND1-N 3.46Å; H52-N54 PolarHBondContact O-N 2.9Å; N54-H91 HydrophobicContact CB-CB 4.3Å; N54-H91 WeakPolarHBondContact CB-CD2 3.34Å; N54-H91 PolarHBondContact ND2-CD2 2.94Å; N54-H91 VanDerWaalsContact ND2-CD2 3.25Å; N54-H91 PolarHBondContact ND2-NE2 2.99Å; N54-H91 VanDerWaalsContact ND2-NE2 3.16Å; N54-S92 PolarHBondContact O-OG 2.88Å
55	H	88.2	Confident	89.3	Confident	50 Å²	50	48.6 Å²	48.6	23%	0.231	26%	0.256	C	S	.	.			trans	-76.8	139.4	-178.1	-169.6	-89	0	0	0	111.2	V51 H52 T57 I58 I88	V51-H55 HydrophobicContact CB-CB 3.53Å; V51-H55 VanDerWaalsContact CB-CG 3.48Å; V51-H55 HydrophobicContact CG1-CB 4.36Å; V51-H55 HydrophobicContact CG2-CB 3.47Å; V51-H55 VanDerWaalsContact CG2-CB 3.47Å; H52-H55 PolarHBondContact CE1-N 3.44Å; H52-H55 PolarHBondContact ND1-N 2.92Å; H52-H55 AromaticContact NE2-CD2 3.79Å; H52-H55 VanDerWaalsContact O-CB 3.25Å; H52-H55 WeakPolarHBondContact O-CB 3.46Å; H52-H55 PolarHBondContact O-N 3.17Å; H55-T57 PolarHBondContact CE1-OG1 3.21Å; H55-T57 WeakPolarHBondContact ND1-CB 3.23Å; H55-T57 PolarHBondContact ND1-N 2.92Å; H55-T57 PolarHBondContact ND1-OG1 2.88Å; H55-T57 PolarHBondContact O-N 2.87Å; H55-I58 WeakPolarHBondContact O-CB 3.39Å; H55-I58 PolarHBondContact O-N 3.41Å; H55-I88 WeakPolarHBondContact O-CG2 3.35Å
56	P	88.4	Confident	89.6	Confident	35 Å²	35	45.3 Å²	45.3	23%	0.227	23%	0.234	C	C	.	.	H	α-helix	trans	-57.1	-30.4	-176.1	20.8	-34.6	0	0	0	114.2	I58 A59 V60 M89 H93	P56-I58 VanDerWaalsContact C-N 3.28Å; P56-I58 PolarHBondContact O-N 2.9Å; P56-A59 WeakPolarHBondContact O-CB 3.49Å; P56-A59 PolarHBondContact O-N 3.17Å; P56-A59 VanDerWaalsContact O-N 3.13Å; P56-V60 WeakPolarHBondContact O-CG2 3.41Å; P56-V60 PolarHBondContact O-N 2.93Å; P56-M89 HydrophobicContact CB-CE 3.31Å; P56-H93 WeakPolarHBondContact CB-NE2 3.3Å
57	T	89.3	Confident	89.8	Confident	53 Å²	53	46.7 Å²	46.7	33%	0.325	24%	0.241	S	C	.	.	H	α-helix	trans	-61.7	-33.1	175	-47	0	0	0	0	113.4	L47 H55 V60 N61	L47-T57 HydrophobicContact CD1-CG2 4.16Å; L47-T57 HydrophobicContact CD2-CG2 3.56Å; H55-T57 PolarHBondContact CE1-OG1 3.21Å; H55-T57 WeakPolarHBondContact ND1-CB 3.23Å; H55-T57 PolarHBondContact ND1-N 2.92Å; H55-T57 PolarHBondContact ND1-OG1 2.88Å; H55-T57 PolarHBondContact O-N 2.87Å; T57-V60 PolarHBondContact O-N 3.4Å; T57-N61 PolarHBondContact O-N 3.48Å; T57-N61 VanDerWaalsContact O-N 3.07Å
58	I	91.6	Very high	90.1	Very high	5 Å²	5	46 Å²	46	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-68.2	-40.8	175.3	-63.3	176.8	0	0	0	109.6	L44 L47 K48 V51 H52 H55 P56 N61 K62 I88	L44-I58 HydrophobicContact CD1-CG2 3.95Å; L47-I58 HydrophobicContact CB-CG1 4.18Å; K48-I58 HydrophobicContact CG-CD1 4.2Å; V51-I58 HydrophobicContact CG2-CD1 4.04Å; V51-I58 HydrophobicContact CG2-CG1 4.09Å; H52-I58 WeakPolarHBondContact O-CD1 3.41Å; H55-I58 WeakPolarHBondContact O-CB 3.39Å; H55-I58 PolarHBondContact O-N 3.41Å; P56-I58 VanDerWaalsContact C-N 3.28Å; P56-I58 PolarHBondContact O-N 2.9Å; I58-N61 PolarHBondContact O-N 3.4Å; I58-K62 WeakPolarHBondContact O-CB 3.43Å; I58-K62 WeakPolarHBondContact O-CG 3.3Å; I58-K62 PolarHBondContact O-N 2.96Å; I58-I88 HydrophobicContact CB-CD1 4.29Å; I58-I88 HydrophobicContact CG2-CD1 3.71Å
59	A	92.2	Very high	90.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-44.9	174.9	0	0	0	0	0	112.2	P56 N61 K62 I63 A85 I88 M89	P56-A59 WeakPolarHBondContact O-CB 3.49Å; P56-A59 PolarHBondContact O-N 3.17Å; P56-A59 VanDerWaalsContact O-N 3.13Å; A59-N61 VanDerWaalsContact C-N 3.32Å; A59-N61 PolarHBondContact O-N 2.94Å; A59-K62 CarbonylContact O-C 3.6Å; A59-K62 WeakPolarHBondContact O-CB 3.42Å; A59-K62 PolarHBondContact O-N 2.94Å; A59-K62 VanDerWaalsContact O-N 3.14Å; A59-I63 VanDerWaalsContact O-CG1 3.31Å; A59-I63 WeakPolarHBondContact O-CG1 3.13Å; A59-I63 PolarHBondContact O-N 3.44Å; A59-A85 HydrophobicContact CB-CB 4.15Å; A59-I88 HydrophobicContact CB-CB 3.96Å; A59-I88 HydrophobicContact CB-CG2 3.75Å; A59-M89 HydrophobicContact CB-CE 3.55Å; A59-M89 HydrophobicContact CB-CG 3.67Å; A59-M89 HydrophobicContact CB-SD 4.04Å
60	V	91.5	Very high	90.5	Very high	58 Å²	58	35.9 Å²	35.9	35%	0.352	19%	0.194	S	C	.	.	H	α-helix	trans	-62	-41.3	178.5	176.8	0	0	0	0	111.3	F21 P56 T57 K62 I63 G64	F21-V60 HydrophobicContact CE2-CG1 4.01Å; F21-V60 HydrophobicContact CZ-CG1 3.63Å; P56-V60 WeakPolarHBondContact O-CG2 3.41Å; P56-V60 PolarHBondContact O-N 2.93Å; T57-V60 PolarHBondContact O-N 3.4Å; V60-K62 VanDerWaalsContact C-N 3.34Å; V60-K62 PolarHBondContact O-N 2.9Å; V60-I63 PolarHBondContact O-N 3.3Å; V60-G64 PolarHBondContact O-N 3.16Å
61	N	92.8	Very high	90.7	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.011	20%	0.202	C	C	.	.	H	α-helix	trans	-59.8	-45	173.5	177.8	-84.6	0	0	0	111.5	Y40 L43 L47 T57 I58 A59 G64 V65	Y40-N61 PolarHBondContact O-ND2 3.23Å; Y40-N61 VanDerWaalsContact O-ND2 3.09Å; L43-N61 WeakPolarHBondContact CB-ND2 3.49Å; L47-N61 HydrophobicContact CD1-CB 3.79Å; T57-N61 PolarHBondContact O-N 3.48Å; T57-N61 VanDerWaalsContact O-N 3.07Å; I58-N61 PolarHBondContact O-N 3.4Å; A59-N61 VanDerWaalsContact C-N 3.32Å; A59-N61 PolarHBondContact O-N 2.94Å; N61-G64 PolarHBondContact O-N 3.47Å; N61-V65 WeakPolarHBondContact O-CG2 3.37Å; N61-V65 PolarHBondContact O-N 3.38Å
62	K	94.1	Very high	90.9	Very high	29 Å²	29	39.2 Å²	39.2	13%	0.126	21%	0.208	C	C	.	.	H	α-helix	trans	-62.5	-40.6	176.4	-76.9	-79.3	178.2	171.4	0	113	I58 A59 V60 G64 V65 G66 N81 E84 A85	I58-K62 WeakPolarHBondContact O-CB 3.43Å; I58-K62 WeakPolarHBondContact O-CG 3.3Å; I58-K62 PolarHBondContact O-N 2.96Å; A59-K62 CarbonylContact O-C 3.6Å; A59-K62 WeakPolarHBondContact O-CB 3.42Å; A59-K62 PolarHBondContact O-N 2.94Å; A59-K62 VanDerWaalsContact O-N 3.14Å; V60-K62 VanDerWaalsContact C-N 3.34Å; V60-K62 PolarHBondContact O-N 2.9Å; K62-G64 VanDerWaalsContact C-N 3.33Å; K62-V65 PolarHBondContact O-N 3.27Å; K62-G66 PolarHBondContact O-N 3.47Å; K62-N81 HydrophobicContact CD-CB 4.36Å; K62-N81 WeakPolarHBondContact CD-OD1 3.22Å; K62-N81 PolarHBondContact NZ-OD1 3.04Å; K62-E84 WeakPolarHBondContact CE-OE2 3.35Å; K62-E84 IonicContact NZ-OE2 3.36Å; K62-E84 PolarHBondContact NZ-OE2 2.98Å; K62-A85 HydrophobicContact CB-CB 3.82Å
