A0A077Z311_TRITR Loading...

MICOS complex subunit MIC10

Component of the MICOS complex, a large protein complex of the mitochondrial inner membrane that plays crucial roles in the maintenance of crista junctions, inner membrane architecture, and formation of contact sites to the outer membrane.

AlphaFold DB , UniProt , Accession A0A077Z311, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 142 aa.

						>A0A077Z311_TRITR|A0A077Z311
MQLNSANNLPENEYDNKMARCLSNGIVKCLGGLSIGLLTTVLMAKCMSLFVLLFFPLNVYFSWLLFHTMSVFLSKVMFNSGRTWPMWLGTGVGLGIAYSDCDYDYRKGTIIRGKLIKVITFIDNSKSELTVIAFSEKGRWRH
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	42.8	Very low	53	Low	240 Å²	240	125.7 Å²	125.7	100%	1.182	69%	0.691	S	S	*	*				0	100.8	0	-77.7	170.5	175.6	0	0	108.5
2	Q	38.8	Very low	54.1	Low	187 Å²	187	122.1 Å²	122.1	87%	0.874	67%	0.67	S	S	*	*			trans	-149.5	83.6	176.6	-79.4	-64.2	-19.9	0	0	108.3
3	L	42.4	Very low	55.3	Low	173 Å²	173	117.2 Å²	117.2	91%	0.906	64%	0.639	S	S	*	*			trans	-148.9	75.7	171.3	-94.2	171.1	0	0	0	107.2
4	N	52.7	Low	56.6	Low	122 Å²	122	117.3 Å²	117.3	65%	0.652	63%	0.627	S	S	*	*			trans	-159.4	47.7	170.9	-125.6	9.1	0	0	0	114.4	N8	N4-N8 PolarHBondContact O-ND2 3.23Å; N4-N8 PolarHBondContact OD1-ND2 3.44Å
5	S	57	Low	58	Low	101 Å²	101	115.5 Å²	115.5	71%	0.706	62%	0.617	S	S	*	*	S	Bend	trans	-124.9	-21.1	173.4	-154.1	0	0	0	0	114.6
6	A	51.7	Low	59.2	Low	87 Å²	87	114.7 Å²	114.7	72%	0.719	61%	0.613	S	S	*	*	S	Bend	trans	-86.7	-27.9	-179.2	0	0	0	0	0	114.7
7	N	55.3	Low	60.3	Low	115 Å²	115	110.1 Å²	110.1	62%	0.615	59%	0.586	S	S	*	*	S	Bend	trans	-85.2	-16.4	179.1	-65.3	-19.3	0	0	0	113.3	L9 P10	N7-L9 PolarHBondContact O-N 2.74Å; N7-P10 WeakPolarHBondContact O-CD 3.38Å
8	N	55.2	Low	61.5	Low	51 Å²	51	109 Å²	109	27%	0.273	58%	0.578	S	S	.	*	H	α-helix	trans	-83	-4.7	-169.6	-65.6	-85.9	0	0	0	114.7	N4 N12	N4-N8 PolarHBondContact O-ND2 3.23Å; N4-N8 PolarHBondContact OD1-ND2 3.44Å; N8-N12 WeakPolarHBondContact O-CB 3.18Å; N8-N12 PolarHBondContact O-N 3.43Å; N8-N12 PolarHBondContact O-ND2 3.21Å; N8-N12 PolarHBondContact O-OD1 2.86Å
9	L	56.6	Low	62.7	Low	120 Å²	120	106.2 Å²	106.2	63%	0.628	57%	0.572	S	S	*	*	H	α-helix	trans	-77.8	-35.1	-178.9	-88.5	102.2	0	0	0	115.8	N7 N12	N7-L9 PolarHBondContact O-N 2.74Å; L9-N12 PolarHBondContact O-OD1 3.07Å
10	P	62.3	Low	63.8	Low	93 Å²	93	108.6 Å²	108.6	60%	0.604	57%	0.573	S	S	*	*	H	α-helix	trans	-79.5	-31.7	166.6	27.3	-34	0	0	0	112.3	N7 Y14	N7-P10 WeakPolarHBondContact O-CD 3.38Å; P10-Y14 PolarHBondContact O-N 3.33Å
11	E	67.9	Low	64.8	Low	94 Å²	94	104.2 Å²	104.2	44%	0.439	55%	0.551	S	S	.	*	H	α-helix	trans	-69.1	-43.9	-178.1	-63.4	179.9	135.7	0	0	111.6	E13 Y14 D15	E11-E13 VanDerWaalsContact C-N 3.29Å; E11-E13 PolarHBondContact O-N 3.35Å; E11-Y14 WeakPolarHBondContact O-CB 2.9Å; E11-Y14 PolarHBondContact O-N 3.35Å; E11-Y14 VanDerWaalsContact O-N 3.16Å; E11-D15 WeakPolarHBondContact O-CB 2.97Å; E11-D15 PolarHBondContact O-N 3.18Å
12	N	65.9	Low	66.9	Low	82 Å²	82	98 Å²	98	44%	0.439	52%	0.522	S	S	.	.	H	α-helix	trans	-64.6	-29	-179.8	68.6	3.3	0	0	0	113.9	N8 L9 N16	N8-N12 WeakPolarHBondContact O-CB 3.18Å; N8-N12 PolarHBondContact O-N 3.43Å; N8-N12 PolarHBondContact O-ND2 3.21Å; N8-N12 PolarHBondContact O-OD1 2.86Å; L9-N12 PolarHBondContact O-OD1 3.07Å; N12-N16 WeakPolarHBondContact O-CB 3.15Å; N12-N16 PolarHBondContact O-N 3.04Å; N12-N16 PolarHBondContact O-ND2 3.14Å
13	E	70.2	Confident	69.3	Low	59 Å²	59	92.3 Å²	92.3	28%	0.276	50%	0.503	S	S	.	.	H	α-helix	trans	-77.8	-38.6	175.8	-171.8	168.4	161.7	0	0	110.8	E11 K17	E11-E13 VanDerWaalsContact C-N 3.29Å; E11-E13 PolarHBondContact O-N 3.35Å; E13-K17 WeakPolarHBondContact O-CG 3.23Å; E13-K17 PolarHBondContact O-N 3.03Å; E13-K17 VanDerWaalsContact O-N 3.12Å
14	Y	73.9	Confident	71.3	Confident	118 Å²	118	88.7 Å²	88.7	46%	0.463	48%	0.484	S	S	.	.	H	α-helix	trans	-62.3	-46.5	173.1	-177.8	-96.2	0	0	0	111.5	P10 E11 N16 K17 M18 Y105	P10-Y14 PolarHBondContact O-N 3.33Å; E11-Y14 WeakPolarHBondContact O-CB 2.9Å; E11-Y14 PolarHBondContact O-N 3.35Å; E11-Y14 VanDerWaalsContact O-N 3.16Å; Y14-N16 PolarHBondContact O-N 2.73Å; Y14-K17 PolarHBondContact O-N 3.44Å; Y14-K17 VanDerWaalsContact O-N 3.13Å; Y14-M18 HydrophobicContact CE1-CE 3.95Å; Y14-M18 HydrophobicContact CE1-SD 4.15Å; Y14-M18 WeakPolarHBondContact O-CB 3.19Å; Y14-M18 PolarHBondContact O-N 3.03Å; Y14-Y105 AromaticContact CD2-CE1 3.82Å; Y14-Y105 HydrophobicContact CD2-CE1 3.82Å; Y14-Y105 AromaticContact CE2-CE1 3.67Å; Y14-Y105 HydrophobicContact CE2-CE1 3.67Å; Y14-Y105 AromaticContact CE2-CZ 3.97Å
15	D	77.2	Confident	72.9	Confident	91 Å²	91	83.3 Å²	83.3	49%	0.487	46%	0.458	S	S	.	.	H	α-helix	trans	-60.9	-44	179.3	-68.3	-20.9	0	0	0	111.6	E11 K17 M18 A19	E11-D15 WeakPolarHBondContact O-CB 2.97Å; E11-D15 PolarHBondContact O-N 3.18Å; D15-K17 VanDerWaalsContact C-N 3.3Å; D15-K17 PolarHBondContact O-N 3.5Å; D15-M18 PolarHBondContact O-N 2.84Å; D15-A19 VanDerWaalsContact O-CB 3.31Å; D15-A19 WeakPolarHBondContact O-CB 3.46Å; D15-A19 PolarHBondContact O-N 3.39Å
16	N	77.9	Confident	74.4	Confident	102 Å²	102	82.6 Å²	82.6	55%	0.545	45%	0.445	S	S	.	.	H	α-helix	trans	-66.5	-28.7	177.1	-81.4	-28.2	0	0	0	113.5	N12 Y14 R20	N12-N16 WeakPolarHBondContact O-CB 3.15Å; N12-N16 PolarHBondContact O-N 3.04Å; N12-N16 PolarHBondContact O-ND2 3.14Å; Y14-N16 PolarHBondContact O-N 2.73Å; N16-R20 PolarHBondContact O-NE 2.96Å
17	K	77.1	Confident	76.1	Confident	37 Å²	37	82.9 Å²	82.9	16%	0.161	44%	0.438	C	S	.	.	H	α-helix	trans	-75.8	-46.6	173.1	-74.2	-178.6	178.6	-164.7	0	110.7	E13 Y14 D15 A19 R20 C21 Y105	E13-K17 WeakPolarHBondContact O-CG 3.23Å; E13-K17 PolarHBondContact O-N 3.03Å; E13-K17 VanDerWaalsContact O-N 3.12Å; Y14-K17 PolarHBondContact O-N 3.44Å; Y14-K17 VanDerWaalsContact O-N 3.13Å; D15-K17 VanDerWaalsContact C-N 3.3Å; D15-K17 PolarHBondContact O-N 3.5Å; K17-A19 VanDerWaalsContact C-N 3.32Å; K17-A19 PolarHBondContact O-N 2.77Å; K17-R20 PolarHBondContact O-N 2.92Å; K17-C21 WeakPolarHBondContact O-CB 3.48Å; K17-C21 PolarHBondContact O-N 3.37Å; K17-Y105 HydrophobicContact CB-CE1 4.15Å; K17-Y105 HydrophobicContact CD-CE1 4.31Å
18	M	81.6	Confident	77.5	Confident	90 Å²	90	81.4 Å²	81.4	44%	0.443	43%	0.426	S	S	.	.	H	α-helix	trans	-59.9	-42.4	178.4	-174.7	179.4	-110.3	0	0	111.5	Y14 D15 R20 C21 L22 Y105	Y14-M18 HydrophobicContact CE1-CE 3.95Å; Y14-M18 HydrophobicContact CE1-SD 4.15Å; Y14-M18 WeakPolarHBondContact O-CB 3.19Å; Y14-M18 PolarHBondContact O-N 3.03Å; D15-M18 PolarHBondContact O-N 2.84Å; M18-R20 PolarHBondContact O-N 2.76Å; M18-C21 VanDerWaalsContact O-CB 3.3Å; M18-C21 WeakPolarHBondContact O-CB 3.28Å; M18-C21 PolarHBondContact O-N 3.46Å; M18-L22 WeakPolarHBondContact O-CB 3.15Å; M18-L22 PolarHBondContact O-N 3.46Å; M18-Y105 WeakPolarHBondContact CA-OH 3.44Å; M18-Y105 PolarHBondContact N-OH 3.37Å
19	A	85.6	Confident	78.7	Confident	56 Å²	56	79.9 Å²	79.9	46%	0.463	42%	0.419	S	S	.	.	H	α-helix	trans	-60.6	-42	177.7	0	0	0	0	0	112.8	D15 K17 S23	D15-A19 VanDerWaalsContact O-CB 3.31Å; D15-A19 WeakPolarHBondContact O-CB 3.46Å; D15-A19 PolarHBondContact O-N 3.39Å; K17-A19 VanDerWaalsContact C-N 3.32Å; K17-A19 PolarHBondContact O-N 2.77Å; A19-S23 WeakPolarHBondContact O-CB 3.12Å; A19-S23 PolarHBondContact O-N 2.93Å
20	R	83.3	Confident	80.1	Confident	154 Å²	154	79.2 Å²	79.2	58%	0.581	42%	0.416	S	S	*	.	H	α-helix	trans	-65	-44.2	176	-79.4	179.9	-81.2	173.4	-6.6	111.8	N16 K17 M18 S23 N24	N16-R20 PolarHBondContact O-NE 2.96Å; K17-R20 PolarHBondContact O-N 2.92Å; M18-R20 PolarHBondContact O-N 2.76Å; R20-S23 PolarHBondContact O-N 2.83Å; R20-N24 PolarHBondContact O-N 3.22Å
21	C	85.9	Confident	81.2	Confident	17 Å²	17	76 Å²	76	12%	0.115	40%	0.399	C	S	.	.	H	α-helix	trans	-57.1	-49.8	175.1	-104.1	0	0	0	0	112.9	K17 M18 N24 G25 C101	K17-C21 WeakPolarHBondContact O-CB 3.48Å; K17-C21 PolarHBondContact O-N 3.37Å; M18-C21 VanDerWaalsContact O-CB 3.3Å; M18-C21 WeakPolarHBondContact O-CB 3.28Å; M18-C21 PolarHBondContact O-N 3.46Å; C21-N24 PolarHBondContact O-N 3.43Å; C21-G25 PolarHBondContact O-N 3.45Å; C21-C101 WeakPolarHBondContact CA-SG 3.49Å; C21-C101 HydrophobicContact CB-CB 4.16Å; C21-C101 WeakPolarHBondContact CB-SG 2.83Å; C21-C101 WeakPolarHBondContact SG-CA 3.3Å; C21-C101 WeakPolarHBondContact SG-CB 3.35Å; C21-C101 CovalentContact SG-SG 2.02Å; C21-C101 PolarHBondContact SG-SG 2.93Å
