A0A5K4FAY8_SCHMA Loading...

MADF domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FAY8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 252 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	53.1	Low	62.9	Low	183 Å²	183	92.8 Å²	92.8	90%	0.901	52%	0.523	S	S	*	.				0	128.6	0	-86.1	172	167.6	0	0	108.1	Y3	M1-Y3 HydrophobicContact CB-CE2 4.34Å
2	Q	62.2	Low	63.1	Low	138 Å²	138	88.6 Å²	88.6	65%	0.645	50%	0.501	S	S	*	.			trans	-100.7	128.2	171	-71.3	-179.2	4.8	0	0	108.2	F10	Q2-F10 WeakPolarHBondContact CA-O 3.31Å
3	Y	61.6	Low	62.8	Low	83 Å²	83	84.7 Å²	84.7	33%	0.325	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	131.6	175.9	-59	-89.3	0	0	0	109.4	M1 K9 F10 C13 F29	M1-Y3 HydrophobicContact CB-CE2 4.34Å; Y3-K9 CarbonylContact O-C 3.59Å; Y3-K9 WeakPolarHBondContact O-CA 3.36Å; Y3-F10 PolarHBondContact N-O 2.65Å; Y3-F10 PolarHBondContact O-N 3.28Å; Y3-C13 HydrophobicContact CD1-CB 4.15Å; Y3-C13 HydrophobicContact CD2-CB 3.9Å; Y3-C13 HydrophobicContact CE1-CB 3.86Å; Y3-C13 HydrophobicContact CE2-CB 3.61Å; Y3-C13 HydrophobicContact CG-CB 4.17Å; Y3-F29 AromaticContact CD1-CE1 3.96Å; Y3-F29 HydrophobicContact CD1-CE1 3.96Å; Y3-F29 HydrophobicContact CG-CD1 4.06Å; Y3-F29 AromaticContact CG-CE1 3.92Å; Y3-F29 HydrophobicContact CG-CE1 3.92Å
4	T	64.1	Low	63	Low	96 Å²	96	87.1 Å²	87.1	59%	0.589	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	118.1	176.3	-56.3	0	0	0	0	110.1	R8	T4-R8 CarbonylContact C-O 3.57Å; T4-R8 VanDerWaalsContact CA-O 3.3Å; T4-R8 WeakPolarHBondContact CA-O 3.48Å
5	V	60.6	Low	63	Low	35 Å²	35	86.7 Å²	86.7	21%	0.212	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	117.5	175.8	177.6	0	0	0	0	108.5	G7 R8 F10 F29 V38 I40	V5-G7 PolarHBondContact O-N 3.14Å; V5-R8 PolarHBondContact N-O 3.44Å; V5-R8 PolarHBondContact O-N 2.9Å; V5-F10 HydrophobicContact CB-CD2 4.11Å; V5-F10 HydrophobicContact CB-CE2 3.69Å; V5-F10 HydrophobicContact CG2-CD2 4.18Å; V5-F10 HydrophobicContact CG2-CE2 4.22Å; V5-F29 HydrophobicContact CG2-CD1 3.95Å; V5-F29 HydrophobicContact CG2-CD2 4.04Å; V5-F29 HydrophobicContact CG2-CE1 3.96Å; V5-F29 HydrophobicContact CG2-CE2 4.06Å; V5-F29 HydrophobicContact CG2-CG 3.97Å; V5-F29 HydrophobicContact CG2-CZ 4.02Å; V5-V38 HydrophobicContact CG1-CG1 4.49Å; V5-I40 HydrophobicContact CB-CD1 4.17Å; V5-I40 HydrophobicContact CG1-CD1 3.35Å; V5-I40 HydrophobicContact CG1-CG1 4.39Å; V5-I40 HydrophobicContact CG2-CD1 3.71Å
6	G	66.2	Low	62.9	Low	84 Å²	84	85 Å²	85	87%	0.866	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	34.5	178.5	0	0	0	0	0	113.8	R8	G6-R8 VanDerWaalsContact C-N 3.31Å; G6-R8 PolarHBondContact O-N 3.35Å
7	G	67.4	Low	62.6	Low	69 Å²	69	84.8 Å²	84.8	71%	0.711	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	-2.4	-177.8	0	0	0	0	0	115.4	V5	V5-G7 PolarHBondContact O-N 3.14Å
8	R	58.5	Low	62.2	Low	149 Å²	149	81.2 Å²	81.2	56%	0.562	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	138.8	176.4	-62.3	-177.1	-176.6	-169.5	-1.7	110.9	T4 V5 G6 F10	T4-R8 CarbonylContact C-O 3.57Å; T4-R8 VanDerWaalsContact CA-O 3.3Å; T4-R8 WeakPolarHBondContact CA-O 3.48Å; V5-R8 PolarHBondContact N-O 3.44Å; V5-R8 PolarHBondContact O-N 2.9Å; G6-R8 VanDerWaalsContact C-N 3.31Å; G6-R8 PolarHBondContact O-N 3.35Å; R8-F10 HydrophobicContact CB-CE2 3.74Å; R8-F10 HydrophobicContact CB-CZ 4.11Å; R8-F10 VanDerWaalsContact O-CD2 3.29Å; R8-F10 WeakPolarHBondContact O-CD2 3.39Å; R8-F10 VanDerWaalsContact O-CE2 3.29Å; R8-F10 WeakPolarHBondContact O-CE2 3.22Å
9	K	67.4	Low	61.8	Low	125 Å²	125	85.2 Å²	85.2	54%	0.543	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	142.1	177.5	-65.6	178	170.6	-167.2	0	110.4	Y3 N31	Y3-K9 CarbonylContact O-C 3.59Å; Y3-K9 WeakPolarHBondContact O-CA 3.36Å; K9-N31 PolarHBondContact O-ND2 3.45Å
10	F	66.1	Low	61.6	Low	5 Å²	5	85.7 Å²	85.7	2%	0.022	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	142.7	178.4	-63.5	-94.6	0	0	0	109.2	Q2 Y3 V5 R8 F29 N31 V38	Q2-F10 WeakPolarHBondContact CA-O 3.31Å; Y3-F10 PolarHBondContact N-O 2.65Å; Y3-F10 PolarHBondContact O-N 3.28Å; V5-F10 HydrophobicContact CB-CD2 4.11Å; V5-F10 HydrophobicContact CB-CE2 3.69Å; V5-F10 HydrophobicContact CG2-CD2 4.18Å; V5-F10 HydrophobicContact CG2-CE2 4.22Å; R8-F10 HydrophobicContact CB-CE2 3.74Å; R8-F10 HydrophobicContact CB-CZ 4.11Å; R8-F10 VanDerWaalsContact O-CD2 3.29Å; R8-F10 WeakPolarHBondContact O-CD2 3.39Å; R8-F10 VanDerWaalsContact O-CE2 3.29Å; R8-F10 WeakPolarHBondContact O-CE2 3.22Å; F10-F29 HydrophobicContact CB-CB 3.98Å; F10-F29 HydrophobicContact CB-CD1 4.39Å; F10-F29 HydrophobicContact CD1-CB 3.55Å; F10-F29 HydrophobicContact CD2-CB 4.2Å; F10-F29 HydrophobicContact CE1-CB 4.07Å; F10-F29 HydrophobicContact CG-CB 3.64Å; F10-F29 HydrophobicContact CG-CG 4.49Å; F10-N31 HydrophobicContact CD1-CB 3.78Å; F10-N31 HydrophobicContact CE1-CB 4.14Å; F10-V38 HydrophobicContact CE1-CB 4.14Å; F10-V38 HydrophobicContact CE1-CG2 3.73Å; F10-V38 HydrophobicContact CZ-CB 4.12Å; F10-V38 HydrophobicContact CZ-CG2 3.57Å
11	S	65.1	Low	61.4	Low	54 Å²	54	89.8 Å²	89.8	38%	0.378	50%	0.499	S	S	.	.	S	Bend	trans	-88	-29.8	-173.2	-58.3	0	0	0	0	112.1	H30	S11-H30 PolarHBondContact N-O 3.04Å
12	T	64.6	Low	61.7	Low	42 Å²	42	82.3 Å²	82.3	26%	0.258	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	148.5	-177.5	52.2	0	0	0	0	111.1	F29 H30	T12-F29 WeakPolarHBondContact O-CA 3.47Å; T12-H30 PolarHBondContact N-O 3.43Å; T12-H30 PolarHBondContact O-N 3.28Å; T12-H30 WeakPolarHBondContact OG1-CB 3.44Å
13	C	59.7	Low	61.8	Low	38 Å²	38	83.1 Å²	83.1	26%	0.257	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	117.2	172.2	-180	0	0	0	0	108	Y3 S28 F29	Y3-C13 HydrophobicContact CD1-CB 4.15Å; Y3-C13 HydrophobicContact CD2-CB 3.9Å; Y3-C13 HydrophobicContact CE1-CB 3.86Å; Y3-C13 HydrophobicContact CE2-CB 3.61Å; Y3-C13 HydrophobicContact CG-CB 4.17Å; C13-S28 CarbonylContact C-O 3.57Å; C13-S28 WeakPolarHBondContact CA-O 3.45Å; C13-F29 HydrophobicContact CB-CD1 3.94Å; C13-F29 HydrophobicContact CB-CE1 3.88Å; C13-F29 VanDerWaalsContact SG-CE1 3.58Å
14	H	65.6	Low	61.4	Low	118 Å²	118	79.7 Å²	79.7	55%	0.546	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	114.1	173	-71.1	-91.7	0	0	0	109.2	S16 S28	H14-S16 PolarHBondContact O-N 3.16Å; H14-S28 PolarHBondContact N-O 3.42Å; H14-S28 PolarHBondContact O-N 3.13Å
15	L	62.9	Low	61.3	Low	81 Å²	81	77.3 Å²	77.3	42%	0.424	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	110.7	172.7	-168.6	71.9	0	0	0	109	Y25 F26 C27 A47	L15-Y25 HydrophobicContact CD1-CD1 4.46Å; L15-Y25 HydrophobicContact CD1-CG 4.01Å; L15-Y25 HydrophobicContact CD2-CD1 4.49Å; L15-F26 CarbonylContact C-O 3.51Å; L15-C27 WeakPolarHBondContact CD1-SG 3.39Å; L15-A47 HydrophobicContact CD1-CB 4.49Å
16	S	62	Low	61.3	Low	60 Å²	60	78 Å²	78	42%	0.42	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	118.5	168.9	-57.5	0	0	0	0	108.8	H14 S18 F26	H14-S16 PolarHBondContact O-N 3.16Å; S16-S18 PolarHBondContact O-N 3.16Å; S16-S18 VanDerWaalsContact O-N 3.16Å; S16-F26 PolarHBondContact N-O 3.12Å; S16-F26 PolarHBondContact O-N 3.32Å
17	V	56.4	Low	61.2	Low	81 Å²	81	74.3 Å²	74.3	49%	0.491	40%	0.396	S	S	.	.			trans	-71.8	108.4	175	-178.7	0	0	0	0	107.8	H19 Y25	V17-H19 PolarHBondContact O-N 2.75Å; V17-Y25 HydrophobicContact CG2-CE1 4.5Å
18	S	56	Low	61	Low	21 Å²	21	72.5 Å²	72.5	15%	0.147	37%	0.373	C	S	.	.			trans	-67.7	133	158.2	49	0	0	0	0	108	S16 S22 S24	S16-S18 PolarHBondContact O-N 3.16Å; S16-S18 VanDerWaalsContact O-N 3.16Å; S18-S22 WeakPolarHBondContact O-CB 3.42Å; S18-S22 WeakPolarHBondContact OG-CB 3.28Å; S18-S22 PolarHBondContact OG-OG 3.04Å; S18-S24 PolarHBondContact OG-O 3.13Å
19	H	55.2	Low	61.4	Low	157 Å²	157	66.4 Å²	66.4	73%	0.727	35%	0.35	S	S	*	.			trans	5.7	137.2	170.1	-122.5	73.9	0	0	0	116.7	V17 H21 S22	V17-H19 PolarHBondContact O-N 2.75Å; H19-H21 PolarHBondContact O-N 2.76Å; H19-S22 VanDerWaalsContact O-CB 3.27Å; H19-S22 WeakPolarHBondContact O-CB 3.46Å; H19-S22 PolarHBondContact O-N 3.12Å
20	S	56.9	Low	61.2	Low	94 Å²	94	62.2 Å²	62.2	66%	0.657	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.7	-32.9	-176	-42.1	0	0	0	0	115.3	R44	S20-R44 PolarHBondContact O-NH1 3.4Å
21	H	57.8	Low	61.1	Low	173 Å²	173	63 Å²	63	80%	0.801	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	1.2	180	-60.2	-80.2	0	0	0	116	H19	H19-H21 PolarHBondContact O-N 2.76Å
22	S	59.7	Low	60.9	Low	26 Å²	26	66.6 Å²	66.6	18%	0.182	35%	0.347	C	S	.	.			trans	-76.2	135.4	179	-174.3	0	0	0	0	111.1	S18 H19 S24 R44	S18-S22 WeakPolarHBondContact O-CB 3.42Å; S18-S22 WeakPolarHBondContact OG-CB 3.28Å; S18-S22 PolarHBondContact OG-OG 3.04Å; H19-S22 VanDerWaalsContact O-CB 3.27Å; H19-S22 WeakPolarHBondContact O-CB 3.46Å; H19-S22 PolarHBondContact O-N 3.12Å; S22-S24 PolarHBondContact O-N 3.46Å; S22-S24 PolarHBondContact OG-N 2.94Å; S22-S24 PolarHBondContact OG-O 3.15Å; S22-S24 PolarHBondContact OG-OG 3.17Å; S22-R44 PolarHBondContact O-NH1 2.95Å
23	K	63.5	Low	60.5	Low	154 Å²	154	73.2 Å²	73.2	67%	0.67	38%	0.378	S	S	*	.	S	Bend	trans	-80.3	3.4	174.5	-65.7	-176.1	-178.7	178.4	0	112.7	R44	K23-R44 PolarHBondContact O-N 3.39Å
24	S	54.2	Low	60.6	Low	12 Å²	12	75.3 Å²	75.3	8%	0.084	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	162.4	-176.3	58.6	0	0	0	0	112	S18 S22 N41 T42	S18-S24 PolarHBondContact OG-O 3.13Å; S22-S24 PolarHBondContact O-N 3.46Å; S22-S24 PolarHBondContact OG-N 2.94Å; S22-S24 PolarHBondContact OG-O 3.15Å; S22-S24 PolarHBondContact OG-OG 3.17Å; S24-N41 WeakPolarHBondContact CB-OD1 3.18Å; S24-N41 PolarHBondContact OG-ND2 3.05Å; S24-N41 PolarHBondContact OG-OD1 3.34Å; S24-T42 CarbonylContact C-O 3.42Å; S24-T42 VanDerWaalsContact CA-O 3.24Å; S24-T42 WeakPolarHBondContact CA-O 3.5Å; S24-T42 WeakPolarHBondContact CB-O 3.44Å
25	Y	61.1	Low	60.2	Low	46 Å²	46	75.9 Å²	75.9	18%	0.18	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	153.1	168.2	-61.8	-72.2	0	0	0	109	L15 V17 N41 T42 R44 A47	L15-Y25 HydrophobicContact CD1-CD1 4.46Å; L15-Y25 HydrophobicContact CD1-CG 4.01Å; L15-Y25 HydrophobicContact CD2-CD1 4.49Å; V17-Y25 HydrophobicContact CG2-CE1 4.5Å; Y25-N41 WeakPolarHBondContact O-CA 3.36Å; Y25-N41 PolarHBondContact O-OD1 3.11Å; Y25-T42 PolarHBondContact N-O 3.42Å; Y25-T42 PolarHBondContact O-N 3.21Å; Y25-T42 PolarHBondContact O-OG1 2.93Å; Y25-R44 HydrophobicContact CD2-CB 4.43Å; Y25-R44 HydrophobicContact CD2-CG 3.8Å; Y25-R44 HydrophobicContact CE1-CG 4.2Å; Y25-R44 HydrophobicContact CE2-CB 3.98Å; Y25-R44 HydrophobicContact CE2-CG 3.09Å; Y25-R44 WeakPolarHBondContact OH-CG 3.35Å; Y25-R44 PolarHBondContact OH-NE 2.73Å; Y25-A47 HydrophobicContact CD2-CB 3.52Å; Y25-A47 HydrophobicContact CE2-CB 4.14Å; Y25-A47 HydrophobicContact CG-CB 4.37Å
26	F	62.2	Low	59.5	Low	49 Å²	49	74.3 Å²	74.3	22%	0.215	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	121	166.8	-75.3	-80.6	0	0	0	108.3	L15 S16 M39 N41	L15-F26 CarbonylContact C-O 3.51Å; S16-F26 PolarHBondContact N-O 3.12Å; S16-F26 PolarHBondContact O-N 3.32Å; F26-M39 HydrophobicContact CB-CG 4.48Å; F26-M39 HydrophobicContact CD1-CG 3.83Å; F26-M39 HydrophobicContact CD1-SD 3.6Å; F26-M39 HydrophobicContact CE1-SD 4.09Å; F26-M39 HydrophobicContact CG-SD 4.34Å; F26-N41 HydrophobicContact CE1-CB 4.3Å
27	C	63.8	Low	59.3	Low	6 Å²	6	75.8 Å²	75.8	4%	0.041	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	119.3	169.1	-64.1	0	0	0	0	108.1	L15 F29 M39 I40 T42	L15-C27 WeakPolarHBondContact CD1-SG 3.39Å; C27-F29 HydrophobicContact CB-CD2 4.2Å; C27-F29 HydrophobicContact CB-CE2 3.41Å; C27-F29 VanDerWaalsContact CB-CE2 3.41Å; C27-F29 HydrophobicContact CB-CZ 3.81Å; C27-M39 CarbonylContact O-C 3.56Å; C27-M39 WeakPolarHBondContact O-CA 3.33Å; C27-I40 PolarHBondContact N-O 3.29Å; C27-I40 PolarHBondContact O-N 3.15Å; C27-T42 PolarHBondContact SG-OG1 3.33Å
28	S	63	Low	59.5	Low	32 Å²	32	74.3 Å²	74.3	22%	0.224	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	113.3	171.5	-68.3	0	0	0	0	108.8	C13 H14 V38	C13-S28 CarbonylContact C-O 3.57Å; C13-S28 WeakPolarHBondContact CA-O 3.45Å; H14-S28 PolarHBondContact N-O 3.42Å; H14-S28 PolarHBondContact O-N 3.13Å; S28-V38 CarbonylContact C-O 3.51Å; S28-V38 WeakPolarHBondContact CA-O 3.03Å