63	I	93.4	Very high	91.1	Very high	23 Å²	23	41.4 Å²	41.4	12%	0.118	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-43.5	173.3	-67.6	164.7	0	0	0	110.4	A59 V60 V65 G66 N67 F82 A85 V103	A59-I63 VanDerWaalsContact O-CG1 3.31Å; A59-I63 WeakPolarHBondContact O-CG1 3.13Å; A59-I63 PolarHBondContact O-N 3.44Å; V60-I63 PolarHBondContact O-N 3.3Å; I63-V65 VanDerWaalsContact C-N 3.35Å; I63-V65 PolarHBondContact O-N 3.38Å; I63-G66 PolarHBondContact O-N 2.89Å; I63-N67 PolarHBondContact O-N 3.19Å; I63-F82 HydrophobicContact CG2-CE1 4.27Å; I63-A85 HydrophobicContact CD1-CB 4.24Å; I63-A85 HydrophobicContact CG1-CB 3.61Å; I63-V103 HydrophobicContact CD1-CG2 3.51Å; I63-V103 HydrophobicContact CG1-CG2 3.85Å
64	G	92.9	Very high	91.5	Very high	5 Å²	5	42.1 Å²	42.1	5%	0.052	21%	0.206	C	C	.	.	H	α-helix	trans	-57.9	-45.2	175.3	0	0	0	0	0	112.7	V60 N61 K62 N67 L68	V60-G64 PolarHBondContact O-N 3.16Å; N61-G64 PolarHBondContact O-N 3.47Å; K62-G64 VanDerWaalsContact C-N 3.33Å; G64-N67 PolarHBondContact O-N 3.49Å; G64-L68 WeakPolarHBondContact O-CG 3.17Å; G64-L68 PolarHBondContact O-N 3.21Å; G64-L68 VanDerWaalsContact O-N 3.16Å
65	V	94.8	Very high	91.8	Very high	12 Å²	12	41.4 Å²	41.4	7%	0.073	20%	0.199	C	C	.	.	H	α-helix	trans	-62.9	-44.8	173.9	175.5	0	0	0	0	111.4	L37 Y40 N61 K62 I63 N67 L68 L69	L37-V65 HydrophobicContact CD1-CG1 3.94Å; Y40-V65 HydrophobicContact CG-CG2 4.26Å; N61-V65 WeakPolarHBondContact O-CG2 3.37Å; N61-V65 PolarHBondContact O-N 3.38Å; K62-V65 PolarHBondContact O-N 3.27Å; I63-V65 VanDerWaalsContact C-N 3.35Å; I63-V65 PolarHBondContact O-N 3.38Å; V65-N67 PolarHBondContact O-N 2.86Å; V65-L68 PolarHBondContact O-N 2.93Å; V65-L69 HydrophobicContact CG1-CD1 3.7Å; V65-L69 HydrophobicContact CG1-CG 4.3Å; V65-L69 VanDerWaalsContact O-CG 3.26Å; V65-L69 WeakPolarHBondContact O-CG 3.44Å; V65-L69 PolarHBondContact O-N 2.98Å
66	G	94.1	Very high	92.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.2	-47.9	177.1	0	0	0	0	0	112.5	K62 I63 L68 L69 E70	K62-G66 PolarHBondContact O-N 3.47Å; I63-G66 PolarHBondContact O-N 2.89Å; G66-L68 VanDerWaalsContact C-N 3.32Å; G66-L68 PolarHBondContact O-N 3.09Å; G66-L69 PolarHBondContact O-N 3.23Å; G66-L69 VanDerWaalsContact O-N 3.17Å; G66-E70 PolarHBondContact O-N 2.88Å
67	N	93	Very high	92.3	Very high	40 Å²	40	46 Å²	46	21%	0.214	22%	0.224	C	C	.	.	H	α-helix	trans	-60.2	-41.6	178.1	-73.3	-12.8	0	0	0	112.1	M28 I63 G64 V65 E70 K71 F82 H106	M28-N67 HydrophobicContact CE-CB 3.77Å; I63-N67 PolarHBondContact O-N 3.19Å; G64-N67 PolarHBondContact O-N 3.49Å; V65-N67 PolarHBondContact O-N 2.86Å; N67-E70 WeakPolarHBondContact O-CB 3.43Å; N67-E70 PolarHBondContact O-N 3.21Å; N67-K71 WeakPolarHBondContact O-CG 3.36Å; N67-K71 PolarHBondContact O-N 3.21Å; N67-K71 VanDerWaalsContact O-N 3.08Å; N67-F82 VanDerWaalsContact N-CZ 3.34Å; N67-F82 VanDerWaalsContact OD1-CE1 3.31Å; N67-F82 WeakPolarHBondContact OD1-CE1 3.43Å; N67-F82 WeakPolarHBondContact OD1-CZ 3.27Å; N67-H106 PolarHBondContact OD1-CE1 3.02Å
68	L	92.7	Very high	92.5	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-64.4	-41.8	176.1	-75.1	172.4	0	0	0	112.3	M28 Y33 A36 L37 Y40 G64 V65 G66 E70 K71 K72	M28-L68 HydrophobicContact CE-CD2 4.41Å; M28-L68 HydrophobicContact CE-CG 4.22Å; M28-L68 HydrophobicContact CG-CD1 4.32Å; M28-L68 HydrophobicContact CG-CD2 3.76Å; M28-L68 HydrophobicContact CG-CG 4.1Å; M28-L68 HydrophobicContact SD-CG 4.32Å; Y33-L68 HydrophobicContact CD1-CD2 3.55Å; Y33-L68 HydrophobicContact CG-CD2 4.19Å; A36-L68 HydrophobicContact CB-CD1 3.68Å; A36-L68 HydrophobicContact CB-CD2 3.91Å; A36-L68 HydrophobicContact CB-CG 4.41Å; L37-L68 HydrophobicContact CB-CD1 4.03Å; L37-L68 HydrophobicContact CD1-CB 4.47Å; L37-L68 HydrophobicContact CD1-CD1 4.32Å; Y40-L68 HydrophobicContact CD2-CD1 3.56Å; Y40-L68 HydrophobicContact CE2-CD1 3.88Å; G64-L68 WeakPolarHBondContact O-CG 3.17Å; G64-L68 PolarHBondContact O-N 3.21Å; G64-L68 VanDerWaalsContact O-N 3.16Å; V65-L68 PolarHBondContact O-N 2.93Å; G66-L68 VanDerWaalsContact C-N 3.32Å; G66-L68 PolarHBondContact O-N 3.09Å; L68-E70 VanDerWaalsContact C-N 3.33Å; L68-K71 PolarHBondContact O-N 3.34Å; L68-K72 WeakPolarHBondContact O-CG 3.33Å; L68-K72 PolarHBondContact O-N 3.41Å; L68-K72 VanDerWaalsContact O-N 3.07Å
69	L	92.8	Very high	92.6	Very high	7 Å²	7	46.5 Å²	46.5	4%	0.037	22%	0.221	C	C	.	.	H	α-helix	trans	-66.5	-36.6	176.9	-68.9	167	0	0	0	111.6	V65 G66 K72 K73 K74 E77 A78 N81	V65-L69 HydrophobicContact CG1-CD1 3.7Å; V65-L69 HydrophobicContact CG1-CG 4.3Å; V65-L69 VanDerWaalsContact O-CG 3.26Å; V65-L69 WeakPolarHBondContact O-CG 3.44Å; V65-L69 PolarHBondContact O-N 2.98Å; G66-L69 PolarHBondContact O-N 3.23Å; G66-L69 VanDerWaalsContact O-N 3.17Å; L69-K72 CarbonylContact O-C 3.39Å; L69-K72 PolarHBondContact O-N 3.28Å; L69-K72 VanDerWaalsContact O-N 3.15Å; L69-K73 PolarHBondContact O-N 2.66Å; L69-K73 VanDerWaalsContact O-N 3.11Å; L69-K74 HydrophobicContact CB-CB 4.23Å; L69-K74 HydrophobicContact CD2-CB 4.04Å; L69-K74 HydrophobicContact CD2-CD 3.63Å; L69-K74 PolarHBondContact O-N 3.42Å; L69-E77 HydrophobicContact CD1-CB 3.79Å; L69-E77 HydrophobicContact CD2-CB 4.2Å; L69-E77 WeakPolarHBondContact CD2-OE2 3.48Å; L69-E77 HydrophobicContact CG-CB 4.49Å; L69-A78 HydrophobicContact CB-CB 3.69Å; L69-N81 WeakPolarHBondContact CD1-ND2 3.31Å
70	E	91.1	Very high	92.7	Very high	41 Å²	41	51.6 Å²	51.6	19%	0.192	25%	0.245	C	C	.	.	H	α-helix	trans	-58.9	-47.5	172.3	-160	-175.8	160.3	0	0	110.9	G66 N67 L68 K72 K73 W75 H106 S109	G66-E70 PolarHBondContact O-N 2.88Å; N67-E70 WeakPolarHBondContact O-CB 3.43Å; N67-E70 PolarHBondContact O-N 3.21Å; L68-E70 VanDerWaalsContact C-N 3.33Å; E70-K72 PolarHBondContact O-N 3.08Å; E70-K73 PolarHBondContact O-N 3.08Å; E70-W75 HydrophobicContact CB-CZ3 4.41Å; E70-W75 HydrophobicContact CG-CE3 3.94Å; E70-W75 HydrophobicContact CG-CH2 4.21Å; E70-W75 HydrophobicContact CG-CZ3 3.32Å; E70-H106 IonicContact OE2-CE1 3.94Å; E70-H106 IonicContact OE2-CG 2.62Å; E70-H106 IonicContact OE2-ND1 2.66Å; E70-H106 PolarHBondContact OE2-ND1 2.92Å; E70-S109 PolarHBondContact OE1-OG 3.41Å
