A0A077ZAH7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZAH7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 173 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	32.7	Very low	38.2	Very low	231 Å²	231	156.9 Å²	156.9	100%	1.138	79%	0.793	S	S	*	*				0	101.3	0	-67.4	176.3	-160.1	0	0	106.9
2	E	35.4	Very low	38.5	Very low	189 Å²	189	158.9 Å²	158.9	88%	0.883	78%	0.783	S	S	*	*			trans	-71.7	121.9	163.8	-82.4	175.6	128.1	0	0	107.3
3	I	36.7	Very low	38.8	Very low	132 Å²	132	152.3 Å²	152.3	68%	0.677	76%	0.76	S	S	*	*			trans	-109.1	96.1	171.7	-57.9	177.3	0	0	0	106.5	T5	I3-T5 HydrophobicContact CG2-CG2 4.1Å; I3-T5 PolarHBondContact O-N 2.67Å
4	T	37.9	Very low	39.2	Very low	99 Å²	99	148.1 Å²	148.1	61%	0.607	75%	0.746	S	S	*	*			trans	-86.3	94.6	171.7	-44	0	0	0	0	108.1	Y6	T4-Y6 HydrophobicContact CG2-CD2 4.33Å; T4-Y6 HydrophobicContact CG2-CE2 3.87Å
5	T	38.7	Very low	39.9	Very low	73 Å²	73	143.7 Å²	143.7	45%	0.448	72%	0.717	S	S	.	*			trans	-86.5	113.4	170.3	34.7	0	0	0	0	110.1	I3 I7	I3-T5 HydrophobicContact CG2-CG2 4.1Å; I3-T5 PolarHBondContact O-N 2.67Å; T5-I7 PolarHBondContact O-N 3.38Å
6	Y	32.7	Very low	40.2	Very low	213 Å²	213	139.6 Å²	139.6	84%	0.835	71%	0.707	S	S	*	*			trans	-77.3	105.5	172.7	-73	-98.8	0	0	0	109.3	T4	T4-Y6 HydrophobicContact CG2-CD2 4.33Å; T4-Y6 HydrophobicContact CG2-CE2 3.87Å
7	I	45.6	Very low	40.8	Very low	131 Å²	131	139.8 Å²	139.8	67%	0.672	72%	0.722	S	S	*	*			trans	-118.6	112	167.3	-56.7	-175.9	0	0	0	107.5	T5	T5-I7 PolarHBondContact O-N 3.38Å
8	E	44.8	Very low	41.8	Very low	166 Å²	166	135.6 Å²	135.6	78%	0.776	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	48.9	78.8	165.4	-65	-174.7	131.5	0	0	117.4	R10	E8-R10 PolarHBondContact O-N 2.8Å
9	G	39.7	Very low	43.1	Very low	98 Å²	98	129.5 Å²	129.5	100%	1.01	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	56	5.7	145.1	0	0	0	0	0	119.5
10	R	38	Very low	45.2	Very low	189 Å²	189	124.8 Å²	124.8	71%	0.713	66%	0.66	S	S	*	*	S	Bend	trans	-135.1	116.6	179.2	-116.6	-179.9	-158.1	161.8	8.2	106.3	E8 R12	E8-R10 PolarHBondContact O-N 2.8Å; R10-R12 VanDerWaalsContact C-N 3.27Å; R10-R12 PolarHBondContact O-N 3.14Å
11	Q	38.6	Very low	47.3	Very low	205 Å²	205	124.2 Å²	124.2	96%	0.958	65%	0.652	S	S	*	*			trans	-57.4	92.9	168.8	-74.8	173.7	-14	0	0	108.8
12	R	40.8	Very low	50	Low	181 Å²	181	113.2 Å²	113.2	68%	0.683	60%	0.598	S	S	*	*			trans	-95.8	131.9	164.4	-63.4	-167.4	-161.9	-174.6	8.2	106.6	R10 V14	R10-R12 VanDerWaalsContact C-N 3.27Å; R10-R12 PolarHBondContact O-N 3.14Å; R12-V14 PolarHBondContact O-N 3.43Å