29	F	65.5	Low	60	Low	20 Å²	20	78 Å²	78	9%	0.088	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	125.7	177.2	-63.1	-91.4	0	0	0	109.2	Y3 V5 F10 T12 C13 C27 S37 V38 I40	Y3-F29 AromaticContact CD1-CE1 3.96Å; Y3-F29 HydrophobicContact CD1-CE1 3.96Å; Y3-F29 HydrophobicContact CG-CD1 4.06Å; Y3-F29 AromaticContact CG-CE1 3.92Å; Y3-F29 HydrophobicContact CG-CE1 3.92Å; V5-F29 HydrophobicContact CG2-CD1 3.95Å; V5-F29 HydrophobicContact CG2-CD2 4.04Å; V5-F29 HydrophobicContact CG2-CE1 3.96Å; V5-F29 HydrophobicContact CG2-CE2 4.06Å; V5-F29 HydrophobicContact CG2-CG 3.97Å; V5-F29 HydrophobicContact CG2-CZ 4.02Å; F10-F29 HydrophobicContact CB-CB 3.98Å; F10-F29 HydrophobicContact CB-CD1 4.39Å; F10-F29 HydrophobicContact CD1-CB 3.55Å; F10-F29 HydrophobicContact CD2-CB 4.2Å; F10-F29 HydrophobicContact CE1-CB 4.07Å; F10-F29 HydrophobicContact CG-CB 3.64Å; F10-F29 HydrophobicContact CG-CG 4.49Å; T12-F29 WeakPolarHBondContact O-CA 3.47Å; C13-F29 HydrophobicContact CB-CD1 3.94Å; C13-F29 HydrophobicContact CB-CE1 3.88Å; C13-F29 VanDerWaalsContact SG-CE1 3.58Å; C27-F29 HydrophobicContact CB-CD2 4.2Å; C27-F29 HydrophobicContact CB-CE2 3.41Å; C27-F29 VanDerWaalsContact CB-CE2 3.41Å; C27-F29 HydrophobicContact CB-CZ 3.81Å; F29-S37 CarbonylContact O-C 3.59Å; F29-S37 VanDerWaalsContact O-CA 3.26Å; F29-S37 WeakPolarHBondContact O-CA 3.39Å; F29-V38 HydrophobicContact CB-CB 4.48Å; F29-V38 PolarHBondContact N-O 2.94Å; F29-V38 PolarHBondContact O-N 2.94Å; F29-I40 HydrophobicContact CD2-CD1 3.77Å; F29-I40 HydrophobicContact CD2-CG1 3.93Å; F29-I40 HydrophobicContact CE2-CB 4.12Å; F29-I40 HydrophobicContact CE2-CD1 3.34Å; F29-I40 HydrophobicContact CE2-CG1 3.72Å; F29-I40 HydrophobicContact CZ-CD1 4.16Å
30	H	63.6	Low	60.5	Low	37 Å²	37	72.9 Å²	72.9	17%	0.171	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	132.4	179.2	177.6	83.1	0	0	0	110.7	S11 T12 H32 D35 S37	S11-H30 PolarHBondContact N-O 3.04Å; T12-H30 PolarHBondContact N-O 3.43Å; T12-H30 PolarHBondContact O-N 3.28Å; T12-H30 WeakPolarHBondContact OG1-CB 3.44Å; H30-H32 AromaticContact CD2-CD2 3.89Å; H30-H32 AromaticContact CD2-CE1 3.65Å; H30-H32 AromaticContact CD2-CG 3.84Å; H30-H32 AromaticContact CD2-ND1 3.7Å; H30-H32 AromaticContact CD2-NE2 3.76Å; H30-H32 AromaticContact NE2-CE1 3.62Å; H30-H32 AromaticContact NE2-CG 3.8Å; H30-H32 AromaticContact NE2-ND1 3.35Å; H30-H32 PolarHBondContact NE2-ND1 3.49Å; H30-D35 IonicContact CE1-OD1 3.57Å; H30-D35 PolarHBondContact CE1-OD1 2.74Å; H30-S37 PolarHBondContact ND1-OG 3.15Å
31	N	63.6	Low	60.8	Low	22 Å²	22	71 Å²	71	12%	0.118	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	108.6	174.9	-179	-32.9	0	0	0	108.7	K9 F10 M33 T34 D35 C36	K9-N31 PolarHBondContact O-ND2 3.45Å; F10-N31 HydrophobicContact CD1-CB 3.78Å; F10-N31 HydrophobicContact CE1-CB 4.14Å; N31-M33 PolarHBondContact O-N 3.25Å; N31-M33 WeakPolarHBondContact OD1-CA 3.47Å; N31-M33 VanDerWaalsContact OD1-CB 3.32Å; N31-M33 WeakPolarHBondContact OD1-CB 3.27Å; N31-M33 PolarHBondContact OD1-N 3.28Å; N31-T34 PolarHBondContact O-N 3.02Å; N31-T34 PolarHBondContact OD1-N 2.97Å; N31-D35 WeakPolarHBondContact O-CA 3.44Å; N31-D35 PolarHBondContact O-N 3.2Å; N31-C36 PolarHBondContact N-O 3.25Å; N31-C36 PolarHBondContact O-N 3.41Å
32	H	62	Low	60.9	Low	129 Å²	129	63.8 Å²	63.8	60%	0.597	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-20.4	180	-81.1	-69	0	0	0	114.1	H30	H30-H32 AromaticContact CD2-CD2 3.89Å; H30-H32 AromaticContact CD2-CE1 3.65Å; H30-H32 AromaticContact CD2-CG 3.84Å; H30-H32 AromaticContact CD2-ND1 3.7Å; H30-H32 AromaticContact CD2-NE2 3.76Å; H30-H32 AromaticContact NE2-CE1 3.62Å; H30-H32 AromaticContact NE2-CG 3.8Å; H30-H32 AromaticContact NE2-ND1 3.35Å; H30-H32 PolarHBondContact NE2-ND1 3.49Å
33	M	56.5	Low	60.7	Low	182 Å²	182	66.3 Å²	66.3	90%	0.897	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-27.8	178.5	-66.7	-171	152.4	0	0	113.1	N31	N31-M33 PolarHBondContact O-N 3.25Å; N31-M33 WeakPolarHBondContact OD1-CA 3.47Å; N31-M33 VanDerWaalsContact OD1-CB 3.32Å; N31-M33 WeakPolarHBondContact OD1-CB 3.27Å; N31-M33 PolarHBondContact OD1-N 3.28Å
34	T	61.1	Low	60.2	Low	81 Å²	81	64.2 Å²	64.2	50%	0.497	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	3.5	-174	66.9	0	0	0	0	113.3	N31 C36	N31-T34 PolarHBondContact O-N 3.02Å; N31-T34 PolarHBondContact OD1-N 2.97Å; T34-C36 PolarHBondContact O-N 2.85Å; T34-C36 PolarHBondContact O-SG 3.34Å; T34-C36 VanDerWaalsContact OG1-CB 3.22Å; T34-C36 WeakPolarHBondContact OG1-CB 3.34Å; T34-C36 PolarHBondContact OG1-SG 2.96Å
35	D	58.3	Low	59.9	Low	130 Å²	130	73.6 Å²	73.6	70%	0.695	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	26.1	-171.2	-157.4	26.5	0	0	0	113.5	H30 N31	H30-D35 IonicContact CE1-OD1 3.57Å; H30-D35 PolarHBondContact CE1-OD1 2.74Å; N31-D35 WeakPolarHBondContact O-CA 3.44Å; N31-D35 PolarHBondContact O-N 3.2Å
36	C	46.3	Very low	59.6	Low	49 Å²	49	74.3 Å²	74.3	33%	0.331	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	128	-175.2	-73.1	0	0	0	0	109.9	N31 T34	N31-C36 PolarHBondContact N-O 3.25Å; N31-C36 PolarHBondContact O-N 3.41Å; T34-C36 PolarHBondContact O-N 2.85Å; T34-C36 PolarHBondContact O-SG 3.34Å; T34-C36 VanDerWaalsContact OG1-CB 3.22Å; T34-C36 WeakPolarHBondContact OG1-CB 3.34Å; T34-C36 PolarHBondContact OG1-SG 2.96Å
37	S	58.9	Low	58.8	Low	90 Å²	90	73.3 Å²	73.3	63%	0.629	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.7	127.4	172	-62.1	0	0	0	0	110.7	F29 H30	F29-S37 CarbonylContact O-C 3.59Å; F29-S37 VanDerWaalsContact O-CA 3.26Å; F29-S37 WeakPolarHBondContact O-CA 3.39Å; H30-S37 PolarHBondContact ND1-OG 3.15Å
38	V	60.3	Low	57.5	Low	51 Å²	51	78 Å²	78	31%	0.309	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.3	176.2	176.9	0	0	0	0	109.3	V5 F10 S28 F29 I40	V5-V38 HydrophobicContact CG1-CG1 4.49Å; F10-V38 HydrophobicContact CE1-CB 4.14Å; F10-V38 HydrophobicContact CE1-CG2 3.73Å; F10-V38 HydrophobicContact CZ-CB 4.12Å; F10-V38 HydrophobicContact CZ-CG2 3.57Å; S28-V38 CarbonylContact C-O 3.51Å; S28-V38 WeakPolarHBondContact CA-O 3.03Å; F29-V38 HydrophobicContact CB-CB 4.48Å; F29-V38 PolarHBondContact N-O 2.94Å; F29-V38 PolarHBondContact O-N 2.94Å; V38-I40 HydrophobicContact CG1-CG1 4.03Å
39	M	67.5	Low	56.2	Low	97 Å²	97	81.2 Å²	81.2	48%	0.478	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.6	176.9	-161.7	-175.7	-65.4	0	0	110.2	F26 C27	F26-M39 HydrophobicContact CB-CG 4.48Å; F26-M39 HydrophobicContact CD1-CG 3.83Å; F26-M39 HydrophobicContact CD1-SD 3.6Å; F26-M39 HydrophobicContact CE1-SD 4.09Å; F26-M39 HydrophobicContact CG-SD 4.34Å; C27-M39 CarbonylContact O-C 3.56Å; C27-M39 WeakPolarHBondContact O-CA 3.33Å
40	I	64.7	Low	54.9	Low	50 Å²	50	84.6 Å²	84.6	26%	0.256	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128	178.4	-48.5	-180	0	0	0	109	V5 C27 F29 V38 T42	V5-I40 HydrophobicContact CB-CD1 4.17Å; V5-I40 HydrophobicContact CG1-CD1 3.35Å; V5-I40 HydrophobicContact CG1-CG1 4.39Å; V5-I40 HydrophobicContact CG2-CD1 3.71Å; C27-I40 PolarHBondContact N-O 3.29Å; C27-I40 PolarHBondContact O-N 3.15Å; F29-I40 HydrophobicContact CD2-CD1 3.77Å; F29-I40 HydrophobicContact CD2-CG1 3.93Å; F29-I40 HydrophobicContact CE2-CB 4.12Å; F29-I40 HydrophobicContact CE2-CD1 3.34Å; F29-I40 HydrophobicContact CE2-CG1 3.72Å; F29-I40 HydrophobicContact CZ-CD1 4.16Å; V38-I40 HydrophobicContact CG1-CG1 4.03Å; I40-T42 HydrophobicContact CB-CG2 4.33Å; I40-T42 HydrophobicContact CG2-CG2 3.83Å; I40-T42 PolarHBondContact O-N 3.09Å
41	N	64.4	Low	53.3	Low	55 Å²	55	92.9 Å²	92.9	29%	0.294	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	101.5	169.1	-167.4	32.5	0	0	0	108.9	S24 Y25 F26 R125	S24-N41 WeakPolarHBondContact CB-OD1 3.18Å; S24-N41 PolarHBondContact OG-ND2 3.05Å; S24-N41 PolarHBondContact OG-OD1 3.34Å; Y25-N41 WeakPolarHBondContact O-CA 3.36Å; Y25-N41 PolarHBondContact O-OD1 3.11Å; F26-N41 HydrophobicContact CE1-CB 4.3Å; N41-R125 PolarHBondContact ND2-NH2 3.28Å
42	T	59.7	Low	51.9	Low	21 Å²	21	99.4 Å²	99.4	13%	0.129	55%	0.549	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	130.4	-178.9	50.8	0	0	0	0	109.8	S24 Y25 C27 I40	S24-T42 CarbonylContact C-O 3.42Å; S24-T42 VanDerWaalsContact CA-O 3.24Å; S24-T42 WeakPolarHBondContact CA-O 3.5Å; S24-T42 WeakPolarHBondContact CB-O 3.44Å; Y25-T42 PolarHBondContact N-O 3.42Å; Y25-T42 PolarHBondContact O-N 3.21Å; Y25-T42 PolarHBondContact O-OG1 2.93Å; C27-T42 PolarHBondContact SG-OG1 3.33Å; I40-T42 HydrophobicContact CB-CG2 4.33Å; I40-T42 HydrophobicContact CG2-CG2 3.83Å; I40-T42 PolarHBondContact O-N 3.09Å
43	P	54.2	Low	50.5	Low	80 Å²	80	98.4 Å²	98.4	52%	0.519	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-56.4	143.7	170.4	4.3	-9.1	0	0	0	110.4	K45 S46	P43-K45 PolarHBondContact O-N 3.4Å; P43-S46 WeakPolarHBondContact CD-OG 3.45Å; P43-S46 WeakPolarHBondContact CG-OG 3.37Å; P43-S46 PolarHBondContact O-N 2.98Å; P43-S46 PolarHBondContact O-OG 2.79Å
44	R	52.8	Low	49.7	Very low	109 Å²	109	95.4 Å²	95.4	41%	0.411	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-30	-176.6	-127.2	172.8	174.6	160.1	-11.4	113.9	S20 S22 K23 Y25	S20-R44 PolarHBondContact O-NH1 3.4Å; S22-R44 PolarHBondContact O-NH1 2.95Å; K23-R44 PolarHBondContact O-N 3.39Å; Y25-R44 HydrophobicContact CD2-CB 4.43Å; Y25-R44 HydrophobicContact CD2-CG 3.8Å; Y25-R44 HydrophobicContact CE1-CG 4.2Å; Y25-R44 HydrophobicContact CE2-CB 3.98Å; Y25-R44 HydrophobicContact CE2-CG 3.09Å; Y25-R44 WeakPolarHBondContact OH-CG 3.35Å; Y25-R44 PolarHBondContact OH-NE 2.73Å
45	K	49.2	Very low	48.7	Very low	209 Å²	209	97.6 Å²	97.6	91%	0.909	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-16.2	178	-67	-171.4	174.3	-171.2	0	115.2	P43	P43-K45 PolarHBondContact O-N 3.4Å
46	S	53.2	Low	47.7	Very low	62 Å²	62	97.5 Å²	97.5	43%	0.434	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.6	-13.2	-172.2	60.6	0	0	0	0	114.4	P43 C48	P43-S46 WeakPolarHBondContact CD-OG 3.45Å; P43-S46 WeakPolarHBondContact CG-OG 3.37Å; P43-S46 PolarHBondContact O-N 2.98Å; P43-S46 PolarHBondContact O-OG 2.79Å; S46-C48 VanDerWaalsContact C-N 3.3Å; S46-C48 PolarHBondContact O-N 3.08Å
47	A	45.5	Very low	47.3	Very low	27 Å²	27	100 Å²	100	22%	0.223	59%	0.586	C	S	.	*	T	Hydrogen-bonded Turn	trans	-76.7	-9.7	-169.7	0	0	0	0	0	115	L15 Y25	L15-A47 HydrophobicContact CD1-CB 4.49Å; Y25-A47 HydrophobicContact CD2-CB 3.52Å; Y25-A47 HydrophobicContact CE2-CB 4.14Å; Y25-A47 HydrophobicContact CG-CB 4.37Å
48	C	36.6	Very low	46.4	Very low	104 Å²	104	104.6 Å²	104.6	70%	0.703	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.1	42.9	-178	-60.5	0	0	0	0	113.1	S46 S50	S46-C48 VanDerWaalsContact C-N 3.3Å; S46-C48 PolarHBondContact O-N 3.08Å; C48-S50 PolarHBondContact O-N 3.39Å
49	A	36.2	Very low	45.2	Very low	101 Å²	101	108.9 Å²	108.9	84%	0.835	62%	0.624	S	S	*	*			trans	-76.2	62.2	167.8	0	0	0	0	0	110.5
50	S	38.8	Very low	43.9	Very low	91 Å²	91	109.8 Å²	109.8	64%	0.636	64%	0.637	S	S	*	*			trans	-100.9	118.5	161	-153.8	0	0	0	0	106.5	C48 L52	C48-S50 PolarHBondContact O-N 3.39Å; S50-L52 PolarHBondContact O-N 3.29Å; S50-L52 VanDerWaalsContact O-N 3.08Å
51	K	29.7	Very low	42.7	Very low	211 Å²	211	113.6 Å²	113.6	92%	0.917	66%	0.663	S	S	*	*			trans	-43	107	-173.9	-69.3	174.5	172.1	-171.2	0	112.7
52	L	34	Very low	42.3	Very low	159 Å²	159	116.1 Å²	116.1	83%	0.832	68%	0.682	S	S	*	*			trans	-136.4	134.1	156.8	-80.4	168.7	0	0	0	108.1	S50	S50-L52 PolarHBondContact O-N 3.29Å; S50-L52 VanDerWaalsContact O-N 3.08Å
53	P	32.9	Very low	41.7	Very low	108 Å²	108	120.1 Å²	120.1	70%	0.701	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-67.3	153.4	-175.7	28.8	-33	0	0	0	110.9
54	P	39.6	Very low	41	Very low	118 Å²	118	122.1 Å²	122.1	77%	0.766	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-70.3	131.2	-176.4	29.4	-31.7	0	0	0	110
55	P	40.6	Very low	40.6	Very low	128 Å²	128	122.8 Å²	122.8	83%	0.831	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-74.7	125.3	162.1	3.2	13	0	0	0	108.5
56	T	36.5	Very low	40.2	Very low	128 Å²	128	119.2 Å²	119.2	79%	0.785	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-64	150.6	171.2	30.6	0	0	0	0	111.8
57	S	37.7	Very low	39.2	Very low	102 Å²	102	127.4 Å²	127.4	71%	0.713	76%	0.755	S	S	*	*			trans	71.7	97.5	158.2	-56.5	0	0	0	0	117.9
58	Q	40.6	Very low	38.7	Very low	186 Å²	186	133.6 Å²	133.6	87%	0.869	78%	0.78	S	S	*	*				173.9	128.1	106.6	-90.5	164.4	90.1	0	0	109.7	P60	Q58-P60 WeakPolarHBondContact O-CD 3.42Å
59	T	34.2	Very low	38.6	Very low	141 Å²	141	132.6 Å²	132.6	87%	0.865	77%	0.774	S	S	*	*			trans	-83.4	126.3	178.2	-57.6	0	0	0	0	109.8
60	P	41.8	Very low	38.4	Very low	116 Å²	116	133.3 Å²	133.3	75%	0.753	76%	0.764	S	S	*	*			trans	-122.2	132	150.8	12.5	9.6	0	0	0	110.8	Q58	Q58-P60 WeakPolarHBondContact O-CD 3.42Å
61	T	39.6	Very low	38.6	Very low	130 Å²	130	137.4 Å²	137.4	80%	0.798	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-52.8	136.5	-176.7	-28.8	0	0	0	0	113
62	P	54.5	Low	39.2	Very low	107 Å²	107	134.7 Å²	134.7	70%	0.695	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-75.9	143.9	177.4	29.5	-32	0	0	0	111.9
63	P	46.7	Very low	39.6	Very low	105 Å²	105	133.5 Å²	133.5	68%	0.682	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-69	157.7	173.4	29.8	-32.9	0	0	0	111.1	T65	P63-T65 PolarHBondContact O-N 3.43Å; P63-T65 VanDerWaalsContact O-N 3.16Å