71	K	89.6	Confident	92.9	Very high	139 Å²	139	49.9 Å²	49.9	60%	0.604	23%	0.234	S	C	*	.	H	α-helix	trans	-61.9	-30.5	175.1	-65.4	-60.8	-178.7	-171.6	0	113.1	Y33 N67 L68 K73	Y33-K71 HydrophobicContact CD1-CB 4.33Å; Y33-K71 HydrophobicContact CD1-CG 4.47Å; Y33-K71 HydrophobicContact CD2-CB 4.44Å; Y33-K71 HydrophobicContact CE1-CB 4.09Å; Y33-K71 HydrophobicContact CE1-CG 3.89Å; Y33-K71 HydrophobicContact CE2-CB 4.22Å; Y33-K71 HydrophobicContact CG-CB 4.48Å; N67-K71 WeakPolarHBondContact O-CG 3.36Å; N67-K71 PolarHBondContact O-N 3.21Å; N67-K71 VanDerWaalsContact O-N 3.08Å; L68-K71 PolarHBondContact O-N 3.34Å; K71-K73 VanDerWaalsContact C-N 3.29Å
72	K	89.8	Confident	93	Very high	81 Å²	81	49.8 Å²	49.8	35%	0.352	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	6.8	174.5	-64.7	-175.8	73.6	165.3	0	113.6	D34 L68 L69 E70 K74	D34-K72 IonicContact OD1-NZ 2.78Å; D34-K72 PolarHBondContact OD1-NZ 2.88Å; L68-K72 WeakPolarHBondContact O-CG 3.33Å; L68-K72 PolarHBondContact O-N 3.41Å; L68-K72 VanDerWaalsContact O-N 3.07Å; L69-K72 CarbonylContact O-C 3.39Å; L69-K72 PolarHBondContact O-N 3.28Å; L69-K72 VanDerWaalsContact O-N 3.15Å; E70-K72 PolarHBondContact O-N 3.08Å; K72-K74 HydrophobicContact CB-CD 4.39Å; K72-K74 HydrophobicContact CB-CG 4.4Å; K72-K74 PolarHBondContact O-N 3.27Å
73	K	91	Very high	93	Very high	159 Å²	159	51.1 Å²	51.1	69%	0.691	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	23.8	-177.7	-54	-179.4	179.5	179.9	0	114.1	L69 E70 K71 W75	L69-K73 PolarHBondContact O-N 2.66Å; L69-K73 VanDerWaalsContact O-N 3.11Å; E70-K73 PolarHBondContact O-N 3.08Å; K71-K73 VanDerWaalsContact C-N 3.29Å; K73-W75 VanDerWaalsContact C-N 3.3Å; K73-W75 HydrophobicContact CB-CZ2 3.96Å; K73-W75 HydrophobicContact CG-CZ2 3.96Å; K73-W75 VanDerWaalsContact O-CD1 3.24Å; K73-W75 PolarHBondContact O-N 3.06Å; K73-W75 PolarHBondContact O-NE1 3.04Å
74	K	92.6	Very high	93	Very high	85 Å²	85	53.3 Å²	53.3	37%	0.37	25%	0.254	S	S	.	.			trans	-90	66.4	176.4	-71.8	176.7	151	-124.3	0	109.9	L69 K72 T76 E77 A78	L69-K74 HydrophobicContact CB-CB 4.23Å; L69-K74 HydrophobicContact CD2-CB 4.04Å; L69-K74 HydrophobicContact CD2-CD 3.63Å; L69-K74 PolarHBondContact O-N 3.42Å; K72-K74 HydrophobicContact CB-CD 4.39Å; K72-K74 HydrophobicContact CB-CG 4.4Å; K72-K74 PolarHBondContact O-N 3.27Å; K74-T76 PolarHBondContact O-N 2.98Å; K74-E77 HydrophobicContact CB-CB 4.39Å; K74-E77 VanDerWaalsContact NZ-CD 3.34Å; K74-E77 IonicContact NZ-OE1 3.75Å; K74-E77 PolarHBondContact NZ-OE1 3.47Å; K74-E77 IonicContact NZ-OE2 3.99Å; K74-E77 PolarHBondContact NZ-OE2 3.31Å; K74-E77 PolarHBondContact O-N 3.08Å; K74-A78 WeakPolarHBondContact O-CB 3.37Å; K74-A78 PolarHBondContact O-N 3.17Å
75	W	92.6	Very high	93	Very high	45 Å²	45	53.1 Å²	53.1	17%	0.17	25%	0.252	C	S	.	.	H	α-helix	trans	-60.6	-39.4	-168.5	-48.7	111.1	0	0	0	113.8	E70 K73 A78 K79 H113 L114	E70-W75 HydrophobicContact CB-CZ3 4.41Å; E70-W75 HydrophobicContact CG-CE3 3.94Å; E70-W75 HydrophobicContact CG-CH2 4.21Å; E70-W75 HydrophobicContact CG-CZ3 3.32Å; K73-W75 VanDerWaalsContact C-N 3.3Å; K73-W75 HydrophobicContact CB-CZ2 3.96Å; K73-W75 HydrophobicContact CG-CZ2 3.96Å; K73-W75 VanDerWaalsContact O-CD1 3.24Å; K73-W75 PolarHBondContact O-N 3.06Å; K73-W75 PolarHBondContact O-NE1 3.04Å; W75-A78 PolarHBondContact O-N 2.87Å; W75-K79 WeakPolarHBondContact O-CB 3.16Å; W75-K79 PolarHBondContact O-N 3.24Å; W75-H113 HydrophobicContact CD2-CB 3.48Å; W75-H113 VanDerWaalsContact CD2-CB 3.48Å; W75-H113 AromaticContact CD2-CG 3.85Å; W75-H113 AromaticContact CE2-CG 3.62Å; W75-H113 HydrophobicContact CE3-CB 3.88Å; W75-H113 AromaticContact CE3-CD2 3.77Å; W75-H113 AromaticContact CE3-CG 3.95Å; W75-H113 HydrophobicContact CG-CB 3.74Å; W75-H113 HydrophobicContact CH2-CB 4.41Å; W75-H113 AromaticContact CH2-CD2 3.34Å; W75-H113 WeakPolarHBondContact CH2-CD2 3.37Å; W75-H113 AromaticContact CH2-CE1 3.91Å; W75-H113 AromaticContact CH2-CG 3.69Å; W75-H113 AromaticContact CH2-NE2 3.52Å; W75-H113 HydrophobicContact CZ2-CB 4.08Å; W75-H113 AromaticContact CZ2-CD2 3.77Å; W75-H113 AromaticContact CZ2-CE1 3.95Å; W75-H113 AromaticContact CZ2-CG 3.58Å; W75-H113 AromaticContact CZ2-ND1 3.7Å; W75-H113 HydrophobicContact CZ3-CB 4.28Å; W75-H113 AromaticContact CZ3-CD2 3.3Å; W75-H113 WeakPolarHBondContact CZ3-CD2 3.32Å; W75-H113 AromaticContact CZ3-CG 3.83Å; W75-H113 AromaticContact CZ3-NE2 3.89Å; W75-L114 HydrophobicContact CB-CD1 4.33Å; W75-L114 HydrophobicContact CB-CD2 3.79Å; W75-L114 HydrophobicContact CB-CG 3.75Å
76	T	93	Very high	92.9	Very high	96 Å²	96	53.4 Å²	53.4	59%	0.589	25%	0.253	S	S	*	.	H	α-helix	trans	-63.6	-49.3	178.5	-46.9	0	0	0	0	111.8	K74 A78 K79 Q80 L114	K74-T76 PolarHBondContact O-N 2.98Å; T76-A78 VanDerWaalsContact C-N 3.34Å; T76-K79 PolarHBondContact O-N 3Å; T76-Q80 PolarHBondContact O-N 3.42Å; T76-Q80 VanDerWaalsContact O-N 3.12Å; T76-L114 WeakPolarHBondContact OG1-CD2 3.42Å
77	E	92.8	Very high	92.8	Very high	86 Å²	86	56.1 Å²	56.1	40%	0.402	28%	0.275	S	S	.	.	H	α-helix	trans	-66.8	-37.8	178.7	-62	173.2	-141.1	0	0	110.9	L69 K74 Q80 N81	L69-E77 HydrophobicContact CD1-CB 3.79Å; L69-E77 HydrophobicContact CD2-CB 4.2Å; L69-E77 WeakPolarHBondContact CD2-OE2 3.48Å; L69-E77 HydrophobicContact CG-CB 4.49Å; K74-E77 HydrophobicContact CB-CB 4.39Å; K74-E77 VanDerWaalsContact NZ-CD 3.34Å; K74-E77 IonicContact NZ-OE1 3.75Å; K74-E77 PolarHBondContact NZ-OE1 3.47Å; K74-E77 IonicContact NZ-OE2 3.99Å; K74-E77 PolarHBondContact NZ-OE2 3.31Å; K74-E77 PolarHBondContact O-N 3.08Å; E77-Q80 PolarHBondContact O-N 3.06Å; E77-N81 PolarHBondContact O-N 2.92Å; E77-N81 VanDerWaalsContact O-N 3.17Å; E77-N81 PolarHBondContact O-ND2 3.42Å
78	A	94.1	Very high	92.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.6	-51.6	176.1	0	0	0	0	0	110.9	L69 K74 W75 T76 Q80 N81 F82	L69-A78 HydrophobicContact CB-CB 3.69Å; K74-A78 WeakPolarHBondContact O-CB 3.37Å; K74-A78 PolarHBondContact O-N 3.17Å; W75-A78 PolarHBondContact O-N 2.87Å; T76-A78 VanDerWaalsContact C-N 3.34Å; A78-Q80 VanDerWaalsContact C-N 3.3Å; A78-Q80 PolarHBondContact O-N 3.39Å; A78-N81 PolarHBondContact O-N 3.47Å; A78-N81 VanDerWaalsContact O-N 3.08Å; A78-F82 HydrophobicContact CB-CD2 4.4Å; A78-F82 HydrophobicContact CB-CE2 4.04Å; A78-F82 WeakPolarHBondContact O-CD2 3.35Å; A78-F82 WeakPolarHBondContact O-CG 3.48Å; A78-F82 PolarHBondContact O-N 2.97Å