22	L	87.4	Confident	81.7	Confident	108 Å²	108	72.9 Å²	72.9	57%	0.565	39%	0.393	S	S	*	.	H	α-helix	trans	-63.4	-44	179.3	-177.9	63.5	0	0	0	111.4	M18 N24 G25 I26	M18-L22 WeakPolarHBondContact O-CB 3.15Å; M18-L22 PolarHBondContact O-N 3.46Å; L22-N24 PolarHBondContact O-N 2.87Å; L22-G25 PolarHBondContact O-N 3.43Å; L22-I26 HydrophobicContact CD1-CD1 4.05Å; L22-I26 HydrophobicContact CD1-CG1 4.25Å; L22-I26 HydrophobicContact CG-CD1 3.82Å; L22-I26 HydrophobicContact CG-CG1 4.44Å; L22-I26 WeakPolarHBondContact O-CB 3.2Å; L22-I26 VanDerWaalsContact O-CG1 3.24Å; L22-I26 WeakPolarHBondContact O-CG1 3.33Å; L22-I26 PolarHBondContact O-N 3.3Å
23	S	88.3	Confident	82.5	Confident	68 Å²	68	70.5 Å²	70.5	48%	0.476	38%	0.38	S	S	.	.	H	α-helix	trans	-59.2	-48.4	177.6	-175.8	0	0	0	0	111.8	A19 R20 G25 I26 V27	A19-S23 WeakPolarHBondContact O-CB 3.12Å; A19-S23 PolarHBondContact O-N 2.93Å; R20-S23 PolarHBondContact O-N 2.83Å; S23-G25 VanDerWaalsContact C-N 3.33Å; S23-G25 PolarHBondContact O-N 2.98Å; S23-I26 PolarHBondContact O-N 2.88Å; S23-V27 WeakPolarHBondContact O-CG2 3.42Å; S23-V27 PolarHBondContact O-N 3.49Å; S23-V27 VanDerWaalsContact O-N 3.08Å
24	N	84.7	Confident	83.1	Confident	98 Å²	98	70.5 Å²	70.5	52%	0.524	39%	0.386	S	S	.	.	H	α-helix	trans	-64.2	-38.9	176.7	-72.8	-9.7	0	0	0	112.1	R20 C21 L22 V27 K28	R20-N24 PolarHBondContact O-N 3.22Å; C21-N24 PolarHBondContact O-N 3.43Å; L22-N24 PolarHBondContact O-N 2.87Å; N24-V27 PolarHBondContact O-N 3.41Å; N24-K28 WeakPolarHBondContact O-CG 3.32Å; N24-K28 PolarHBondContact O-N 2.73Å
25	G	86	Confident	83.6	Confident	9 Å²	9	69.9 Å²	69.9	9%	0.093	39%	0.39	C	S	.	.	H	α-helix	trans	-64.2	-43.5	177.4	0	0	0	0	0	112.8	C21 L22 S23 K28 C29 A97	C21-G25 PolarHBondContact O-N 3.45Å; L22-G25 PolarHBondContact O-N 3.43Å; S23-G25 VanDerWaalsContact C-N 3.33Å; S23-G25 PolarHBondContact O-N 2.98Å; G25-K28 PolarHBondContact O-N 3.32Å; G25-C29 WeakPolarHBondContact O-CB 3.3Å; G25-C29 PolarHBondContact O-N 3.26Å; G25-C29 PolarHBondContact O-SG 3.4Å; G25-A97 VanDerWaalsContact CA-CB 3.48Å
26	I	88	Confident	83.5	Confident	85 Å²	85	67 Å²	67	44%	0.436	38%	0.381	S	S	.	.	H	α-helix	trans	-61.8	-46.1	175.7	-69.7	165.1	0	0	0	110.2	L22 S23 K28 C29 L30	L22-I26 HydrophobicContact CD1-CD1 4.05Å; L22-I26 HydrophobicContact CD1-CG1 4.25Å; L22-I26 HydrophobicContact CG-CD1 3.82Å; L22-I26 HydrophobicContact CG-CG1 4.44Å; L22-I26 WeakPolarHBondContact O-CB 3.2Å; L22-I26 VanDerWaalsContact O-CG1 3.24Å; L22-I26 WeakPolarHBondContact O-CG1 3.33Å; L22-I26 PolarHBondContact O-N 3.3Å; S23-I26 PolarHBondContact O-N 2.88Å; I26-K28 VanDerWaalsContact C-N 3.32Å; I26-K28 PolarHBondContact O-N 2.9Å; I26-C29 PolarHBondContact O-N 2.85Å; I26-L30 HydrophobicContact CG2-CD1 3.73Å; I26-L30 HydrophobicContact CG2-CG 4.21Å; I26-L30 WeakPolarHBondContact O-CB 3.27Å; I26-L30 VanDerWaalsContact O-CG 3.29Å; I26-L30 WeakPolarHBondContact O-CG 3.45Å; I26-L30 PolarHBondContact O-N 2.94Å
27	V	87.7	Confident	83.6	Confident	94 Å²	94	67.1 Å²	67.1	57%	0.57	38%	0.381	S	S	*	.	H	α-helix	trans	-60.1	-42.3	178.4	172.6	0	0	0	0	111.2	S23 N24 L30 G31	S23-V27 WeakPolarHBondContact O-CG2 3.42Å; S23-V27 PolarHBondContact O-N 3.49Å; S23-V27 VanDerWaalsContact O-N 3.08Å; N24-V27 PolarHBondContact O-N 3.41Å; V27-L30 PolarHBondContact O-N 3.49Å; V27-G31 PolarHBondContact O-N 3.43Å
28	K	84.1	Confident	83.8	Confident	83 Å²	83	70.8 Å²	70.8	36%	0.361	40%	0.402	S	S	.	.	H	α-helix	trans	-67.8	-39.5	176.7	-73.4	-176	178.1	-173	0	112.7	N24 G25 I26 G31 G32 I96 D100	N24-K28 WeakPolarHBondContact O-CG 3.32Å; N24-K28 PolarHBondContact O-N 2.73Å; G25-K28 PolarHBondContact O-N 3.32Å; I26-K28 VanDerWaalsContact C-N 3.32Å; I26-K28 PolarHBondContact O-N 2.9Å; K28-G31 PolarHBondContact O-N 2.8Å; K28-G32 PolarHBondContact O-N 2.67Å; K28-I96 HydrophobicContact CD-CG2 3.97Å; K28-D100 IonicContact NZ-OD1 2.75Å; K28-D100 IonicContact NZ-OD2 3.75Å; K28-D100 PolarHBondContact NZ-OD2 3.4Å
29	C	81.9	Confident	83.6	Confident	20 Å²	20	69.6 Å²	69.6	14%	0.135	40%	0.4	C	S	.	.	H	α-helix	trans	-63.7	-46	175	-68.5	0	0	0	0	111	G25 I26 G31 G32 L33	G25-C29 WeakPolarHBondContact O-CB 3.3Å; G25-C29 PolarHBondContact O-N 3.26Å; G25-C29 PolarHBondContact O-SG 3.4Å; I26-C29 PolarHBondContact O-N 2.85Å; C29-G31 PolarHBondContact O-N 2.77Å; C29-G32 PolarHBondContact O-N 2.83Å; C29-L33 VanDerWaalsContact O-CB 3.31Å; C29-L33 WeakPolarHBondContact O-CB 3.24Å; C29-L33 WeakPolarHBondContact O-CG 3.12Å; C29-L33 PolarHBondContact O-N 3.32Å
30	L	84.6	Confident	83	Confident	106 Å²	106	69.8 Å²	69.8	56%	0.555	40%	0.396	S	S	*	.	H	α-helix	trans	-64.4	-39.5	177.2	-69.3	173.6	0	0	0	112.1	I26 V27 L33 S34	I26-L30 HydrophobicContact CG2-CD1 3.73Å; I26-L30 HydrophobicContact CG2-CG 4.21Å; I26-L30 WeakPolarHBondContact O-CB 3.27Å; I26-L30 VanDerWaalsContact O-CG 3.29Å; I26-L30 WeakPolarHBondContact O-CG 3.45Å; I26-L30 PolarHBondContact O-N 2.94Å; V27-L30 PolarHBondContact O-N 3.49Å; L30-L33 PolarHBondContact O-N 3.43Å; L30-S34 WeakPolarHBondContact O-CB 2.97Å; L30-S34 PolarHBondContact O-N 2.94Å; L30-S34 PolarHBondContact O-OG 3.48Å
31	G	85.5	Confident	82.7	Confident	25 Å²	25	66.3 Å²	66.3	26%	0.258	39%	0.391	S	S	.	.	H	α-helix	trans	-61	-49.9	172.7	0	0	0	0	0	112.2	V27 K28 C29 L33 S34 I35	V27-G31 PolarHBondContact O-N 3.43Å; K28-G31 PolarHBondContact O-N 2.8Å; C29-G31 PolarHBondContact O-N 2.77Å; G31-L33 VanDerWaalsContact C-N 3.33Å; G31-L33 PolarHBondContact O-N 2.85Å; G31-S34 WeakPolarHBondContact CA-OG 3.44Å; G31-S34 PolarHBondContact O-N 3.05Å; G31-S34 PolarHBondContact O-OG 2.8Å; G31-I35 WeakPolarHBondContact O-CB 3.35Å; G31-I35 WeakPolarHBondContact O-CD1 3.38Å; G31-I35 WeakPolarHBondContact O-CG1 3.2Å; G31-I35 PolarHBondContact O-N 3.34Å
32	G	79.7	Confident	82.1	Confident	29 Å²	29	71 Å²	71	30%	0.299	41%	0.414	S	S	.	.	H	α-helix	trans	-62.6	-37.6	177.1	0	0	0	0	0	113.2	K28 C29 G36	K28-G32 PolarHBondContact O-N 2.67Å; C29-G32 PolarHBondContact O-N 2.83Å; G32-G36 WeakPolarHBondContact O-CA 3.34Å; G32-G36 PolarHBondContact O-N 2.89Å
33	L	81.7	Confident	81.2	Confident	32 Å²	32	72.2 Å²	72.2	17%	0.168	42%	0.419	C	S	.	.	H	α-helix	trans	-71.4	-42.8	177.6	-74.2	176.7	0	0	0	112.7	C29 L30 G31 G36 L37 M86	C29-L33 VanDerWaalsContact O-CB 3.31Å; C29-L33 WeakPolarHBondContact O-CB 3.24Å; C29-L33 WeakPolarHBondContact O-CG 3.12Å; C29-L33 PolarHBondContact O-N 3.32Å; L30-L33 PolarHBondContact O-N 3.43Å; G31-L33 VanDerWaalsContact C-N 3.33Å; G31-L33 PolarHBondContact O-N 2.85Å; L33-G36 PolarHBondContact O-N 2.88Å; L33-L37 WeakPolarHBondContact O-CB 3.41Å; L33-L37 WeakPolarHBondContact O-CG 3.28Å; L33-L37 PolarHBondContact O-N 2.69Å; L33-M86 HydrophobicContact CD1-CE 3.63Å; L33-M86 HydrophobicContact CD2-CE 3.41Å; L33-M86 VanDerWaalsContact CD2-CE 3.41Å; L33-M86 HydrophobicContact CD2-CG 3.97Å; L33-M86 HydrophobicContact CD2-SD 3.48Å; L33-M86 WeakPolarHBondContact CD2-SD 2.82Å; L33-M86 HydrophobicContact CG-CE 4.08Å
34	S	82.5	Confident	80.2	Confident	58 Å²	58	72.2 Å²	72.2	41%	0.406	42%	0.423	S	S	.	.	H	α-helix	trans	-64.9	-45.3	176.5	54	0	0	0	0	111.5	L30 G31 G36 L37 L38	L30-S34 WeakPolarHBondContact O-CB 2.97Å; L30-S34 PolarHBondContact O-N 2.94Å; L30-S34 PolarHBondContact O-OG 3.48Å; G31-S34 WeakPolarHBondContact CA-OG 3.44Å; G31-S34 PolarHBondContact O-N 3.05Å; G31-S34 PolarHBondContact O-OG 2.8Å; S34-G36 VanDerWaalsContact C-N 3.34Å; S34-L37 PolarHBondContact O-N 2.81Å; S34-L38 WeakPolarHBondContact O-CB 3.34Å; S34-L38 VanDerWaalsContact O-CG 3.25Å; S34-L38 WeakPolarHBondContact O-CG 3.28Å; S34-L38 PolarHBondContact O-N 3.35Å
35	I	85	Confident	79.4	Confident	106 Å²	106	75 Å²	75	54%	0.544	43%	0.43	S	S	.	.	H	α-helix	trans	-63.6	-42	174	-65	162.8	0	0	0	110.4	G31 L38 T39	G31-I35 WeakPolarHBondContact O-CB 3.35Å; G31-I35 WeakPolarHBondContact O-CD1 3.38Å; G31-I35 WeakPolarHBondContact O-CG1 3.2Å; G31-I35 PolarHBondContact O-N 3.34Å; I35-L38 PolarHBondContact O-N 2.98Å; I35-T39 WeakPolarHBondContact O-CB 3.22Å; I35-T39 PolarHBondContact O-N 2.82Å; I35-T39 PolarHBondContact O-OG1 2.89Å
36	G	76.1	Confident	78.3	Confident	30 Å²	30	77.9 Å²	77.9	31%	0.309	45%	0.448	S	S	.	.	H	α-helix	trans	-62.6	-43.5	177.8	0	0	0	0	0	112.8	G32 L33 S34 T40	G32-G36 WeakPolarHBondContact O-CA 3.34Å; G32-G36 PolarHBondContact O-N 2.89Å; L33-G36 PolarHBondContact O-N 2.88Å; S34-G36 VanDerWaalsContact C-N 3.34Å; G36-T40 VanDerWaalsContact O-CB 3.3Å; G36-T40 WeakPolarHBondContact O-CB 3.41Å; G36-T40 PolarHBondContact O-N 3.19Å; G36-T40 PolarHBondContact O-OG1 2.77Å