64	P	39.6	Very low	40.5	Very low	123 Å²	123	134.5 Å²	134.5	80%	0.799	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-62.3	120.9	-173.1	25.6	-32.7	0	0	0	110.3	T66	P64-T66 PolarHBondContact O-N 3.29Å
65	T	46.1	Very low	41.7	Very low	123 Å²	123	132 Å²	132	76%	0.755	75%	0.749	S	S	*	*			trans	-70.5	100.5	177.3	-63.6	0	0	0	0	108.8	P63 R67	P63-T65 PolarHBondContact O-N 3.43Å; P63-T65 VanDerWaalsContact O-N 3.16Å; T65-R67 PolarHBondContact O-N 2.94Å; T65-R67 VanDerWaalsContact O-N 3.16Å
66	T	40.7	Very low	43.6	Very low	134 Å²	134	136.6 Å²	136.6	82%	0.822	75%	0.75	S	S	*	*			trans	-56.4	119	165.8	-50.6	0	0	0	0	108.3	P64 Q68	P64-T66 PolarHBondContact O-N 3.29Å; T66-Q68 PolarHBondContact O-N 2.95Å
67	R	32.3	Very low	45.8	Very low	234 Å²	234	133 Å²	133	88%	0.883	72%	0.722	S	S	*	*			trans	-26.2	109.4	-178.3	-74.6	175	167	-179.8	-3.9	113.4	T65 S69	T65-R67 PolarHBondContact O-N 2.94Å; T65-R67 VanDerWaalsContact O-N 3.16Å; R67-S69 VanDerWaalsContact C-N 3.3Å; R67-S69 PolarHBondContact O-N 3.37Å
68	Q	35.2	Very low	48.1	Very low	156 Å²	156	130.6 Å²	130.6	73%	0.729	70%	0.703	S	S	*	*			trans	-62.8	98.9	154.7	-86.7	179.2	-4	0	0	107.2	T66 N70	T66-Q68 PolarHBondContact O-N 2.95Å; Q68-N70 PolarHBondContact O-N 3.46Å
69	S	32.7	Very low	50.3	Low	83 Å²	83	126.3 Å²	126.3	58%	0.58	69%	0.69	S	S	*	*			trans	-55.7	103.4	169.4	56.1	0	0	0	0	109.1	R67 M71	R67-S69 VanDerWaalsContact C-N 3.3Å; R67-S69 PolarHBondContact O-N 3.37Å; S69-M71 WeakPolarHBondContact O-CG 3.15Å; S69-M71 PolarHBondContact O-N 3Å
70	N	33.3	Very low	52.9	Low	117 Å²	117	124.9 Å²	124.9	63%	0.626	67%	0.673	S	S	*	*			trans	32.2	65.9	137.4	-155.3	0.8	0	0	0	116.3	Q68	Q68-N70 PolarHBondContact O-N 3.46Å
71	M	43.2	Very low	55.2	Low	176 Å²	176	119.4 Å²	119.4	87%	0.867	64%	0.638	S	S	*	*			trans	-102.6	24.8	175.4	-64.9	-132	174.4	0	0	113.2	S69	S69-M71 WeakPolarHBondContact O-CG 3.15Å; S69-M71 PolarHBondContact O-N 3Å
72	N	41.7	Very low	57.6	Low	155 Å²	155	113.9 Å²	113.9	83%	0.829	61%	0.605	S	S	*	*			trans	-114.3	20.4	174	-131.7	18.3	0	0	0	112.7	V74	N72-V74 PolarHBondContact O-N 3.42Å
73	M	42.9	Very low	59.2	Low	133 Å²	133	113 Å²	113	66%	0.655	60%	0.595	S	S	*	*	S	Bend	trans	-69.7	117.4	160.5	-72.6	-161.5	175.5	0	0	107.5	T75	M73-T75 PolarHBondContact O-N 3.06Å; M73-T75 PolarHBondContact O-OG1 3.25Å; M73-T75 VanDerWaalsContact O-OG1 3.09Å
74	V	51.5	Low	61.3	Low	130 Å²	130	110.3 Å²	110.3	79%	0.788	57%	0.573	S	S	*	*			trans	-59.8	82.7	167.2	179.4	0	0	0	0	107	N72 R76	N72-V74 PolarHBondContact O-N 3.42Å; V74-R76 PolarHBondContact O-N 3.47Å
75	T	65.2	Low	63.8	Low	66 Å²	66	104.4 Å²	104.4	41%	0.405	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-66.4	122.1	-177	-56	0	0	0	0	104.9	M73 P124 R126	M73-T75 PolarHBondContact O-N 3.06Å; M73-T75 PolarHBondContact O-OG1 3.25Å; M73-T75 VanDerWaalsContact O-OG1 3.09Å; T75-P124 HydrophobicContact CG2-CG 4.41Å; T75-R126 PolarHBondContact O-NH1 3.24Å; T75-R126 PolarHBondContact O-NH2 2.89Å
76	R	79.7	Confident	65.9	Low	224 Å²	224	98.9 Å²	98.9	85%	0.845	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-58.8	152.3	174.7	-68.3	-178.2	172.9	-163.1	-0.9	108.6	V74 T78 R126	V74-R76 PolarHBondContact O-N 3.47Å; R76-T78 PolarHBondContact O-N 3.5Å; R76-R126 PolarHBondContact O-NH2 2.88Å; R76-R126 VanDerWaalsContact O-NH2 3.13Å
77	Y	82.6	Confident	68.3	Low	53 Å²	53	98.7 Å²	98.7	21%	0.208	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-64.9	126	171	-73.8	-93.4	0	0	0	107.7	E81 L85 R126 Q130 L131 K134	Y77-E81 WeakPolarHBondContact CA-OE2 3.09Å; Y77-E81 HydrophobicContact CD1-CG 3.81Å; Y77-E81 WeakPolarHBondContact CD1-OE1 3.5Å; Y77-E81 HydrophobicContact CE1-CG 4.4Å; Y77-E81 WeakPolarHBondContact CE1-OE1 3.38Å; Y77-L85 HydrophobicContact CE1-CD2 4.48Å; Y77-R126 HydrophobicContact CE1-CG 4.2Å; Y77-Q130 PolarHBondContact OH-O 3.43Å; Y77-L131 HydrophobicContact CE1-CD1 4.02Å; Y77-K134 HydrophobicContact CD1-CG 4.27Å; Y77-K134 HydrophobicContact CD2-CD 3.96Å; Y77-K134 HydrophobicContact CD2-CG 4.02Å; Y77-K134 HydrophobicContact CE1-CB 4.47Å; Y77-K134 HydrophobicContact CE1-CG 4.2Å; Y77-K134 HydrophobicContact CE2-CB 3.95Å; Y77-K134 HydrophobicContact CE2-CD 4.2Å; Y77-K134 HydrophobicContact CE2-CG 3.92Å; Y77-K134 HydrophobicContact CG-CD 4.32Å; Y77-K134 HydrophobicContact CG-CG 4.21Å
78	T	86.8	Confident	71.1	Confident	51 Å²	51	88.4 Å²	88.4	31%	0.313	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-67	161.8	168.4	63.2	0	0	0	0	109.4	R76 E80 E81 A82 W123	R76-T78 PolarHBondContact O-N 3.5Å; T78-E80 WeakPolarHBondContact CB-OE2 3.37Å; T78-E80 PolarHBondContact O-N 3.45Å; T78-E81 PolarHBondContact O-N 3.3Å; T78-E81 WeakPolarHBondContact OG1-CB 3.36Å; T78-E81 PolarHBondContact OG1-N 3.08Å; T78-E81 VanDerWaalsContact OG1-N 3.08Å; T78-A82 WeakPolarHBondContact O-CB 3.47Å; T78-A82 PolarHBondContact O-N 3.27Å; T78-W123 HydrophobicContact CG2-CH2 4.35Å; T78-W123 HydrophobicContact CG2-CZ3 3.73Å; T78-W123 WeakPolarHBondContact OG1-CH2 3.38Å; T78-W123 WeakPolarHBondContact OG1-CZ3 3.34Å
79	T	86.2	Confident	73.6	Confident	96 Å²	96	81 Å²	81	59%	0.589	42%	0.417	S	S	*	.	H	α-helix	trans	-61.6	-39	178.7	-57.4	0	0	0	0	110.5	A82 N83	T79-A82 PolarHBondContact O-N 3.34Å; T79-N83 WeakPolarHBondContact O-CB 3.48Å; T79-N83 PolarHBondContact O-N 3.1Å; T79-N83 PolarHBondContact O-ND2 2.96Å
80	E	88.9	Confident	76.1	Confident	111 Å²	111	80.6 Å²	80.6	52%	0.519	41%	0.408	S	S	.	.	H	α-helix	trans	-68.8	-44.2	179.2	-57.2	70.6	-150.9	0	0	111.2	T78 A82 N83 E84 W123	T78-E80 WeakPolarHBondContact CB-OE2 3.37Å; T78-E80 PolarHBondContact O-N 3.45Å; E80-A82 VanDerWaalsContact C-N 3.3Å; E80-A82 PolarHBondContact O-N 3.1Å; E80-N83 PolarHBondContact O-N 3.18Å; E80-E84 PolarHBondContact O-N 2.86Å; E80-W123 HydrophobicContact CB-CH2 3.79Å; E80-W123 HydrophobicContact CB-CZ2 3.61Å
81	E	90.2	Very high	78.7	Confident	1 Å²	1	84.4 Å²	84.4	1%	0.005	41%	0.414	C	S	.	.	H	α-helix	trans	-59.7	-43.4	174.4	-173.3	-173.3	179.9	0	0	110.4	Y77 T78 L85 W123 R126	Y77-E81 WeakPolarHBondContact CA-OE2 3.09Å; Y77-E81 HydrophobicContact CD1-CG 3.81Å; Y77-E81 WeakPolarHBondContact CD1-OE1 3.5Å; Y77-E81 HydrophobicContact CE1-CG 4.4Å; Y77-E81 WeakPolarHBondContact CE1-OE1 3.38Å; T78-E81 PolarHBondContact O-N 3.3Å; T78-E81 WeakPolarHBondContact OG1-CB 3.36Å; T78-E81 PolarHBondContact OG1-N 3.08Å; T78-E81 VanDerWaalsContact OG1-N 3.08Å; E81-L85 WeakPolarHBondContact O-CB 3.4Å; E81-L85 PolarHBondContact O-N 3.09Å; E81-W123 HydrophobicContact CB-CD2 3.76Å; E81-W123 HydrophobicContact CB-CE3 3.92Å; E81-W123 HydrophobicContact CB-CG 4.25Å; E81-W123 HydrophobicContact CB-CH2 4.43Å; E81-W123 HydrophobicContact CB-CZ2 4.27Å; E81-W123 HydrophobicContact CB-CZ3 4.27Å; E81-W123 HydrophobicContact CG-CB 4.3Å; E81-W123 HydrophobicContact CG-CD2 3.99Å; E81-W123 HydrophobicContact CG-CE3 4.34Å; E81-W123 HydrophobicContact CG-CG 3.96Å; E81-R126 WeakPolarHBondContact OE1-CG 3.38Å; E81-R126 IonicContact OE1-CZ 3.58Å; E81-R126 IonicContact OE1-NE 3.66Å; E81-R126 PolarHBondContact OE1-NE 3.46Å; E81-R126 IonicContact OE1-NH2 3.37Å; E81-R126 IonicContact OE2-CZ 2.9Å; E81-R126 IonicContact OE2-NE 2.87Å; E81-R126 IonicContact OE2-NH2 3.68Å; E81-R126 PolarHBondContact OE2-NH2 3.42Å
82	A	89.3	Confident	80.6	Confident	13 Å²	13	77.4 Å²	77.4	11%	0.107	38%	0.378	C	S	.	.	H	α-helix	trans	-68.3	-37.9	178.6	0	0	0	0	0	112.7	T78 T79 E80 L85 A86	T78-A82 WeakPolarHBondContact O-CB 3.47Å; T78-A82 PolarHBondContact O-N 3.27Å; T79-A82 PolarHBondContact O-N 3.34Å; E80-A82 VanDerWaalsContact C-N 3.3Å; E80-A82 PolarHBondContact O-N 3.1Å; A82-L85 PolarHBondContact O-N 3.44Å; A82-A86 WeakPolarHBondContact O-CB 3.25Å; A82-A86 PolarHBondContact O-N 2.96Å
83	N	89.2	Confident	82.5	Confident	90 Å²	90	75 Å²	75	48%	0.481	36%	0.357	S	S	.	.	H	α-helix	trans	-67.8	-41.5	176.9	-78	-17.1	0	0	0	111.7	T79 E80 A86 K87	T79-N83 WeakPolarHBondContact O-CB 3.48Å; T79-N83 PolarHBondContact O-N 3.1Å; T79-N83 PolarHBondContact O-ND2 2.96Å; E80-N83 PolarHBondContact O-N 3.18Å; N83-A86 WeakPolarHBondContact O-CB 2.99Å; N83-A86 PolarHBondContact O-N 3.22Å; N83-K87 WeakPolarHBondContact O-CG 3.39Å; N83-K87 PolarHBondContact O-N 3.17Å
84	E	90.6	Very high	84.1	Confident	47 Å²	47	73.6 Å²	73.6	22%	0.22	35%	0.352	C	S	.	.	H	α-helix	trans	-65	-42.3	173.9	-74.5	-56.9	130	0	0	111.7	E80 A86 K87 L88 L118	E80-E84 PolarHBondContact O-N 2.86Å; E84-A86 VanDerWaalsContact C-N 3.3Å; E84-A86 PolarHBondContact O-N 3.39Å; E84-K87 PolarHBondContact O-N 3.39Å; E84-K87 IonicContact OE1-NZ 2.73Å; E84-K87 PolarHBondContact OE1-NZ 2.93Å; E84-L88 WeakPolarHBondContact O-CG 3.08Å; E84-L88 PolarHBondContact O-N 2.85Å; E84-L118 HydrophobicContact CB-CD2 3.96Å
85	L	91.7	Very high	85.4	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-60	-41.8	172.1	179.9	59.6	0	0	0	111.6	Y77 E81 A82 L88 V89 W111 F114 L118 L131 K134 L138	Y77-L85 HydrophobicContact CE1-CD2 4.48Å; E81-L85 WeakPolarHBondContact O-CB 3.4Å; E81-L85 PolarHBondContact O-N 3.09Å; A82-L85 PolarHBondContact O-N 3.44Å; L85-L88 PolarHBondContact O-N 3.06Å; L85-V89 HydrophobicContact CD1-CG2 3.87Å; L85-V89 HydrophobicContact CG-CG2 4.24Å; L85-V89 WeakPolarHBondContact O-CB 3.3Å; L85-V89 WeakPolarHBondContact O-CG2 3.43Å; L85-V89 PolarHBondContact O-N 3Å; L85-W111 HydrophobicContact CD1-CZ3 4.24Å; L85-F114 HydrophobicContact CD1-CD2 4.37Å; L85-L118 HydrophobicContact CB-CD1 4.36Å; L85-L118 HydrophobicContact CD1-CD1 4.25Å; L85-L131 HydrophobicContact CD1-CD1 3.89Å; L85-L131 HydrophobicContact CD1-CD2 4Å; L85-L131 HydrophobicContact CD1-CG 3.72Å; L85-L131 HydrophobicContact CD2-CD1 3.78Å; L85-L131 HydrophobicContact CD2-CG 4.13Å; L85-L131 HydrophobicContact CG-CD1 4.4Å; L85-K134 HydrophobicContact CD2-CB 3.97Å; L85-K134 HydrophobicContact CD2-CG 3.74Å; L85-L138 HydrophobicContact CB-CD1 4.47Å; L85-L138 HydrophobicContact CD2-CD1 4.13Å; L85-L138 HydrophobicContact CG-CD1 4.19Å
86	A	90.1	Very high	85.8	Confident	7 Å²	7	68.2 Å²	68.2	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-60.5	-45.6	176.6	0	0	0	0	0	112	A82 N83 E84 L88 V89 L90 L138 F142	A82-A86 WeakPolarHBondContact O-CB 3.25Å; A82-A86 PolarHBondContact O-N 2.96Å; N83-A86 WeakPolarHBondContact O-CB 2.99Å; N83-A86 PolarHBondContact O-N 3.22Å; E84-A86 VanDerWaalsContact C-N 3.3Å; E84-A86 PolarHBondContact O-N 3.39Å; A86-L88 PolarHBondContact O-N 3.46Å; A86-V89 PolarHBondContact O-N 3.2Å; A86-L90 WeakPolarHBondContact O-CB 3.39Å; A86-L90 WeakPolarHBondContact O-CG 3.37Å; A86-L90 PolarHBondContact O-N 2.95Å; A86-L138 HydrophobicContact CB-CD1 4.26Å; A86-F142 HydrophobicContact CB-CE2 3.78Å; A86-F142 HydrophobicContact CB-CZ 3.64Å
87	K	90	Very high	85.4	Confident	129 Å²	129	63.6 Å²	63.6	56%	0.561	30%	0.299	S	S	*	.	H	α-helix	trans	-57.6	-47.7	176	-70.9	173.7	-172	172	0	111.6	N83 E84 V89 L90 R91	N83-K87 WeakPolarHBondContact O-CG 3.39Å; N83-K87 PolarHBondContact O-N 3.17Å; E84-K87 PolarHBondContact O-N 3.39Å; E84-K87 IonicContact OE1-NZ 2.73Å; E84-K87 PolarHBondContact OE1-NZ 2.93Å; K87-V89 PolarHBondContact O-N 3.5Å; K87-L90 PolarHBondContact O-N 2.94Å; K87-R91 VanDerWaalsContact O-CB 3.27Å; K87-R91 WeakPolarHBondContact O-CB 3.34Å; K87-R91 PolarHBondContact O-N 3.2Å
88	L	91	Very high	84.7	Confident	19 Å²	19	63.9 Å²	63.9	10%	0.099	30%	0.304	C	S	.	.	H	α-helix	trans	-60.1	-48.1	177.2	-70.1	169.6	0	0	0	111.4	E84 L85 A86 L90 R91 Y92 F114 Y117 L118	E84-L88 WeakPolarHBondContact O-CG 3.08Å; E84-L88 PolarHBondContact O-N 2.85Å; L85-L88 PolarHBondContact O-N 3.06Å; A86-L88 PolarHBondContact O-N 3.46Å; L88-L90 VanDerWaalsContact C-N 3.34Å; L88-L90 PolarHBondContact O-N 3.19Å; L88-R91 PolarHBondContact O-N 3.43Å; L88-Y92 VanDerWaalsContact O-CD2 3.3Å; L88-Y92 WeakPolarHBondContact O-CD2 3.18Å; L88-Y92 PolarHBondContact O-N 3.05Å; L88-Y92 VanDerWaalsContact O-N 3.08Å; L88-F114 HydrophobicContact CB-CD1 4.4Å; L88-F114 HydrophobicContact CB-CD2 4.15Å; L88-F114 HydrophobicContact CB-CE1 4.2Å; L88-F114 HydrophobicContact CB-CE2 3.94Å; L88-F114 HydrophobicContact CB-CG 4.39Å; L88-F114 HydrophobicContact CB-CZ 3.98Å; L88-F114 HydrophobicContact CD1-CB 4.3Å; L88-F114 HydrophobicContact CD1-CD1 4.26Å; L88-F114 HydrophobicContact CD1-CG 4.12Å; L88-F114 HydrophobicContact CD2-CD1 4.45Å; L88-F114 HydrophobicContact CD2-CE1 4.39Å; L88-Y117 HydrophobicContact CD1-CD1 3.66Å; L88-Y117 HydrophobicContact CD1-CE1 4.03Å; L88-Y117 HydrophobicContact CD2-CD1 4.27Å; L88-Y117 HydrophobicContact CD2-CE1 4.24Å; L88-Y117 HydrophobicContact CG-CD1 4.46Å; L88-Y117 HydrophobicContact CG-CE1 4.45Å; L88-L118 HydrophobicContact CD1-CD2 4.4Å; L88-L118 HydrophobicContact CD1-CG 4.41Å