13	P	43	Very low	52.6	Low	73 Å²	73	104.2 Å²	104.2	47%	0.474	56%	0.556	S	S	.	*			trans	-58	115.2	166.9	24.2	-30.1	0	0	0	107.6	Y15	P13-Y15 HydrophobicContact CG-CE2 4.31Å; P13-Y15 PolarHBondContact O-N 3.04Å
14	V	44.1	Very low	55.3	Low	94 Å²	94	99.3 Å²	99.3	57%	0.57	53%	0.53	S	S	*	.			trans	-69.8	98.8	172.5	178.5	0	0	0	0	106	R12 S16	R12-V14 PolarHBondContact O-N 3.43Å; V14-S16 PolarHBondContact O-N 2.85Å; V14-S16 VanDerWaalsContact O-N 3.07Å
15	Y	50.4	Low	57.9	Low	81 Å²	81	94.7 Å²	94.7	32%	0.318	50%	0.502	S	S	.	.			trans	-67.2	104.7	168.9	-65.3	-58.5	0	0	0	107.6	P13 C17 P77 Y109 P129	P13-Y15 HydrophobicContact CG-CE2 4.31Å; P13-Y15 PolarHBondContact O-N 3.04Å; Y15-C17 PolarHBondContact O-N 3.27Å; Y15-P77 HydrophobicContact CD1-CB 3.83Å; Y15-P77 HydrophobicContact CD1-CG 3.07Å; Y15-P77 HydrophobicContact CE1-CB 4.34Å; Y15-P77 HydrophobicContact CE1-CG 3.65Å; Y15-P77 HydrophobicContact CG-CG 3.71Å; Y15-Y109 PolarHBondContact OH-O 3.11Å; Y15-P129 HydrophobicContact CE1-CB 4.28Å
16	S	44.7	Very low	60.4	Low	79 Å²	79	91.2 Å²	91.2	55%	0.552	48%	0.48	S	S	*	.			trans	-58.6	131	166.9	-171.4	0	0	0	0	107.6	V14 A18	V14-S16 PolarHBondContact O-N 2.85Å; V14-S16 VanDerWaalsContact O-N 3.07Å; S16-A18 CarbonylContact O-C 3.58Å; S16-A18 PolarHBondContact O-N 2.84Å; S16-A18 WeakPolarHBondContact OG-CB 3.47Å; S16-A18 PolarHBondContact OG-N 3.37Å
17	C	49.6	Very low	63.1	Low	142 Å²	142	81.1 Å²	81.1	96%	0.959	44%	0.441	S	S	*	.	S	Bend	trans	-64.2	-2.9	169.6	-63.4	0	0	0	0	112.2	Y15	Y15-C17 PolarHBondContact O-N 3.27Å
18	A	58.8	Low	65.2	Low	64 Å²	64	76.2 Å²	76.2	53%	0.529	42%	0.418	S	S	.	.	S	Bend	trans	-76.2	114.9	161.1	0	0	0	0	0	108.4	S16	S16-A18 CarbonylContact O-C 3.58Å; S16-A18 PolarHBondContact O-N 2.84Å; S16-A18 WeakPolarHBondContact OG-CB 3.47Å; S16-A18 PolarHBondContact OG-N 3.37Å
19	G	67.4	Low	67.4	Low	21 Å²	21	71 Å²	71	22%	0.216	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-49.5	160.5	174.9	0	0	0	0	0	112.6	C74	G19-C74 VanDerWaalsContact CA-O 3.26Å; G19-C74 WeakPolarHBondContact CA-O 3.49Å
20	I	84.8	Confident	69.5	Low	35 Å²	35	71.7 Å²	71.7	18%	0.179	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	162	174.9	74.7	175.9	0	0	0	110.1	C74 P77 K131	I20-C74 HydrophobicContact CG1-CB 4.26Å; I20-C74 PolarHBondContact O-N 3.17Å; I20-P77 HydrophobicContact CD1-CB 4.33Å; I20-P77 HydrophobicContact CG1-CB 4.48Å; I20-P77 HydrophobicContact CG2-CB 3.66Å; I20-K131 WeakPolarHBondContact CD1-O 3.44Å