37	L	78.3	Confident	77.2	Confident	105 Å²	105	78 Å²	78	55%	0.55	45%	0.448	S	S	.	.	H	α-helix	trans	-65.2	-48.6	175	-80.9	162.5	0	0	0	111.5	L33 S34 T39 T40 V41	L33-L37 WeakPolarHBondContact O-CB 3.41Å; L33-L37 WeakPolarHBondContact O-CG 3.28Å; L33-L37 PolarHBondContact O-N 2.69Å; S34-L37 PolarHBondContact O-N 2.81Å; L37-T39 VanDerWaalsContact C-N 3.33Å; L37-T39 PolarHBondContact O-N 3.43Å; L37-T40 PolarHBondContact O-N 3.15Å; L37-V41 WeakPolarHBondContact O-CG2 3.3Å; L37-V41 PolarHBondContact O-N 2.93Å
38	L	81.9	Confident	76.1	Confident	113 Å²	113	77.4 Å²	77.4	59%	0.592	45%	0.448	S	S	*	.	H	α-helix	trans	-58.7	-45.9	176.6	-75.1	169	0	0	0	111.2	S34 I35 V41 L42	S34-L38 WeakPolarHBondContact O-CB 3.34Å; S34-L38 VanDerWaalsContact O-CG 3.25Å; S34-L38 WeakPolarHBondContact O-CG 3.28Å; S34-L38 PolarHBondContact O-N 3.35Å; I35-L38 PolarHBondContact O-N 2.98Å; L38-V41 PolarHBondContact O-N 3.44Å; L38-L42 WeakPolarHBondContact O-CB 3.24Å; L38-L42 VanDerWaalsContact O-CG 3.28Å; L38-L42 WeakPolarHBondContact O-CG 3.2Å; L38-L42 PolarHBondContact O-N 2.91Å
39	T	76.9	Confident	75.1	Confident	65 Å²	65	78.5 Å²	78.5	40%	0.399	46%	0.457	S	S	.	.	H	α-helix	trans	-65.9	-39.8	179.1	-54.4	0	0	0	0	111	I35 L37 V41 L42 M43	I35-T39 WeakPolarHBondContact O-CB 3.22Å; I35-T39 PolarHBondContact O-N 2.82Å; I35-T39 PolarHBondContact O-OG1 2.89Å; L37-T39 VanDerWaalsContact C-N 3.33Å; L37-T39 PolarHBondContact O-N 3.43Å; T39-V41 PolarHBondContact O-N 3.03Å; T39-L42 PolarHBondContact O-N 3.4Å; T39-M43 HydrophobicContact CG2-CG 4.21Å; T39-M43 HydrophobicContact CG2-SD 4.38Å; T39-M43 VanDerWaalsContact O-CB 3.28Å; T39-M43 WeakPolarHBondContact O-CB 3.26Å; T39-M43 VanDerWaalsContact O-CG 3.3Å; T39-M43 WeakPolarHBondContact O-CG 3.41Å; T39-M43 PolarHBondContact O-N 2.91Å
40	T	73.6	Confident	74.2	Confident	61 Å²	61	82 Å²	82	37%	0.374	47%	0.47	S	S	.	.	H	α-helix	trans	-63.2	-42.9	176	-58.6	0	0	0	0	111.1	G36 L37 A44	G36-T40 VanDerWaalsContact O-CB 3.3Å; G36-T40 WeakPolarHBondContact O-CB 3.41Å; G36-T40 PolarHBondContact O-N 3.19Å; G36-T40 PolarHBondContact O-OG1 2.77Å; L37-T40 PolarHBondContact O-N 3.15Å; T40-A44 VanDerWaalsContact O-CB 3.22Å; T40-A44 WeakPolarHBondContact O-CB 3.4Å; T40-A44 PolarHBondContact O-N 3.33Å
41	V	76.9	Confident	73	Confident	81 Å²	81	78.9 Å²	78.9	49%	0.491	46%	0.456	S	S	.	.	H	α-helix	trans	-68.1	-43.2	177.3	173.7	0	0	0	0	111.4	L37 L38 T39 A44 K45	L37-V41 WeakPolarHBondContact O-CG2 3.3Å; L37-V41 PolarHBondContact O-N 2.93Å; L38-V41 PolarHBondContact O-N 3.44Å; T39-V41 PolarHBondContact O-N 3.03Å; V41-A44 PolarHBondContact O-N 3.05Å; V41-K45 WeakPolarHBondContact O-CB 3.49Å; V41-K45 WeakPolarHBondContact O-CG 3.49Å; V41-K45 PolarHBondContact O-N 3.47Å
42	L	74.6	Confident	71.9	Confident	115 Å²	115	84 Å²	84	60%	0.602	48%	0.477	S	S	*	.	H	α-helix	trans	-62.9	-43.8	175.7	-75.5	173.2	0	0	0	111.2	L38 T39 K45 C46	L38-L42 WeakPolarHBondContact O-CB 3.24Å; L38-L42 VanDerWaalsContact O-CG 3.28Å; L38-L42 WeakPolarHBondContact O-CG 3.2Å; L38-L42 PolarHBondContact O-N 2.91Å; T39-L42 PolarHBondContact O-N 3.4Å; L42-K45 PolarHBondContact O-N 3.08Å; L42-C46 WeakPolarHBondContact O-CA 2.95Å; L42-C46 WeakPolarHBondContact O-CB 3.34Å; L42-C46 PolarHBondContact O-N 3.04Å
43	M	66.5	Low	71.1	Confident	134 Å²	134	88.9 Å²	88.9	66%	0.66	50%	0.495	S	S	*	.	H	α-helix	trans	-69.3	-38.1	177.1	-73.3	-158.9	123.6	0	0	112.2	T39 K45 C46 M47	T39-M43 HydrophobicContact CG2-CG 4.21Å; T39-M43 HydrophobicContact CG2-SD 4.38Å; T39-M43 VanDerWaalsContact O-CB 3.28Å; T39-M43 WeakPolarHBondContact O-CB 3.26Å; T39-M43 VanDerWaalsContact O-CG 3.3Å; T39-M43 WeakPolarHBondContact O-CG 3.41Å; T39-M43 PolarHBondContact O-N 2.91Å; M43-K45 VanDerWaalsContact C-N 3.33Å; M43-K45 PolarHBondContact O-N 2.85Å; M43-C46 PolarHBondContact O-N 2.64Å; M43-M47 VanDerWaalsContact O-CB 3.24Å; M43-M47 WeakPolarHBondContact O-CB 3.16Å; M43-M47 PolarHBondContact O-N 3.43Å
44	A	67.1	Low	70.2	Confident	68 Å²	68	93 Å²	93	56%	0.562	51%	0.512	S	S	*	.	H	α-helix	trans	-63.3	-38.9	174.8	0	0	0	0	0	112.1	T40 V41	T40-A44 VanDerWaalsContact O-CB 3.22Å; T40-A44 WeakPolarHBondContact O-CB 3.4Å; T40-A44 PolarHBondContact O-N 3.33Å; V41-A44 PolarHBondContact O-N 3.05Å
45	K	68	Low	69.1	Low	156 Å²	156	94 Å²	94	68%	0.678	51%	0.509	S	S	*	.	H	α-helix	trans	-75.3	-41.4	174.3	-73.2	-172.3	172.8	-176.4	0	112.8	V41 L42 M43 S48 L49	V41-K45 WeakPolarHBondContact O-CB 3.49Å; V41-K45 WeakPolarHBondContact O-CG 3.49Å; V41-K45 PolarHBondContact O-N 3.47Å; L42-K45 PolarHBondContact O-N 3.08Å; M43-K45 VanDerWaalsContact C-N 3.33Å; M43-K45 PolarHBondContact O-N 2.85Å; K45-S48 WeakPolarHBondContact O-CB 3.36Å; K45-S48 PolarHBondContact O-N 2.89Å; K45-L49 PolarHBondContact O-N 3.42Å
46	C	63.9	Low	68.1	Low	69 Å²	69	92.8 Å²	92.8	47%	0.466	51%	0.508	S	S	.	.	H	α-helix	trans	-72.2	-32.8	-176.8	-171	0	0	0	0	112	L42 M43 S48 L49 F50	L42-C46 WeakPolarHBondContact O-CA 2.95Å; L42-C46 WeakPolarHBondContact O-CB 3.34Å; L42-C46 PolarHBondContact O-N 3.04Å; M43-C46 PolarHBondContact O-N 2.64Å; C46-S48 PolarHBondContact O-N 3.44Å; C46-L49 CarbonylContact O-C 3.47Å; C46-L49 PolarHBondContact O-N 2.87Å; C46-F50 VanDerWaalsContact O-CB 3.3Å; C46-F50 WeakPolarHBondContact O-CB 3.39Å; C46-F50 PolarHBondContact O-N 2.86Å
47	M	63.9	Low	67.3	Low	88 Å²	88	98.6 Å²	98.6	43%	0.433	53%	0.531	S	S	.	.	H	α-helix	trans	-60.2	-31.6	174	-169.4	152.6	70.1	0	0	111.5	M43 V51	M43-M47 VanDerWaalsContact O-CB 3.24Å; M43-M47 WeakPolarHBondContact O-CB 3.16Å; M43-M47 PolarHBondContact O-N 3.43Å; M47-V51 WeakPolarHBondContact O-CG2 3.34Å; M47-V51 PolarHBondContact O-N 2.91Å
48	S	65.2	Low	66.5	Low	82 Å²	82	101.3 Å²	101.3	57%	0.573	55%	0.547	S	S	*	.	H	α-helix	trans	-69.2	-36.3	172.5	-152.6	0	0	0	0	112.7	K45 C46 L52	K45-S48 WeakPolarHBondContact O-CB 3.36Å; K45-S48 PolarHBondContact O-N 2.89Å; C46-S48 PolarHBondContact O-N 3.44Å; S48-L52 WeakPolarHBondContact O-CG 3.3Å
49	L	63.2	Low	65.6	Low	105 Å²	105	99.3 Å²	99.3	55%	0.55	54%	0.539	S	S	.	.	H	α-helix	trans	-82.8	-34.4	-178.3	-164.9	70	0	0	0	113	K45 C46 L52 L53	K45-L49 PolarHBondContact O-N 3.42Å; C46-L49 CarbonylContact O-C 3.47Å; C46-L49 PolarHBondContact O-N 2.87Å; L49-L52 PolarHBondContact O-N 2.86Å; L49-L53 HydrophobicContact CD2-CD1 4.41Å; L49-L53 HydrophobicContact CG-CD1 4.06Å; L49-L53 PolarHBondContact O-N 2.89Å
50	F	62.7	Low	65	Low	93 Å²	93	102.1 Å²	102.1	41%	0.408	54%	0.543	S	S	.	.	H	α-helix	trans	-68.6	-37.6	179.2	-172.2	-113	0	0	0	111.6	C46 L52 L53 F54 W63	C46-F50 VanDerWaalsContact O-CB 3.3Å; C46-F50 WeakPolarHBondContact O-CB 3.39Å; C46-F50 PolarHBondContact O-N 2.86Å; F50-L52 PolarHBondContact O-N 3.46Å; F50-L53 PolarHBondContact O-N 3.34Å; F50-F54 AromaticContact CD2-CD2 3.57Å; F50-F54 HydrophobicContact CD2-CD2 3.57Å; F50-F54 AromaticContact CD2-CE2 3.98Å; F50-F54 HydrophobicContact CD2-CE2 3.98Å; F50-F54 HydrophobicContact CD2-CG 4.28Å; F50-F54 HydrophobicContact CE2-CB 4.41Å; F50-F54 HydrophobicContact CE2-CD1 4.36Å; F50-F54 AromaticContact CE2-CD2 3.28Å; F50-F54 HydrophobicContact CE2-CD2 3.28Å; F50-F54 AromaticContact CE2-CE2 3.47Å; F50-F54 HydrophobicContact CE2-CE2 3.47Å; F50-F54 VanDerWaalsContact CE2-CE2 3.47Å; F50-F54 AromaticContact CE2-CG 3.77Å; F50-F54 HydrophobicContact CE2-CG 3.77Å; F50-F54 HydrophobicContact CE2-CZ 4.09Å; F50-F54 HydrophobicContact CZ-CB 4.47Å; F50-F54 HydrophobicContact CZ-CD1 4.45Å; F50-F54 HydrophobicContact CZ-CD2 4.05Å; F50-F54 HydrophobicContact CZ-CE2 4.4Å; F50-F54 HydrophobicContact CZ-CG 4.07Å; F50-F54 PolarHBondContact O-N 2.91Å; F50-F54 VanDerWaalsContact O-N 3.07Å; F50-W63 AromaticContact CD1-CH2 3.45Å; F50-W63 HydrophobicContact CD1-CH2 3.45Å; F50-W63 VanDerWaalsContact CD1-CH2 3.45Å; F50-W63 HydrophobicContact CD1-CZ2 4.38Å; F50-W63 HydrophobicContact CD1-CZ3 4.14Å; F50-W63 AromaticContact CE1-CH2 3.11Å; F50-W63 HydrophobicContact CE1-CH2 3.11Å; F50-W63 AromaticContact CE1-CZ2 3.64Å; F50-W63 HydrophobicContact CE1-CZ2 3.64Å; F50-W63 HydrophobicContact CE1-CZ3 4.06Å; F50-W63 HydrophobicContact CG-CH2 4.43Å; F50-W63 AromaticContact CZ-CH2 3.86Å; F50-W63 HydrophobicContact CZ-CH2 3.86Å; F50-W63 AromaticContact CZ-CZ2 3.99Å; F50-W63 HydrophobicContact CZ-CZ2 3.99Å