89	V	88.7	Confident	83.5	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-66.6	-37.3	-176.1	172.9	0	0	0	0	111.8	L85 A86 K87 Y92 R93 W96 W111 F114 L139	L85-V89 HydrophobicContact CD1-CG2 3.87Å; L85-V89 HydrophobicContact CG-CG2 4.24Å; L85-V89 WeakPolarHBondContact O-CB 3.3Å; L85-V89 WeakPolarHBondContact O-CG2 3.43Å; L85-V89 PolarHBondContact O-N 3Å; A86-V89 PolarHBondContact O-N 3.2Å; K87-V89 PolarHBondContact O-N 3.5Å; V89-Y92 CarbonylContact O-C 3.53Å; V89-R93 PolarHBondContact O-N 2.87Å; V89-W96 PolarHBondContact O-NE1 3.04Å; V89-W111 HydrophobicContact CG2-CH2 3.68Å; V89-W111 HydrophobicContact CG2-CZ3 3.85Å; V89-F114 HydrophobicContact CG2-CD2 4.42Å; V89-F114 HydrophobicContact CG2-CE2 4.02Å; V89-L139 HydrophobicContact CG1-CD1 3.45Å; V89-L139 VanDerWaalsContact CG1-CD1 3.45Å; V89-L139 HydrophobicContact CG1-CD2 3.55Å; V89-L139 HydrophobicContact CG1-CG 3.27Å
90	L	85.7	Confident	82.2	Confident	75 Å²	75	75.7 Å²	75.7	39%	0.393	34%	0.343	S	S	.	.	H	α-helix	trans	-69.1	-40.7	173.1	-72.2	173	0	0	0	112.1	A86 K87 L88 Y92 R93 F142	A86-L90 WeakPolarHBondContact O-CB 3.39Å; A86-L90 WeakPolarHBondContact O-CG 3.37Å; A86-L90 PolarHBondContact O-N 2.95Å; K87-L90 PolarHBondContact O-N 2.94Å; L88-L90 VanDerWaalsContact C-N 3.34Å; L88-L90 PolarHBondContact O-N 3.19Å; L90-Y92 PolarHBondContact O-N 3.43Å; L90-R93 WeakPolarHBondContact O-CB 3.39Å; L90-R93 PolarHBondContact O-N 2.51Å; L90-R93 VanDerWaalsContact O-N 3.1Å; L90-F142 HydrophobicContact CD1-CD2 4.34Å; L90-F142 HydrophobicContact CD1-CE2 4.11Å; L90-F142 HydrophobicContact CD1-CZ 4.27Å; L90-F142 HydrophobicContact CD2-CD2 3.93Å; L90-F142 HydrophobicContact CD2-CE2 4.43Å; L90-F142 HydrophobicContact CD2-CG 4.3Å; L90-F142 HydrophobicContact CG-CD2 4.21Å; L90-F142 HydrophobicContact CG-CE2 4.2Å
91	R	86.6	Confident	80.5	Confident	197 Å²	197	77.4 Å²	77.4	74%	0.743	35%	0.351	S	S	*	.	H	α-helix	trans	-60.2	-35.6	177.7	-169.4	176.4	-156.8	-179.6	6.1	112.5	K87 L88	K87-R91 VanDerWaalsContact O-CB 3.27Å; K87-R91 WeakPolarHBondContact O-CB 3.34Å; K87-R91 PolarHBondContact O-N 3.2Å; L88-R91 PolarHBondContact O-N 3.43Å
92	Y	84.1	Confident	79.2	Confident	28 Å²	28	78.3 Å²	78.3	11%	0.11	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	22.3	178.2	-65.8	-79.6	0	0	0	112.8	L88 V89 L90 D94 I95 W96 L110 F114	L88-Y92 VanDerWaalsContact O-CD2 3.3Å; L88-Y92 WeakPolarHBondContact O-CD2 3.18Å; L88-Y92 PolarHBondContact O-N 3.05Å; L88-Y92 VanDerWaalsContact O-N 3.08Å; V89-Y92 CarbonylContact O-C 3.53Å; L90-Y92 PolarHBondContact O-N 3.43Å; Y92-D94 PolarHBondContact O-N 2.89Å; Y92-I95 HydrophobicContact CD1-CD1 3.53Å; Y92-I95 HydrophobicContact CD1-CG1 4.46Å; Y92-I95 HydrophobicContact CE1-CD1 4.35Å; Y92-I95 HydrophobicContact CG-CD1 4.34Å; Y92-I95 WeakPolarHBondContact O-CB 3.4Å; Y92-I95 PolarHBondContact O-N 2.9Å; Y92-W96 PolarHBondContact O-NE1 3.32Å; Y92-L110 HydrophobicContact CD1-CD1 4.32Å; Y92-L110 HydrophobicContact CD1-CD2 4.33Å; Y92-L110 HydrophobicContact CD2-CD1 4.45Å; Y92-L110 HydrophobicContact CE1-CD1 4.37Å; Y92-L110 HydrophobicContact CG-CD1 4.33Å; Y92-L110 HydrophobicContact CG-CD2 4.17Å; Y92-F114 AromaticContact CD2-CE1 3.56Å; Y92-F114 HydrophobicContact CD2-CE1 3.56Å; Y92-F114 AromaticContact CD2-CZ 3.4Å; Y92-F114 HydrophobicContact CD2-CZ 3.4Å; Y92-F114 AromaticContact CE2-CE1 3.72Å; Y92-F114 HydrophobicContact CE2-CE1 3.72Å; Y92-F114 HydrophobicContact CE2-CZ 4.07Å; Y92-F114 HydrophobicContact CG-CE1 4.38Å; Y92-F114 HydrophobicContact CG-CZ 4.02Å
93	R	82.1	Confident	78.3	Confident	104 Å²	104	80.3 Å²	80.3	39%	0.392	37%	0.37	S	S	.	.	H	α-helix	trans	-54.3	-39.9	-177.5	-172.5	-173.5	70.9	-174.5	-3.5	113.1	V89 L90 I95 W96 K97	V89-R93 PolarHBondContact O-N 2.87Å; L90-R93 WeakPolarHBondContact O-CB 3.39Å; L90-R93 PolarHBondContact O-N 2.51Å; L90-R93 VanDerWaalsContact O-N 3.1Å; R93-I95 VanDerWaalsContact C-N 3.3Å; R93-I95 PolarHBondContact O-N 3.2Å; R93-W96 PolarHBondContact O-N 3.04Å; R93-K97 HydrophobicContact CG-CD 4.37Å; R93-K97 HydrophobicContact CG-CG 4.48Å; R93-K97 PolarHBondContact O-N 2.89Å; R93-K97 VanDerWaalsContact O-N 3.09Å
94	D	76.5	Confident	77.8	Confident	105 Å²	105	80.4 Å²	80.4	56%	0.561	38%	0.378	S	S	*	.	H	α-helix	trans	-69.3	-32.3	-173.7	-56.2	-31.5	0	0	0	111.6	Y92 W96 K97 D98	Y92-D94 PolarHBondContact O-N 2.89Å; D94-W96 VanDerWaalsContact C-N 3.3Å; D94-W96 PolarHBondContact O-N 3.28Å; D94-K97 PolarHBondContact O-N 3.18Å; D94-D98 WeakPolarHBondContact O-CB 3.48Å; D94-D98 PolarHBondContact O-N 3.13Å; D94-D98 VanDerWaalsContact O-N 3.1Å
95	I	78	Confident	77.4	Confident	43 Å²	43	83.1 Å²	83.1	22%	0.221	39%	0.394	C	S	.	.	H	α-helix	trans	-59.6	-45.1	170.5	-57.5	-174.7	0	0	0	109.5	Y92 R93 K97 S102 V106 L110	Y92-I95 HydrophobicContact CD1-CD1 3.53Å; Y92-I95 HydrophobicContact CD1-CG1 4.46Å; Y92-I95 HydrophobicContact CE1-CD1 4.35Å; Y92-I95 HydrophobicContact CG-CD1 4.34Å; Y92-I95 WeakPolarHBondContact O-CB 3.4Å; Y92-I95 PolarHBondContact O-N 2.9Å; R93-I95 VanDerWaalsContact C-N 3.3Å; R93-I95 PolarHBondContact O-N 3.2Å; I95-K97 PolarHBondContact O-N 2.68Å; I95-S102 VanDerWaalsContact CG2-OG 3.25Å; I95-S102 WeakPolarHBondContact CG2-OG 3.34Å; I95-S102 WeakPolarHBondContact O-CB 3.48Å; I95-S102 PolarHBondContact O-OG 3.33Å; I95-V106 HydrophobicContact CG2-CG1 4.48Å; I95-L110 HydrophobicContact CB-CD2 4.49Å; I95-L110 HydrophobicContact CD1-CD2 3.88Å; I95-L110 HydrophobicContact CG2-CD2 4.15Å
96	W	74	Confident	77	Confident	40 Å²	40	86.4 Å²	86.4	15%	0.152	41%	0.414	C	S	.	.	H	α-helix	trans	-70.3	-31.3	-177.5	-47.8	125.2	0	0	0	113.7	V89 Y92 R93 D94 Q107 L110 W111 F114 L139	V89-W96 PolarHBondContact O-NE1 3.04Å; Y92-W96 PolarHBondContact O-NE1 3.32Å; R93-W96 PolarHBondContact O-N 3.04Å; D94-W96 VanDerWaalsContact C-N 3.3Å; D94-W96 PolarHBondContact O-N 3.28Å; W96-Q107 HydrophobicContact CE3-CG 4.02Å; W96-Q107 HydrophobicContact CZ3-CB 3.78Å; W96-Q107 HydrophobicContact CZ3-CG 3.72Å; W96-L110 HydrophobicContact CH2-CB 3.95Å; W96-L110 HydrophobicContact CH2-CD2 3.47Å; W96-L110 VanDerWaalsContact CH2-CD2 3.47Å; W96-L110 HydrophobicContact CH2-CG 3.81Å; W96-L110 HydrophobicContact CZ2-CD2 3.38Å; W96-L110 HydrophobicContact CZ2-CG 3.88Å; W96-L110 HydrophobicContact CZ3-CD2 4.24Å; W96-W111 AromaticContact CH2-CD1 3.84Å; W96-W111 AromaticContact CH2-CD2 3.99Å; W96-W111 HydrophobicContact CH2-CD2 3.99Å; W96-W111 AromaticContact CH2-CE2 3.4Å; W96-W111 HydrophobicContact CH2-CG 4.22Å; W96-W111 AromaticContact CH2-CZ2 3.74Å; W96-W111 HydrophobicContact CH2-CZ2 3.74Å; W96-W111 AromaticContact CH2-NE1 3.27Å; W96-W111 VanDerWaalsContact CH2-NE1 3.27Å; W96-W111 HydrophobicContact CZ2-CD2 4.46Å; W96-W111 AromaticContact CZ2-CE2 3.89Å; W96-W111 HydrophobicContact CZ2-CH2 4.27Å; W96-W111 AromaticContact CZ2-CZ2 3.79Å; W96-W111 HydrophobicContact CZ2-CZ2 3.79Å; W96-W111 AromaticContact CZ3-CE2 3.85Å; W96-W111 HydrophobicContact CZ3-CZ2 4.17Å; W96-W111 AromaticContact CZ3-NE1 3.35Å; W96-W111 VanDerWaalsContact CZ3-NE1 3.35Å; W96-F114 AromaticContact CZ2-CE2 3.93Å; W96-F114 HydrophobicContact CZ2-CE2 3.93Å; W96-F114 HydrophobicContact CZ2-CZ 4.2Å; W96-L139 HydrophobicContact CG-CD1 4.49Å
97	K	71.1	Confident	76.7	Confident	126 Å²	126	88 Å²	88	55%	0.548	42%	0.42	S	S	.	.	H	α-helix	trans	-77.9	-29.6	-179.4	-74.7	-170.7	173.8	-171.1	0	112.7	R93 D94 I95 K99	R93-K97 HydrophobicContact CG-CD 4.37Å; R93-K97 HydrophobicContact CG-CG 4.48Å; R93-K97 PolarHBondContact O-N 2.89Å; R93-K97 VanDerWaalsContact O-N 3.09Å; D94-K97 PolarHBondContact O-N 3.18Å; I95-K97 PolarHBondContact O-N 2.68Å; K97-K99 PolarHBondContact O-N 2.8Å
98	D	67	Low	76.5	Confident	60 Å²	60	86.5 Å²	86.5	32%	0.321	41%	0.414	S	S	.	.			trans	-75.4	94.9	-177.3	-163.5	-26.5	0	0	0	111.9	D94 K100 H101 S102	D94-D98 WeakPolarHBondContact O-CB 3.48Å; D94-D98 PolarHBondContact O-N 3.13Å; D94-D98 VanDerWaalsContact O-N 3.1Å; D98-K100 PolarHBondContact O-N 3.06Å; D98-K100 WeakPolarHBondContact OD1-CA 3.35Å; D98-K100 WeakPolarHBondContact OD1-CB 3.5Å; D98-K100 PolarHBondContact OD1-N 3.44Å; D98-H101 HydrophobicContact CB-CB 4.46Å; D98-H101 IonicContact OD1-CD2 3.05Å; D98-H101 PolarHBondContact OD1-CD2 2.87Å; D98-H101 PolarHBondContact OD1-N 3.48Å; D98-H101 IonicContact OD2-CD2 3.43Å; D98-H101 PolarHBondContact OD2-CD2 3.28Å; D98-H101 IonicContact OD2-CG 3.73Å; D98-S102 WeakPolarHBondContact O-CB 3.29Å; D98-S102 PolarHBondContact O-N 3.38Å
99	K	62.4	Low	76.4	Confident	207 Å²	207	89.5 Å²	89.5	90%	0.9	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.2	175.9	-69	-177.1	179.1	178.3	0	113	K97	K97-K99 PolarHBondContact O-N 2.8Å
100	K	59.8	Low	76.4	Confident	188 Å²	188	90 Å²	90	82%	0.817	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-33.2	-174.6	-65.4	-172	177.9	-174.9	0	112	D98	D98-K100 PolarHBondContact O-N 3.06Å; D98-K100 WeakPolarHBondContact OD1-CA 3.35Å; D98-K100 WeakPolarHBondContact OD1-CB 3.5Å; D98-K100 PolarHBondContact OD1-N 3.44Å
101	H	52.7	Low	76.7	Confident	146 Å²	146	86.6 Å²	86.6	68%	0.676	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-17.9	-173.7	-67.6	-79.2	0	0	0	114.7	D98 S103	D98-H101 HydrophobicContact CB-CB 4.46Å; D98-H101 IonicContact OD1-CD2 3.05Å; D98-H101 PolarHBondContact OD1-CD2 2.87Å; D98-H101 PolarHBondContact OD1-N 3.48Å; D98-H101 IonicContact OD2-CD2 3.43Å; D98-H101 PolarHBondContact OD2-CD2 3.28Å; D98-H101 IonicContact OD2-CG 3.73Å; H101-S103 PolarHBondContact O-N 2.97Å
102	S	61.9	Low	76.9	Confident	20 Å²	20	79.4 Å²	79.4	14%	0.14	39%	0.387	C	S	.	.			trans	-85.6	84.2	179.7	-83.9	0	0	0	0	113.6	I95 D98 S104	I95-S102 VanDerWaalsContact CG2-OG 3.25Å; I95-S102 WeakPolarHBondContact CG2-OG 3.34Å; I95-S102 WeakPolarHBondContact O-CB 3.48Å; I95-S102 PolarHBondContact O-OG 3.33Å; D98-S102 WeakPolarHBondContact O-CB 3.29Å; D98-S102 PolarHBondContact O-N 3.38Å; S102-S104 PolarHBondContact O-N 3.14Å
103	S	72.1	Confident	77.2	Confident	55 Å²	55	80 Å²	80	39%	0.385	39%	0.391	S	S	.	.			trans	-52.1	138.6	161.6	163.6	0	0	0	0	110.7	H101 L105 V106 Q107	H101-S103 PolarHBondContact O-N 2.97Å; S103-L105 PolarHBondContact O-N 3.06Å; S103-L105 VanDerWaalsContact O-N 3.07Å; S103-L105 WeakPolarHBondContact OG-CB 3.44Å; S103-L105 PolarHBondContact OG-N 3.35Å; S103-V106 WeakPolarHBondContact O-CB 3.38Å; S103-V106 PolarHBondContact O-N 3Å; S103-Q107 PolarHBondContact O-N 3.25Å
104	S	78.5	Confident	77.7	Confident	93 Å²	93	75.3 Å²	75.3	65%	0.65	37%	0.373	S	S	*	.	H	α-helix	trans	-54.3	-28.2	173.9	60.6	0	0	0	0	112.5	S102 K108	S102-S104 PolarHBondContact O-N 3.14Å; S104-K108 WeakPolarHBondContact O-CB 3.32Å; S104-K108 PolarHBondContact O-N 3.24Å
105	L	81.8	Confident	78.4	Confident	103 Å²	103	71 Å²	71	54%	0.539	35%	0.351	S	S	.	.	H	α-helix	trans	-69.5	-42.8	174	-65.3	174.4	0	0	0	112.2	S103 Q107 K108 H109	S103-L105 PolarHBondContact O-N 3.06Å; S103-L105 VanDerWaalsContact O-N 3.07Å; S103-L105 WeakPolarHBondContact OG-CB 3.44Å; S103-L105 PolarHBondContact OG-N 3.35Å; L105-Q107 VanDerWaalsContact C-N 3.34Å; L105-K108 PolarHBondContact O-N 3.42Å; L105-H109 WeakPolarHBondContact O-CB 3.49Å; L105-H109 PolarHBondContact O-N 3.43Å
106	V	82.2	Confident	79	Confident	69 Å²	69	71.8 Å²	71.8	42%	0.418	35%	0.354	S	S	.	.	H	α-helix	trans	-62.8	-45.7	176.4	174.6	0	0	0	0	109.5	I95 S103 K108 H109 L110	I95-V106 HydrophobicContact CG2-CG1 4.48Å; S103-V106 WeakPolarHBondContact O-CB 3.38Å; S103-V106 PolarHBondContact O-N 3Å; V106-K108 PolarHBondContact O-N 3.07Å; V106-H109 PolarHBondContact O-N 3.36Å; V106-L110 WeakPolarHBondContact O-CB 3.32Å; V106-L110 PolarHBondContact O-N 3.29Å
107	Q	84.1	Confident	79.8	Confident	42 Å²	42	73.6 Å²	73.6	20%	0.196	36%	0.361	C	S	.	.	H	α-helix	trans	-59.1	-48.4	175.9	-66.4	-168.2	1.3	0	0	111.7	W96 S103 L105 H109 L110 W111	W96-Q107 HydrophobicContact CE3-CG 4.02Å; W96-Q107 HydrophobicContact CZ3-CB 3.78Å; W96-Q107 HydrophobicContact CZ3-CG 3.72Å; S103-Q107 PolarHBondContact O-N 3.25Å; L105-Q107 VanDerWaalsContact C-N 3.34Å; Q107-H109 VanDerWaalsContact C-N 3.34Å; Q107-H109 PolarHBondContact O-N 2.86Å; Q107-L110 PolarHBondContact O-N 3.08Å; Q107-W111 PolarHBondContact O-N 3.45Å
108	K	86.9	Confident	80.7	Confident	97 Å²	97	67.7 Å²	67.7	42%	0.422	34%	0.336	S	S	.	.	H	α-helix	trans	-58.6	-46.6	177.5	-179.8	-178.3	176.1	-177	0	111.4	S104 L105 V106 L110 W111 M112 W128	S104-K108 WeakPolarHBondContact O-CB 3.32Å; S104-K108 PolarHBondContact O-N 3.24Å; L105-K108 PolarHBondContact O-N 3.42Å; V106-K108 PolarHBondContact O-N 3.07Å; K108-L110 VanDerWaalsContact C-N 3.34Å; K108-L110 PolarHBondContact O-N 2.91Å; K108-W111 PolarHBondContact O-N 3.23Å; K108-M112 HydrophobicContact CG-SD 4.33Å; K108-M112 WeakPolarHBondContact O-CG 3.37Å; K108-M112 PolarHBondContact O-N 3.05Å; K108-W128 HydrophobicContact CD-CZ2 4.5Å; K108-W128 HydrophobicContact CG-CH2 4.33Å; K108-W128 HydrophobicContact CG-CZ2 4.31Å; K108-W128 HydrophobicContact CG-CZ3 4.49Å