21	F	88.7	Confident	71.4	Confident	112 Å²	112	64.6 Å²	64.6	49%	0.491	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.1	168.5	-68.7	-84.2	0	0	0	110.2	L71 Q72 H73 S132	F21-L71 HydrophobicContact CB-CB 4.29Å; F21-L71 HydrophobicContact CB-CD1 4.37Å; F21-L71 HydrophobicContact CD1-CB 4.04Å; F21-Q72 WeakPolarHBondContact CA-O 3.47Å; F21-H73 HydrophobicContact CD1-CB 4.16Å; F21-H73 HydrophobicContact CE1-CB 3.81Å; F21-H73 AromaticContact CE1-CD2 3.95Å; F21-H73 HydrophobicContact CZ-CB 4.48Å; F21-H73 AromaticContact CZ-CD2 3.78Å; F21-S132 WeakPolarHBondContact O-CA 3.36Å; F21-S132 WeakPolarHBondContact O-CB 3.49Å
22	C	90.6	Very high	73.3	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	143.2	170.7	-68.4	0	0	0	0	110.7	H24 L71 Q72 C74 C79 S132	C22-H24 PolarHBondContact O-N 3.45Å; C22-H24 VanDerWaalsContact O-N 3.17Å; C22-L71 WeakPolarHBondContact O-CA 3.31Å; C22-Q72 PolarHBondContact N-O 2.76Å; C22-Q72 PolarHBondContact O-N 2.77Å; C22-C74 PolarHBondContact SG-SG 2.94Å; C22-C79 VanDerWaalsContact CA-SG 3.52Å; C22-C79 HydrophobicContact CB-CB 4Å; C22-C79 WeakPolarHBondContact CB-SG 3.23Å; C22-C79 WeakPolarHBondContact SG-CA 3.41Å; C22-C79 WeakPolarHBondContact SG-CB 3.26Å; C22-C79 CovalentContact SG-SG 2.01Å; C22-C79 PolarHBondContact SG-SG 2.9Å; C22-S132 CarbonylContact C-O 3.53Å; C22-S132 VanDerWaalsContact CA-O 3.3Å; C22-S132 WeakPolarHBondContact CA-O 3.21Å
23	V	90.1	Very high	75.2	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.006	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	118.7	165.2	172.8	0	0	0	0	108.6	L63 I66 H69 L71 R94 G95 S132	V23-L63 HydrophobicContact CG1-CD2 4.39Å; V23-I66 HydrophobicContact CG2-CG2 3.86Å; V23-H69 HydrophobicContact CG1-CB 3.76Å; V23-L71 HydrophobicContact CG2-CD2 4.32Å; V23-R94 CarbonylContact O-C 3.5Å; V23-R94 WeakPolarHBondContact O-CB 3.44Å; V23-G95 PolarHBondContact O-N 2.01Å; V23-S132 PolarHBondContact N-O 3.48Å
24	H	92.2	Very high	77.2	Confident	28 Å²	28	56 Å²	56	13%	0.13	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	106.7	178.8	-173	-137.4	0	0	0	108.9	C22 V55 Q70 Q72 R94	C22-H24 PolarHBondContact O-N 3.45Å; C22-H24 VanDerWaalsContact O-N 3.17Å; H24-V55 WeakPolarHBondContact ND1-CG1 3.46Å; H24-Q70 PolarHBondContact N-O 2.79Å; H24-Q72 HydrophobicContact CB-CB 3.6Å; H24-R94 WeakPolarHBondContact CA-O 3.47Å; H24-R94 PolarHBondContact CD2-O 3.38Å