51	V	60.7	Low	64.5	Low	42 Å²	42	107.3 Å²	107.3	26%	0.255	56%	0.561	S	S	.	*	H	α-helix	trans	-62.9	-29.9	172	171.5	0	0	0	0	111.7	M47 F55	M47-V51 WeakPolarHBondContact O-CG2 3.34Å; M47-V51 PolarHBondContact O-N 2.91Å; V51-F55 HydrophobicContact CG1-CD2 4.45Å; V51-F55 HydrophobicContact CG1-CE2 3.95Å; V51-F55 HydrophobicContact CG1-CZ 4.38Å; V51-F55 WeakPolarHBondContact O-CD2 3.44Å
52	L	61.5	Low	64	Low	133 Å²	133	107 Å²	107	70%	0.696	56%	0.562	S	S	*	*	H	α-helix	trans	-83.1	-30.7	178	-67.6	172.6	0	0	0	113.4	S48 L49 F50	S48-L52 WeakPolarHBondContact O-CG 3.3Å; L49-L52 PolarHBondContact O-N 2.86Å; F50-L52 PolarHBondContact O-N 3.46Å
53	L	63	Low	63.5	Low	130 Å²	130	104.4 Å²	104.4	68%	0.681	54%	0.544	S	S	*	.	H	α-helix	trans	-91.7	-24.6	-175	-73.6	174.3	0	0	0	114.6	L49 F50	L49-L53 HydrophobicContact CD2-CD1 4.41Å; L49-L53 HydrophobicContact CG-CD1 4.06Å; L49-L53 PolarHBondContact O-N 2.89Å; F50-L53 PolarHBondContact O-N 3.34Å
54	F	63.3	Low	63.4	Low	118 Å²	118	102.9 Å²	102.9	52%	0.518	54%	0.538	S	S	.	.	S	Bend	trans	-104.4	20.4	-175.7	-92.4	-97.3	0	0	0	114.4	F50 P56 W63	F50-F54 AromaticContact CD2-CD2 3.57Å; F50-F54 HydrophobicContact CD2-CD2 3.57Å; F50-F54 AromaticContact CD2-CE2 3.98Å; F50-F54 HydrophobicContact CD2-CE2 3.98Å; F50-F54 HydrophobicContact CD2-CG 4.28Å; F50-F54 HydrophobicContact CE2-CB 4.41Å; F50-F54 HydrophobicContact CE2-CD1 4.36Å; F50-F54 AromaticContact CE2-CD2 3.28Å; F50-F54 HydrophobicContact CE2-CD2 3.28Å; F50-F54 AromaticContact CE2-CE2 3.47Å; F50-F54 HydrophobicContact CE2-CE2 3.47Å; F50-F54 VanDerWaalsContact CE2-CE2 3.47Å; F50-F54 AromaticContact CE2-CG 3.77Å; F50-F54 HydrophobicContact CE2-CG 3.77Å; F50-F54 HydrophobicContact CE2-CZ 4.09Å; F50-F54 HydrophobicContact CZ-CB 4.47Å; F50-F54 HydrophobicContact CZ-CD1 4.45Å; F50-F54 HydrophobicContact CZ-CD2 4.05Å; F50-F54 HydrophobicContact CZ-CE2 4.4Å; F50-F54 HydrophobicContact CZ-CG 4.07Å; F50-F54 PolarHBondContact O-N 2.91Å; F50-F54 VanDerWaalsContact O-N 3.07Å; F54-P56 WeakPolarHBondContact O-CD 3.25Å; F54-W63 HydrophobicContact CB-CH2 3.82Å; F54-W63 HydrophobicContact CB-CZ2 3.69Å; F54-W63 HydrophobicContact CG-CZ2 4.38Å
55	F	59.3	Low	63.4	Low	79 Å²	79	104.7 Å²	104.7	35%	0.346	54%	0.538	S	S	.	.			trans	-99.4	80.5	176.9	-98.1	-122.4	0	0	0	112.6	V51 Y60 W63	V51-F55 HydrophobicContact CG1-CD2 4.45Å; V51-F55 HydrophobicContact CG1-CE2 3.95Å; V51-F55 HydrophobicContact CG1-CZ 4.38Å; V51-F55 WeakPolarHBondContact O-CD2 3.44Å; F55-Y60 HydrophobicContact CD1-CD2 4.13Å; F55-Y60 AromaticContact CD1-CE1 4Å; F55-Y60 HydrophobicContact CD1-CE1 4Å; F55-Y60 AromaticContact CD1-CE2 3.26Å; F55-Y60 HydrophobicContact CD1-CE2 3.26Å; F55-Y60 AromaticContact CD1-CZ 3.21Å; F55-Y60 WeakPolarHBondContact CD1-OH 3.36Å; F55-Y60 HydrophobicContact CE1-CD1 4.01Å; F55-Y60 HydrophobicContact CE1-CD2 4.16Å; F55-Y60 AromaticContact CE1-CE1 3.32Å; F55-Y60 HydrophobicContact CE1-CE1 3.32Å; F55-Y60 AromaticContact CE1-CE2 3.49Å; F55-Y60 HydrophobicContact CE1-CE2 3.49Å; F55-Y60 VanDerWaalsContact CE1-CE2 3.49Å; F55-Y60 HydrophobicContact CE1-CG 4.41Å; F55-Y60 AromaticContact CE1-CZ 3.04Å; F55-Y60 WeakPolarHBondContact CE1-OH 3.47Å; F55-Y60 HydrophobicContact CG-CE2 4.32Å; F55-Y60 HydrophobicContact CZ-CE1 4.25Å; F55-W63 HydrophobicContact CE2-CE3 4.16Å; F55-W63 HydrophobicContact CE2-CZ3 4.38Å
56	P	64.2	Low	63.5	Low	81 Å²	81	105 Å²	105	53%	0.526	54%	0.539	S	S	.	.			trans	-78.5	134.7	146.6	30.2	-23	0	0	0	108.3	F54 N58 V59	F54-P56 WeakPolarHBondContact O-CD 3.25Å; P56-N58 PolarHBondContact O-N 3Å; P56-V59 HydrophobicContact CG-CG2 4.34Å; P56-V59 PolarHBondContact O-N 3.09Å
57	L	59.3	Low	63.7	Low	153 Å²	153	105 Å²	105	80%	0.801	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-6.9	-173.1	-93	84.2	0	0	0	116.5
58	N	60.7	Low	64	Low	162 Å²	162	104.3 Å²	104.3	87%	0.866	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	3.5	-168.9	-110.8	-16.9	0	0	0	115.9	P56	P56-N58 PolarHBondContact O-N 3Å
59	V	63.4	Low	64.2	Low	71 Å²	71	106.2 Å²	106.2	43%	0.43	54%	0.535	S	S	.	.	S	Bend	trans	-118.1	13.8	177.5	-156.4	0	0	0	0	112.1	P56 F61 W63	P56-V59 HydrophobicContact CG-CG2 4.34Å; P56-V59 PolarHBondContact O-N 3.09Å; V59-F61 VanDerWaalsContact C-N 3.31Å; V59-F61 PolarHBondContact O-N 3.43Å; V59-W63 WeakPolarHBondContact O-CB 3.36Å; V59-W63 PolarHBondContact O-N 3.43Å
60	Y	63.3	Low	64.5	Low	123 Å²	123	103.6 Å²	103.6	48%	0.482	53%	0.525	S	S	.	.	H	α-helix	trans	-58.4	-34.3	-174.3	-102.5	-102.8	0	0	0	114.1	F55 L64	F55-Y60 HydrophobicContact CD1-CD2 4.13Å; F55-Y60 AromaticContact CD1-CE1 4Å; F55-Y60 HydrophobicContact CD1-CE1 4Å; F55-Y60 AromaticContact CD1-CE2 3.26Å; F55-Y60 HydrophobicContact CD1-CE2 3.26Å; F55-Y60 AromaticContact CD1-CZ 3.21Å; F55-Y60 WeakPolarHBondContact CD1-OH 3.36Å; F55-Y60 HydrophobicContact CE1-CD1 4.01Å; F55-Y60 HydrophobicContact CE1-CD2 4.16Å; F55-Y60 AromaticContact CE1-CE1 3.32Å; F55-Y60 HydrophobicContact CE1-CE1 3.32Å; F55-Y60 AromaticContact CE1-CE2 3.49Å; F55-Y60 HydrophobicContact CE1-CE2 3.49Å; F55-Y60 VanDerWaalsContact CE1-CE2 3.49Å; F55-Y60 HydrophobicContact CE1-CG 4.41Å; F55-Y60 AromaticContact CE1-CZ 3.04Å; F55-Y60 WeakPolarHBondContact CE1-OH 3.47Å; F55-Y60 HydrophobicContact CG-CE2 4.32Å; F55-Y60 HydrophobicContact CZ-CE1 4.25Å; Y60-L64 WeakPolarHBondContact O-CB 3.11Å; Y60-L64 PolarHBondContact O-N 2.96Å
61	F	63.5	Low	64.7	Low	170 Å²	170	101.7 Å²	101.7	75%	0.746	52%	0.521	S	S	*	.	H	α-helix	trans	-75.7	-43.4	-171.7	-147.2	-93.3	0	0	0	113	V59 L64 L65	V59-F61 VanDerWaalsContact C-N 3.31Å; V59-F61 PolarHBondContact O-N 3.43Å; F61-L64 PolarHBondContact O-N 2.97Å; F61-L65 PolarHBondContact O-N 3.29Å
62	S	66.8	Low	65.1	Low	75 Å²	75	106.2 Å²	106.2	52%	0.524	54%	0.538	S	S	.	.	H	α-helix	trans	-72.7	-33.2	175.4	-163.9	0	0	0	0	111.7	F66	S62-F66 PolarHBondContact O-N 2.81Å; S62-F66 VanDerWaalsContact O-N 3.14Å
63	W	65	Low	65.3	Low	61 Å²	61	104.2 Å²	104.2	23%	0.231	53%	0.527	C	S	.	.	H	α-helix	trans	-68.6	-35	172.9	-96.1	77.4	0	0	0	112.8	F50 F54 F55 V59 F66 H67	F50-W63 AromaticContact CD1-CH2 3.45Å; F50-W63 HydrophobicContact CD1-CH2 3.45Å; F50-W63 VanDerWaalsContact CD1-CH2 3.45Å; F50-W63 HydrophobicContact CD1-CZ2 4.38Å; F50-W63 HydrophobicContact CD1-CZ3 4.14Å; F50-W63 AromaticContact CE1-CH2 3.11Å; F50-W63 HydrophobicContact CE1-CH2 3.11Å; F50-W63 AromaticContact CE1-CZ2 3.64Å; F50-W63 HydrophobicContact CE1-CZ2 3.64Å; F50-W63 HydrophobicContact CE1-CZ3 4.06Å; F50-W63 HydrophobicContact CG-CH2 4.43Å; F50-W63 AromaticContact CZ-CH2 3.86Å; F50-W63 HydrophobicContact CZ-CH2 3.86Å; F50-W63 AromaticContact CZ-CZ2 3.99Å; F50-W63 HydrophobicContact CZ-CZ2 3.99Å; F54-W63 HydrophobicContact CB-CH2 3.82Å; F54-W63 HydrophobicContact CB-CZ2 3.69Å; F54-W63 HydrophobicContact CG-CZ2 4.38Å; F55-W63 HydrophobicContact CE2-CE3 4.16Å; F55-W63 HydrophobicContact CE2-CZ3 4.38Å; V59-W63 WeakPolarHBondContact O-CB 3.36Å; V59-W63 PolarHBondContact O-N 3.43Å; W63-F66 PolarHBondContact O-N 2.73Å; W63-H67 WeakPolarHBondContact O-CB 3.44Å; W63-H67 PolarHBondContact O-N 3.5Å
64	L	63.9	Low	65.4	Low	102 Å²	102	100 Å²	100	53%	0.534	51%	0.508	S	S	.	.	H	α-helix	trans	-66.6	-38.2	177.1	-166.3	72.6	0	0	0	111.6	Y60 F61 H67 T68	Y60-L64 WeakPolarHBondContact O-CB 3.11Å; Y60-L64 PolarHBondContact O-N 2.96Å; F61-L64 PolarHBondContact O-N 2.97Å; L64-H67 PolarHBondContact O-N 2.58Å; L64-T68 HydrophobicContact CG-CG2 4.38Å; L64-T68 VanDerWaalsContact O-CB 3.28Å; L64-T68 WeakPolarHBondContact O-CB 3.18Å; L64-T68 WeakPolarHBondContact O-CG2 3.37Å; L64-T68 PolarHBondContact O-N 2.81Å; L64-T68 PolarHBondContact O-OG1 3.05Å
65	L	66.3	Low	65.3	Low	106 Å²	106	101.2 Å²	101.2	56%	0.555	51%	0.513	S	S	*	.	H	α-helix	trans	-65.7	-46	173.4	-69.2	175.6	0	0	0	111.5	F61 H67 T68 M69	F61-L65 PolarHBondContact O-N 3.29Å; L65-H67 VanDerWaalsContact C-N 3.35Å; L65-H67 PolarHBondContact O-N 3.26Å; L65-T68 WeakPolarHBondContact CA-OG1 3.33Å; L65-T68 PolarHBondContact O-OG1 2.83Å; L65-M69 WeakPolarHBondContact O-CB 3.31Å; L65-M69 VanDerWaalsContact O-CG 3.27Å; L65-M69 WeakPolarHBondContact O-CG 2.99Å; L65-M69 PolarHBondContact O-N 3.05Å
66	F	69.8	Low	65.6	Low	161 Å²	161	101.2 Å²	101.2	71%	0.706	52%	0.52	S	S	*	.	H	α-helix	trans	-64	-38.8	176	-100.9	-97.9	0	0	0	112.9	S62 W63 S70	S62-F66 PolarHBondContact O-N 2.81Å; S62-F66 VanDerWaalsContact O-N 3.14Å; W63-F66 PolarHBondContact O-N 2.73Å; F66-S70 VanDerWaalsContact O-CB 3.23Å; F66-S70 WeakPolarHBondContact O-CB 3.41Å; F66-S70 PolarHBondContact O-N 3.1Å