109	H	87.6	Confident	81.8	Confident	82 Å²	82	69.3 Å²	69.3	38%	0.38	34%	0.341	S	S	.	.	H	α-helix	trans	-61.1	-44.9	179.1	-170.9	81.5	0	0	0	111.1	L105 V106 Q107 W111 M112 Q113	L105-H109 WeakPolarHBondContact O-CB 3.49Å; L105-H109 PolarHBondContact O-N 3.43Å; V106-H109 PolarHBondContact O-N 3.36Å; Q107-H109 VanDerWaalsContact C-N 3.34Å; Q107-H109 PolarHBondContact O-N 2.86Å; H109-W111 PolarHBondContact O-N 3.04Å; H109-M112 WeakPolarHBondContact O-CB 3.36Å; H109-M112 PolarHBondContact O-N 3.15Å; H109-M112 VanDerWaalsContact O-N 3.14Å; H109-Q113 PolarHBondContact NE2-NE2 2.94Å; H109-Q113 VanDerWaalsContact NE2-NE2 3.18Å; H109-Q113 WeakPolarHBondContact O-CG 3.43Å; H109-Q113 PolarHBondContact O-N 3.46Å
110	L	89.2	Confident	83.2	Confident	10 Å²	10	63.9 Å²	63.9	5%	0.052	33%	0.329	C	S	.	.	H	α-helix	trans	-62.5	-42.4	178.8	-171.4	57.7	0	0	0	112.4	Y92 I95 W96 V106 Q107 K108 M112 Q113 F114	Y92-L110 HydrophobicContact CD1-CD1 4.32Å; Y92-L110 HydrophobicContact CD1-CD2 4.33Å; Y92-L110 HydrophobicContact CD2-CD1 4.45Å; Y92-L110 HydrophobicContact CE1-CD1 4.37Å; Y92-L110 HydrophobicContact CG-CD1 4.33Å; Y92-L110 HydrophobicContact CG-CD2 4.17Å; I95-L110 HydrophobicContact CB-CD2 4.49Å; I95-L110 HydrophobicContact CD1-CD2 3.88Å; I95-L110 HydrophobicContact CG2-CD2 4.15Å; W96-L110 HydrophobicContact CH2-CB 3.95Å; W96-L110 HydrophobicContact CH2-CD2 3.47Å; W96-L110 VanDerWaalsContact CH2-CD2 3.47Å; W96-L110 HydrophobicContact CH2-CG 3.81Å; W96-L110 HydrophobicContact CZ2-CD2 3.38Å; W96-L110 HydrophobicContact CZ2-CG 3.88Å; W96-L110 HydrophobicContact CZ3-CD2 4.24Å; V106-L110 WeakPolarHBondContact O-CB 3.32Å; V106-L110 PolarHBondContact O-N 3.29Å; Q107-L110 PolarHBondContact O-N 3.08Å; K108-L110 VanDerWaalsContact C-N 3.34Å; K108-L110 PolarHBondContact O-N 2.91Å; L110-M112 VanDerWaalsContact C-N 3.31Å; L110-M112 PolarHBondContact O-N 3.35Å; L110-Q113 WeakPolarHBondContact O-CB 3.42Å; L110-Q113 PolarHBondContact O-N 2.85Å; L110-F114 HydrophobicContact CD1-CD1 4.18Å; L110-F114 HydrophobicContact CD1-CE1 3.44Å; L110-F114 VanDerWaalsContact CD1-CE1 3.44Å; L110-F114 HydrophobicContact CD1-CZ 3.88Å; L110-F114 HydrophobicContact CD2-CZ 4.24Å; L110-F114 HydrophobicContact CG-CD1 4.47Å; L110-F114 HydrophobicContact CG-CE1 3.79Å; L110-F114 HydrophobicContact CG-CE2 4.46Å; L110-F114 HydrophobicContact CG-CZ 3.77Å; L110-F114 WeakPolarHBondContact O-CD1 3.39Å; L110-F114 WeakPolarHBondContact O-CG 3.42Å; L110-F114 PolarHBondContact O-N 3.46Å
111	W	92.1	Very high	84.5	Confident	3 Å²	3	60.8 Å²	60.8	1%	0.011	32%	0.315	C	S	.	.	H	α-helix	trans	-64.3	-35.1	174	-72.2	117.1	0	0	0	113.1	L85 V89 W96 Q107 K108 H109 F114 S115 W128 L131 R132	L85-W111 HydrophobicContact CD1-CZ3 4.24Å; V89-W111 HydrophobicContact CG2-CH2 3.68Å; V89-W111 HydrophobicContact CG2-CZ3 3.85Å; W96-W111 AromaticContact CH2-CD1 3.84Å; W96-W111 AromaticContact CH2-CD2 3.99Å; W96-W111 HydrophobicContact CH2-CD2 3.99Å; W96-W111 AromaticContact CH2-CE2 3.4Å; W96-W111 HydrophobicContact CH2-CG 4.22Å; W96-W111 AromaticContact CH2-CZ2 3.74Å; W96-W111 HydrophobicContact CH2-CZ2 3.74Å; W96-W111 AromaticContact CH2-NE1 3.27Å; W96-W111 VanDerWaalsContact CH2-NE1 3.27Å; W96-W111 HydrophobicContact CZ2-CD2 4.46Å; W96-W111 AromaticContact CZ2-CE2 3.89Å; W96-W111 HydrophobicContact CZ2-CH2 4.27Å; W96-W111 AromaticContact CZ2-CZ2 3.79Å; W96-W111 HydrophobicContact CZ2-CZ2 3.79Å; W96-W111 AromaticContact CZ3-CE2 3.85Å; W96-W111 HydrophobicContact CZ3-CZ2 4.17Å; W96-W111 AromaticContact CZ3-NE1 3.35Å; W96-W111 VanDerWaalsContact CZ3-NE1 3.35Å; Q107-W111 PolarHBondContact O-N 3.45Å; K108-W111 PolarHBondContact O-N 3.23Å; H109-W111 PolarHBondContact O-N 3.04Å; W111-F114 AromaticContact CE3-CD2 3.78Å; W111-F114 HydrophobicContact CE3-CD2 3.78Å; W111-F114 HydrophobicContact CE3-CE2 4.38Å; W111-F114 AromaticContact CZ3-CD2 3.8Å; W111-F114 HydrophobicContact CZ3-CD2 3.8Å; W111-F114 HydrophobicContact CZ3-CE2 4.18Å; W111-F114 PolarHBondContact O-N 3.48Å; W111-S115 PolarHBondContact O-N 3.49Å; W111-W128 HydrophobicContact CB-CB 4.17Å; W111-W128 HydrophobicContact CB-CE3 4.06Å; W111-L131 HydrophobicContact CE3-CD2 4.26Å; W111-L131 HydrophobicContact CE3-CG 4.4Å; W111-R132 HydrophobicContact CD2-CB 3.77Å; W111-R132 HydrophobicContact CD2-CG 4.19Å; W111-R132 HydrophobicContact CE3-CB 4.24Å; W111-R132 HydrophobicContact CG-CB 4Å; W111-R132 HydrophobicContact CG-CG 4.4Å; W111-R132 HydrophobicContact CZ2-CB 4.33Å; W111-R132 HydrophobicContact CZ2-CG 4.09Å
112	M	90.7	Very high	86.2	Confident	46 Å²	46	57 Å²	57	23%	0.227	32%	0.316	C	S	.	.	H	α-helix	trans	-65.3	-43.4	173.3	-74.3	177.4	48.7	0	0	111.4	K108 H109 L110 F114 S115 Q116 W128	K108-M112 HydrophobicContact CG-SD 4.33Å; K108-M112 WeakPolarHBondContact O-CG 3.37Å; K108-M112 PolarHBondContact O-N 3.05Å; H109-M112 WeakPolarHBondContact O-CB 3.36Å; H109-M112 PolarHBondContact O-N 3.15Å; H109-M112 VanDerWaalsContact O-N 3.14Å; L110-M112 VanDerWaalsContact C-N 3.31Å; L110-M112 PolarHBondContact O-N 3.35Å; M112-F114 VanDerWaalsContact C-N 3.33Å; M112-F114 PolarHBondContact O-N 3.23Å; M112-S115 WeakPolarHBondContact O-CB 3.5Å; M112-S115 PolarHBondContact O-N 3.31Å; M112-Q116 WeakPolarHBondContact O-CG 3.49Å; M112-Q116 PolarHBondContact O-N 2.9Å; M112-W128 HydrophobicContact CG-CB 4.11Å; M112-W128 HydrophobicContact CG-CG 3.99Å
113	Q	90.2	Very high	87.4	Confident	42 Å²	42	59 Å²	59	20%	0.196	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-41.8	175.5	-68.6	-61.8	-25.3	0	0	111.4	H109 L110 S115 Q116 Y117	H109-Q113 PolarHBondContact NE2-NE2 2.94Å; H109-Q113 VanDerWaalsContact NE2-NE2 3.18Å; H109-Q113 WeakPolarHBondContact O-CG 3.43Å; H109-Q113 PolarHBondContact O-N 3.46Å; L110-Q113 WeakPolarHBondContact O-CB 3.42Å; L110-Q113 PolarHBondContact O-N 2.85Å; Q113-S115 PolarHBondContact O-N 2.89Å; Q113-Q116 PolarHBondContact O-N 3.26Å; Q113-Y117 WeakPolarHBondContact O-CB 3.33Å; Q113-Y117 PolarHBondContact O-N 3.38Å
114	F	92	Very high	88.1	Confident	5 Å²	5	59 Å²	59	2%	0.022	32%	0.319	C	S	.	.	H	α-helix	trans	-63.4	-41.2	176	-68.7	2.4	0	0	0	112.2	L85 L88 V89 Y92 W96 L110 W111 M112 Q116 Y117 L118 L131	L85-F114 HydrophobicContact CD1-CD2 4.37Å; L88-F114 HydrophobicContact CB-CD1 4.4Å; L88-F114 HydrophobicContact CB-CD2 4.15Å; L88-F114 HydrophobicContact CB-CE1 4.2Å; L88-F114 HydrophobicContact CB-CE2 3.94Å; L88-F114 HydrophobicContact CB-CG 4.39Å; L88-F114 HydrophobicContact CB-CZ 3.98Å; L88-F114 HydrophobicContact CD1-CB 4.3Å; L88-F114 HydrophobicContact CD1-CD1 4.26Å; L88-F114 HydrophobicContact CD1-CG 4.12Å; L88-F114 HydrophobicContact CD2-CD1 4.45Å; L88-F114 HydrophobicContact CD2-CE1 4.39Å; V89-F114 HydrophobicContact CG2-CD2 4.42Å; V89-F114 HydrophobicContact CG2-CE2 4.02Å; Y92-F114 AromaticContact CD2-CE1 3.56Å; Y92-F114 HydrophobicContact CD2-CE1 3.56Å; Y92-F114 AromaticContact CD2-CZ 3.4Å; Y92-F114 HydrophobicContact CD2-CZ 3.4Å; Y92-F114 AromaticContact CE2-CE1 3.72Å; Y92-F114 HydrophobicContact CE2-CE1 3.72Å; Y92-F114 HydrophobicContact CE2-CZ 4.07Å; Y92-F114 HydrophobicContact CG-CE1 4.38Å; Y92-F114 HydrophobicContact CG-CZ 4.02Å; W96-F114 AromaticContact CZ2-CE2 3.93Å; W96-F114 HydrophobicContact CZ2-CE2 3.93Å; W96-F114 HydrophobicContact CZ2-CZ 4.2Å; L110-F114 HydrophobicContact CD1-CD1 4.18Å; L110-F114 HydrophobicContact CD1-CE1 3.44Å; L110-F114 VanDerWaalsContact CD1-CE1 3.44Å; L110-F114 HydrophobicContact CD1-CZ 3.88Å; L110-F114 HydrophobicContact CD2-CZ 4.24Å; L110-F114 HydrophobicContact CG-CD1 4.47Å; L110-F114 HydrophobicContact CG-CE1 3.79Å; L110-F114 HydrophobicContact CG-CE2 4.46Å; L110-F114 HydrophobicContact CG-CZ 3.77Å; L110-F114 WeakPolarHBondContact O-CD1 3.39Å; L110-F114 WeakPolarHBondContact O-CG 3.42Å; L110-F114 PolarHBondContact O-N 3.46Å; W111-F114 AromaticContact CE3-CD2 3.78Å; W111-F114 HydrophobicContact CE3-CD2 3.78Å; W111-F114 HydrophobicContact CE3-CE2 4.38Å; W111-F114 AromaticContact CZ3-CD2 3.8Å; W111-F114 HydrophobicContact CZ3-CD2 3.8Å; W111-F114 HydrophobicContact CZ3-CE2 4.18Å; W111-F114 PolarHBondContact O-N 3.48Å; M112-F114 VanDerWaalsContact C-N 3.33Å; M112-F114 PolarHBondContact O-N 3.23Å; F114-Q116 VanDerWaalsContact C-N 3.32Å; F114-Q116 PolarHBondContact O-N 3.42Å; F114-Y117 PolarHBondContact O-N 2.99Å; F114-L118 WeakPolarHBondContact O-CB 3.44Å; F114-L118 WeakPolarHBondContact O-CG 3.35Å; F114-L118 PolarHBondContact O-N 3.46Å; F114-L131 HydrophobicContact CB-CD2 3.46Å; F114-L131 VanDerWaalsContact CB-CD2 3.46Å
115	S	91.5	Very high	88.4	Confident	14 Å²	14	62 Å²	62	10%	0.098	32%	0.317	C	S	.	.	H	α-helix	trans	-60.6	-42.5	175.8	167.4	0	0	0	0	111.4	W111 M112 Q113 H119 R126	W111-S115 PolarHBondContact O-N 3.49Å; M112-S115 WeakPolarHBondContact O-CB 3.5Å; M112-S115 PolarHBondContact O-N 3.31Å; Q113-S115 PolarHBondContact O-N 2.89Å; S115-H119 WeakPolarHBondContact O-CB 3.43Å; S115-H119 PolarHBondContact O-N 3.04Å; S115-H119 VanDerWaalsContact O-N 3.08Å; S115-R126 PolarHBondContact OG-O 3.16Å
116	Q	90.4	Very high	88.5	Confident	59 Å²	59	58.3 Å²	58.3	28%	0.276	30%	0.295	S	S	.	.	H	α-helix	trans	-67	-43.5	176.5	-71	174.8	-16.7	0	0	112.2	M112 Q113 F114 H119 S120	M112-Q116 WeakPolarHBondContact O-CG 3.49Å; M112-Q116 PolarHBondContact O-N 2.9Å; Q113-Q116 PolarHBondContact O-N 3.26Å; F114-Q116 VanDerWaalsContact C-N 3.32Å; F114-Q116 PolarHBondContact O-N 3.42Å; Q116-H119 PolarHBondContact O-N 2.92Å; Q116-S120 PolarHBondContact O-N 3.07Å
117	Y	91.5	Very high	88.7	Confident	78 Å²	78	59 Å²	59	31%	0.306	30%	0.297	S	S	.	.	H	α-helix	trans	-62.5	-45.5	177.6	174.5	-92.4	0	0	0	112.6	L88 Q113 F114 H119 S120 K121	L88-Y117 HydrophobicContact CD1-CD1 3.66Å; L88-Y117 HydrophobicContact CD1-CE1 4.03Å; L88-Y117 HydrophobicContact CD2-CD1 4.27Å; L88-Y117 HydrophobicContact CD2-CE1 4.24Å; L88-Y117 HydrophobicContact CG-CD1 4.46Å; L88-Y117 HydrophobicContact CG-CE1 4.45Å; Q113-Y117 WeakPolarHBondContact O-CB 3.33Å; Q113-Y117 PolarHBondContact O-N 3.38Å; F114-Y117 PolarHBondContact O-N 2.99Å; Y117-H119 VanDerWaalsContact C-N 3.27Å; Y117-H119 PolarHBondContact O-N 3.46Å; Y117-S120 PolarHBondContact O-N 3.29Å; Y117-S120 PolarHBondContact O-OG 3.05Å; Y117-K121 HydrophobicContact CD1-CG 4.49Å; Y117-K121 HydrophobicContact CE1-CG 4.06Å; Y117-K121 WeakPolarHBondContact O-CG 3.45Å; Y117-K121 PolarHBondContact O-N 3.47Å; Y117-K121 VanDerWaalsContact O-N 3.07Å; Y117-K121 WeakPolarHBondContact OH-CE 3.4Å
118	L	90.3	Very high	88.9	Confident	3 Å²	3	60.4 Å²	60.4	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-65	-37.6	177.2	-70.5	172.1	0	0	0	111	E84 L85 L88 F114 K121 W123 L131	E84-L118 HydrophobicContact CB-CD2 3.96Å; L85-L118 HydrophobicContact CB-CD1 4.36Å; L85-L118 HydrophobicContact CD1-CD1 4.25Å; L88-L118 HydrophobicContact CD1-CD2 4.4Å; L88-L118 HydrophobicContact CD1-CG 4.41Å; F114-L118 WeakPolarHBondContact O-CB 3.44Å; F114-L118 WeakPolarHBondContact O-CG 3.35Å; F114-L118 PolarHBondContact O-N 3.46Å; L118-K121 WeakPolarHBondContact O-CB 3.39Å; L118-K121 PolarHBondContact O-N 3.09Å; L118-W123 WeakPolarHBondContact O-CB 3.39Å; L118-W123 PolarHBondContact O-N 3.4Å; L118-W123 VanDerWaalsContact O-N 3.15Å; L118-L131 HydrophobicContact CD1-CD1 3.42Å; L118-L131 VanDerWaalsContact CD1-CD1 3.42Å; L118-L131 HydrophobicContact CD1-CD2 4Å; L118-L131 HydrophobicContact CD1-CG 4.3Å
119	H	90.1	Very high	89	Confident	94 Å²	94	57.9 Å²	57.9	44%	0.435	29%	0.293	S	S	.	.	H	α-helix	trans	-64.8	-39.6	174.8	-171.3	45.4	0	0	0	112.4	S115 Q116 Y117 K121 G122 W123	S115-H119 WeakPolarHBondContact O-CB 3.43Å; S115-H119 PolarHBondContact O-N 3.04Å; S115-H119 VanDerWaalsContact O-N 3.08Å; Q116-H119 PolarHBondContact O-N 2.92Å; Y117-H119 VanDerWaalsContact C-N 3.27Å; Y117-H119 PolarHBondContact O-N 3.46Å; H119-K121 PolarHBondContact O-N 2.65Å; H119-G122 PolarHBondContact O-N 3.48Å; H119-W123 PolarHBondContact ND1-O 2.9Å
120	S	91.1	Very high	89.1	Confident	92 Å²	92	58.4 Å²	58.4	64%	0.643	30%	0.296	S	S	*	.	H	α-helix	trans	-68.5	-22.7	176.3	71.5	0	0	0	0	113.2	Q116 Y117 G122	Q116-S120 PolarHBondContact O-N 3.07Å; Y117-S120 PolarHBondContact O-N 3.29Å; Y117-S120 PolarHBondContact O-OG 3.05Å; S120-G122 PolarHBondContact O-N 3Å
121	K	88.3	Confident	89.1	Confident	123 Å²	123	57.9 Å²	57.9	54%	0.535	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-2.3	168.8	-72.8	-72.1	-170.7	174.4	0	114.1	Y117 L118 H119	Y117-K121 HydrophobicContact CD1-CG 4.49Å; Y117-K121 HydrophobicContact CE1-CG 4.06Å; Y117-K121 WeakPolarHBondContact O-CG 3.45Å; Y117-K121 PolarHBondContact O-N 3.47Å; Y117-K121 VanDerWaalsContact O-N 3.07Å; Y117-K121 WeakPolarHBondContact OH-CE 3.4Å; L118-K121 WeakPolarHBondContact O-CB 3.39Å; L118-K121 PolarHBondContact O-N 3.09Å; H119-K121 PolarHBondContact O-N 2.65Å