25	C	92.3	Very high	79	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.014	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	159.1	-179.5	68.2	0	0	0	0	111.4	V55 C60 I93 R94	C25-V55 WeakPolarHBondContact CA-O 3.4Å; C25-C60 HydrophobicContact CB-CB 3.71Å; C25-C60 WeakPolarHBondContact CB-SG 3.47Å; C25-C60 PolarHBondContact O-SG 3.15Å; C25-C60 VanDerWaalsContact O-SG 3.32Å; C25-C60 WeakPolarHBondContact SG-CA 3.47Å; C25-C60 WeakPolarHBondContact SG-CB 3.41Å; C25-C60 CovalentContact SG-SG 2.04Å; C25-C60 PolarHBondContact SG-SG 3.26Å; C25-I93 CarbonylContact O-C 3.56Å; C25-I93 WeakPolarHBondContact O-CA 3.47Å; C25-R94 PolarHBondContact N-O 3.49Å; C25-R94 PolarHBondContact O-N 2.96Å; C25-R94 VanDerWaalsContact SG-CD 3.57Å
26	A	91.5	Very high	80.4	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	146.5	166.4	0	0	0	0	0	110.8	Y51 P52 V55 V56 N57 V92 I93	A26-Y51 HydrophobicContact CB-CE1 3.73Å; A26-P52 HydrophobicContact CB-CG 3.89Å; A26-V55 PolarHBondContact N-O 2.79Å; A26-V56 HydrophobicContact CB-CG2 4.28Å; A26-V56 CarbonylContact O-C 3.58Å; A26-V56 VanDerWaalsContact O-CA 3.27Å; A26-V56 WeakPolarHBondContact O-CA 3.1Å; A26-N57 PolarHBondContact O-N 2.84Å; A26-V92 CarbonylContact C-O 3.53Å; A26-V92 VanDerWaalsContact CA-O 3.27Å; A26-V92 WeakPolarHBondContact CA-O 3.05Å; A26-I93 HydrophobicContact CB-CG1 4.29Å; A26-I93 HydrophobicContact CB-CG2 4.45Å
27	S	90.5	Very high	82.4	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.014	28%	0.283	C	S	.	.			trans	-65.6	164.1	168.8	-64.1	0	0	0	0	110.2	Y51 P90 V92	S27-Y51 PolarHBondContact O-OH 3.37Å; S27-P90 PolarHBondContact OG-O 2.9Å; S27-V92 PolarHBondContact N-O 3.23Å; S27-V92 PolarHBondContact OG-N 2.91Å; S27-V92 VanDerWaalsContact OG-N 3.07Å
28	P	89.9	Confident	84.2	Confident	27 Å²	27	46.8 Å²	46.8	18%	0.175	26%	0.259	C	S	.	.			trans	-64.5	141.7	166.4	-23.2	34.8	0	0	0	110.9	S30 T31 V56	P28-S30 WeakPolarHBondContact CB-OG 3.49Å; P28-S30 PolarHBondContact O-N 3.1Å; P28-T31 WeakPolarHBondContact O-CB 3.45Å; P28-T31 PolarHBondContact O-N 3.27Å; P28-T31 VanDerWaalsContact O-N 3.1Å; P28-T31 PolarHBondContact O-OG1 3.48Å; P28-V56 HydrophobicContact CB-CG1 4.3Å; P28-V56 HydrophobicContact CG-CG1 4.16Å
29	R	89.3	Confident	85.5	Confident	57 Å²	57	44.3 Å²	44.3	22%	0.215	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-62.9	-29	175.7	-67.5	177.9	65.4	93.5	-4	112.2	T31 V32 L37 D41 Y51	R29-T31 PolarHBondContact O-N 3.3Å; R29-V32 PolarHBondContact O-N 3.04Å; R29-L37 HydrophobicContact CB-CD1 4.08Å; R29-L37 HydrophobicContact CB-CD2 3.78Å; R29-L37 HydrophobicContact CG-CD2 4.02Å; R29-D41 IonicContact CZ-OD1 3.46Å; R29-D41 IonicContact CZ-OD2 3.46Å; R29-D41 IonicContact NH1-OD1 2.75Å; R29-D41 PolarHBondContact NH1-OD1 3.32Å; R29-D41 IonicContact NH1-OD2 3.42Å; R29-D41 PolarHBondContact NH1-OD2 2.48Å; R29-D41 IonicContact NH2-OD1 2.67Å; R29-D41 IonicContact NH2-OD2 2.64Å; R29-D41 PolarHBondContact NH2-OD2 2.78Å; R29-Y51 HydrophobicContact CG-CD1 4.32Å; R29-Y51 HydrophobicContact CG-CE1 3.85Å; R29-Y51 HydrophobicContact CG-CE2 4.2Å