79	K	93.3	Very high	92.5	Very high	67 Å²	67	55.3 Å²	55.3	29%	0.291	27%	0.271	S	S	.	.	H	α-helix	trans	-53.6	-46.7	177	-176.9	179.6	-179.9	177.8	0	111.4	W75 T76 N81 F82 T83 I107 C110 D111 L114	W75-K79 WeakPolarHBondContact O-CB 3.16Å; W75-K79 PolarHBondContact O-N 3.24Å; T76-K79 PolarHBondContact O-N 3Å; K79-N81 VanDerWaalsContact C-N 3.34Å; K79-N81 PolarHBondContact O-N 3.36Å; K79-F82 PolarHBondContact O-N 3.48Å; K79-T83 HydrophobicContact CG-CG2 4.25Å; K79-T83 WeakPolarHBondContact O-CG2 3.08Å; K79-T83 PolarHBondContact O-N 2.62Å; K79-T83 PolarHBondContact O-OG1 3.38Å; K79-I107 HydrophobicContact CG-CG2 4.35Å; K79-C110 HydrophobicContact CB-CB 4Å; K79-D111 VanDerWaalsContact CD-OD1 3.25Å; K79-D111 WeakPolarHBondContact CD-OD1 3.49Å; K79-D111 WeakPolarHBondContact CE-OD1 3.47Å; K79-D111 IonicContact NZ-OD1 3.13Å; K79-D111 PolarHBondContact NZ-OD1 3.21Å; K79-D111 IonicContact NZ-OD2 2.6Å; K79-D111 PolarHBondContact NZ-OD2 2.92Å; K79-L114 HydrophobicContact CD-CD1 4.34Å
80	Q	95.5	Very high	92.3	Very high	108 Å²	108	58.8 Å²	58.8	51%	0.505	29%	0.286	S	S	.	.	H	α-helix	trans	-59.8	-42.8	178.6	-176.4	-179.4	-5.5	0	0	112.4	T76 E77 A78 T83 E84	T76-Q80 PolarHBondContact O-N 3.42Å; T76-Q80 VanDerWaalsContact O-N 3.12Å; E77-Q80 PolarHBondContact O-N 3.06Å; A78-Q80 VanDerWaalsContact C-N 3.3Å; A78-Q80 PolarHBondContact O-N 3.39Å; Q80-T83 WeakPolarHBondContact CA-OG1 3.25Å; Q80-T83 PolarHBondContact O-N 2.88Å; Q80-T83 PolarHBondContact O-OG1 3.24Å; Q80-E84 PolarHBondContact NE2-OE1 3.41Å; Q80-E84 VanDerWaalsContact NE2-OE1 3.08Å; Q80-E84 WeakPolarHBondContact O-CB 3.14Å; Q80-E84 WeakPolarHBondContact O-CG 3.48Å; Q80-E84 PolarHBondContact O-N 3.37Å
81	N	94.6	Very high	92.2	Very high	21 Å²	21	62.9 Å²	62.9	11%	0.112	31%	0.305	C	S	.	.	H	α-helix	trans	-67.8	-37.6	178.4	-77.8	-80.9	0	0	0	111.9	K62 L69 E77 A78 K79 A85	K62-N81 HydrophobicContact CD-CB 4.36Å; K62-N81 WeakPolarHBondContact CD-OD1 3.22Å; K62-N81 PolarHBondContact NZ-OD1 3.04Å; L69-N81 WeakPolarHBondContact CD1-ND2 3.31Å; E77-N81 PolarHBondContact O-N 2.92Å; E77-N81 VanDerWaalsContact O-N 3.17Å; E77-N81 PolarHBondContact O-ND2 3.42Å; A78-N81 PolarHBondContact O-N 3.47Å; A78-N81 VanDerWaalsContact O-N 3.08Å; K79-N81 VanDerWaalsContact C-N 3.34Å; K79-N81 PolarHBondContact O-N 3.36Å; N81-A85 WeakPolarHBondContact O-CB 3.25Å; N81-A85 PolarHBondContact O-N 3.07Å
82	F	95.3	Very high	91.9	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.4	-40.7	175	-66.7	-52.5	0	0	0	112.9	I63 N67 A78 K79 A85 L86 V103 H106 I107	I63-F82 HydrophobicContact CG2-CE1 4.27Å; N67-F82 VanDerWaalsContact N-CZ 3.34Å; N67-F82 VanDerWaalsContact OD1-CE1 3.31Å; N67-F82 WeakPolarHBondContact OD1-CE1 3.43Å; N67-F82 WeakPolarHBondContact OD1-CZ 3.27Å; A78-F82 HydrophobicContact CB-CD2 4.4Å; A78-F82 HydrophobicContact CB-CE2 4.04Å; A78-F82 WeakPolarHBondContact O-CD2 3.35Å; A78-F82 WeakPolarHBondContact O-CG 3.48Å; A78-F82 PolarHBondContact O-N 2.97Å; K79-F82 PolarHBondContact O-N 3.48Å; F82-A85 PolarHBondContact O-N 3.48Å; F82-L86 WeakPolarHBondContact O-CB 3.31Å; F82-L86 PolarHBondContact O-N 3Å; F82-V103 HydrophobicContact CB-CG1 3.93Å; F82-V103 HydrophobicContact CD1-CG1 4.4Å; F82-V103 VanDerWaalsContact O-CG1 3.31Å; F82-V103 WeakPolarHBondContact O-CG1 3.48Å; F82-H106 HydrophobicContact CD1-CB 4.12Å; F82-H106 HydrophobicContact CD2-CB 3.82Å; F82-H106 HydrophobicContact CE1-CB 3.9Å; F82-H106 AromaticContact CE1-CG 3.99Å; F82-H106 HydrophobicContact CE2-CB 3.6Å; F82-H106 HydrophobicContact CG-CB 4.08Å; F82-H106 HydrophobicContact CZ-CB 3.62Å; F82-H106 AromaticContact CZ-CG 3.77Å; F82-H106 AromaticContact CZ-ND1 3.97Å; F82-I107 HydrophobicContact CB-CD1 4.12Å; F82-I107 HydrophobicContact CB-CG1 3.58Å
83	T	94.4	Very high	91.5	Very high	58 Å²	58	58.2 Å²	58.2	36%	0.356	29%	0.291	S	S	.	.	H	α-helix	trans	-66.7	-41	177.8	54	0	0	0	0	111.8	K79 Q80 L86 A87 I107	K79-T83 HydrophobicContact CG-CG2 4.25Å; K79-T83 WeakPolarHBondContact O-CG2 3.08Å; K79-T83 PolarHBondContact O-N 2.62Å; K79-T83 PolarHBondContact O-OG1 3.38Å; Q80-T83 WeakPolarHBondContact CA-OG1 3.25Å; Q80-T83 PolarHBondContact O-N 2.88Å; Q80-T83 PolarHBondContact O-OG1 3.24Å; T83-L86 PolarHBondContact O-N 3.35Å; T83-A87 PolarHBondContact O-N 2.84Å; T83-I107 HydrophobicContact CG2-CD1 3.88Å; T83-I107 HydrophobicContact CG2-CG1 4.31Å
84	E	93.5	Very high	90.9	Very high	69 Å²	69	52.2 Å²	52.2	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-62.5	-42.8	173	-73.4	176.2	-160.8	0	0	111.6	K62 Q80 L86 A87 I88	K62-E84 WeakPolarHBondContact CE-OE2 3.35Å; K62-E84 IonicContact NZ-OE2 3.36Å; K62-E84 PolarHBondContact NZ-OE2 2.98Å; Q80-E84 PolarHBondContact NE2-OE1 3.41Å; Q80-E84 VanDerWaalsContact NE2-OE1 3.08Å; Q80-E84 WeakPolarHBondContact O-CB 3.14Å; Q80-E84 WeakPolarHBondContact O-CG 3.48Å; Q80-E84 PolarHBondContact O-N 3.37Å; E84-L86 VanDerWaalsContact C-N 3.34Å; E84-L86 PolarHBondContact O-N 3.49Å; E84-A87 PolarHBondContact O-N 3.14Å; E84-I88 WeakPolarHBondContact O-CG1 3.31Å; E84-I88 PolarHBondContact O-N 3.19Å
85	A	93	Very high	90.2	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-41.1	175.6	0	0	0	0	0	112.3	A59 K62 I63 N81 F82 I88 M89	A59-A85 HydrophobicContact CB-CB 4.15Å; K62-A85 HydrophobicContact CB-CB 3.82Å; I63-A85 HydrophobicContact CD1-CB 4.24Å; I63-A85 HydrophobicContact CG1-CB 3.61Å; N81-A85 WeakPolarHBondContact O-CB 3.25Å; N81-A85 PolarHBondContact O-N 3.07Å; F82-A85 PolarHBondContact O-N 3.48Å; A85-I88 PolarHBondContact O-N 3.23Å; A85-M89 WeakPolarHBondContact O-CB 3.19Å; A85-M89 VanDerWaalsContact O-CG 3.24Å; A85-M89 WeakPolarHBondContact O-CG 3.41Å; A85-M89 PolarHBondContact O-N 2.94Å