122	G	86.9	Confident	89	Confident	67 Å²	67	61.9 Å²	61.9	69%	0.691	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.4	1.5	-179.4	0	0	0	0	0	114.3	H119 S120	H119-G122 PolarHBondContact O-N 3.48Å; S120-G122 PolarHBondContact O-N 3Å
123	W	88.2	Confident	89	Confident	61 Å²	61	68.1 Å²	68.1	23%	0.231	33%	0.329	C	S	.	.			trans	-75.1	152.9	177.3	-61.2	109.3	0	0	0	111.9	T78 E80 E81 L118 H119 R125	T78-W123 HydrophobicContact CG2-CH2 4.35Å; T78-W123 HydrophobicContact CG2-CZ3 3.73Å; T78-W123 WeakPolarHBondContact OG1-CH2 3.38Å; T78-W123 WeakPolarHBondContact OG1-CZ3 3.34Å; E80-W123 HydrophobicContact CB-CH2 3.79Å; E80-W123 HydrophobicContact CB-CZ2 3.61Å; E81-W123 HydrophobicContact CB-CD2 3.76Å; E81-W123 HydrophobicContact CB-CE3 3.92Å; E81-W123 HydrophobicContact CB-CG 4.25Å; E81-W123 HydrophobicContact CB-CH2 4.43Å; E81-W123 HydrophobicContact CB-CZ2 4.27Å; E81-W123 HydrophobicContact CB-CZ3 4.27Å; E81-W123 HydrophobicContact CG-CB 4.3Å; E81-W123 HydrophobicContact CG-CD2 3.99Å; E81-W123 HydrophobicContact CG-CE3 4.34Å; E81-W123 HydrophobicContact CG-CG 3.96Å; L118-W123 WeakPolarHBondContact O-CB 3.39Å; L118-W123 PolarHBondContact O-N 3.4Å; L118-W123 VanDerWaalsContact O-N 3.15Å; H119-W123 PolarHBondContact ND1-O 2.9Å; W123-R125 PolarHBondContact O-N 3.07Å
124	P	85.8	Confident	89	Confident	56 Å²	56	69.3 Å²	69.3	36%	0.364	33%	0.334	S	S	.	.			trans	-54.1	139.2	175.5	-25.8	34.4	0	0	0	111.4	T75 R126	T75-P124 HydrophobicContact CG2-CG 4.41Å; P124-R126 WeakPolarHBondContact O-CG 3.46Å; P124-R126 PolarHBondContact O-N 2.84Å
125	R	85.2	Confident	88.9	Confident	157 Å²	157	69.1 Å²	69.1	59%	0.592	33%	0.333	S	S	*	.			trans	-64.1	104.7	-179.2	-170.2	177.6	-177.5	-165	4.2	110.4	N41 W123	N41-R125 PolarHBondContact ND2-NH2 3.28Å; W123-R125 PolarHBondContact O-N 3.07Å
126	R	84.3	Confident	88.7	Confident	24 Å²	24	72.3 Å²	72.3	9%	0.091	35%	0.346	C	S	.	.			trans	-88.5	143.1	176.9	-54.4	-53.1	-170.4	162.4	4.2	111.4	T75 R76 Y77 E81 S115 P124 W128 L131	T75-R126 PolarHBondContact O-NH1 3.24Å; T75-R126 PolarHBondContact O-NH2 2.89Å; R76-R126 PolarHBondContact O-NH2 2.88Å; R76-R126 VanDerWaalsContact O-NH2 3.13Å; Y77-R126 HydrophobicContact CE1-CG 4.2Å; E81-R126 WeakPolarHBondContact OE1-CG 3.38Å; E81-R126 IonicContact OE1-CZ 3.58Å; E81-R126 IonicContact OE1-NE 3.66Å; E81-R126 PolarHBondContact OE1-NE 3.46Å; E81-R126 IonicContact OE1-NH2 3.37Å; E81-R126 IonicContact OE2-CZ 2.9Å; E81-R126 IonicContact OE2-NE 2.87Å; E81-R126 IonicContact OE2-NH2 3.68Å; E81-R126 PolarHBondContact OE2-NH2 3.42Å; S115-R126 PolarHBondContact OG-O 3.16Å; P124-R126 WeakPolarHBondContact O-CG 3.46Å; P124-R126 PolarHBondContact O-N 2.84Å; R126-W128 PolarHBondContact O-N 3.29Å; R126-L131 HydrophobicContact CB-CD1 4.43Å
127	N	87.1	Confident	88.6	Confident	85 Å²	85	71.3 Å²	71.3	46%	0.455	35%	0.346	S	S	.	.			trans	-65.8	134.1	168.9	-173.8	-43.3	0	0	0	109.3	T129 Q130 L131	N127-T129 PolarHBondContact O-N 2.87Å; N127-T129 WeakPolarHBondContact OD1-CB 3.43Å; N127-T129 PolarHBondContact OD1-N 3Å; N127-T129 PolarHBondContact OD1-OG1 3.18Å; N127-Q130 HydrophobicContact CB-CG 4.17Å; N127-Q130 WeakPolarHBondContact O-CA 3.4Å; N127-Q130 WeakPolarHBondContact O-CB 3.47Å; N127-Q130 PolarHBondContact O-N 2.91Å; N127-L131 PolarHBondContact O-N 3.14Å
128	W	88.2	Confident	88.4	Confident	71 Å²	71	68.6 Å²	68.6	27%	0.269	34%	0.337	S	S	.	.	H	α-helix	trans	-53.9	-30.9	179.2	71	-94.8	0	0	0	112.5	K108 W111 M112 R126 L131 R132	K108-W128 HydrophobicContact CD-CZ2 4.5Å; K108-W128 HydrophobicContact CG-CH2 4.33Å; K108-W128 HydrophobicContact CG-CZ2 4.31Å; K108-W128 HydrophobicContact CG-CZ3 4.49Å; W111-W128 HydrophobicContact CB-CB 4.17Å; W111-W128 HydrophobicContact CB-CE3 4.06Å; M112-W128 HydrophobicContact CG-CB 4.11Å; M112-W128 HydrophobicContact CG-CG 3.99Å; R126-W128 PolarHBondContact O-N 3.29Å; W128-L131 PolarHBondContact O-N 3.45Å; W128-R132 WeakPolarHBondContact O-CB 3.26Å; W128-R132 PolarHBondContact O-N 3.48Å
129	T	88.7	Confident	88.1	Confident	43 Å²	43	69.6 Å²	69.6	26%	0.264	34%	0.342	S	S	.	.	H	α-helix	trans	-67.2	-40.4	175.5	-53.7	0	0	0	0	112	N127 L131 R133	N127-T129 PolarHBondContact O-N 2.87Å; N127-T129 WeakPolarHBondContact OD1-CB 3.43Å; N127-T129 PolarHBondContact OD1-N 3Å; N127-T129 PolarHBondContact OD1-OG1 3.18Å; T129-L131 VanDerWaalsContact C-N 3.35Å; T129-R133 WeakPolarHBondContact O-CG 3.15Å; T129-R133 PolarHBondContact O-N 3.01Å; T129-R133 VanDerWaalsContact O-N 3.14Å
130	Q	89.1	Confident	87.8	Confident	93 Å²	93	72.8 Å²	72.8	44%	0.435	35%	0.35	S	S	.	.	H	α-helix	trans	-67.1	-41.4	175.2	-68.4	171.5	-34.9	0	0	110.4	Y77 N127 R133 K134	Y77-Q130 PolarHBondContact OH-O 3.43Å; N127-Q130 HydrophobicContact CB-CG 4.17Å; N127-Q130 WeakPolarHBondContact O-CA 3.4Å; N127-Q130 WeakPolarHBondContact O-CB 3.47Å; N127-Q130 PolarHBondContact O-N 2.91Å; Q130-R133 PolarHBondContact O-N 2.87Å; Q130-K134 PolarHBondContact O-N 3.34Å
131	L	90.2	Very high	87.5	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-43.8	177.6	-159.3	77.1	0	0	0	111.5	Y77 L85 W111 F114 L118 R126 N127 W128 T129 R133 K134 G135	Y77-L131 HydrophobicContact CE1-CD1 4.02Å; L85-L131 HydrophobicContact CD1-CD1 3.89Å; L85-L131 HydrophobicContact CD1-CD2 4Å; L85-L131 HydrophobicContact CD1-CG 3.72Å; L85-L131 HydrophobicContact CD2-CD1 3.78Å; L85-L131 HydrophobicContact CD2-CG 4.13Å; L85-L131 HydrophobicContact CG-CD1 4.4Å; W111-L131 HydrophobicContact CE3-CD2 4.26Å; W111-L131 HydrophobicContact CE3-CG 4.4Å; F114-L131 HydrophobicContact CB-CD2 3.46Å; F114-L131 VanDerWaalsContact CB-CD2 3.46Å; L118-L131 HydrophobicContact CD1-CD1 3.42Å; L118-L131 VanDerWaalsContact CD1-CD1 3.42Å; L118-L131 HydrophobicContact CD1-CD2 4Å; L118-L131 HydrophobicContact CD1-CG 4.3Å; R126-L131 HydrophobicContact CB-CD1 4.43Å; N127-L131 PolarHBondContact O-N 3.14Å; W128-L131 PolarHBondContact O-N 3.45Å; T129-L131 VanDerWaalsContact C-N 3.35Å; L131-R133 PolarHBondContact O-N 2.71Å; L131-K134 PolarHBondContact O-N 2.96Å; L131-G135 PolarHBondContact O-N 3.48Å
132	R	90.2	Very high	87.1	Confident	87 Å²	87	72 Å²	72	33%	0.328	34%	0.335	S	S	.	.	H	α-helix	trans	-57.2	-48.8	174.3	177.2	178.2	-177.9	-167.8	6.8	111.9	W111 W128 K134 G135 Q136	W111-R132 HydrophobicContact CD2-CB 3.77Å; W111-R132 HydrophobicContact CD2-CG 4.19Å; W111-R132 HydrophobicContact CE3-CB 4.24Å; W111-R132 HydrophobicContact CG-CB 4Å; W111-R132 HydrophobicContact CG-CG 4.4Å; W111-R132 HydrophobicContact CZ2-CB 4.33Å; W111-R132 HydrophobicContact CZ2-CG 4.09Å; W128-R132 WeakPolarHBondContact O-CB 3.26Å; W128-R132 PolarHBondContact O-N 3.48Å; R132-K134 VanDerWaalsContact C-N 3.34Å; R132-K134 PolarHBondContact O-N 3.18Å; R132-G135 PolarHBondContact O-N 3.23Å; R132-Q136 HydrophobicContact CG-CG 4.37Å; R132-Q136 WeakPolarHBondContact O-CB 2.99Å; R132-Q136 VanDerWaalsContact O-CG 3.29Å; R132-Q136 WeakPolarHBondContact O-CG 3.46Å; R132-Q136 PolarHBondContact O-N 3.24Å
133	R	89.6	Confident	86.5	Confident	176 Å²	176	72.1 Å²	72.1	66%	0.664	32%	0.32	S	S	*	.	H	α-helix	trans	-60.1	-44.1	178.6	-71.1	178.6	-170.9	165.7	1.7	111.4	T129 Q130 L131 S137	T129-R133 WeakPolarHBondContact O-CG 3.15Å; T129-R133 PolarHBondContact O-N 3.01Å; T129-R133 VanDerWaalsContact O-N 3.14Å; Q130-R133 PolarHBondContact O-N 2.87Å; L131-R133 PolarHBondContact O-N 2.71Å; R133-S137 WeakPolarHBondContact O-CB 3.22Å; R133-S137 PolarHBondContact O-N 2.95Å
134	K	90.2	Very high	85.8	Confident	68 Å²	68	73.6 Å²	73.6	30%	0.296	33%	0.332	S	S	.	.	H	α-helix	trans	-65.6	-46.9	177.6	-175.3	66.9	174.4	-175.5	0	111.6	Y77 L85 Q130 L131 R132 S137 L138	Y77-K134 HydrophobicContact CD1-CG 4.27Å; Y77-K134 HydrophobicContact CD2-CD 3.96Å; Y77-K134 HydrophobicContact CD2-CG 4.02Å; Y77-K134 HydrophobicContact CE1-CB 4.47Å; Y77-K134 HydrophobicContact CE1-CG 4.2Å; Y77-K134 HydrophobicContact CE2-CB 3.95Å; Y77-K134 HydrophobicContact CE2-CD 4.2Å; Y77-K134 HydrophobicContact CE2-CG 3.92Å; Y77-K134 HydrophobicContact CG-CD 4.32Å; Y77-K134 HydrophobicContact CG-CG 4.21Å; L85-K134 HydrophobicContact CD2-CB 3.97Å; L85-K134 HydrophobicContact CD2-CG 3.74Å; Q130-K134 PolarHBondContact O-N 3.34Å; L131-K134 PolarHBondContact O-N 2.96Å; R132-K134 VanDerWaalsContact C-N 3.34Å; R132-K134 PolarHBondContact O-N 3.18Å; K134-S137 WeakPolarHBondContact O-CB 3.18Å; K134-S137 PolarHBondContact O-N 2.92Å; K134-S137 VanDerWaalsContact O-N 3.17Å; K134-L138 HydrophobicContact CG-CD1 4.38Å; K134-L138 WeakPolarHBondContact O-CG 3.29Å; K134-L138 PolarHBondContact O-N 3.27Å
135	G	90	Very high	84.8	Confident	0 Å²	0	77 Å²	77	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-62.7	-41.5	178.8	0	0	0	0	0	113.1	L131 R132 S137 L138 L139	L131-G135 PolarHBondContact O-N 3.48Å; R132-G135 PolarHBondContact O-N 3.23Å; G135-S137 VanDerWaalsContact C-N 3.34Å; G135-S137 PolarHBondContact O-N 3.48Å; G135-L138 WeakPolarHBondContact O-CB 3.37Å; G135-L138 PolarHBondContact O-N 2.93Å; G135-L139 PolarHBondContact O-N 3.37Å
136	Q	87.2	Confident	83.6	Confident	81 Å²	81	73.9 Å²	73.9	38%	0.379	34%	0.343	S	S	.	.	H	α-helix	trans	-64.2	-38.6	172.6	-73.8	179.3	-24.4	0	0	112.2	R132 L138 L139 R140	R132-Q136 HydrophobicContact CG-CG 4.37Å; R132-Q136 WeakPolarHBondContact O-CB 2.99Å; R132-Q136 VanDerWaalsContact O-CG 3.29Å; R132-Q136 WeakPolarHBondContact O-CG 3.46Å; R132-Q136 PolarHBondContact O-N 3.24Å; Q136-L138 VanDerWaalsContact C-N 3.29Å; Q136-L138 PolarHBondContact O-N 3.01Å; Q136-L139 PolarHBondContact O-N 3.44Å; Q136-R140 PolarHBondContact O-N 2.79Å; Q136-R140 VanDerWaalsContact O-N 3.11Å
137	S	88.6	Confident	82.4	Confident	38 Å²	38	76 Å²	76	27%	0.266	36%	0.359	S	S	.	.	H	α-helix	trans	-63.3	-36.6	173.4	-175.2	0	0	0	0	112.3	R133 K134 G135 K141	R133-S137 WeakPolarHBondContact O-CB 3.22Å; R133-S137 PolarHBondContact O-N 2.95Å; K134-S137 WeakPolarHBondContact O-CB 3.18Å; K134-S137 PolarHBondContact O-N 2.92Å; K134-S137 VanDerWaalsContact O-N 3.17Å; G135-S137 VanDerWaalsContact C-N 3.34Å; G135-S137 PolarHBondContact O-N 3.48Å; S137-K141 WeakPolarHBondContact O-CG 3.37Å; S137-K141 PolarHBondContact O-N 3.48Å
138	L	87.4	Confident	81	Confident	22 Å²	22	76.6 Å²	76.6	12%	0.115	36%	0.362	C	S	.	.	H	α-helix	trans	-68.4	-44.1	175.9	-69.4	167.5	0	0	0	111.1	L85 A86 K134 G135 Q136 R140 K141 F142	L85-L138 HydrophobicContact CB-CD1 4.47Å; L85-L138 HydrophobicContact CD2-CD1 4.13Å; L85-L138 HydrophobicContact CG-CD1 4.19Å; A86-L138 HydrophobicContact CB-CD1 4.26Å; K134-L138 HydrophobicContact CG-CD1 4.38Å; K134-L138 WeakPolarHBondContact O-CG 3.29Å; K134-L138 PolarHBondContact O-N 3.27Å; G135-L138 WeakPolarHBondContact O-CB 3.37Å; G135-L138 PolarHBondContact O-N 2.93Å; Q136-L138 VanDerWaalsContact C-N 3.29Å; Q136-L138 PolarHBondContact O-N 3.01Å; L138-R140 VanDerWaalsContact C-N 3.31Å; L138-R140 PolarHBondContact O-N 2.96Å; L138-K141 WeakPolarHBondContact O-CB 3.24Å; L138-K141 PolarHBondContact O-N 2.96Å; L138-K141 VanDerWaalsContact O-N 3.15Å; L138-F142 HydrophobicContact CB-CD2 4.44Å; L138-F142 HydrophobicContact CB-CE2 3.92Å; L138-F142 WeakPolarHBondContact O-CD2 3.47Å; L138-F142 WeakPolarHBondContact O-CG 3.27Å; L138-F142 PolarHBondContact O-N 3.25Å
139	L	84.3	Confident	79.1	Confident	24 Å²	24	79.4 Å²	79.4	13%	0.126	38%	0.378	C	S	.	.	H	α-helix	trans	-56.1	-42.6	175.2	-79.2	168.4	0	0	0	113	V89 W96 G135 Q136 F142 N143	V89-L139 HydrophobicContact CG1-CD1 3.45Å; V89-L139 VanDerWaalsContact CG1-CD1 3.45Å; V89-L139 HydrophobicContact CG1-CD2 3.55Å; V89-L139 HydrophobicContact CG1-CG 3.27Å; W96-L139 HydrophobicContact CG-CD1 4.49Å; G135-L139 PolarHBondContact O-N 3.37Å; Q136-L139 PolarHBondContact O-N 3.44Å; L139-F142 PolarHBondContact O-N 3.3Å; L139-N143 VanDerWaalsContact O-CG 3.32Å; L139-N143 PolarHBondContact O-N 3.49Å; L139-N143 PolarHBondContact O-ND2 3.16Å
140	R	83.4	Confident	77.2	Confident	161 Å²	161	82.2 Å²	82.2	61%	0.608	39%	0.391	S	S	*	.	H	α-helix	trans	-60.4	-49.8	175.4	-72.6	-171.7	-64.3	-156.9	2.9	111.2	Q136 L138 F142 N143 D144	Q136-R140 PolarHBondContact O-N 2.79Å; Q136-R140 VanDerWaalsContact O-N 3.11Å; L138-R140 VanDerWaalsContact C-N 3.31Å; L138-R140 PolarHBondContact O-N 2.96Å; R140-F142 VanDerWaalsContact C-N 3.27Å; R140-F142 PolarHBondContact O-N 3.21Å; R140-N143 PolarHBondContact O-N 2.84Å; R140-N143 VanDerWaalsContact O-N 3.09Å; R140-D144 PolarHBondContact O-N 3.34Å