30	S	84.8	Confident	86.5	Confident	113 Å²	113	43.3 Å²	43.3	79%	0.79	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-62.1	-9.7	174.7	54.6	0	0	0	0	114.4	P28 V32	P28-S30 WeakPolarHBondContact CB-OG 3.49Å; P28-S30 PolarHBondContact O-N 3.1Å; S30-V32 VanDerWaalsContact C-N 3.28Å; S30-V32 PolarHBondContact O-N 2.74Å
31	T	77.1	Confident	86.7	Confident	40 Å²	40	44.1 Å²	44.1	25%	0.245	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-74.3	-16.9	178.8	-55.8	0	0	0	0	113.1	P28 R29 L89	P28-T31 WeakPolarHBondContact O-CB 3.45Å; P28-T31 PolarHBondContact O-N 3.27Å; P28-T31 VanDerWaalsContact O-N 3.1Å; P28-T31 PolarHBondContact O-OG1 3.48Å; R29-T31 PolarHBondContact O-N 3.3Å; T31-L89 HydrophobicContact CG2-CB 3.42Å; T31-L89 VanDerWaalsContact CG2-CB 3.42Å; T31-L89 HydrophobicContact CG2-CD1 4.37Å; T31-L89 HydrophobicContact CG2-CG 4.42Å
32	V	79.2	Confident	86.8	Confident	20 Å²	20	45 Å²	45	12%	0.121	24%	0.239	C	C	.	.	S	Bend	trans	-134.5	163.3	-176.6	-69.9	0	0	0	0	112.9	R29 S30 M36 L37 L91	R29-V32 PolarHBondContact O-N 3.04Å; S30-V32 VanDerWaalsContact C-N 3.28Å; S30-V32 PolarHBondContact O-N 2.74Å; V32-M36 HydrophobicContact CB-CB 4.45Å; V32-M36 HydrophobicContact CB-CE 4.35Å; V32-M36 HydrophobicContact CB-CG 4.35Å; V32-M36 HydrophobicContact CB-SD 3.8Å; V32-M36 HydrophobicContact CG1-CE 3.68Å; V32-M36 HydrophobicContact CG1-SD 3.75Å; V32-L37 HydrophobicContact CG2-CD2 3.38Å; V32-L37 HydrophobicContact CG2-CG 3.72Å; V32-L91 HydrophobicContact CB-CB 4.38Å; V32-L91 HydrophobicContact CG1-CB 3.6Å; V32-L91 HydrophobicContact CG2-CB 3.87Å; V32-L91 HydrophobicContact CG2-CD1 4.01Å; V32-L91 HydrophobicContact CG2-CD2 4.05Å; V32-L91 HydrophobicContact CG2-CG 4.21Å
33	K	81.2	Confident	86.6	Confident	135 Å²	135	46.4 Å²	46.4	59%	0.587	25%	0.247	S	C	*	.			trans	-69.7	152.3	178.6	-64.8	-179.1	-178.9	178.3	0	111.3	N35 M36 L37	K33-N35 VanDerWaalsContact C-N 3.34Å; K33-N35 WeakPolarHBondContact CB-OD1 3.34Å; K33-N35 PolarHBondContact O-N 3.39Å; K33-M36 WeakPolarHBondContact O-CB 3.22Å; K33-M36 PolarHBondContact O-N 3.18Å; K33-L37 PolarHBondContact O-N 3.04Å
34	N	84.1	Confident	86.6	Confident	124 Å²	124	46.6 Å²	46.6	66%	0.663	25%	0.247	S	C	*	.	H	α-helix	trans	-54.6	-43.9	-177.1	-67.8	-13	0	0	0	113.7	M36 L37 D38	N34-M36 PolarHBondContact O-N 3.04Å; N34-M36 VanDerWaalsContact O-N 3.11Å; N34-L37 WeakPolarHBondContact O-CA 3.3Å; N34-L37 WeakPolarHBondContact O-CB 3.44Å; N34-L37 PolarHBondContact O-N 3.27Å; N34-D38 PolarHBondContact O-N 2.95Å