86	L	92.7	Very high	89.7	Confident	19 Å²	19	56 Å²	56	10%	0.099	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-46.9	178.1	-178.6	63.7	0	0	0	111.1	F82 T83 E84 I88 M89 E90 R100 V103 M104 I107	F82-L86 WeakPolarHBondContact O-CB 3.31Å; F82-L86 PolarHBondContact O-N 3Å; T83-L86 PolarHBondContact O-N 3.35Å; E84-L86 VanDerWaalsContact C-N 3.34Å; E84-L86 PolarHBondContact O-N 3.49Å; L86-I88 VanDerWaalsContact C-N 3.3Å; L86-I88 PolarHBondContact O-N 3.23Å; L86-M89 PolarHBondContact O-N 2.95Å; L86-E90 HydrophobicContact CD1-CG 4.33Å; L86-E90 HydrophobicContact CG-CG 4.44Å; L86-E90 WeakPolarHBondContact O-CB 3.25Å; L86-E90 VanDerWaalsContact O-CG 3.32Å; L86-E90 WeakPolarHBondContact O-CG 3.38Å; L86-E90 PolarHBondContact O-N 3.07Å; L86-R100 HydrophobicContact CD1-CB 4.45Å; L86-R100 HydrophobicContact CD1-CG 3.81Å; L86-V103 HydrophobicContact CB-CG1 4.01Å; L86-M104 HydrophobicContact CD2-CG 4.31Å; L86-M104 HydrophobicContact CD2-SD 3.48Å; L86-M104 WeakPolarHBondContact CD2-SD 3.44Å; L86-I107 HydrophobicContact CD2-CD1 4.02Å
87	A	91.8	Very high	89.1	Confident	56 Å²	56	54.2 Å²	54.2	46%	0.463	30%	0.298	S	S	.	.	H	α-helix	trans	-59.7	-40.5	177.7	0	0	0	0	0	112.3	T83 E84 H91	T83-A87 PolarHBondContact O-N 2.84Å; E84-A87 PolarHBondContact O-N 3.14Å; A87-H91 PolarHBondContact O-N 3.34Å
88	I	91.1	Very high	88.6	Confident	19 Å²	19	55 Å²	55	10%	0.097	31%	0.311	C	S	.	.	H	α-helix	trans	-67.4	-41.7	176.2	-66.6	169	0	0	0	111.4	H55 I58 A59 E84 A85 L86 H91 S92	H55-I88 WeakPolarHBondContact O-CG2 3.35Å; I58-I88 HydrophobicContact CB-CD1 4.29Å; I58-I88 HydrophobicContact CG2-CD1 3.71Å; A59-I88 HydrophobicContact CB-CB 3.96Å; A59-I88 HydrophobicContact CB-CG2 3.75Å; E84-I88 WeakPolarHBondContact O-CG1 3.31Å; E84-I88 PolarHBondContact O-N 3.19Å; A85-I88 PolarHBondContact O-N 3.23Å; L86-I88 VanDerWaalsContact C-N 3.3Å; L86-I88 PolarHBondContact O-N 3.23Å; I88-H91 PolarHBondContact O-N 3.46Å; I88-S92 PolarHBondContact O-N 2.83Å; I88-S92 PolarHBondContact O-OG 3.02Å
89	M	88.8	Confident	88	Confident	6 Å²	6	58.3 Å²	58.3	3%	0.03	33%	0.328	C	S	.	.	H	α-helix	trans	-65.3	-43.3	178.1	-72.7	-77.4	83.2	0	0	112.3	P56 A59 A85 L86 H91 S92 H93 L99	P56-M89 HydrophobicContact CB-CE 3.31Å; A59-M89 HydrophobicContact CB-CE 3.55Å; A59-M89 HydrophobicContact CB-CG 3.67Å; A59-M89 HydrophobicContact CB-SD 4.04Å; A85-M89 WeakPolarHBondContact O-CB 3.19Å; A85-M89 VanDerWaalsContact O-CG 3.24Å; A85-M89 WeakPolarHBondContact O-CG 3.41Å; A85-M89 PolarHBondContact O-N 2.94Å; L86-M89 PolarHBondContact O-N 2.95Å; M89-H91 VanDerWaalsContact C-N 3.25Å; M89-H91 PolarHBondContact O-N 3.1Å; M89-S92 PolarHBondContact O-N 3.14Å; M89-S92 VanDerWaalsContact O-N 3.15Å; M89-H93 PolarHBondContact O-N 3.06Å; M89-L99 HydrophobicContact SD-CD1 4.05Å
90	E	88.8	Confident	87.6	Confident	79 Å²	79	58.8 Å²	58.8	37%	0.369	33%	0.328	S	S	.	.	H	α-helix	trans	-58.7	-39.6	175.7	-75	179.2	160.6	0	0	111.4	L86 G94 R100	L86-E90 HydrophobicContact CD1-CG 4.33Å; L86-E90 HydrophobicContact CG-CG 4.44Å; L86-E90 WeakPolarHBondContact O-CB 3.25Å; L86-E90 VanDerWaalsContact O-CG 3.32Å; L86-E90 WeakPolarHBondContact O-CG 3.38Å; L86-E90 PolarHBondContact O-N 3.07Å; E90-G94 VanDerWaalsContact O-CA 3.27Å; E90-G94 WeakPolarHBondContact O-CA 3.4Å; E90-G94 PolarHBondContact O-N 3.33Å; E90-G94 VanDerWaalsContact O-N 3.16Å; E90-R100 VanDerWaalsContact CD-NH1 3.35Å; E90-R100 IonicContact OE1-CZ 2.64Å; E90-R100 IonicContact OE1-NH1 3.05Å; E90-R100 PolarHBondContact OE1-NH1 3.36Å; E90-R100 IonicContact OE1-NH2 2.96Å; E90-R100 PolarHBondContact OE1-NH2 2.93Å
91	H	87.6	Confident	87.2	Confident	127 Å²	127	57 Å²	57	59%	0.588	33%	0.332	S	S	*	.	H	α-helix	trans	-69.5	-35.8	175.7	-169.6	85	0	0	0	113.2	N54 A87 I88 M89	N54-H91 HydrophobicContact CB-CB 4.3Å; N54-H91 WeakPolarHBondContact CB-CD2 3.34Å; N54-H91 PolarHBondContact ND2-CD2 2.94Å; N54-H91 VanDerWaalsContact ND2-CD2 3.25Å; N54-H91 PolarHBondContact ND2-NE2 2.99Å; N54-H91 VanDerWaalsContact ND2-NE2 3.16Å; A87-H91 PolarHBondContact O-N 3.34Å; I88-H91 PolarHBondContact O-N 3.46Å; M89-H91 VanDerWaalsContact C-N 3.25Å; M89-H91 PolarHBondContact O-N 3.1Å
92	S	84.4	Confident	87	Confident	41 Å²	41	58.3 Å²	58.3	29%	0.287	34%	0.343	S	S	.	.	H	α-helix	trans	-84.5	-43.8	-174	-58.5	0	0	0	0	114.2	N54 I88 M89	N54-S92 PolarHBondContact O-OG 2.88Å; I88-S92 PolarHBondContact O-N 2.83Å; I88-S92 PolarHBondContact O-OG 3.02Å; M89-S92 PolarHBondContact O-N 3.14Å; M89-S92 VanDerWaalsContact O-N 3.15Å
93	H	80	Confident	86.8	Confident	82 Å²	82	58.4 Å²	58.4	38%	0.38	34%	0.343	S	S	.	.	H	α-helix	trans	-116	-5.6	-170.5	-62.4	-66.7	0	0	0	113.3	P56 M89 H97	P56-H93 WeakPolarHBondContact CB-NE2 3.3Å; M89-H93 PolarHBondContact O-N 3.06Å; H93-H97 HydrophobicContact CB-CB 3.67Å; H93-H97 AromaticContact CG-CD2 3.66Å; H93-H97 AromaticContact ND1-CD2 3.97Å
94	G	79.2	Confident	86.7	Confident	32 Å²	32	59.2 Å²	59.2	33%	0.33	34%	0.344	S	S	.	.			trans	76.6	178.2	-170.3	0	0	0	0	0	113	E90 T96	E90-G94 VanDerWaalsContact O-CA 3.27Å; E90-G94 WeakPolarHBondContact O-CA 3.4Å; E90-G94 PolarHBondContact O-N 3.33Å; E90-G94 VanDerWaalsContact O-N 3.16Å; G94-T96 VanDerWaalsContact C-N 3.27Å; G94-T96 PolarHBondContact O-N 3.21Å
95	S	78.6	Confident	86.7	Confident	82 Å²	82	62.6 Å²	62.6	57%	0.573	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-6.3	-174	54.3	0	0	0	0	114.9	R100	S95-R100 WeakPolarHBondContact O-CD 3.36Å
96	T	80.7	Confident	86.6	Confident	129 Å²	129	64.7 Å²	64.7	79%	0.791	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-3.9	-175.2	53.5	0	0	0	0	113.9	G94	G94-T96 VanDerWaalsContact C-N 3.27Å; G94-T96 PolarHBondContact O-N 3.21Å
97	H	81.3	Confident	86.7	Confident	57 Å²	57	64.4 Å²	64.4	26%	0.264	37%	0.368	S	S	.	.			trans	-68.3	133.6	-174.6	-164.3	-92	0	0	0	112.1	H93 L99 R100	H93-H97 HydrophobicContact CB-CB 3.67Å; H93-H97 AromaticContact CG-CD2 3.66Å; H93-H97 AromaticContact ND1-CD2 3.97Å; H97-L99 VanDerWaalsContact CE1-CD1 3.46Å; H97-L99 WeakPolarHBondContact CE1-CD1 3.24Å; H97-L99 VanDerWaalsContact CE1-CG 3.47Å; H97-L99 WeakPolarHBondContact CE1-CG 3.39Å; H97-L99 WeakPolarHBondContact ND1-CB 3.46Å; H97-L99 PolarHBondContact ND1-N 3.45Å; H97-L99 PolarHBondContact O-N 3.49Å; H97-L99 VanDerWaalsContact O-N 3.12Å; H97-R100 WeakPolarHBondContact O-CB 3.46Å; H97-R100 PolarHBondContact O-N 3.33Å
98	P	82	Confident	86.7	Confident	104 Å²	104	64.5 Å²	64.5	68%	0.675	37%	0.365	S	S	*	.	H	α-helix	trans	-55.1	-33.5	-178.6	-28.2	34.8	0	0	0	114.7	R100 A101	P98-R100 PolarHBondContact O-N 2.86Å; P98-A101 PolarHBondContact O-N 3.03Å; P98-A101 VanDerWaalsContact O-N 3.12Å