141	K	84.5	Confident	75.3	Confident	132 Å²	132	83.9 Å²	83.9	57%	0.574	40%	0.399	S	S	*	.	H	α-helix	trans	-56.3	-39.5	176.6	-69.7	-176	176.8	-157	0	113	S137 L138 M145	S137-K141 WeakPolarHBondContact O-CG 3.37Å; S137-K141 PolarHBondContact O-N 3.48Å; L138-K141 WeakPolarHBondContact O-CB 3.24Å; L138-K141 PolarHBondContact O-N 2.96Å; L138-K141 VanDerWaalsContact O-N 3.15Å; K141-M145 WeakPolarHBondContact O-CB 3.38Å; K141-M145 PolarHBondContact O-N 3.32Å
142	F	79.9	Confident	73.5	Confident	67 Å²	67	88.7 Å²	88.7	29%	0.294	43%	0.428	S	S	.	.	H	α-helix	trans	-68.3	-42.3	176.9	-65.9	-51.8	0	0	0	112.4	A86 L90 L138 L139 R140 M145 T146	A86-F142 HydrophobicContact CB-CE2 3.78Å; A86-F142 HydrophobicContact CB-CZ 3.64Å; L90-F142 HydrophobicContact CD1-CD2 4.34Å; L90-F142 HydrophobicContact CD1-CE2 4.11Å; L90-F142 HydrophobicContact CD1-CZ 4.27Å; L90-F142 HydrophobicContact CD2-CD2 3.93Å; L90-F142 HydrophobicContact CD2-CE2 4.43Å; L90-F142 HydrophobicContact CD2-CG 4.3Å; L90-F142 HydrophobicContact CG-CD2 4.21Å; L90-F142 HydrophobicContact CG-CE2 4.2Å; L138-F142 HydrophobicContact CB-CD2 4.44Å; L138-F142 HydrophobicContact CB-CE2 3.92Å; L138-F142 WeakPolarHBondContact O-CD2 3.47Å; L138-F142 WeakPolarHBondContact O-CG 3.27Å; L138-F142 PolarHBondContact O-N 3.25Å; L139-F142 PolarHBondContact O-N 3.3Å; R140-F142 VanDerWaalsContact C-N 3.27Å; R140-F142 PolarHBondContact O-N 3.21Å; F142-M145 PolarHBondContact O-N 2.81Å; F142-T146 PolarHBondContact O-N 3.3Å; F142-T146 PolarHBondContact O-OG1 3.37Å
143	N	74.3	Confident	71.5	Confident	68 Å²	68	88.9 Å²	88.9	36%	0.364	44%	0.443	S	S	.	.	H	α-helix	trans	-64.7	-42.9	176.3	-68.8	-23.8	0	0	0	111.2	L139 R140 M145 T146 T147	L139-N143 VanDerWaalsContact O-CG 3.32Å; L139-N143 PolarHBondContact O-N 3.49Å; L139-N143 PolarHBondContact O-ND2 3.16Å; R140-N143 PolarHBondContact O-N 2.84Å; R140-N143 VanDerWaalsContact O-N 3.09Å; N143-M145 VanDerWaalsContact C-N 3.34Å; N143-M145 PolarHBondContact O-N 2.79Å; N143-T146 WeakPolarHBondContact CA-OG1 3.44Å; N143-T146 PolarHBondContact O-N 3.44Å; N143-T146 PolarHBondContact O-OG1 2.91Å; N143-T147 PolarHBondContact O-N 3.35Å; N143-T147 PolarHBondContact O-OG1 2.93Å
144	D	74.3	Confident	69.5	Low	92 Å²	92	88.4 Å²	88.4	49%	0.492	45%	0.445	S	S	.	.	H	α-helix	trans	-62.9	-41.4	178.3	-59.5	-22.5	0	0	0	110.9	R140 T146 T147 N148	R140-D144 PolarHBondContact O-N 3.34Å; D144-T146 PolarHBondContact O-N 2.91Å; D144-T147 PolarHBondContact O-N 2.84Å; D144-N148 WeakPolarHBondContact O-CB 3.35Å; D144-N148 VanDerWaalsContact O-CG 3.24Å; D144-N148 PolarHBondContact O-N 3.17Å; D144-N148 PolarHBondContact O-ND2 2.66Å
145	M	65.2	Low	67.7	Low	128 Å²	128	89.2 Å²	89.2	63%	0.631	46%	0.46	S	S	*	.	H	α-helix	trans	-65.5	-38.1	176.8	-168.5	172.6	-74.7	0	0	112.3	K141 F142 N143 Q149	K141-M145 WeakPolarHBondContact O-CB 3.38Å; K141-M145 PolarHBondContact O-N 3.32Å; F142-M145 PolarHBondContact O-N 2.81Å; N143-M145 VanDerWaalsContact C-N 3.34Å; N143-M145 PolarHBondContact O-N 2.79Å; M145-Q149 VanDerWaalsContact O-CG 3.28Å; M145-Q149 WeakPolarHBondContact O-CG 3.32Å; M145-Q149 PolarHBondContact O-N 3.41Å; M145-Q149 VanDerWaalsContact O-N 3.13Å
146	T	59.9	Low	65.3	Low	91 Å²	91	94.4 Å²	94.4	56%	0.558	49%	0.488	S	S	*	.	H	α-helix	trans	-69.2	-34.3	174.3	48.9	0	0	0	0	112.9	F142 N143 D144 L150	F142-T146 PolarHBondContact O-N 3.3Å; F142-T146 PolarHBondContact O-OG1 3.37Å; N143-T146 WeakPolarHBondContact CA-OG1 3.44Å; N143-T146 PolarHBondContact O-N 3.44Å; N143-T146 PolarHBondContact O-OG1 2.91Å; D144-T146 PolarHBondContact O-N 2.91Å; T146-L150 WeakPolarHBondContact O-CB 3.4Å; T146-L150 PolarHBondContact O-N 3.45Å
147	T	58.6	Low	63.4	Low	70 Å²	70	95.8 Å²	95.8	43%	0.429	50%	0.504	S	S	.	.	H	α-helix	trans	-69.2	-44.2	176.3	-54.2	0	0	0	0	110.8	N143 D144 Q149 L150 E151	N143-T147 PolarHBondContact O-N 3.35Å; N143-T147 PolarHBondContact O-OG1 2.93Å; D144-T147 PolarHBondContact O-N 2.84Å; T147-Q149 PolarHBondContact O-N 3.24Å; T147-L150 PolarHBondContact O-N 3.16Å; T147-L150 VanDerWaalsContact O-N 3.15Å; T147-E151 PolarHBondContact O-N 3.14Å
148	N	56.3	Low	61.4	Low	96 Å²	96	100.2 Å²	100.2	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-64.8	-37.5	179.1	-67.6	-22.6	0	0	0	112.4	D144 L150 V152	D144-N148 WeakPolarHBondContact O-CB 3.35Å; D144-N148 VanDerWaalsContact O-CG 3.24Å; D144-N148 PolarHBondContact O-N 3.17Å; D144-N148 PolarHBondContact O-ND2 2.66Å; N148-L150 VanDerWaalsContact C-N 3.34Å; N148-V152 WeakPolarHBondContact O-CB 3.37Å; N148-V152 WeakPolarHBondContact O-CG2 3.3Å; N148-V152 PolarHBondContact O-N 3.48Å
149	Q	49.4	Very low	59	Low	131 Å²	131	104.4 Å²	104.4	61%	0.612	56%	0.556	S	S	*	*	H	α-helix	trans	-66.9	-35.4	174.3	-72.5	-90.9	61.6	0	0	112.2	M145 T147 S153	M145-Q149 VanDerWaalsContact O-CG 3.28Å; M145-Q149 WeakPolarHBondContact O-CG 3.32Å; M145-Q149 PolarHBondContact O-N 3.41Å; M145-Q149 VanDerWaalsContact O-N 3.13Å; T147-Q149 PolarHBondContact O-N 3.24Å; Q149-S153 WeakPolarHBondContact O-CB 3.17Å; Q149-S153 PolarHBondContact O-N 3.05Å; Q149-S153 VanDerWaalsContact O-N 3.12Å; Q149-S153 PolarHBondContact O-OG 2.78Å
150	L	48.8	Very low	57.1	Low	102 Å²	102	109.4 Å²	109.4	53%	0.534	58%	0.581	S	S	.	*	H	α-helix	trans	-73.6	-35.6	179.1	-162.7	77.3	0	0	0	112	T146 T147 N148 K154	T146-L150 WeakPolarHBondContact O-CB 3.4Å; T146-L150 PolarHBondContact O-N 3.45Å; T147-L150 PolarHBondContact O-N 3.16Å; T147-L150 VanDerWaalsContact O-N 3.15Å; N148-L150 VanDerWaalsContact C-N 3.34Å; L150-K154 WeakPolarHBondContact O-CG 3.42Å; L150-K154 PolarHBondContact O-N 2.73Å; L150-K154 VanDerWaalsContact O-N 3.16Å
151	E	49.7	Very low	55.2	Low	128 Å²	128	110.2 Å²	110.2	60%	0.598	59%	0.592	S	S	*	*	H	α-helix	trans	-74.4	-36.8	176.3	-71.4	-162.6	143.5	0	0	112.6	T147 S153 K154 S155	T147-E151 PolarHBondContact O-N 3.14Å; E151-S153 VanDerWaalsContact C-N 3.3Å; E151-S153 PolarHBondContact O-N 3.35Å; E151-K154 PolarHBondContact O-N 3.01Å; E151-S155 WeakPolarHBondContact O-CB 3.29Å; E151-S155 PolarHBondContact O-N 2.82Å; E151-S155 VanDerWaalsContact O-N 3.16Å; E151-S155 PolarHBondContact O-OG 2.74Å
152	V	50.8	Low	53	Low	100 Å²	100	110.6 Å²	110.6	61%	0.606	60%	0.6	S	S	*	*	H	α-helix	trans	-66.2	-33.9	172.6	174	0	0	0	0	111.5	N148 S155	N148-V152 WeakPolarHBondContact O-CB 3.37Å; N148-V152 WeakPolarHBondContact O-CG2 3.3Å; N148-V152 PolarHBondContact O-N 3.48Å; V152-S155 WeakPolarHBondContact CA-OG 3.38Å; V152-S155 PolarHBondContact O-OG 3.42Å
153	S	48.3	Very low	51.2	Low	92 Å²	92	113.4 Å²	113.4	64%	0.643	63%	0.625	S	S	*	*	H	α-helix	trans	-76.3	-23.3	177.4	-55.8	0	0	0	0	113.6	Q149 E151	Q149-S153 WeakPolarHBondContact O-CB 3.17Å; Q149-S153 PolarHBondContact O-N 3.05Å; Q149-S153 VanDerWaalsContact O-N 3.12Å; Q149-S153 PolarHBondContact O-OG 2.78Å; E151-S153 VanDerWaalsContact C-N 3.3Å; E151-S153 PolarHBondContact O-N 3.35Å
154	K	48.5	Very low	49.9	Very low	165 Å²	165	114.5 Å²	114.5	72%	0.717	64%	0.638	S	S	*	*	H	α-helix	trans	-90.4	-14.2	177.3	-79.1	-179.2	176.6	-178.1	0	114	L150 E151	L150-K154 WeakPolarHBondContact O-CG 3.42Å; L150-K154 PolarHBondContact O-N 2.73Å; L150-K154 VanDerWaalsContact O-N 3.16Å; E151-K154 PolarHBondContact O-N 3.01Å
155	S	52.1	Low	48.2	Very low	86 Å²	86	116.7 Å²	116.7	60%	0.601	65%	0.65	S	S	*	*	S	Bend	trans	-96.2	17.6	-176.9	45.7	0	0	0	0	114	E151 V152 P157	E151-S155 WeakPolarHBondContact O-CB 3.29Å; E151-S155 PolarHBondContact O-N 2.82Å; E151-S155 VanDerWaalsContact O-N 3.16Å; E151-S155 PolarHBondContact O-OG 2.74Å; V152-S155 WeakPolarHBondContact CA-OG 3.38Å; V152-S155 PolarHBondContact O-OG 3.42Å; S155-P157 WeakPolarHBondContact O-CD 3.38Å
156	N	39.9	Very low	47.1	Very low	108 Å²	108	119.8 Å²	119.8	58%	0.578	66%	0.662	S	S	*	*			trans	-112.8	89.8	166	-166.6	5.1	0	0	0	112.1	N158	N156-N158 PolarHBondContact O-N 2.77Å; N156-N158 PolarHBondContact OD1-N 2.92Å; N156-N158 VanDerWaalsContact OD1-N 3.14Å
157	P	47.2	Very low	46.2	Very low	111 Å²	111	121.9 Å²	121.9	72%	0.721	68%	0.675	S	S	*	*			trans	-79.8	5.5	171.5	-8.6	26.4	0	0	0	114.2	S155	S155-P157 WeakPolarHBondContact O-CD 3.38Å
158	N	46.4	Very low	45.4	Very low	130 Å²	130	124 Å²	124	70%	0.695	69%	0.69	S	S	*	*			trans	-122	27.4	-163.2	-81.2	-6.4	0	0	0	116	N156 I160	N156-N158 PolarHBondContact O-N 2.77Å; N156-N158 PolarHBondContact OD1-N 2.92Å; N156-N158 VanDerWaalsContact OD1-N 3.14Å; N158-I160 PolarHBondContact O-N 3.28Å
159	S	38.2	Very low	44.7	Very low	111 Å²	111	128 Å²	128	78%	0.776	71%	0.71	S	S	*	*			trans	-94	72.7	169.5	-165.1	0	0	0	0	111
160	I	44.4	Very low	44	Very low	129 Å²	129	127.3 Å²	127.3	66%	0.662	72%	0.72	S	S	*	*			trans	-76	127.9	164.5	-68.1	171.8	0	0	0	107.7	N158	N158-I160 PolarHBondContact O-N 3.28Å
161	E	43.6	Very low	43.7	Very low	178 Å²	178	128.1 Å²	128.1	83%	0.832	73%	0.734	S	S	*	*			trans	50.3	117.3	154	-61.9	171.1	136	0	0	119.3
162	N	37.1	Very low	43.1	Very low	139 Å²	139	127.2 Å²	127.2	74%	0.743	74%	0.742	S	S	*	*				161	120.7	109.3	-166.1	3.9	0	0	0	110.2
163	P	41.6	Very low	42.6	Very low	127 Å²	127	129.7 Å²	129.7	83%	0.825	75%	0.752	S	S	*	*			trans	-92.5	103.8	170.6	33.6	-24.4	0	0	0	109.6
164	S	47.1	Very low	41.9	Very low	91 Å²	91	130.2 Å²	130.2	64%	0.636	76%	0.762	S	S	*	*			trans	-146.7	110.5	165.2	-173.4	0	0	0	0	111.8
165	N	39.7	Very low	41.5	Very low	138 Å²	138	129.4 Å²	129.4	74%	0.738	77%	0.766	S	S	*	*			trans	10.3	122.7	147.2	-59.7	-28.9	0	0	0	116.9
166	H	42.2	Very low	40.6	Very low	192 Å²	192	130.4 Å²	130.4	89%	0.889	78%	0.779	S	S	*	*				-176.8	123.9	128	-85.3	-60.5	0	0	0	109.6
167	T	40.2	Very low	40.4	Very low	136 Å²	136	132.3 Å²	132.3	83%	0.834	78%	0.784	S	S	*	*			trans	-94.4	173.2	172.5	-16.6	0	0	0	0	109.7
168	P	41.7	Very low	40	Very low	114 Å²	114	133.6 Å²	133.6	74%	0.74	79%	0.79	S	S	*	*				-118.4	165.7	-106.6	39.2	-22.5	0	0	0	113.3
169	L	41	Very low	39.4	Very low	179 Å²	179	133.4 Å²	133.4	94%	0.937	79%	0.788	S	S	*	*			trans	-143	132.3	165.5	-94.2	149.6	0	0	0	112
170	S	36	Very low	39.2	Very low	117 Å²	117	131 Å²	131	82%	0.818	78%	0.782	S	S	*	*			trans	-30.7	140.8	175.7	-66.6	0	0	0	0	119.2
171	S	42.2	Very low	38.7	Very low	119 Å²	119	132.7 Å²	132.7	83%	0.832	79%	0.786	S	S	*	*				-163.3	121.1	121.2	60.3	0	0	0	0	112.5
172	S	37.4	Very low	38.4	Very low	109 Å²	109	132.1 Å²	132.1	76%	0.762	79%	0.787	S	S	*	*			trans	-23.7	122.7	163	-179.8	0	0	0	0	117.2
173	N	39.2	Very low	38.3	Very low	153 Å²	153	127.7 Å²	127.7	82%	0.818	78%	0.775	S	S	*	*			trans	-150.7	114.1	131	-107.7	-10.1	0	0	0	108.5	N175	N173-N175 PolarHBondContact O-N 2.95Å
174	A	34.9	Very low	37.8	Very low	103 Å²	103	126.6 Å²	126.6	85%	0.851	77%	0.77	S	S	*	*			trans	-66.8	91.1	-175.9	0	0	0	0	0	111.1
175	N	38.9	Very low	37.3	Very low	148 Å²	148	129 Å²	129	79%	0.791	78%	0.78	S	S	*	*			trans	-102.2	123.1	153.8	-83.7	-36.6	0	0	0	107.1	N173 H177	N173-N175 PolarHBondContact O-N 2.95Å; N175-H177 VanDerWaalsContact C-N 3.27Å; N175-H177 PolarHBondContact O-N 2.8Å
176	A	33.8	Very low	37	Very low	106 Å²	106	128 Å²	128	88%	0.876	78%	0.779	S	S	*	*			trans	-58.9	91.2	176.1	0	0	0	0	0	109.9	V178	A176-V178 PolarHBondContact O-N 2.99Å
177	H	35.3	Very low	36.9	Very low	148 Å²	148	126.7 Å²	126.7	69%	0.685	77%	0.774	S	S	*	*			trans	-78.2	104	173.9	-169.9	-110.6	0	0	0	107.5	N175 N179	N175-H177 VanDerWaalsContact C-N 3.27Å; N175-H177 PolarHBondContact O-N 2.8Å; H177-N179 VanDerWaalsContact CE1-CG 3.5Å; H177-N179 PolarHBondContact CE1-OD1 2.91Å; H177-N179 VanDerWaalsContact ND1-CB 3.31Å; H177-N179 WeakPolarHBondContact ND1-CB 3.48Å; H177-N179 PolarHBondContact O-N 3.03Å
178	V	39.8	Very low	36.4	Very low	139 Å²	139	126.5 Å²	126.5	84%	0.842	77%	0.768	S	S	*	*			trans	-74.5	83.3	162.7	-173.6	0	0	0	0	106.6	A176 G180	A176-V178 PolarHBondContact O-N 2.99Å; V178-G180 PolarHBondContact O-N 3.38Å; V178-G180 VanDerWaalsContact O-N 3.12Å
179	N	33.2	Very low	36.3	Very low	125 Å²	125	130.1 Å²	130.1	67%	0.668	78%	0.775	S	S	*	*			trans	-73	92.4	169	-153.4	28.9	0	0	0	108.2	H177	H177-N179 VanDerWaalsContact CE1-CG 3.5Å; H177-N179 PolarHBondContact CE1-OD1 2.91Å; H177-N179 VanDerWaalsContact ND1-CB 3.31Å; H177-N179 WeakPolarHBondContact ND1-CB 3.48Å; H177-N179 PolarHBondContact O-N 3.03Å
180	G	34.1	Very low	35.8	Very low	62 Å²	62	127.5 Å²	127.5	64%	0.639	77%	0.772	S	S	*	*			trans	-98.3	82.6	169.6	0	0	0	0	0	109.7	V178 I182	V178-G180 PolarHBondContact O-N 3.38Å; V178-G180 VanDerWaalsContact O-N 3.12Å; G180-I182 PolarHBondContact O-N 2.84Å
181	H	32.6	Very low	36.1	Very low	163 Å²	163	126.2 Å²	126.2	76%	0.755	76%	0.763	S	S	*	*			trans	-35.4	113.8	173.5	-176.2	43.2	0	0	0	113.1	G183	H181-G183 VanDerWaalsContact C-N 3.27Å; H181-G183 PolarHBondContact O-N 2.73Å
182	I	38.5	Very low	35.8	Very low	166 Å²	166	127.3 Å²	127.3	85%	0.851	76%	0.764	S	S	*	*			trans	-75	88.5	164.7	-58.3	170.6	0	0	0	105.7	G180 S184	G180-I182 PolarHBondContact O-N 2.84Å; I182-S184 PolarHBondContact O-N 3.44Å