35	N	81.4	Confident	86.5	Confident	97 Å²	97	51.1 Å²	51.1	52%	0.519	27%	0.272	S	S	.	.	H	α-helix	trans	-57	-31.8	178.9	64.9	-25.6	0	0	0	113.7	K33 A39	K33-N35 VanDerWaalsContact C-N 3.34Å; K33-N35 WeakPolarHBondContact CB-OD1 3.34Å; K33-N35 PolarHBondContact O-N 3.39Å; N35-A39 PolarHBondContact O-N 3.02Å; N35-A39 VanDerWaalsContact O-N 3.15Å
36	M	81.1	Confident	86.3	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.02	31%	0.307	C	S	.	.	H	α-helix	trans	-82.5	-33.4	180	-170.4	172.1	170.9	0	0	111.6	V32 K33 N34 M40 A84 D85 V86	V32-M36 HydrophobicContact CB-CB 4.45Å; V32-M36 HydrophobicContact CB-CE 4.35Å; V32-M36 HydrophobicContact CB-CG 4.35Å; V32-M36 HydrophobicContact CB-SD 3.8Å; V32-M36 HydrophobicContact CG1-CE 3.68Å; V32-M36 HydrophobicContact CG1-SD 3.75Å; K33-M36 WeakPolarHBondContact O-CB 3.22Å; K33-M36 PolarHBondContact O-N 3.18Å; N34-M36 PolarHBondContact O-N 3.04Å; N34-M36 VanDerWaalsContact O-N 3.11Å; M36-M40 WeakPolarHBondContact O-CB 3.34Å; M36-M40 PolarHBondContact O-N 3.43Å; M36-A84 VanDerWaalsContact CE-CA 3.47Å; M36-A84 HydrophobicContact CE-CB 3.14Å; M36-A84 WeakPolarHBondContact CE-O 3.4Å; M36-A84 HydrophobicContact CG-CB 4.12Å; M36-A84 HydrophobicContact SD-CB 4.47Å; M36-D85 VanDerWaalsContact CE-N 3.3Å; M36-V86 HydrophobicContact CE-CB 4.38Å; M36-V86 HydrophobicContact CE-CG2 3.79Å; M36-V86 HydrophobicContact SD-CB 4.01Å; M36-V86 HydrophobicContact SD-CG2 3.45Å; M36-V86 WeakPolarHBondContact SD-CG2 3.26Å
37	L	86.3	Confident	86.1	Confident	13 Å²	13	60.1 Å²	60.1	7%	0.068	32%	0.316	C	S	.	.	H	α-helix	trans	-62.8	-44.7	168	-67	175.2	0	0	0	110.8	R29 V32 K33 N34 A39 M40 D41 L91	R29-L37 HydrophobicContact CB-CD1 4.08Å; R29-L37 HydrophobicContact CB-CD2 3.78Å; R29-L37 HydrophobicContact CG-CD2 4.02Å; V32-L37 HydrophobicContact CG2-CD2 3.38Å; V32-L37 HydrophobicContact CG2-CG 3.72Å; K33-L37 PolarHBondContact O-N 3.04Å; N34-L37 WeakPolarHBondContact O-CA 3.3Å; N34-L37 WeakPolarHBondContact O-CB 3.44Å; N34-L37 PolarHBondContact O-N 3.27Å; L37-A39 VanDerWaalsContact C-N 3.33Å; L37-A39 PolarHBondContact O-N 3.45Å; L37-M40 WeakPolarHBondContact O-CB 3.47Å; L37-M40 PolarHBondContact O-N 3.11Å; L37-M40 VanDerWaalsContact O-N 3.14Å; L37-D41 WeakPolarHBondContact O-CB 3.44Å; L37-D41 VanDerWaalsContact O-CG 3.32Å; L37-D41 PolarHBondContact O-N 2.87Å; L37-L91 HydrophobicContact CD2-CD1 4.33Å; L37-L91 HydrophobicContact CD2-CD2 4.16Å