99	L	80.9	Confident	86.8	Confident	68 Å²	68	65 Å²	65	36%	0.356	37%	0.37	S	S	.	.	H	α-helix	trans	-60.5	-25.2	176.5	-67.4	174.3	0	0	0	113	M89 H97 A101 S102 V103	M89-L99 HydrophobicContact SD-CD1 4.05Å; H97-L99 VanDerWaalsContact CE1-CD1 3.46Å; H97-L99 WeakPolarHBondContact CE1-CD1 3.24Å; H97-L99 VanDerWaalsContact CE1-CG 3.47Å; H97-L99 WeakPolarHBondContact CE1-CG 3.39Å; H97-L99 WeakPolarHBondContact ND1-CB 3.46Å; H97-L99 PolarHBondContact ND1-N 3.45Å; H97-L99 PolarHBondContact O-N 3.49Å; H97-L99 VanDerWaalsContact O-N 3.12Å; L99-A101 VanDerWaalsContact C-N 3.32Å; L99-A101 PolarHBondContact O-N 3.06Å; L99-S102 PolarHBondContact O-N 2.96Å; L99-V103 WeakPolarHBondContact O-CG2 3.39Å; L99-V103 PolarHBondContact O-N 2.99Å
100	R	85.6	Confident	86.9	Confident	77 Å²	77	64.7 Å²	64.7	29%	0.291	37%	0.369	S	S	.	.	H	α-helix	trans	-55.5	-49.2	173.7	-177.4	-168	179.3	90.1	14.8	110.8	L86 E90 S95 H97 P98 S102 V103 M104	L86-R100 HydrophobicContact CD1-CB 4.45Å; L86-R100 HydrophobicContact CD1-CG 3.81Å; E90-R100 VanDerWaalsContact CD-NH1 3.35Å; E90-R100 IonicContact OE1-CZ 2.64Å; E90-R100 IonicContact OE1-NH1 3.05Å; E90-R100 PolarHBondContact OE1-NH1 3.36Å; E90-R100 IonicContact OE1-NH2 2.96Å; E90-R100 PolarHBondContact OE1-NH2 2.93Å; S95-R100 WeakPolarHBondContact O-CD 3.36Å; H97-R100 WeakPolarHBondContact O-CB 3.46Å; H97-R100 PolarHBondContact O-N 3.33Å; P98-R100 PolarHBondContact O-N 2.86Å; R100-S102 VanDerWaalsContact C-N 3.34Å; R100-S102 PolarHBondContact O-N 3.22Å; R100-V103 PolarHBondContact O-N 3.13Å; R100-M104 HydrophobicContact CG-CG 4.41Å; R100-M104 WeakPolarHBondContact O-CB 3.38Å; R100-M104 WeakPolarHBondContact O-CG 3.47Å; R100-M104 PolarHBondContact O-N 3.07Å
101	A	87.6	Confident	87	Confident	70 Å²	70	63.1 Å²	63.1	58%	0.579	36%	0.363	S	S	*	.	H	α-helix	trans	-63.1	-43.3	-176.8	0	0	0	0	0	111.1	P98 L99 M104 E105	P98-A101 PolarHBondContact O-N 3.03Å; P98-A101 VanDerWaalsContact O-N 3.12Å; L99-A101 VanDerWaalsContact C-N 3.32Å; L99-A101 PolarHBondContact O-N 3.06Å; A101-M104 PolarHBondContact O-N 2.9Å; A101-E105 PolarHBondContact O-N 3.36Å
102	S	90.1	Very high	87.2	Confident	49 Å²	49	66.7 Å²	66.7	34%	0.343	37%	0.371	S	S	.	.	H	α-helix	trans	-62.9	-46.5	176.9	173.8	0	0	0	0	112.3	L99 R100 M104 E105 H106	L99-S102 PolarHBondContact O-N 2.96Å; R100-S102 VanDerWaalsContact C-N 3.34Å; R100-S102 PolarHBondContact O-N 3.22Å; S102-M104 VanDerWaalsContact C-N 3.32Å; S102-M104 PolarHBondContact O-N 2.77Å; S102-E105 WeakPolarHBondContact O-CB 3.38Å; S102-E105 PolarHBondContact O-N 2.95Å; S102-H106 PolarHBondContact O-CD2 2.97Å; S102-H106 PolarHBondContact O-N 3.46Å; S102-H106 VanDerWaalsContact O-N 3.14Å
103	V	91	Very high	87.4	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.012	38%	0.376	C	S	.	.	H	α-helix	trans	-64.7	-38	177.9	177.8	0	0	0	0	111.5	I63 F82 L86 L99 R100 E105 H106 I107	I63-V103 HydrophobicContact CD1-CG2 3.51Å; I63-V103 HydrophobicContact CG1-CG2 3.85Å; F82-V103 HydrophobicContact CB-CG1 3.93Å; F82-V103 HydrophobicContact CD1-CG1 4.4Å; F82-V103 VanDerWaalsContact O-CG1 3.31Å; F82-V103 WeakPolarHBondContact O-CG1 3.48Å; L86-V103 HydrophobicContact CB-CG1 4.01Å; L99-V103 WeakPolarHBondContact O-CG2 3.39Å; L99-V103 PolarHBondContact O-N 2.99Å; R100-V103 PolarHBondContact O-N 3.13Å; V103-E105 VanDerWaalsContact C-N 3.31Å; V103-E105 PolarHBondContact O-N 3.34Å; V103-H106 PolarHBondContact O-N 2.9Å; V103-I107 HydrophobicContact CG1-CD1 4.1Å; V103-I107 WeakPolarHBondContact O-CG1 3.38Å; V103-I107 PolarHBondContact O-N 3.39Å
104	M	91.8	Very high	87.9	Confident	75 Å²	75	67.2 Å²	67.2	37%	0.369	37%	0.37	S	S	.	.	H	α-helix	trans	-64	-35.5	174.8	-74.6	-66	-61.9	0	0	112.7	L86 R100 A101 S102 I107 S108	L86-M104 HydrophobicContact CD2-CG 4.31Å; L86-M104 HydrophobicContact CD2-SD 3.48Å; L86-M104 WeakPolarHBondContact CD2-SD 3.44Å; R100-M104 HydrophobicContact CG-CG 4.41Å; R100-M104 WeakPolarHBondContact O-CB 3.38Å; R100-M104 WeakPolarHBondContact O-CG 3.47Å; R100-M104 PolarHBondContact O-N 3.07Å; A101-M104 PolarHBondContact O-N 2.9Å; S102-M104 VanDerWaalsContact C-N 3.32Å; S102-M104 PolarHBondContact O-N 2.77Å; M104-I107 PolarHBondContact O-N 3.36Å; M104-I107 HydrophobicContact SD-CD1 4.31Å; M104-S108 WeakPolarHBondContact O-CB 3.46Å; M104-S108 PolarHBondContact O-N 2.9Å; M104-S108 PolarHBondContact O-OG 3.42Å
105	E	92.7	Very high	88.1	Confident	141 Å²	141	71.5 Å²	71.5	66%	0.659	39%	0.386	S	S	*	.	H	α-helix	trans	-63.1	-44.8	173.6	-174.5	177.5	-175.3	0	0	111.1	A101 S102 V103 I107 S108 S109	A101-E105 PolarHBondContact O-N 3.36Å; S102-E105 WeakPolarHBondContact O-CB 3.38Å; S102-E105 PolarHBondContact O-N 2.95Å; V103-E105 VanDerWaalsContact C-N 3.31Å; V103-E105 PolarHBondContact O-N 3.34Å; E105-I107 PolarHBondContact O-N 3.48Å; E105-S108 PolarHBondContact O-N 3.43Å; E105-S109 WeakPolarHBondContact O-CB 3.31Å; E105-S109 PolarHBondContact O-N 2.98Å
106	H	92.5	Very high	87.8	Confident	44 Å²	44	69.2 Å²	69.2	20%	0.204	38%	0.375	C	S	.	.	H	α-helix	trans	-62.3	-41.4	174.8	-71.6	-71	0	0	0	112.8	N67 E70 F82 S102 V103 S108 S109 C110	N67-H106 PolarHBondContact OD1-CE1 3.02Å; E70-H106 IonicContact OE2-CE1 3.94Å; E70-H106 IonicContact OE2-CG 2.62Å; E70-H106 IonicContact OE2-ND1 2.66Å; E70-H106 PolarHBondContact OE2-ND1 2.92Å; F82-H106 HydrophobicContact CD1-CB 4.12Å; F82-H106 HydrophobicContact CD2-CB 3.82Å; F82-H106 HydrophobicContact CE1-CB 3.9Å; F82-H106 AromaticContact CE1-CG 3.99Å; F82-H106 HydrophobicContact CE2-CB 3.6Å; F82-H106 HydrophobicContact CG-CB 4.08Å; F82-H106 HydrophobicContact CZ-CB 3.62Å; F82-H106 AromaticContact CZ-CG 3.77Å; F82-H106 AromaticContact CZ-ND1 3.97Å; S102-H106 PolarHBondContact O-CD2 2.97Å; S102-H106 PolarHBondContact O-N 3.46Å; S102-H106 VanDerWaalsContact O-N 3.14Å; V103-H106 PolarHBondContact O-N 2.9Å; H106-S108 VanDerWaalsContact C-N 3.34Å; H106-S109 WeakPolarHBondContact O-CB 3.33Å; H106-S109 PolarHBondContact O-N 3.28Å; H106-C110 PolarHBondContact O-N 3.22Å; H106-C110 PolarHBondContact O-SG 3.16Å