67	H	69.8	Low	65.3	Low	71 Å²	71	100.9 Å²	100.9	33%	0.329	51%	0.512	S	S	.	.	H	α-helix	trans	-75.3	-38.1	-178.5	-160.9	-85.5	0	0	0	111.8	W63 L64 L65 S70 V71	W63-H67 WeakPolarHBondContact O-CB 3.44Å; W63-H67 PolarHBondContact O-N 3.5Å; L64-H67 PolarHBondContact O-N 2.58Å; L65-H67 VanDerWaalsContact C-N 3.35Å; L65-H67 PolarHBondContact O-N 3.26Å; H67-S70 PolarHBondContact O-N 3.01Å; H67-V71 VanDerWaalsContact O-CB 3.32Å; H67-V71 WeakPolarHBondContact O-CB 3.34Å; H67-V71 WeakPolarHBondContact O-CG2 3.39Å; H67-V71 PolarHBondContact O-N 3.32Å
68	T	68.8	Low	65.2	Low	73 Å²	73	98.7 Å²	98.7	45%	0.448	50%	0.496	S	S	.	.	H	α-helix	trans	-66.1	-40.7	173.8	51.9	0	0	0	0	111.2	L64 L65 F72	L64-T68 HydrophobicContact CG-CG2 4.38Å; L64-T68 VanDerWaalsContact O-CB 3.28Å; L64-T68 WeakPolarHBondContact O-CB 3.18Å; L64-T68 WeakPolarHBondContact O-CG2 3.37Å; L64-T68 PolarHBondContact O-N 2.81Å; L64-T68 PolarHBondContact O-OG1 3.05Å; L65-T68 WeakPolarHBondContact CA-OG1 3.33Å; L65-T68 PolarHBondContact O-OG1 2.83Å; T68-F72 WeakPolarHBondContact O-CB 3.21Å; T68-F72 PolarHBondContact O-N 3.38Å
69	M	69.3	Low	65	Low	122 Å²	122	97.6 Å²	97.6	60%	0.601	49%	0.49	S	S	*	.	H	α-helix	trans	-66.5	-40.7	173.8	-67.5	-139.2	78.1	0	0	112.7	L65 F72 L73	L65-M69 WeakPolarHBondContact O-CB 3.31Å; L65-M69 VanDerWaalsContact O-CG 3.27Å; L65-M69 WeakPolarHBondContact O-CG 2.99Å; L65-M69 PolarHBondContact O-N 3.05Å; M69-F72 PolarHBondContact O-N 3.16Å; M69-L73 WeakPolarHBondContact O-CB 3.49Å; M69-L73 WeakPolarHBondContact O-CG 3.35Å; M69-L73 PolarHBondContact O-N 3.41Å
70	S	69.8	Low	64.6	Low	49 Å²	49	97.9 Å²	97.9	34%	0.343	50%	0.496	S	S	.	.	H	α-helix	trans	-68	-42.8	178.2	-178.2	0	0	0	0	112.8	F66 H67 L73 S74	F66-S70 VanDerWaalsContact O-CB 3.23Å; F66-S70 WeakPolarHBondContact O-CB 3.41Å; F66-S70 PolarHBondContact O-N 3.1Å; H67-S70 PolarHBondContact O-N 3.01Å; S70-L73 PolarHBondContact O-N 3.24Å; S70-S74 WeakPolarHBondContact O-CB 3.49Å; S70-S74 PolarHBondContact O-N 2.88Å; S70-S74 PolarHBondContact O-OG 3.39Å
71	V	68	Low	64.4	Low	53 Å²	53	96 Å²	96	32%	0.321	51%	0.514	S	S	.	.	H	α-helix	trans	-69.3	-35.9	175.7	174.3	0	0	0	0	110.8	H67 K75	H67-V71 VanDerWaalsContact O-CB 3.32Å; H67-V71 WeakPolarHBondContact O-CB 3.34Å; H67-V71 WeakPolarHBondContact O-CG2 3.39Å; H67-V71 PolarHBondContact O-N 3.32Å; V71-K75 HydrophobicContact CG1-CD 4.39Å; V71-K75 WeakPolarHBondContact O-CB 3.34Å; V71-K75 WeakPolarHBondContact O-CG 3.22Å; V71-K75 PolarHBondContact O-N 3.08Å
72	F	67.7	Low	64	Low	138 Å²	138	96.8 Å²	96.8	61%	0.605	51%	0.512	S	S	*	.	H	α-helix	trans	-65.8	-45.7	175.2	-171.7	-97.9	0	0	0	111.6	T68 M69 K75 V76	T68-F72 WeakPolarHBondContact O-CB 3.21Å; T68-F72 PolarHBondContact O-N 3.38Å; M69-F72 PolarHBondContact O-N 3.16Å; F72-K75 PolarHBondContact O-N 2.94Å; F72-V76 HydrophobicContact CD1-CG2 3.88Å; F72-V76 HydrophobicContact CE1-CG2 3.6Å; F72-V76 HydrophobicContact CE2-CG2 4.3Å; F72-V76 HydrophobicContact CG-CG2 4.36Å; F72-V76 HydrophobicContact CZ-CG2 3.83Å; F72-V76 WeakPolarHBondContact O-CB 3.3Å; F72-V76 VanDerWaalsContact O-CG2 3.24Å; F72-V76 WeakPolarHBondContact O-CG2 3.29Å; F72-V76 PolarHBondContact O-N 2.85Å
73	L	65.6	Low	63.7	Low	90 Å²	90	97.2 Å²	97.2	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-63.3	-42	175.4	-76.8	164.7	0	0	0	112.3	M69 S70 V76 M77	M69-L73 WeakPolarHBondContact O-CB 3.49Å; M69-L73 WeakPolarHBondContact O-CG 3.35Å; M69-L73 PolarHBondContact O-N 3.41Å; S70-L73 PolarHBondContact O-N 3.24Å; L73-V76 PolarHBondContact O-N 3.47Å; L73-M77 WeakPolarHBondContact O-CB 3.43Å; L73-M77 VanDerWaalsContact O-CG 3.26Å; L73-M77 WeakPolarHBondContact O-CG 3.44Å; L73-M77 PolarHBondContact O-N 3.49Å
74	S	64.9	Low	63.5	Low	42 Å²	42	97.8 Å²	97.8	29%	0.294	51%	0.513	S	S	.	.	H	α-helix	trans	-61	-47.4	175.1	-62	0	0	0	0	110.7	S70 F78	S70-S74 WeakPolarHBondContact O-CB 3.49Å; S70-S74 PolarHBondContact O-N 2.88Å; S70-S74 PolarHBondContact O-OG 3.39Å; S74-F78 WeakPolarHBondContact O-CB 3.19Å; S74-F78 WeakPolarHBondContact O-CD2 3.34Å; S74-F78 PolarHBondContact O-N 2.96Å
75	K	61.9	Low	63.5	Low	143 Å²	143	95.1 Å²	95.1	62%	0.622	50%	0.502	S	S	*	.	H	α-helix	trans	-65.7	-45.9	177.5	-76.3	-173.1	176.6	-176.6	0	112.4	V71 F72 M77 N79	V71-K75 HydrophobicContact CG1-CD 4.39Å; V71-K75 WeakPolarHBondContact O-CB 3.34Å; V71-K75 WeakPolarHBondContact O-CG 3.22Å; V71-K75 PolarHBondContact O-N 3.08Å; F72-K75 PolarHBondContact O-N 2.94Å; K75-M77 VanDerWaalsContact C-N 3.28Å; K75-M77 PolarHBondContact O-N 2.75Å; K75-N79 WeakPolarHBondContact O-CA 3.48Å; K75-N79 WeakPolarHBondContact O-CB 3.43Å; K75-N79 PolarHBondContact O-N 2.99Å
76	V	65	Low	63.4	Low	80 Å²	80	94.1 Å²	94.1	49%	0.485	50%	0.496	S	S	.	.	H	α-helix	trans	-60.1	-41.4	-177.9	164	0	0	0	0	111.4	F72 L73	F72-V76 HydrophobicContact CD1-CG2 3.88Å; F72-V76 HydrophobicContact CE1-CG2 3.6Å; F72-V76 HydrophobicContact CE2-CG2 4.3Å; F72-V76 HydrophobicContact CG-CG2 4.36Å; F72-V76 HydrophobicContact CZ-CG2 3.83Å; F72-V76 WeakPolarHBondContact O-CB 3.3Å; F72-V76 VanDerWaalsContact O-CG2 3.24Å; F72-V76 WeakPolarHBondContact O-CG2 3.29Å; F72-V76 PolarHBondContact O-N 2.85Å; L73-V76 PolarHBondContact O-N 3.47Å
77	M	57.9	Low	63.2	Low	73 Å²	73	95.1 Å²	95.1	36%	0.36	50%	0.495	S	S	.	.	H	α-helix	trans	-100.3	-19.5	-171.5	-51.9	-108	-74	0	0	113.5	L73 K75 W84	L73-M77 WeakPolarHBondContact O-CB 3.43Å; L73-M77 VanDerWaalsContact O-CG 3.26Å; L73-M77 WeakPolarHBondContact O-CG 3.44Å; L73-M77 PolarHBondContact O-N 3.49Å; K75-M77 VanDerWaalsContact C-N 3.28Å; K75-M77 PolarHBondContact O-N 2.75Å; M77-W84 HydrophobicContact CB-CD2 3.94Å; M77-W84 HydrophobicContact CB-CE3 2.85Å; M77-W84 HydrophobicContact CB-CH2 4.07Å; M77-W84 HydrophobicContact CB-CZ3 2.93Å; M77-W84 HydrophobicContact CE-CD2 3.3Å; M77-W84 HydrophobicContact CE-CE3 3.34Å; M77-W84 HydrophobicContact CE-CG 3.95Å; M77-W84 HydrophobicContact CE-CH2 3.27Å; M77-W84 HydrophobicContact CE-CZ2 3.39Å; M77-W84 HydrophobicContact CE-CZ3 3.31Å; M77-W84 HydrophobicContact CG-CE3 3.57Å; M77-W84 HydrophobicContact CG-CH2 3.89Å; M77-W84 HydrophobicContact CG-CZ3 3.19Å; M77-W84 HydrophobicContact SD-CE3 4.12Å; M77-W84 HydrophobicContact SD-CH2 4.34Å; M77-W84 HydrophobicContact SD-CZ3 4.01Å
78	F	58.3	Low	63.1	Low	107 Å²	107	97 Å²	97	47%	0.469	51%	0.507	S	S	.	.	H	α-helix	trans	-92.8	-20.7	170.9	-74.1	-96.8	0	0	0	113.7	S74 W84 P85	S74-F78 WeakPolarHBondContact O-CB 3.19Å; S74-F78 WeakPolarHBondContact O-CD2 3.34Å; S74-F78 PolarHBondContact O-N 2.96Å; F78-W84 AromaticContact CD2-CE3 3.92Å; F78-W84 HydrophobicContact CD2-CE3 3.92Å; F78-W84 HydrophobicContact CD2-CZ3 4.11Å; F78-W84 HydrophobicContact CE2-CD2 4.45Å; F78-W84 AromaticContact CE2-CE3 3.75Å; F78-W84 HydrophobicContact CE2-CE3 3.75Å; F78-W84 AromaticContact CE2-CZ3 3.93Å; F78-W84 HydrophobicContact CE2-CZ3 3.93Å; F78-P85 HydrophobicContact CE1-CG 3.67Å; F78-P85 HydrophobicContact CZ-CB 4.48Å; F78-P85 HydrophobicContact CZ-CG 3.71Å
79	N	56.2	Low	63.1	Low	139 Å²	139	94.7 Å²	94.7	74%	0.743	50%	0.498	S	S	*	.	S	Bend	trans	-100.4	29.8	-173.4	-161.7	45.7	0	0	0	114.9	K75	K75-N79 WeakPolarHBondContact O-CA 3.48Å; K75-N79 WeakPolarHBondContact O-CB 3.43Å; K75-N79 PolarHBondContact O-N 2.99Å
80	S	55.6	Low	63.2	Low	78 Å²	78	90.8 Å²	90.8	55%	0.545	48%	0.481	S	S	.	.	S	Bend	trans	-134.9	43.2	171.2	-169.1	0	0	0	0	111.2	R82	S80-R82 WeakPolarHBondContact O-CG 3.33Å; S80-R82 PolarHBondContact O-N 3.33Å
81	G	57.7	Low	63.6	Low	83 Å²	83	90.4 Å²	90.4	86%	0.856	49%	0.485	S	S	*	.	S	Bend	trans	57.5	18.2	175.6	0	0	0	0	0	114.8
82	R	56.6	Low	63.9	Low	186 Å²	186	92.4 Å²	92.4	70%	0.702	50%	0.497	S	S	*	.			trans	-107.5	107.4	-173.9	-58.7	-132.3	-172.2	-175	3.7	108.5	S80 W84	S80-R82 WeakPolarHBondContact O-CG 3.33Å; S80-R82 PolarHBondContact O-N 3.33Å; R82-W84 PolarHBondContact O-N 2.88Å
83	T	60	Low	64.4	Low	85 Å²	85	86.2 Å²	86.2	52%	0.521	47%	0.472	S	S	.	.			trans	-67	43.3	173.4	44.9	0	0	0	0	112.2	P85 M86 W87	T83-P85 VanDerWaalsContact C-CD 3.42Å; T83-P85 VanDerWaalsContact C-N 3.34Å; T83-P85 VanDerWaalsContact O-N 3.14Å; T83-M86 WeakPolarHBondContact O-CA 3.48Å; T83-M86 WeakPolarHBondContact O-CB 3.21Å; T83-M86 PolarHBondContact O-N 3.35Å; T83-W87 PolarHBondContact O-N 3.36Å; T83-W87 PolarHBondContact OG1-NE1 3.12Å