38	D	87.9	Confident	86	Confident	87 Å²	87	69 Å²	69	47%	0.465	36%	0.357	S	S	.	.	H	α-helix	trans	-61.1	-43.9	178.1	-61.6	-28.2	0	0	0	110.9	N34 M40 D41 Q42	N34-D38 PolarHBondContact O-N 2.95Å; D38-M40 VanDerWaalsContact C-N 3.34Å; D38-M40 PolarHBondContact O-N 3.17Å; D38-D41 PolarHBondContact O-N 2.96Å; D38-Q42 WeakPolarHBondContact O-CB 3.44Å; D38-Q42 VanDerWaalsContact O-CG 3.23Å; D38-Q42 WeakPolarHBondContact O-CG 3.43Å; D38-Q42 PolarHBondContact O-N 2.97Å
39	A	85.8	Confident	85.9	Confident	12 Å²	12	69 Å²	69	10%	0.099	36%	0.357	C	S	.	.	H	α-helix	trans	-63.2	-39.7	175	0	0	0	0	0	112.4	N35 L37 L43 L121 I123	N35-A39 PolarHBondContact O-N 3.02Å; N35-A39 VanDerWaalsContact O-N 3.15Å; L37-A39 VanDerWaalsContact C-N 3.33Å; L37-A39 PolarHBondContact O-N 3.45Å; A39-L43 WeakPolarHBondContact O-CB 3.39Å; A39-L43 PolarHBondContact O-N 3.21Å; A39-L121 HydrophobicContact CB-CD1 3.79Å; A39-L121 HydrophobicContact CB-CD2 4.35Å; A39-I123 HydrophobicContact CB-CD1 4.09Å
40	M	87	Confident	86	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	38%	0.378	C	S	.	.	H	α-helix	trans	-65.3	-45.8	175.6	-172.5	61.1	69.2	0	0	111.3	M36 L37 D38 Q42 L43 L44 I82 A84 L91 I93 I123	M36-M40 WeakPolarHBondContact O-CB 3.34Å; M36-M40 PolarHBondContact O-N 3.43Å; L37-M40 WeakPolarHBondContact O-CB 3.47Å; L37-M40 PolarHBondContact O-N 3.11Å; L37-M40 VanDerWaalsContact O-N 3.14Å; D38-M40 VanDerWaalsContact C-N 3.34Å; D38-M40 PolarHBondContact O-N 3.17Å; M40-Q42 VanDerWaalsContact C-N 3.35Å; M40-Q42 PolarHBondContact O-N 2.87Å; M40-L43 WeakPolarHBondContact O-CB 3.4Å; M40-L43 PolarHBondContact O-N 3.37Å; M40-L43 VanDerWaalsContact O-N 3.17Å; M40-L43 HydrophobicContact SD-CD2 4.43Å; M40-L44 HydrophobicContact CG-CD1 4.02Å; M40-L44 HydrophobicContact CG-CG 4.36Å; M40-L44 VanDerWaalsContact O-CG 3.26Å; M40-L44 WeakPolarHBondContact O-CG 3.3Å; M40-L44 PolarHBondContact O-N 3.49Å; M40-L44 HydrophobicContact SD-CG 4.44Å; M40-I82 HydrophobicContact CE-CD1 3.89Å; M40-I82 HydrophobicContact CE-CG1 3.89Å; M40-I82 HydrophobicContact CE-CG2 4.35Å; M40-I82 HydrophobicContact SD-CD1 3.72Å; M40-I82 HydrophobicContact SD-CG1 4.27Å; M40-I82 HydrophobicContact SD-CG2 4.2Å; M40-A84 HydrophobicContact CE-CB 3.84Å; M40-L91 HydrophobicContact CB-CD2 3.96Å; M40-L91 HydrophobicContact CE-CD2 3.8Å; M40-L91 HydrophobicContact CG-CD2 3.77Å; M40-I93 HydrophobicContact CG-CD1 4.1Å; M40-I93 HydrophobicContact SD-CD1 4.09Å; M40-I123 HydrophobicContact CE-CG2 4.36Å