107	I	93.3	Very high	86.7	Confident	13 Å²	13	65.3 Å²	65.3	7%	0.067	35%	0.353	C	S	.	.	H	α-helix	trans	-61.2	-45.4	174.3	-68.2	166.2	0	0	0	110.3	K79 F82 T83 L86 V103 M104 E105 S109 C110 D111	K79-I107 HydrophobicContact CG-CG2 4.35Å; F82-I107 HydrophobicContact CB-CD1 4.12Å; F82-I107 HydrophobicContact CB-CG1 3.58Å; T83-I107 HydrophobicContact CG2-CD1 3.88Å; T83-I107 HydrophobicContact CG2-CG1 4.31Å; L86-I107 HydrophobicContact CD2-CD1 4.02Å; V103-I107 HydrophobicContact CG1-CD1 4.1Å; V103-I107 WeakPolarHBondContact O-CG1 3.38Å; V103-I107 PolarHBondContact O-N 3.39Å; M104-I107 PolarHBondContact O-N 3.36Å; M104-I107 HydrophobicContact SD-CD1 4.31Å; E105-I107 PolarHBondContact O-N 3.48Å; I107-S109 VanDerWaalsContact C-N 3.34Å; I107-S109 PolarHBondContact O-N 3.36Å; I107-C110 WeakPolarHBondContact O-CB 3.5Å; I107-C110 PolarHBondContact O-N 3.34Å; I107-D111 PolarHBondContact O-N 3.25Å
108	S	92.8	Very high	85.3	Confident	57 Å²	57	65.4 Å²	65.4	40%	0.399	37%	0.369	S	S	.	.	H	α-helix	trans	-64.1	-38.4	178.5	-56.4	0	0	0	0	111.9	M104 E105 H106 D111 R112	M104-S108 WeakPolarHBondContact O-CB 3.46Å; M104-S108 PolarHBondContact O-N 2.9Å; M104-S108 PolarHBondContact O-OG 3.42Å; E105-S108 PolarHBondContact O-N 3.43Å; H106-S108 VanDerWaalsContact C-N 3.34Å; S108-D111 PolarHBondContact O-N 2.74Å; S108-R112 VanDerWaalsContact O-CG 3.27Å; S108-R112 WeakPolarHBondContact O-CG 3.43Å; S108-R112 PolarHBondContact O-N 3.19Å
109	S	92.1	Very high	83.6	Confident	30 Å²	30	68.3 Å²	68.3	21%	0.21	37%	0.374	C	S	.	.	H	α-helix	trans	-59.5	-50.3	172.1	-179.2	0	0	0	0	110.8	E70 E105 H106 I107 D111 R112 H113	E70-S109 PolarHBondContact OE1-OG 3.41Å; E105-S109 WeakPolarHBondContact O-CB 3.31Å; E105-S109 PolarHBondContact O-N 2.98Å; H106-S109 WeakPolarHBondContact O-CB 3.33Å; H106-S109 PolarHBondContact O-N 3.28Å; I107-S109 VanDerWaalsContact C-N 3.34Å; I107-S109 PolarHBondContact O-N 3.36Å; S109-D111 VanDerWaalsContact C-N 3.32Å; S109-D111 PolarHBondContact O-N 3.37Å; S109-R112 PolarHBondContact O-N 3.32Å; S109-H113 PolarHBondContact O-CD2 3.36Å; S109-H113 PolarHBondContact O-N 3.03Å
110	C	91.2	Very high	82	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-58.9	-43.1	176.7	-65.5	0	0	0	0	111.8	K79 H106 I107 H113 L114	K79-C110 HydrophobicContact CB-CB 4Å; H106-C110 PolarHBondContact O-N 3.22Å; H106-C110 PolarHBondContact O-SG 3.16Å; I107-C110 WeakPolarHBondContact O-CB 3.5Å; I107-C110 PolarHBondContact O-N 3.34Å; C110-H113 PolarHBondContact O-N 3.38Å; C110-L114 WeakPolarHBondContact O-CB 3.48Å; C110-L114 VanDerWaalsContact O-CG 3.28Å; C110-L114 WeakPolarHBondContact O-CG 3.22Å; C110-L114 PolarHBondContact O-N 2.85Å
111	D	91.9	Very high	80.1	Confident	46 Å²	46	76.8 Å²	76.8	25%	0.246	42%	0.419	C	S	.	.	H	α-helix	trans	-64.8	-39.5	178.1	-77.9	-22.1	0	0	0	112.7	K79 I107 S108 S109 H113 L114 N115	K79-D111 VanDerWaalsContact CD-OD1 3.25Å; K79-D111 WeakPolarHBondContact CD-OD1 3.49Å; K79-D111 WeakPolarHBondContact CE-OD1 3.47Å; K79-D111 IonicContact NZ-OD1 3.13Å; K79-D111 PolarHBondContact NZ-OD1 3.21Å; K79-D111 IonicContact NZ-OD2 2.6Å; K79-D111 PolarHBondContact NZ-OD2 2.92Å; I107-D111 PolarHBondContact O-N 3.25Å; S108-D111 PolarHBondContact O-N 2.74Å; S109-D111 VanDerWaalsContact C-N 3.32Å; S109-D111 PolarHBondContact O-N 3.37Å; D111-H113 VanDerWaalsContact C-N 3.32Å; D111-H113 PolarHBondContact O-N 3.31Å; D111-L114 PolarHBondContact O-N 3.38Å; D111-N115 VanDerWaalsContact O-CB 3.25Å; D111-N115 WeakPolarHBondContact O-CB 3.11Å; D111-N115 PolarHBondContact O-N 2.88Å; D111-N115 PolarHBondContact O-ND2 3.15Å
112	R	91.2	Very high	78.1	Confident	201 Å²	201	80.5 Å²	80.5	76%	0.758	43%	0.429	S	S	*	.	H	α-helix	trans	-62.1	-41.3	173.4	-73.2	174.6	67.8	-177.4	1.4	111.6	S108 S109 G116	S108-R112 VanDerWaalsContact O-CG 3.27Å; S108-R112 WeakPolarHBondContact O-CG 3.43Å; S108-R112 PolarHBondContact O-N 3.19Å; S109-R112 PolarHBondContact O-N 3.32Å; R112-G116 PolarHBondContact O-N 3.17Å
113	H	89.6	Confident	75.9	Confident	86 Å²	86	84 Å²	84	40%	0.398	45%	0.448	S	S	.	.	H	α-helix	trans	-69.4	-40	177.6	-79.2	-66.8	0	0	0	112.6	W75 S109 C110 D111 G116 S117	W75-H113 HydrophobicContact CD2-CB 3.48Å; W75-H113 VanDerWaalsContact CD2-CB 3.48Å; W75-H113 AromaticContact CD2-CG 3.85Å; W75-H113 AromaticContact CE2-CG 3.62Å; W75-H113 HydrophobicContact CE3-CB 3.88Å; W75-H113 AromaticContact CE3-CD2 3.77Å; W75-H113 AromaticContact CE3-CG 3.95Å; W75-H113 HydrophobicContact CG-CB 3.74Å; W75-H113 HydrophobicContact CH2-CB 4.41Å; W75-H113 AromaticContact CH2-CD2 3.34Å; W75-H113 WeakPolarHBondContact CH2-CD2 3.37Å; W75-H113 AromaticContact CH2-CE1 3.91Å; W75-H113 AromaticContact CH2-CG 3.69Å; W75-H113 AromaticContact CH2-NE2 3.52Å; W75-H113 HydrophobicContact CZ2-CB 4.08Å; W75-H113 AromaticContact CZ2-CD2 3.77Å; W75-H113 AromaticContact CZ2-CE1 3.95Å; W75-H113 AromaticContact CZ2-CG 3.58Å; W75-H113 AromaticContact CZ2-ND1 3.7Å; W75-H113 HydrophobicContact CZ3-CB 4.28Å; W75-H113 AromaticContact CZ3-CD2 3.3Å; W75-H113 WeakPolarHBondContact CZ3-CD2 3.32Å; W75-H113 AromaticContact CZ3-CG 3.83Å; W75-H113 AromaticContact CZ3-NE2 3.89Å; S109-H113 PolarHBondContact O-CD2 3.36Å; S109-H113 PolarHBondContact O-N 3.03Å; C110-H113 PolarHBondContact O-N 3.38Å; D111-H113 VanDerWaalsContact C-N 3.32Å; D111-H113 PolarHBondContact O-N 3.31Å; H113-G116 PolarHBondContact O-N 3.24Å; H113-S117 WeakPolarHBondContact O-CB 3.27Å; H113-S117 PolarHBondContact O-N 3.12Å; H113-S117 PolarHBondContact O-OG 3.12Å
114	L	89.6	Confident	73.5	Confident	49 Å²	49	87.4 Å²	87.4	26%	0.257	48%	0.484	S	S	.	.	H	α-helix	trans	-67.4	-41.7	176.4	-71.8	169.8	0	0	0	112.5	W75 T76 K79 C110 D111 G116 S117 G118	W75-L114 HydrophobicContact CB-CD1 4.33Å; W75-L114 HydrophobicContact CB-CD2 3.79Å; W75-L114 HydrophobicContact CB-CG 3.75Å; T76-L114 WeakPolarHBondContact OG1-CD2 3.42Å; K79-L114 HydrophobicContact CD-CD1 4.34Å; C110-L114 WeakPolarHBondContact O-CB 3.48Å; C110-L114 VanDerWaalsContact O-CG 3.28Å; C110-L114 WeakPolarHBondContact O-CG 3.22Å; C110-L114 PolarHBondContact O-N 2.85Å; D111-L114 PolarHBondContact O-N 3.38Å; L114-G116 VanDerWaalsContact C-N 3.35Å; L114-S117 WeakPolarHBondContact CA-OG 3.05Å; L114-S117 PolarHBondContact O-OG 3.16Å; L114-G118 PolarHBondContact O-N 2.6Å