84	W	60.7	Low	65.1	Low	72 Å²	72	86.7 Å²	86.7	27%	0.273	48%	0.475	S	S	.	.	H	α-helix	trans	-38.5	-55.5	-177	131.5	36.9	0	0	0	112.8	M77 F78 R82 M86 W87 L88	M77-W84 HydrophobicContact CB-CD2 3.94Å; M77-W84 HydrophobicContact CB-CE3 2.85Å; M77-W84 HydrophobicContact CB-CH2 4.07Å; M77-W84 HydrophobicContact CB-CZ3 2.93Å; M77-W84 HydrophobicContact CE-CD2 3.3Å; M77-W84 HydrophobicContact CE-CE3 3.34Å; M77-W84 HydrophobicContact CE-CG 3.95Å; M77-W84 HydrophobicContact CE-CH2 3.27Å; M77-W84 HydrophobicContact CE-CZ2 3.39Å; M77-W84 HydrophobicContact CE-CZ3 3.31Å; M77-W84 HydrophobicContact CG-CE3 3.57Å; M77-W84 HydrophobicContact CG-CH2 3.89Å; M77-W84 HydrophobicContact CG-CZ3 3.19Å; M77-W84 HydrophobicContact SD-CE3 4.12Å; M77-W84 HydrophobicContact SD-CH2 4.34Å; M77-W84 HydrophobicContact SD-CZ3 4.01Å; F78-W84 AromaticContact CD2-CE3 3.92Å; F78-W84 HydrophobicContact CD2-CE3 3.92Å; F78-W84 HydrophobicContact CD2-CZ3 4.11Å; F78-W84 HydrophobicContact CE2-CD2 4.45Å; F78-W84 AromaticContact CE2-CE3 3.75Å; F78-W84 HydrophobicContact CE2-CE3 3.75Å; F78-W84 AromaticContact CE2-CZ3 3.93Å; F78-W84 HydrophobicContact CE2-CZ3 3.93Å; R82-W84 PolarHBondContact O-N 2.88Å; W84-M86 PolarHBondContact O-N 3.19Å; W84-M86 VanDerWaalsContact O-N 3.15Å; W84-W87 WeakPolarHBondContact O-CA 3.06Å; W84-W87 WeakPolarHBondContact O-CB 2.93Å; W84-W87 PolarHBondContact O-N 3.24Å; W84-L88 VanDerWaalsContact CD1-CD1 3.41Å; W84-L88 VanDerWaalsContact NE1-CD1 3.25Å; W84-L88 PolarHBondContact O-N 3.08Å
85	P	63.1	Low	66	Low	46 Å²	46	86.7 Å²	86.7	30%	0.299	48%	0.481	S	S	.	.	H	α-helix	trans	-63.3	-28.2	-171.7	22.7	-35	0	0	0	111.6	F78 T83 G89	F78-P85 HydrophobicContact CE1-CG 3.67Å; F78-P85 HydrophobicContact CZ-CB 4.48Å; F78-P85 HydrophobicContact CZ-CG 3.71Å; T83-P85 VanDerWaalsContact C-CD 3.42Å; T83-P85 VanDerWaalsContact C-N 3.34Å; T83-P85 VanDerWaalsContact O-N 3.14Å; P85-G89 PolarHBondContact O-N 3.3Å
86	M	64.4	Low	66.9	Low	85 Å²	85	83.7 Å²	83.7	42%	0.419	47%	0.471	S	S	.	.	H	α-helix	trans	-67	-45.6	171.4	-157.5	87.2	179	0	0	110.9	L33 T83 W84 T90	L33-M86 HydrophobicContact CD1-CE 3.63Å; L33-M86 HydrophobicContact CD2-CE 3.41Å; L33-M86 VanDerWaalsContact CD2-CE 3.41Å; L33-M86 HydrophobicContact CD2-CG 3.97Å; L33-M86 HydrophobicContact CD2-SD 3.48Å; L33-M86 WeakPolarHBondContact CD2-SD 2.82Å; L33-M86 HydrophobicContact CG-CE 4.08Å; T83-M86 WeakPolarHBondContact O-CA 3.48Å; T83-M86 WeakPolarHBondContact O-CB 3.21Å; T83-M86 PolarHBondContact O-N 3.35Å; W84-M86 PolarHBondContact O-N 3.19Å; W84-M86 VanDerWaalsContact O-N 3.15Å; M86-T90 WeakPolarHBondContact O-CB 3.34Å; M86-T90 PolarHBondContact O-N 3.47Å; M86-T90 PolarHBondContact O-OG1 3.47Å
87	W	67	Low	67.6	Low	183 Å²	183	80.3 Å²	80.3	69%	0.693	45%	0.452	S	S	*	.	H	α-helix	trans	-66.4	-40.6	179.7	-68.6	97.2	0	0	0	112.8	T83 W84 G91	T83-W87 PolarHBondContact O-N 3.36Å; T83-W87 PolarHBondContact OG1-NE1 3.12Å; W84-W87 WeakPolarHBondContact O-CA 3.06Å; W84-W87 WeakPolarHBondContact O-CB 2.93Å; W84-W87 PolarHBondContact O-N 3.24Å; W87-G91 PolarHBondContact O-N 2.94Å
88	L	67.3	Low	68.9	Low	109 Å²	109	84.9 Å²	84.9	57%	0.571	47%	0.466	S	S	*	.	H	α-helix	trans	-70.1	-42.4	176.6	-69.4	-175.7	0	0	0	111.8	W84 G91 V92	W84-L88 VanDerWaalsContact CD1-CD1 3.41Å; W84-L88 VanDerWaalsContact NE1-CD1 3.25Å; W84-L88 PolarHBondContact O-N 3.08Å; L88-G91 PolarHBondContact O-N 3.47Å; L88-V92 WeakPolarHBondContact O-CG2 3.44Å; L88-V92 PolarHBondContact O-N 3.19Å
89	G	68.4	Low	70.1	Confident	26 Å²	26	82.9 Å²	82.9	27%	0.268	47%	0.466	S	S	.	.	H	α-helix	trans	-64	-40.8	175.6	0	0	0	0	0	112.6	P85 G93	P85-G89 PolarHBondContact O-N 3.3Å; G89-G93 PolarHBondContact O-N 2.88Å
90	T	72	Confident	71.4	Confident	39 Å²	39	79.3 Å²	79.3	24%	0.239	45%	0.446	C	S	.	.	H	α-helix	trans	-70	-40.2	176.5	-52.4	0	0	0	0	111.2	M86 G93 L94	M86-T90 WeakPolarHBondContact O-CB 3.34Å; M86-T90 PolarHBondContact O-N 3.47Å; M86-T90 PolarHBondContact O-OG1 3.47Å; T90-G93 PolarHBondContact O-N 3.45Å; T90-L94 HydrophobicContact CG2-CD1 3.86Å; T90-L94 HydrophobicContact CG2-CG 4.16Å; T90-L94 VanDerWaalsContact O-CB 3.3Å; T90-L94 WeakPolarHBondContact O-CB 3.24Å; T90-L94 VanDerWaalsContact O-CG 3.22Å; T90-L94 WeakPolarHBondContact O-CG 3.48Å; T90-L94 PolarHBondContact O-N 3.25Å
91	G	77	Confident	72.7	Confident	42 Å²	42	76.6 Å²	76.6	43%	0.433	43%	0.427	S	S	.	.	H	α-helix	trans	-63.6	-42.6	178.4	0	0	0	0	0	113.1	W87 L88 G95	W87-G91 PolarHBondContact O-N 2.94Å; L88-G91 PolarHBondContact O-N 3.47Å; G91-G95 PolarHBondContact O-N 3.4Å
92	V	75.1	Confident	74	Confident	95 Å²	95	75.2 Å²	75.2	58%	0.576	40%	0.4	S	S	*	.	H	α-helix	trans	-66.6	-44.2	174.2	174.7	0	0	0	0	110.9	L88 L94 G95 I96	L88-V92 WeakPolarHBondContact O-CG2 3.44Å; L88-V92 PolarHBondContact O-N 3.19Å; V92-L94 PolarHBondContact O-N 2.02Å; V92-G95 PolarHBondContact O-N 3.01Å; V92-I96 HydrophobicContact CG1-CD1 4.07Å; V92-I96 WeakPolarHBondContact O-CG1 3.43Å; V92-I96 PolarHBondContact O-N 3.27Å; V92-I96 VanDerWaalsContact O-N 3.08Å
93	G	77.3	Confident	75.2	Confident	8 Å²	8	73.8 Å²	73.8	8%	0.082	40%	0.396	C	S	.	.	H	α-helix	trans	-61	-42.8	177.8	0	0	0	0	0	113.2	G89 T90 A97	G89-G93 PolarHBondContact O-N 2.88Å; T90-G93 PolarHBondContact O-N 3.45Å; G93-A97 WeakPolarHBondContact O-CB 3.48Å; G93-A97 PolarHBondContact O-N 2.86Å
94	L	81.8	Confident	76	Confident	100 Å²	100	74 Å²	74	52%	0.524	39%	0.394	S	S	.	.	H	α-helix	trans	-66.3	-41.2	175.1	-74.6	173.1	0	0	0	112	T90 V92 A97 Y98	T90-L94 HydrophobicContact CG2-CD1 3.86Å; T90-L94 HydrophobicContact CG2-CG 4.16Å; T90-L94 VanDerWaalsContact O-CB 3.3Å; T90-L94 WeakPolarHBondContact O-CB 3.24Å; T90-L94 VanDerWaalsContact O-CG 3.22Å; T90-L94 WeakPolarHBondContact O-CG 3.48Å; T90-L94 PolarHBondContact O-N 3.25Å; V92-L94 PolarHBondContact O-N 2.02Å; L94-A97 PolarHBondContact O-N 3.39Å; L94-Y98 WeakPolarHBondContact O-CB 3.39Å; L94-Y98 PolarHBondContact O-N 3.49Å
95	G	82	Confident	76.6	Confident	41 Å²	41	74.3 Å²	74.3	42%	0.423	40%	0.395	S	S	.	.	H	α-helix	trans	-61.5	-45	178.4	0	0	0	0	0	112.5	G91 V92 Y98 S99	G91-G95 PolarHBondContact O-N 3.4Å; V92-G95 PolarHBondContact O-N 3.01Å; G95-Y98 PolarHBondContact O-N 3.42Å; G95-S99 PolarHBondContact O-N 3.49Å; G95-S99 PolarHBondContact O-OG 3.06Å
96	I	80.7	Confident	77.1	Confident	80 Å²	80	81.1 Å²	81.1	41%	0.41	42%	0.415	S	S	.	.	H	α-helix	trans	-62.6	-52.1	175.6	-63	169.4	0	0	0	109.6	K28 V92 Y98 S99 D100	K28-I96 HydrophobicContact CD-CG2 3.97Å; V92-I96 HydrophobicContact CG1-CD1 4.07Å; V92-I96 WeakPolarHBondContact O-CG1 3.43Å; V92-I96 PolarHBondContact O-N 3.27Å; V92-I96 VanDerWaalsContact O-N 3.08Å; I96-Y98 VanDerWaalsContact C-N 3.25Å; I96-Y98 PolarHBondContact O-N 3.16Å; I96-S99 PolarHBondContact O-N 3.43Å; I96-S99 VanDerWaalsContact O-N 3.09Å; I96-S99 PolarHBondContact O-OG 3.05Å; I96-D100 PolarHBondContact O-N 3.23Å
97	A	81.6	Confident	77.3	Confident	10 Å²	10	83.3 Å²	83.3	8%	0.083	42%	0.422	C	S	.	.	H	α-helix	trans	-57.2	-38.8	179.6	0	0	0	0	0	112.9	G25 G93 L94 C101	G25-A97 VanDerWaalsContact CA-CB 3.48Å; G93-A97 WeakPolarHBondContact O-CB 3.48Å; G93-A97 PolarHBondContact O-N 2.86Å; L94-A97 PolarHBondContact O-N 3.39Å; A97-C101 PolarHBondContact O-N 2.86Å; A97-C101 PolarHBondContact O-SG 3.43Å
98	Y	83.2	Confident	76.9	Confident	169 Å²	169	76.1 Å²	76.1	66%	0.663	41%	0.406	S	S	*	.	H	α-helix	trans	-67.1	-42.9	177	-174.7	-95.8	0	0	0	111.8	L94 G95 I96 D100 C101 D102	L94-Y98 WeakPolarHBondContact O-CB 3.39Å; L94-Y98 PolarHBondContact O-N 3.49Å; G95-Y98 PolarHBondContact O-N 3.42Å; I96-Y98 VanDerWaalsContact C-N 3.25Å; I96-Y98 PolarHBondContact O-N 3.16Å; Y98-D100 VanDerWaalsContact C-N 3.35Å; Y98-D100 PolarHBondContact O-N 3.14Å; Y98-C101 WeakPolarHBondContact O-CB 3.46Å; Y98-C101 PolarHBondContact O-N 3.19Å; Y98-D102 PolarHBondContact O-N 3.08Å
99	S	85.1	Confident	76.3	Confident	65 Å²	65	74.4 Å²	74.4	46%	0.455	40%	0.399	S	S	.	.	H	α-helix	trans	-65.2	-36.6	178.7	67.8	0	0	0	0	113	G95 I96 C101 Y103	G95-S99 PolarHBondContact O-N 3.49Å; G95-S99 PolarHBondContact O-OG 3.06Å; I96-S99 PolarHBondContact O-N 3.43Å; I96-S99 VanDerWaalsContact O-N 3.09Å; I96-S99 PolarHBondContact O-OG 3.05Å; S99-C101 VanDerWaalsContact C-N 3.31Å; S99-C101 PolarHBondContact O-N 2.86Å; S99-Y103 WeakPolarHBondContact O-CB 3.04Å; S99-Y103 PolarHBondContact O-N 3.33Å; S99-Y103 VanDerWaalsContact O-N 3.1Å