183	G	34.8	Very low	35.8	Very low	47 Å²	47	130.2 Å²	130.2	49%	0.485	77%	0.765	S	S	.	*			trans	-72.8	115.7	170.9	0	0	0	0	0	109.8	H181 V185	H181-G183 VanDerWaalsContact C-N 3.27Å; H181-G183 PolarHBondContact O-N 2.73Å; G183-V185 PolarHBondContact O-N 2.73Å
184	S	31.3	Very low	35.9	Very low	104 Å²	104	133.3 Å²	133.3	73%	0.727	77%	0.765	S	S	*	*			trans	-48.7	121.8	166.6	-174.6	0	0	0	0	111.4	I182	I182-S184 PolarHBondContact O-N 3.44Å
185	V	37.2	Very low	36.5	Very low	140 Å²	140	132.3 Å²	132.3	85%	0.848	75%	0.75	S	S	*	*			trans	-132.2	92.4	156.3	-177	0	0	0	0	106.4	G183	G183-V185 PolarHBondContact O-N 2.73Å
186	T	33.1	Very low	36.6	Very low	117 Å²	117	132.3 Å²	132.3	72%	0.718	75%	0.75	S	S	*	*			trans	-57	158.1	154.5	-1.9	0	0	0	0	109.8
187	E	38.7	Very low	37.6	Very low	166 Å²	166	131.4 Å²	131.4	78%	0.776	73%	0.73	S	S	*	*			trans	106.1	98.5	156.6	-145.3	169.7	167.3	0	0	116.9
188	N	31.6	Very low	38.1	Very low	132 Å²	132	128.5 Å²	128.5	71%	0.706	72%	0.724	S	S	*	*			trans	38.8	111.5	131.9	-56.6	-27.9	0	0	0	117.5
189	Q	39.6	Very low	38	Very low	189 Å²	189	128.1 Å²	128.1	88%	0.883	72%	0.722	S	S	*	*				177.1	135.2	109.4	-92.3	172.4	45.2	0	0	111.1	S191	Q189-S191 PolarHBondContact O-N 3.02Å
190	S	30.5	Very low	38.7	Very low	125 Å²	125	128.2 Å²	128.2	87%	0.874	72%	0.722	S	S	*	*			trans	-47.3	112.7	164.2	166.2	0	0	0	0	111.2
191	S	40.8	Very low	39.1	Very low	90 Å²	90	131.1 Å²	131.1	63%	0.629	73%	0.728	S	S	*	*			trans	-150.7	117.2	162.3	-175.9	0	0	0	0	108.5	Q189 H193	Q189-S191 PolarHBondContact O-N 3.02Å; S191-H193 VanDerWaalsContact C-N 3.32Å; S191-H193 PolarHBondContact O-N 3.01Å
192	V	36.2	Very low	39.5	Very low	141 Å²	141	129.1 Å²	129.1	86%	0.855	73%	0.729	S	S	*	*			trans	-57.7	93.2	177.9	179.2	0	0	0	0	108.6	R194	V192-R194 PolarHBondContact O-N 2.94Å
193	H	36.8	Very low	40	Very low	171 Å²	171	126.3 Å²	126.3	79%	0.792	73%	0.725	S	S	*	*			trans	-71.6	91.9	176.1	-97.7	31	0	0	0	109.3	S191 P195	S191-H193 VanDerWaalsContact C-N 3.32Å; S191-H193 PolarHBondContact O-N 3.01Å; H193-P195 WeakPolarHBondContact O-CD 3.35Å
194	R	42.8	Very low	40.3	Very low	218 Å²	218	129.6 Å²	129.6	82%	0.823	74%	0.737	S	S	*	*			trans	-61.7	120.9	159.3	-135.2	-179.8	-172.9	177.2	2	106.7	V192 N196	V192-R194 PolarHBondContact O-N 2.94Å; R194-N196 PolarHBondContact O-N 2.82Å
195	P	46.9	Very low	40.8	Very low	81 Å²	81	131.2 Å²	131.2	53%	0.526	74%	0.743	S	S	.	*			trans	-67.1	105.3	175.9	-9.7	22.8	0	0	0	108	H193 L197	H193-P195 WeakPolarHBondContact O-CD 3.35Å; P195-L197 PolarHBondContact O-N 2.74Å
196	N	40.7	Very low	40.8	Very low	149 Å²	149	130.3 Å²	130.3	80%	0.797	74%	0.737	S	S	*	*			trans	-65.5	108.8	169.4	-75.7	-35.8	0	0	0	107.7	R194	R194-N196 PolarHBondContact O-N 2.82Å
197	L	55.6	Low	40.9	Very low	87 Å²	87	129.5 Å²	129.5	46%	0.455	74%	0.736	S	S	.	*			trans	-63.6	149.1	166.8	-79.2	100.8	0	0	0	108.9	P195 T199	P195-L197 PolarHBondContact O-N 2.74Å; L197-T199 PolarHBondContact O-N 2.9Å
198	P	44.5	Very low	40.8	Very low	87 Å²	87	128.1 Å²	128.1	57%	0.565	73%	0.732	S	S	*	*			trans	-60.1	110.1	167.7	24.6	-31.1	0	0	0	109.1	L200	P198-L200 PolarHBondContact O-N 3.09Å; P198-L200 VanDerWaalsContact O-N 3.16Å
199	T	39.5	Very low	41	Very low	130 Å²	130	127.2 Å²	127.2	80%	0.798	73%	0.732	S	S	*	*			trans	-69.2	107.4	172.5	-54.3	0	0	0	0	108.1	L197 T201	L197-T199 PolarHBondContact O-N 2.9Å; T199-T201 PolarHBondContact O-N 3Å
200	L	46.4	Very low	41	Very low	127 Å²	127	122.5 Å²	122.5	67%	0.665	72%	0.72	S	S	*	*			trans	-74.1	110.9	165.8	-66.5	174	0	0	0	107.3	P198	P198-L200 PolarHBondContact O-N 3.09Å; P198-L200 VanDerWaalsContact O-N 3.16Å
201	T	42.1	Very low	41.2	Very low	123 Å²	123	125.6 Å²	125.6	76%	0.755	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-51.6	128.6	167.2	40.9	0	0	0	0	109.1	T199 S203	T199-T201 PolarHBondContact O-N 3Å; T201-S203 PolarHBondContact O-N 2.88Å
202	P	41.8	Very low	40.9	Very low	121 Å²	121	128.3 Å²	128.3	79%	0.786	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-60.9	140.3	178.3	24.4	-31.8	0	0	0	110
203	S	48.6	Very low	40.8	Very low	108 Å²	108	126 Å²	126	76%	0.755	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-58.8	146.1	172.2	-63	0	0	0	0	110.5	T201 V205	T201-S203 PolarHBondContact O-N 2.88Å; S203-V205 PolarHBondContact O-N 3.16Å
204	P	40.7	Very low	40.8	Very low	115 Å²	115	123.7 Å²	123.7	75%	0.747	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-57.1	139.1	-177.8	22.8	-33.3	0	0	0	111.5	V206	P204-V206 PolarHBondContact O-N 3.31Å; P204-V206 VanDerWaalsContact O-N 3.14Å
205	V	42.1	Very low	40.5	Very low	139 Å²	139	118.8 Å²	118.8	84%	0.842	71%	0.714	S	S	*	*			trans	-69.3	107.4	172.4	179	0	0	0	0	107.7	S203	S203-V205 PolarHBondContact O-N 3.16Å
206	V	37.6	Very low	39.7	Very low	120 Å²	120	120.1 Å²	120.1	73%	0.727	73%	0.726	S	S	*	*			trans	-87.9	112.4	168.4	-169.9	0	0	0	0	107.4	P204 I208	P204-V206 PolarHBondContact O-N 3.31Å; P204-V206 VanDerWaalsContact O-N 3.14Å; V206-I208 PolarHBondContact O-N 2.91Å; V206-I208 VanDerWaalsContact O-N 3.09Å
207	S	34.9	Very low	39.6	Very low	100 Å²	100	121.1 Å²	121.1	70%	0.699	73%	0.73	S	S	*	*			trans	-62	109.6	169.7	-62.2	0	0	0	0	108.8	T209	S207-T209 VanDerWaalsContact C-N 3.32Å; S207-T209 PolarHBondContact O-N 2.89Å
208	I	37.8	Very low	38.6	Very low	137 Å²	137	122.1 Å²	122.1	70%	0.703	74%	0.744	S	S	*	*			trans	-76.7	91.2	172	-47.6	174.1	0	0	0	106.4	V206 S210	V206-I208 PolarHBondContact O-N 2.91Å; V206-I208 VanDerWaalsContact O-N 3.09Å; I208-S210 PolarHBondContact O-N 2.89Å
209	T	35.4	Very low	38.5	Very low	113 Å²	113	123.4 Å²	123.4	69%	0.693	75%	0.753	S	S	*	*			trans	-68.3	88.3	162.3	-50.8	0	0	0	0	107	S207 K211	S207-T209 VanDerWaalsContact C-N 3.32Å; S207-T209 PolarHBondContact O-N 2.89Å; T209-K211 HydrophobicContact CG2-CG 4.1Å; T209-K211 PolarHBondContact O-N 2.87Å
210	S	38.4	Very low	38.5	Very low	91 Å²	91	122.8 Å²	122.8	64%	0.636	75%	0.751	S	S	*	*			trans	-69.9	90.8	168.2	-153.2	0	0	0	0	107	I208 L212	I208-S210 PolarHBondContact O-N 2.89Å; S210-L212 PolarHBondContact O-N 3.08Å
211	K	36.6	Very low	38.1	Very low	190 Å²	190	122 Å²	122	83%	0.826	75%	0.752	S	S	*	*			trans	-69.9	79.6	160.9	-67.6	-171.8	-178.8	-177.4	0	106.3	T209 A213	T209-K211 HydrophobicContact CG2-CG 4.1Å; T209-K211 PolarHBondContact O-N 2.87Å; K211-A213 VanDerWaalsContact C-N 3.34Å; K211-A213 PolarHBondContact O-N 3.04Å
212	L	34	Very low	37.8	Very low	146 Å²	146	122.2 Å²	122.2	76%	0.764	75%	0.748	S	S	*	*			trans	-66.9	103.9	163.8	-145.7	81.3	0	0	0	105.2	S210 T214	S210-L212 PolarHBondContact O-N 3.08Å; L212-T214 VanDerWaalsContact C-N 3.33Å; L212-T214 PolarHBondContact O-N 2.94Å
213	A	34.6	Very low	37.6	Very low	92 Å²	92	124.3 Å²	124.3	76%	0.76	75%	0.747	S	S	*	*			trans	-61.5	99.4	169.8	0	0	0	0	0	107.3	K211	K211-A213 VanDerWaalsContact C-N 3.34Å; K211-A213 PolarHBondContact O-N 3.04Å
214	T	35.4	Very low	37	Very low	124 Å²	124	125.5 Å²	125.5	76%	0.761	75%	0.75	S	S	*	*			trans	-58.1	129.5	165.1	-25.6	0	0	0	0	107.4	L212 S216	L212-T214 VanDerWaalsContact C-N 3.33Å; L212-T214 PolarHBondContact O-N 2.94Å; T214-S216 PolarHBondContact O-N 3.25Å
215	P	37.5	Very low	36.8	Very low	114 Å²	114	127.3 Å²	127.3	74%	0.74	75%	0.748	S	S	*	*			trans	-60.2	116.5	169.9	-16	29	0	0	0	108.1	L217	P215-L217 PolarHBondContact O-N 3.07Å
216	S	29.8	Very low	36.7	Very low	109 Å²	109	126 Å²	126	76%	0.762	74%	0.743	S	S	*	*			trans	-63.5	110.4	172.1	179.9	0	0	0	0	108.7	T214	T214-S216 PolarHBondContact O-N 3.25Å
217	L	39	Very low	36.6	Very low	170 Å²	170	126.8 Å²	126.8	89%	0.89	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-90.6	119.5	154.2	-88.4	132	0	0	0	106.7	P215	P215-L217 PolarHBondContact O-N 3.07Å
218	S	35	Very low	37.1	Very low	108 Å²	108	127.3 Å²	127.3	76%	0.755	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-52.7	144.4	-168.1	-37.8	0	0	0	0	115.9
219	P	41.7	Very low	37.1	Very low	114 Å²	114	126.4 Å²	126.4	74%	0.74	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-98.9	161.9	160.4	37.7	-28.1	0	0	0	111
220	P	40.1	Very low	37.3	Very low	117 Å²	117	128.7 Å²	128.7	76%	0.76	75%	0.749	S	S	*	*				-140.3	158.4	107.4	41.4	-28.5	0	0	0	108.9
221	T	37.9	Very low	37	Very low	111 Å²	111	129.6 Å²	129.6	68%	0.681	75%	0.747	S	S	*	*			cis	-179.7	132.1	33	-15.8	0	0	0	0	101.6
222	N	35.9	Very low	36.9	Very low	127 Å²	127	131.3 Å²	131.3	68%	0.679	75%	0.748	S	S	*	*				173.4	129	78	-95.6	-37.7	0	0	0	108.4
223	H	37.6	Very low	36.9	Very low	165 Å²	165	128.2 Å²	128.2	76%	0.764	74%	0.739	S	S	*	*			trans	60.4	109.3	137.4	-65.9	-66	0	0	0	123.6
224	V	35.9	Very low	37.1	Very low	134 Å²	134	132.1 Å²	132.1	81%	0.812	74%	0.742	S	S	*	*				98.7	106.7	127.3	-176.8	0	0	0	0	119.3
225	Q	35.6	Very low	36.9	Very low	153 Å²	153	133.6 Å²	133.6	72%	0.715	75%	0.745	S	S	*	*			trans	-94.8	153.1	161.5	170.8	178.8	-28.4	0	0	107.6	N227	Q225-N227 PolarHBondContact NE2-OD1 3.21Å
226	P	39.8	Very low	36.7	Very low	112 Å²	112	133 Å²	133	73%	0.727	74%	0.741	S	S	*	*				-159.5	143.1	67.4	38.6	-12.8	0	0	0	123.5
227	N	36.6	Very low	36.9	Very low	135 Å²	135	136 Å²	136	72%	0.722	74%	0.743	S	S	*	*			trans	73.6	148.1	135.1	-73.4	8.5	0	0	0	125.2	Q225	Q225-N227 PolarHBondContact NE2-OD1 3.21Å
228	P	44.1	Very low	36.6	Very low	111 Å²	111	137.7 Å²	137.7	72%	0.721	74%	0.737	S	S	*	*			trans	-108.9	-179.9	-167.2	44.9	-32.1	0	0	0	113
229	P	38.9	Very low	36.5	Very low	118 Å²	118	138.5 Å²	138.5	77%	0.766	73%	0.732	S	S	*	*				-160.1	179.7	87	38.9	-16.2	0	0	0	117.3
230	H	38.3	Very low	35.9	Very low	161 Å²	161	139.8 Å²	139.8	75%	0.745	73%	0.732	S	S	*	*			trans	98.8	96.9	142.9	-130.4	70.8	0	0	0	121.5
231	N	32.6	Very low	35.6	Very low	111 Å²	111	140.9 Å²	140.9	59%	0.594	73%	0.731	S	S	*	*				77.9	146	118.2	-136	4.4	0	0	0	121.8
232	W	34.9	Very low	35.4	Very low	225 Å²	225	140.2 Å²	140.2	85%	0.852	73%	0.731	S	S	*	*			trans	70.2	143.7	178.2	-46	91.9	0	0	0	115
233	S	33	Very low	35.6	Very low	82 Å²	82	139.2 Å²	139.2	57%	0.573	73%	0.734	S	S	*	*			cis	-172.4	144.8	-14.9	-177.9	0	0	0	0	103
234	E	39.4	Very low	35.6	Very low	174 Å²	174	139.7 Å²	139.7	81%	0.813	74%	0.736	S	S	*	*			trans	65.3	109.4	152.3	-72.4	172	160	0	0	122.5
235	N	30.5	Very low	35.9	Very low	155 Å²	155	140.4 Å²	140.4	83%	0.829	74%	0.741	S	S	*	*				76.1	151.5	126.9	-117.4	0.5	0	0	0	119.2
236	P	33.7	Very low	35.9	Very low	101 Å²	101	137.3 Å²	137.3	66%	0.656	74%	0.736	S	S	*	*				-122.3	-169.1	-123.5	26.8	-0.9	0	0	0	109.7
237	Q	33.9	Very low	36	Very low	171 Å²	171	138.2 Å²	138.2	80%	0.799	74%	0.739	S	S	*	*			trans	90.1	138.4	173.8	-48.3	-166.1	-25.2	0	0	115
238	R	32.5	Very low	36.4	Very low	206 Å²	206	138.6 Å²	138.6	78%	0.777	75%	0.747	S	S	*	*			trans	85.2	98.6	156.6	-64.8	-160.2	154.6	-152.3	-2.9	115
239	I	33.2	Very low	36.3	Very low	126 Å²	126	136.1 Å²	136.1	65%	0.646	74%	0.742	S	S	*	*				85.2	99.7	91.4	-74.6	162.4	0	0	0	106.9
240	L	30.5	Very low	36.3	Very low	141 Å²	141	139.4 Å²	139.4	74%	0.738	75%	0.747	S	S	*	*				75.1	124.2	99.1	-140.3	100.6	0	0	0	111.3
241	N	32.4	Very low	36.5	Very low	140 Å²	140	137 Å²	137	75%	0.749	75%	0.748	S	S	*	*			trans	73.1	147.1	170.9	-57.4	-6.2	0	0	0	114
242	S	34.6	Very low	36.9	Very low	97 Å²	97	142.2 Å²	142.2	68%	0.678	78%	0.784	S	S	*	*			cis	-173.8	154.1	-4.8	-114.5	0	0	0	0	105
243	S	39.1	Very low	37	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	78%	0.781	S	S	*	*			trans	58.2	111.2	149.4	52.1	0	0	0	0	119.9
244	H	37.5	Very low	37.2	Very low	174 Å²	174	141.1 Å²	141.1	81%	0.806	79%	0.792	S	S	*	*				68.9	101.9	86.2	-123.1	-71	0	0	0	113.9
245	V	42.2	Very low	37	Very low	149 Å²	149	139.2 Å²	139.2	90%	0.903	79%	0.791	S	S	*	*			trans	-156.8	131.2	138.5	-156.3	0	0	0	0	110
246	S	36.1	Very low	37.4	Very low	89 Å²	89	138.3 Å²	138.3	62%	0.622	79%	0.788	S	S	*	*			trans	-84.5	165.9	-179.2	-52.3	0	0	0	0	113.5
247	T	42.4	Very low	37.7	Very low	130 Å²	130	140.6 Å²	140.6	80%	0.798	80%	0.797	S	S	*	*				133.9	116.6	127.6	-50	0	0	0	0	114.8
248	T	43.8	Very low	37.9	Very low	143 Å²	143	138.6 Å²	138.6	88%	0.877	80%	0.796	S	S	*	*			trans	-160.1	128.7	150.3	13.1	0	0	0	0	103.9
249	G	42.9	Very low	38.3	Very low	60 Å²	60	133.8 Å²	133.8	62%	0.619	80%	0.798	S	S	*	*			cis	105.5	88.4	21.4	0	0	0	0	0	109.7
250	H	39.3	Very low	38.7	Very low	187 Å²	187	134.4 Å²	134.4	87%	0.866	81%	0.809	S	S	*	*			trans	-167.8	111.3	158.1	-95.9	-174.6	0	0	0	108.3
251	S	41.5	Very low	39.4	Very low	111 Å²	111	133.8 Å²	133.8	78%	0.776	82%	0.815	S	S	*	*				79.3	94.2	96.5	-72.5	0	0	0	0	115.1
252	T	40.5	Very low	40	Very low	220 Å²	220	133.3 Å²	133.3	100%	1.35	82%	0.821	S	S	*	*				-144.1	0	108.1	12.5	0	0	0	0	108

Retrieved 252 of 252 residues in 157.1 ms (Link to these results)

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