115	N	83.3	Confident	71.3	Confident	122 Å²	122	91 Å²	91	65%	0.652	51%	0.505	S	S	*	.	H	α-helix	trans	-71.1	-32.6	176.7	-68.4	-13.9	0	0	0	111.8	D111	D111-N115 VanDerWaalsContact O-CB 3.25Å; D111-N115 WeakPolarHBondContact O-CB 3.11Å; D111-N115 PolarHBondContact O-N 2.88Å; D111-N115 PolarHBondContact O-ND2 3.15Å
116	G	71.6	Confident	69.1	Low	33 Å²	33	91.4 Å²	91.4	34%	0.34	52%	0.517	S	S	.	.	H	α-helix	trans	-74.7	-34.7	176.5	0	0	0	0	0	113.6	R112 H113 L114 G118 Q119	R112-G116 PolarHBondContact O-N 3.17Å; H113-G116 PolarHBondContact O-N 3.24Å; L114-G116 VanDerWaalsContact C-N 3.35Å; G116-G118 VanDerWaalsContact C-N 3.29Å; G116-G118 PolarHBondContact O-N 2.96Å; G116-Q119 PolarHBondContact O-N 3.31Å
117	S	58.5	Low	66.8	Low	48 Å²	48	93.9 Å²	93.9	34%	0.336	54%	0.539	S	S	.	.	H	α-helix	trans	-68.4	-28.5	175.2	48.8	0	0	0	0	112.7	H113 L114 Q119 L120	H113-S117 WeakPolarHBondContact O-CB 3.27Å; H113-S117 PolarHBondContact O-N 3.12Å; H113-S117 PolarHBondContact O-OG 3.12Å; L114-S117 WeakPolarHBondContact CA-OG 3.05Å; L114-S117 PolarHBondContact O-OG 3.16Å; S117-Q119 PolarHBondContact O-N 2.9Å; S117-Q119 VanDerWaalsContact O-N 3.15Å; S117-L120 PolarHBondContact O-N 3.17Å; S117-L120 VanDerWaalsContact O-N 3.12Å
118	G	52.6	Low	64.5	Low	59 Å²	59	101.2 Å²	101.2	61%	0.608	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-8.3	172.7	0	0	0	0	0	114.9	L114 G116	L114-G118 PolarHBondContact O-N 2.6Å; G116-G118 VanDerWaalsContact C-N 3.29Å; G116-G118 PolarHBondContact O-N 2.96Å
119	Q	46.4	Very low	62.4	Low	165 Å²	165	103 Å²	103	77%	0.771	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-2.1	173.8	-72.7	176.3	16.4	0	0	113.5	G116 S117	G116-Q119 PolarHBondContact O-N 3.31Å; S117-Q119 PolarHBondContact O-N 2.9Å; S117-Q119 VanDerWaalsContact O-N 3.15Å
120	L	46.4	Very low	60.3	Low	143 Å²	143	107.1 Å²	107.1	75%	0.749	63%	0.626	S	S	*	*	S	Bend	trans	-109.3	2.7	-179.1	-71.4	169.9	0	0	0	113.7	S117	S117-L120 PolarHBondContact O-N 3.17Å; S117-L120 VanDerWaalsContact O-N 3.12Å
121	E	45.9	Very low	58.3	Low	179 Å²	179	113 Å²	113	84%	0.836	67%	0.667	S	S	*	*	S	Bend	trans	-107.3	12.2	178.9	-67.1	-172.1	166.3	0	0	114.1
122	D	45	Very low	56.3	Low	148 Å²	148	116.3 Å²	116.3	79%	0.791	69%	0.694	S	S	*	*	S	Bend	trans	-113.7	14.3	179.2	-162.3	28.5	0	0	0	114.5
123	T	43.8	Very low	54.5	Low	122 Å²	122	111.8 Å²	111.8	75%	0.748	69%	0.693	S	S	*	*	S	Bend	trans	-143.2	79.7	177.6	54.5	0	0	0	0	111.4
124	G	41.6	Very low	52.9	Low	75 Å²	75	116.5 Å²	116.5	77%	0.773	72%	0.715	S	S	*	*	S	Bend	trans	-173.4	-8.3	177.2	0	0	0	0	0	121.1
125	D	44.5	Very low	51.1	Low	150 Å²	150	121.3 Å²	121.3	80%	0.802	74%	0.741	S	S	*	*	S	Bend	trans	-154.5	60.1	177.6	-146.2	5.4	0	0	0	113.7
126	T	46.6	Very low	50	Low	149 Å²	149	122.7 Å²	122.7	91%	0.914	75%	0.748	S	S	*	*			trans	-138.2	60.9	155.9	62.9	0	0	0	0	108.7
127	S	45.4	Very low	48.9	Very low	96 Å²	96	125 Å²	125	67%	0.671	76%	0.759	S	S	*	*			trans	-129.8	72.2	169.4	63.3	0	0	0	0	109.1
128	D	44.4	Very low	48.7	Very low	168 Å²	168	128.1 Å²	128.1	90%	0.898	78%	0.776	S	S	*	*	S	Bend	trans	-165.3	140.3	147.1	-106.5	-27	0	0	0	110.4
129	A	48.1	Very low	48.7	Very low	95 Å²	95	133.6 Å²	133.6	79%	0.785	79%	0.786	S	S	*	*			trans	82.4	61.6	175.9	0	0	0	0	0	117.9
130	S	48.7	Very low	49	Very low	116 Å²	116	130.9 Å²	130.9	81%	0.811	78%	0.781	S	S	*	*	S	Bend	trans	-147.2	127.5	143.2	-76.2	0	0	0	0	110.3
131	S	49.5	Very low	49.4	Very low	124 Å²	124	129 Å²	129	87%	0.867	78%	0.78	S	S	*	*			trans	78.9	100.1	168.6	75	0	0	0	0	118.6
132	S	48.7	Very low	49.8	Very low	115 Å²	115	125.2 Å²	125.2	80%	0.804	77%	0.773	S	S	*	*			trans	176.8	94.3	148.6	159.7	0	0	0	0	111.8
133	S	54.3	Low	50.3	Low	105 Å²	105	123 Å²	123	73%	0.734	77%	0.769	S	S	*	*			trans	171.8	94.9	138.9	58.5	0	0	0	0	107.9
134	H	55.7	Low	50.7	Low	185 Å²	185	122.5 Å²	122.5	86%	0.856	77%	0.771	S	S	*	*				96.7	92.8	100.6	-97.3	53.9	0	0	0	111.2
135	D	51.4	Low	51.4	Low	150 Å²	150	127.7 Å²	127.7	80%	0.802	78%	0.775	S	S	*	*			trans	-79.4	121.3	157.7	-163.6	5.6	0	0	0	106.5
136	D	60.4	Low	51.9	Low	152 Å²	152	125.9 Å²	125.9	81%	0.813	77%	0.771	S	S	*	*			trans	-138.1	127.9	161.8	-165	24.5	0	0	0	109
137	S	49.1	Very low	52.4	Low	80 Å²	80	125.9 Å²	125.9	56%	0.559	77%	0.765	S	S	*	*			trans	-93	-176.8	-168.7	-67.8	0	0	0	0	111
138	T	54.6	Low	52.8	Low	115 Å²	115	126.4 Å²	126.4	71%	0.706	77%	0.769	S	S	*	*			trans	96	106.7	163.1	75.6	0	0	0	0	114.7
139	E	52	Low	53.3	Low	173 Å²	173	123.4 Å²	123.4	81%	0.808	76%	0.762	S	S	*	*				80	143.1	98.4	-73.8	-169.7	148.5	0	0	110.7
140	T	52.3	Low	54.1	Low	109 Å²	109	126 Å²	126	67%	0.669	77%	0.767	S	S	*	*			cis	-171	155.8	-3.5	27.9	0	0	0	0	104.8
141	S	54.7	Low	54.6	Low	103 Å²	103	129 Å²	129	72%	0.72	77%	0.769	S	S	*	*			trans	70.1	122.2	143.3	-61.8	0	0	0	0	122.2
142	S	55	Low	55.4	Low	100 Å²	100	129.6 Å²	129.6	70%	0.699	77%	0.767	S	S	*	*				65.7	107.2	125.8	82.8	0	0	0	0	117.2
143	S	54.5	Low	56.2	Low	100 Å²	100	133.8 Å²	133.8	70%	0.699	80%	0.797	S	S	*	*				107.1	154.5	77.5	61.1	0	0	0	0	110.8
144	S	53.6	Low	56.3	Low	113 Å²	113	135.2 Å²	135.2	79%	0.79	80%	0.8	S	S	*	*			trans	82.1	110.3	163.7	26.5	0	0	0	0	119.1
145	E	54.9	Low	56.4	Low	183 Å²	183	132.6 Å²	132.6	86%	0.855	80%	0.797	S	S	*	*			trans	-48.5	-170.8	153.9	-49.1	175.9	112.5	0	0	112.9
146	P	55.9	Low	56.6	Low	112 Å²	112	131.6 Å²	131.6	73%	0.727	80%	0.796	S	S	*	*			cis	-146.5	-179.5	6.9	42	-20	0	0	0	117.5
147	N	56.2	Low	56.4	Low	149 Å²	149	130.4 Å²	130.4	80%	0.797	80%	0.795	S	S	*	*			trans	51.9	119.9	144.4	-130	-3.1	0	0	0	121.3
148	S	55.5	Low	56.9	Low	107 Å²	107	133.6 Å²	133.6	75%	0.748	81%	0.81	S	S	*	*				173.8	129.8	102.3	58.4	0	0	0	0	113.2
149	S	54	Low	57	Low	106 Å²	106	134.8 Å²	134.8	74%	0.741	82%	0.817	S	S	*	*			trans	17.4	129.2	144.4	-49.8	0	0	0	0	121.6
150	T	65.2	Low	57.4	Low	148 Å²	148	132.1 Å²	132.1	91%	0.908	82%	0.818	S	S	*	*			trans	-136.4	120.9	140.9	30.1	0	0	0	0	110
151	E	58.6	Low	57.8	Low	180 Å²	180	133.8 Å²	133.8	84%	0.841	83%	0.829	S	S	*	*			trans	-64.3	153.5	171.7	-69.2	166.7	90	0	0	111.8
152	T	66.9	Low	58	Low	136 Å²	136	136.4 Å²	136.4	83%	0.834	84%	0.838	S	S	*	*				171	133.1	121	32.4	0	0	0	0	113
153	S	66.2	Low	58.3	Low	203 Å²	203	139.7 Å²	139.7	100%	1.42	85%	0.851	S	S	*	*			trans	92.2	0	171.5	-47.9	0	0	0	0	118.2

Retrieved 153 of 153 residues in 163 ms (Link to these results)

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