100	D	83.2	Confident	75.6	Confident	64 Å²	64	76.9 Å²	76.9	34%	0.342	41%	0.406	S	S	.	.	H	α-helix	trans	-64	-40.4	173.6	-58.8	-58.7	0	0	0	110.9	K28 I96 Y98 Y103 D104	K28-D100 IonicContact NZ-OD1 2.75Å; K28-D100 IonicContact NZ-OD2 3.75Å; K28-D100 PolarHBondContact NZ-OD2 3.4Å; I96-D100 PolarHBondContact O-N 3.23Å; Y98-D100 VanDerWaalsContact C-N 3.35Å; Y98-D100 PolarHBondContact O-N 3.14Å; D100-Y103 WeakPolarHBondContact O-CB 3.31Å; D100-Y103 PolarHBondContact O-N 2.97Å; D100-D104 PolarHBondContact O-N 3.39Å; D100-D104 VanDerWaalsContact O-N 3.08Å
101	C	83.3	Confident	74.7	Confident	20 Å²	20	79.4 Å²	79.4	14%	0.135	42%	0.417	C	S	.	.	H	α-helix	trans	-68.4	-48.3	179.4	-75	0	0	0	0	112.9	C21 A97 Y98 S99 Y103 D104 Y105	C21-C101 WeakPolarHBondContact CA-SG 3.49Å; C21-C101 HydrophobicContact CB-CB 4.16Å; C21-C101 WeakPolarHBondContact CB-SG 2.83Å; C21-C101 WeakPolarHBondContact SG-CA 3.3Å; C21-C101 WeakPolarHBondContact SG-CB 3.35Å; C21-C101 CovalentContact SG-SG 2.02Å; C21-C101 PolarHBondContact SG-SG 2.93Å; A97-C101 PolarHBondContact O-N 2.86Å; A97-C101 PolarHBondContact O-SG 3.43Å; Y98-C101 WeakPolarHBondContact O-CB 3.46Å; Y98-C101 PolarHBondContact O-N 3.19Å; S99-C101 VanDerWaalsContact C-N 3.31Å; S99-C101 PolarHBondContact O-N 2.86Å; C101-Y103 PolarHBondContact O-N 3.12Å; C101-D104 PolarHBondContact O-N 2.85Å; C101-D104 VanDerWaalsContact O-N 3.12Å; C101-Y105 HydrophobicContact CB-CE2 4.46Å; C101-Y105 WeakPolarHBondContact O-CD2 3.26Å; C101-Y105 PolarHBondContact O-N 3.28Å
102	D	83.4	Confident	73.6	Confident	55 Å²	55	89.3 Å²	89.3	29%	0.294	44%	0.441	S	S	.	.	H	α-helix	trans	-57.8	-39.2	176.5	-172.1	60	0	0	0	110.8	Y98 Y105 R106	Y98-D102 PolarHBondContact O-N 3.08Å; D102-Y105 PolarHBondContact O-N 2.86Å; D102-R106 WeakPolarHBondContact O-CG 3.31Å; D102-R106 PolarHBondContact O-N 2.99Å; D102-R106 IonicContact OD1-NE 3.54Å; D102-R106 IonicContact OD1-NH2 3.29Å; D102-R106 IonicContact OD2-CZ 3.57Å; D102-R106 VanDerWaalsContact OD2-CZ 3.29Å; D102-R106 IonicContact OD2-NE 2.94Å; D102-R106 PolarHBondContact OD2-NE 3.4Å; D102-R106 IonicContact OD2-NH2 2.58Å; D102-R106 PolarHBondContact OD2-NH2 3.41Å
103	Y	82.2	Confident	72.6	Confident	155 Å²	155	88.2 Å²	88.2	61%	0.608	45%	0.449	S	S	*	.	H	α-helix	trans	-60.9	-46.1	174.8	-175	-96.9	0	0	0	112.7	S99 D100 C101 Y105 R106 K107	S99-Y103 WeakPolarHBondContact O-CB 3.04Å; S99-Y103 PolarHBondContact O-N 3.33Å; S99-Y103 VanDerWaalsContact O-N 3.1Å; D100-Y103 WeakPolarHBondContact O-CB 3.31Å; D100-Y103 PolarHBondContact O-N 2.97Å; C101-Y103 PolarHBondContact O-N 3.12Å; Y103-Y105 VanDerWaalsContact C-N 3.35Å; Y103-Y105 PolarHBondContact O-N 2.94Å; Y103-R106 PolarHBondContact O-N 2.92Å; Y103-K107 PolarHBondContact O-N 2.82Å
104	D	76.4	Confident	71.4	Confident	91 Å²	91	92.7 Å²	92.7	49%	0.487	47%	0.466	S	S	.	.	H	α-helix	trans	-67.3	-31.8	177.8	-87	-10.5	0	0	0	113.2	D100 C101	D100-D104 PolarHBondContact O-N 3.39Å; D100-D104 VanDerWaalsContact O-N 3.08Å; C101-D104 PolarHBondContact O-N 2.85Å; C101-D104 VanDerWaalsContact O-N 3.12Å
105	Y	74.8	Confident	69.9	Low	77 Å²	77	92.3 Å²	92.3	30%	0.302	46%	0.464	S	S	.	.	H	α-helix	trans	-71.3	-39.3	173.6	-78	-69.8	0	0	0	112.2	Y14 K17 M18 C101 D102 Y103 K107 G108	Y14-Y105 AromaticContact CD2-CE1 3.82Å; Y14-Y105 HydrophobicContact CD2-CE1 3.82Å; Y14-Y105 AromaticContact CE2-CE1 3.67Å; Y14-Y105 HydrophobicContact CE2-CE1 3.67Å; Y14-Y105 AromaticContact CE2-CZ 3.97Å; K17-Y105 HydrophobicContact CB-CE1 4.15Å; K17-Y105 HydrophobicContact CD-CE1 4.31Å; M18-Y105 WeakPolarHBondContact CA-OH 3.44Å; M18-Y105 PolarHBondContact N-OH 3.37Å; C101-Y105 HydrophobicContact CB-CE2 4.46Å; C101-Y105 WeakPolarHBondContact O-CD2 3.26Å; C101-Y105 PolarHBondContact O-N 3.28Å; D102-Y105 PolarHBondContact O-N 2.86Å; Y103-Y105 VanDerWaalsContact C-N 3.35Å; Y103-Y105 PolarHBondContact O-N 2.94Å; Y105-K107 VanDerWaalsContact C-N 3.27Å; Y105-K107 PolarHBondContact O-N 3.13Å; Y105-G108 PolarHBondContact O-N 3.12Å
106	R	74	Confident	68.5	Low	189 Å²	189	92.8 Å²	92.8	71%	0.713	46%	0.457	S	S	*	.	H	α-helix	trans	-66.4	-25.8	177.5	-75	-179.7	-165.5	-81.2	-9.5	113.6	D102 Y103 G108	D102-R106 WeakPolarHBondContact O-CG 3.31Å; D102-R106 PolarHBondContact O-N 2.99Å; D102-R106 IonicContact OD1-NE 3.54Å; D102-R106 IonicContact OD1-NH2 3.29Å; D102-R106 IonicContact OD2-CZ 3.57Å; D102-R106 VanDerWaalsContact OD2-CZ 3.29Å; D102-R106 IonicContact OD2-NE 2.94Å; D102-R106 PolarHBondContact OD2-NE 3.4Å; D102-R106 IonicContact OD2-NH2 2.58Å; D102-R106 PolarHBondContact OD2-NH2 3.41Å; Y103-R106 PolarHBondContact O-N 2.92Å; R106-G108 PolarHBondContact O-N 3.41Å
107	K	67.9	Low	67.3	Low	131 Å²	131	95.8 Å²	95.8	57%	0.57	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-0.7	-178.7	-161	169.3	178.8	-179.6	0	114.3	Y103 Y105	Y103-K107 PolarHBondContact O-N 2.82Å; Y105-K107 VanDerWaalsContact C-N 3.27Å; Y105-K107 PolarHBondContact O-N 3.13Å
108	G	59.1	Low	66.2	Low	33 Å²	33	99.1 Å²	99.1	34%	0.34	49%	0.486	S	S	.	.			trans	78	149.3	176	0	0	0	0	0	112.1	Y105 R106 I110	Y105-G108 PolarHBondContact O-N 3.12Å; R106-G108 PolarHBondContact O-N 3.41Å; G108-I110 PolarHBondContact O-N 3.37Å; G108-I110 VanDerWaalsContact O-N 3.08Å
109	T	54.6	Low	65	Low	72 Å²	72	94 Å²	94	44%	0.442	47%	0.47	S	S	.	.			trans	-69.1	102.8	173.3	42.5	0	0	0	0	109	I111	T109-I111 PolarHBondContact O-N 3.43Å
110	I	52.1	Low	63.8	Low	79 Å²	79	94.9 Å²	94.9	41%	0.405	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	83.3	167	-39.1	178.3	0	0	0	106.4	G108 R112 G113	G108-I110 PolarHBondContact O-N 3.37Å; G108-I110 VanDerWaalsContact O-N 3.08Å; I110-R112 VanDerWaalsContact C-N 3.31Å; I110-R112 PolarHBondContact O-N 3.22Å; I110-G113 VanDerWaalsContact CG2-C 3.47Å
111	I	54.4	Low	62.8	Low	92 Å²	92	96.7 Å²	96.7	47%	0.472	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	98	171	-51.8	-179.9	0	0	0	106	T109 G113 K114 I116	T109-I111 PolarHBondContact O-N 3.43Å; I111-G113 PolarHBondContact O-N 2.86Å; I111-K114 PolarHBondContact O-N 3.16Å; I111-I116 HydrophobicContact CD1-CD1 4.33Å
112	R	53.8	Low	61.8	Low	249 Å²	249	101.9 Å²	101.9	94%	0.94	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	57.5	179.2	-74	-176.7	165.8	-176.2	-2.8	115.2	I110 K114	I110-R112 VanDerWaalsContact C-N 3.31Å; I110-R112 PolarHBondContact O-N 3.22Å; R112-K114 VanDerWaalsContact C-N 3.35Å; R112-K114 PolarHBondContact O-N 3.32Å
113	G	53.9	Low	60.8	Low	72 Å²	72	102.5 Å²	102.5	74%	0.742	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	12.7	172	0	0	0	0	0	115.8	I110 I111	I110-G113 VanDerWaalsContact CG2-C 3.47Å; I111-G113 PolarHBondContact O-N 2.86Å
114	K	51.9	Low	59.8	Low	103 Å²	103	102.4 Å²	102.4	45%	0.448	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	119.3	174.6	-128	179.6	-171.5	-150.7	0	110.7	I111 R112 I116 S135	I111-K114 PolarHBondContact O-N 3.16Å; R112-K114 VanDerWaalsContact C-N 3.35Å; R112-K114 PolarHBondContact O-N 3.32Å; K114-I116 HydrophobicContact CB-CG1 4.39Å; K114-I116 PolarHBondContact O-N 3.34Å; K114-S135 WeakPolarHBondContact CD-OG 3.34Å; K114-S135 WeakPolarHBondContact CE-OG 3.5Å; K114-S135 VanDerWaalsContact CG-OG 3.31Å; K114-S135 WeakPolarHBondContact CG-OG 3.18Å; K114-S135 PolarHBondContact NZ-OG 3.36Å
115	L	51.1	Low	59.3	Low	92 Å²	92	102.9 Å²	102.9	48%	0.482	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	119.1	164.8	-77.9	161.3	0	0	0	107.8	E136	L115-E136 PolarHBondContact O-N 2.97Å
116	I	52.9	Low	58.7	Low	51 Å²	51	105.4 Å²	105.4	26%	0.262	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	110	174.2	-55.8	178.8	0	0	0	107.3	I111 K114 V118 A133 F134	I111-I116 HydrophobicContact CD1-CD1 4.33Å; K114-I116 HydrophobicContact CB-CG1 4.39Å; K114-I116 PolarHBondContact O-N 3.34Å; I116-V118 HydrophobicContact CG2-CG2 4.42Å; I116-V118 PolarHBondContact O-N 3.26Å; I116-A133 HydrophobicContact CG2-CB 3.61Å; I116-F134 CarbonylContact C-O 3.58Å; I116-F134 VanDerWaalsContact CA-O 3.26Å; I116-F134 WeakPolarHBondContact CA-O 3.15Å
117	K	54.6	Low	57.9	Low	142 Å²	142	102.5 Å²	102.5	62%	0.617	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	110.2	171.4	-169.5	173.9	-176.2	175.2	0	107.1	I119 F134	K117-I119 HydrophobicContact CG-CG1 4.43Å; K117-F134 PolarHBondContact N-O 3.23Å; K117-F134 PolarHBondContact O-N 3.38Å
118	V	58	Low	57.2	Low	80 Å²	80	102.5 Å²	102.5	49%	0.485	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	118	173.7	179.6	0	0	0	0	107.8	I116 T120 V131 A133	I116-V118 HydrophobicContact CG2-CG2 4.42Å; I116-V118 PolarHBondContact O-N 3.26Å; V118-T120 HydrophobicContact CG1-CG2 4.37Å; V118-V131 HydrophobicContact CG1-CG1 3.21Å; V118-A133 HydrophobicContact CG2-CB 4.49Å
119	I	59.3	Low	56.9	Low	63 Å²	63	106.7 Å²	106.7	32%	0.323	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.2	113.2	169.9	-54.1	172.8	0	0	0	105.8	K117 F121 I132 F134	K117-I119 HydrophobicContact CG-CG1 4.43Å; I119-F121 HydrophobicContact CB-CD2 4.47Å; I119-F121 HydrophobicContact CB-CE2 3.82Å; I119-F121 HydrophobicContact CB-CZ 4.19Å; I119-F121 HydrophobicContact CG2-CD1 4.49Å; I119-F121 HydrophobicContact CG2-CD2 4.01Å; I119-F121 HydrophobicContact CG2-CE1 3.99Å; I119-F121 HydrophobicContact CG2-CE2 3.44Å; I119-F121 VanDerWaalsContact CG2-CE2 3.44Å; I119-F121 HydrophobicContact CG2-CZ 3.43Å; I119-F121 VanDerWaalsContact CG2-CZ 3.43Å; I119-I132 PolarHBondContact N-O 2.75Å; I119-I132 VanDerWaalsContact N-O 3.12Å; I119-I132 PolarHBondContact O-N 3.3Å; I119-F134 HydrophobicContact CD1-CD2 4.1Å; I119-F134 HydrophobicContact CD1-CE2 4.27Å; I119-F134 HydrophobicContact CG1-CD2 4.42Å
120	T	59.5	Low	57.1	Low	82 Å²	82	106.8 Å²	106.8	50%	0.503	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83	115.3	171.6	46.9	0	0	0	0	108.5	V118 V131	V118-T120 HydrophobicContact CG1-CG2 4.37Å; T120-V131 HydrophobicContact CG2-CG2 4.36Å
121	F	61.6	Low	57.4	Low	102 Å²	102	107.3 Å²	107.3	45%	0.447	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.8	123.9	168.1	-63.9	-85.7	0	0	0	107.8	I119 D123 T130 I132	I119-F121 HydrophobicContact CB-CD2 4.47Å; I119-F121 HydrophobicContact CB-CE2 3.82Å; I119-F121 HydrophobicContact CB-CZ 4.19Å; I119-F121 HydrophobicContact CG2-CD1 4.49Å; I119-F121 HydrophobicContact CG2-CD2 4.01Å; I119-F121 HydrophobicContact CG2-CE1 3.99Å; I119-F121 HydrophobicContact CG2-CE2 3.44Å; I119-F121 VanDerWaalsContact CG2-CE2 3.44Å; I119-F121 HydrophobicContact CG2-CZ 3.43Å; I119-F121 VanDerWaalsContact CG2-CZ 3.43Å; F121-D123 PolarHBondContact O-N 3.01Å; F121-T130 PolarHBondContact N-O 3.17Å; F121-T130 PolarHBondContact O-N 2.97Å; F121-I132 HydrophobicContact CD2-CD1 3.95Å; F121-I132 HydrophobicContact CD2-CG1 4.36Å; F121-I132 HydrophobicContact CE2-CD1 4.08Å
122	I	61.6	Low	57.6	Low	129 Å²	129	106.7 Å²	106.7	66%	0.662	57%	0.567	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.5	97.3	167.6	-57.7	173.9	0	0	0	105.5	N124	I122-N124 VanDerWaalsContact C-N 3.35Å; I122-N124 PolarHBondContact O-N 3.23Å; I122-N124 VanDerWaalsContact O-N 3.08Å
123	D	63.5	Low	57.8	Low	68 Å²	68	97.9 Å²	97.9	36%	0.364	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	95.6	165.8	-175.1	10.2	0	0	0	108.1	F121 S125 K126	F121-D123 PolarHBondContact O-N 3.01Å; D123-S125 PolarHBondContact O-N 3.08Å; D123-S125 WeakPolarHBondContact OD1-CB 3.47Å; D123-S125 PolarHBondContact OD1-N 3.03Å; D123-K126 PolarHBondContact O-N 3.18Å
124	N	61.9	Low	57.9	Low	153 Å²	153	99.6 Å²	99.6	82%	0.818	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-13.5	176.2	-114.9	-60.2	0	0	0	112.2	I122	I122-N124 VanDerWaalsContact C-N 3.35Å; I122-N124 PolarHBondContact O-N 3.23Å; I122-N124 VanDerWaalsContact O-N 3.08Å
125	S	64.3	Low	58	Low	101 Å²	101	96.7 Å²	96.7	71%	0.706	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-15.1	178.3	-168.2	0	0	0	0	114.4	D123	D123-S125 PolarHBondContact O-N 3.08Å; D123-S125 WeakPolarHBondContact OD1-CB 3.47Å; D123-S125 PolarHBondContact OD1-N 3.03Å
126	K	62.2	Low	58.5	Low	131 Å²	131	99.1 Å²	99.1	57%	0.57	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.3	0.6	-174.6	-80.2	-172.9	177	-175.2	0	116.4	D123 E128	D123-K126 PolarHBondContact O-N 3.18Å; K126-E128 HydrophobicContact CB-CB 4.23Å; K126-E128 HydrophobicContact CB-CG 4.47Å; K126-E128 WeakPolarHBondContact O-CG 3.41Å; K126-E128 PolarHBondContact O-N 3.24Å
127	S	57.8	Low	58.6	Low	128 Å²	128	106.2 Å²	106.2	90%	0.895	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.2	24.8	-170.9	55.1	0	0	0	0	113.1
128	E	52.4	Low	58.4	Low	130 Å²	130	102.8 Å²	102.8	61%	0.607	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.5	122.8	-179.9	-73.7	-168.9	113.2	0	0	108.2	K126 T130	K126-E128 HydrophobicContact CB-CB 4.23Å; K126-E128 HydrophobicContact CB-CG 4.47Å; K126-E128 WeakPolarHBondContact O-CG 3.41Å; K126-E128 PolarHBondContact O-N 3.24Å; E128-T130 PolarHBondContact O-N 3.46Å
129	L	53.8	Low	57.9	Low	122 Å²	122	109.4 Å²	109.4	64%	0.639	59%	0.587	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-72.4	109.7	169.1	-86.7	103.4	0	0	0	108.8
130	T	59.2	Low	56.9	Low	74 Å²	74	117.9 Å²	117.9	45%	0.454	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.7	114.3	170.1	1	0	0	0	0	109.2	F121 E128	F121-T130 PolarHBondContact N-O 3.17Å; F121-T130 PolarHBondContact O-N 2.97Å; E128-T130 PolarHBondContact O-N 3.46Å
131	V	57.3	Low	56.2	Low	90 Å²	90	125.6 Å²	125.6	55%	0.545	64%	0.635	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95	104	180	-172.8	0	0	0	0	108.4	V118 T120	V118-V131 HydrophobicContact CG1-CG1 3.21Å; T120-V131 HydrophobicContact CG2-CG2 4.36Å
132	I	59.8	Low	55.5	Low	78 Å²	78	132.9 Å²	132.9	40%	0.4	67%	0.67	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.1	118.6	175.4	-50.6	177.3	0	0	0	108.4	I119 F121 F134	I119-I132 PolarHBondContact N-O 2.75Å; I119-I132 VanDerWaalsContact N-O 3.12Å; I119-I132 PolarHBondContact O-N 3.3Å; F121-I132 HydrophobicContact CD2-CD1 3.95Å; F121-I132 HydrophobicContact CD2-CG1 4.36Å; F121-I132 HydrophobicContact CE2-CD1 4.08Å; I132-F134 HydrophobicContact CB-CD2 4.44Å; I132-F134 HydrophobicContact CB-CE2 3.89Å; I132-F134 HydrophobicContact CG2-CD2 3.9Å; I132-F134 HydrophobicContact CG2-CE2 3.34Å; I132-F134 HydrophobicContact CG2-CZ 3.74Å
133	A	57.2	Low	55.2	Low	64 Å²	64	133.1 Å²	133.1	53%	0.529	67%	0.67	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.9	108.8	-178.7	0	0	0	0	0	109.4	I116 V118	I116-A133 HydrophobicContact CG2-CB 3.61Å; V118-A133 HydrophobicContact CG2-CB 4.49Å
134	F	55.2	Low	54.8	Low	108 Å²	108	136.5 Å²	136.5	47%	0.474	69%	0.687	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.5	119.6	178.2	-74.7	-89.7	0	0	0	110.6	I116 K117 I119 I132	I116-F134 CarbonylContact C-O 3.58Å; I116-F134 VanDerWaalsContact CA-O 3.26Å; I116-F134 WeakPolarHBondContact CA-O 3.15Å; K117-F134 PolarHBondContact N-O 3.23Å; K117-F134 PolarHBondContact O-N 3.38Å; I119-F134 HydrophobicContact CD1-CD2 4.1Å; I119-F134 HydrophobicContact CD1-CE2 4.27Å; I119-F134 HydrophobicContact CG1-CD2 4.42Å; I132-F134 HydrophobicContact CB-CD2 4.44Å; I132-F134 HydrophobicContact CB-CE2 3.89Å; I132-F134 HydrophobicContact CG2-CD2 3.9Å; I132-F134 HydrophobicContact CG2-CE2 3.34Å; I132-F134 HydrophobicContact CG2-CZ 3.74Å
135	S	55.5	Low	54.4	Low	43 Å²	43	135.6 Å²	135.6	30%	0.301	68%	0.679	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.7	115.7	173.8	177.5	0	0	0	0	110.6	K114 K137	K114-S135 WeakPolarHBondContact CD-OG 3.34Å; K114-S135 WeakPolarHBondContact CE-OG 3.5Å; K114-S135 VanDerWaalsContact CG-OG 3.31Å; K114-S135 WeakPolarHBondContact CG-OG 3.18Å; K114-S135 PolarHBondContact NZ-OG 3.36Å; S135-K137 PolarHBondContact O-N 2.7Å; S135-K137 VanDerWaalsContact O-N 3.16Å
136	E	61.3	Low	53.8	Low	143 Å²	143	137.6 Å²	137.6	67%	0.668	68%	0.678	S	S	*	*			trans	-79	98.6	179.6	-140.5	179	-177.7	0	0	109.5	L115 G138	L115-E136 PolarHBondContact O-N 2.97Å; E136-G138 VanDerWaalsContact C-N 3.29Å; E136-G138 PolarHBondContact O-N 3.45Å; E136-G138 VanDerWaalsContact O-N 3.14Å
137	K	53.7	Low	53.3	Low	199 Å²	199	138.1 Å²	138.1	87%	0.865	68%	0.684	S	S	*	*			trans	-86.6	71.2	175.3	-147	180	-173.5	-177.5	0	109.1	S135	S135-K137 PolarHBondContact O-N 2.7Å; S135-K137 VanDerWaalsContact O-N 3.16Å
138	G	51.1	Low	53	Low	71 Å²	71	138.7 Å²	138.7	73%	0.732	67%	0.67	S	S	*	*			trans	-88.5	107.1	179.2	0	0	0	0	0	112.8	E136	E136-G138 VanDerWaalsContact C-N 3.29Å; E136-G138 PolarHBondContact O-N 3.45Å; E136-G138 VanDerWaalsContact O-N 3.14Å
139	R	47.7	Very low	53	Low	219 Å²	219	139.4 Å²	139.4	83%	0.826	68%	0.675	S	S	*	*			trans	-88.2	127.4	174.9	168.7	-164.8	-64.3	176.2	-1.7	109.7
140	W	38.3	Very low	52.9	Low	241 Å²	241	140.7 Å²	140.7	91%	0.913	68%	0.678	S	S	*	*			trans	-145.5	112	148	-67	102	0	0	0	108.9
141	R	44.6	Very low	52.4	Low	243 Å²	243	146.3 Å²	146.3	92%	0.917	70%	0.696	S	S	*	*			trans	-104.2	125.1	158.4	-85.9	-151.2	-89.5	-162.3	-3.7	106.1
142	H	47.3	Very low	52	Low	256 Å²	256	151.4 Å²	151.4	100%	1.185	71%	0.71	S	S	*	*			trans	-82.2	0	154	-80.4	-79.3	0	0	0	108.9

Retrieved 142 of 142 residues in 77.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).