41	D	90	Very high	86.3	Confident	52 Å²	52	69.2 Å²	69.2	28%	0.278	34%	0.342	S	S	.	.	H	α-helix	trans	-64.2	-41.3	179.4	-71.1	-18.3	0	0	0	111.3	R29 L37 D38 L43 L44 N45	R29-D41 IonicContact CZ-OD1 3.46Å; R29-D41 IonicContact CZ-OD2 3.46Å; R29-D41 IonicContact NH1-OD1 2.75Å; R29-D41 PolarHBondContact NH1-OD1 3.32Å; R29-D41 IonicContact NH1-OD2 3.42Å; R29-D41 PolarHBondContact NH1-OD2 2.48Å; R29-D41 IonicContact NH2-OD1 2.67Å; R29-D41 IonicContact NH2-OD2 2.64Å; R29-D41 PolarHBondContact NH2-OD2 2.78Å; L37-D41 WeakPolarHBondContact O-CB 3.44Å; L37-D41 VanDerWaalsContact O-CG 3.32Å; L37-D41 PolarHBondContact O-N 2.87Å; D38-D41 PolarHBondContact O-N 2.96Å; D41-L43 VanDerWaalsContact C-N 3.32Å; D41-L43 PolarHBondContact O-N 3.32Å; D41-L44 PolarHBondContact O-N 3.29Å; D41-N45 WeakPolarHBondContact O-CB 3.22Å; D41-N45 PolarHBondContact O-N 3.47Å
42	Q	89.7	Confident	87	Confident	130 Å²	130	67.6 Å²	67.6	61%	0.607	33%	0.332	S	S	*	.	H	α-helix	trans	-59.3	-44.6	172.7	-74.7	174.2	23.9	0	0	111.3	D38 M40 N45 L46	D38-Q42 WeakPolarHBondContact O-CB 3.44Å; D38-Q42 VanDerWaalsContact O-CG 3.23Å; D38-Q42 WeakPolarHBondContact O-CG 3.43Å; D38-Q42 PolarHBondContact O-N 2.97Å; M40-Q42 VanDerWaalsContact C-N 3.35Å; M40-Q42 PolarHBondContact O-N 2.87Å; Q42-N45 PolarHBondContact O-N 3.33Å; Q42-L46 WeakPolarHBondContact O-CB 3.47Å; Q42-L46 VanDerWaalsContact O-CG 3.26Å; Q42-L46 WeakPolarHBondContact O-CG 2.94Å; Q42-L46 PolarHBondContact O-N 2.97Å
43	L	87.8	Confident	87.5	Confident	30 Å²	30	73.8 Å²	73.8	16%	0.157	35%	0.354	C	S	.	.	H	α-helix	trans	-63.9	-44.2	178.5	179.4	66.2	0	0	0	112.4	A39 M40 D41 L46 R47 I82 L117 I123	A39-L43 WeakPolarHBondContact O-CB 3.39Å; A39-L43 PolarHBondContact O-N 3.21Å; M40-L43 WeakPolarHBondContact O-CB 3.4Å; M40-L43 PolarHBondContact O-N 3.37Å; M40-L43 VanDerWaalsContact O-N 3.17Å; M40-L43 HydrophobicContact SD-CD2 4.43Å; D41-L43 VanDerWaalsContact C-N 3.32Å; D41-L43 PolarHBondContact O-N 3.32Å; L43-L46 PolarHBondContact O-N 3.2Å; L43-R47 WeakPolarHBondContact O-CD 3.42Å; L43-R47 WeakPolarHBondContact O-CG 3.27Å; L43-R47 PolarHBondContact O-N 2.64Å; L43-I82 HydrophobicContact CD2-CD1 3.13Å; L43-I82 HydrophobicContact CG-CD1 4.45Å; L43-L117 HydrophobicContact CD1-CD1 4.11Å; L43-L117 HydrophobicContact CD2-CD1 3.4Å; L43-L117 HydrophobicContact CG-CD1 4.39Å; L43-I123 HydrophobicContact CD2-CG2 4.28Å
44	L	89.2	Confident	88	Confident	4 Å²	4	72.1 Å²	72.1	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-63.9	-43.4	176.9	-66.3	171.3	0	0	0	110.5	M40 D41 L46 R47 Q48 T49 Y51 I93 F100	M40-L44 HydrophobicContact CG-CD1 4.02Å; M40-L44 HydrophobicContact CG-CG 4.36Å; M40-L44 VanDerWaalsContact O-CG 3.26Å; M40-L44 WeakPolarHBondContact O-CG 3.3Å; M40-L44 PolarHBondContact O-N 3.49Å; M40-L44 HydrophobicContact SD-CG 4.44Å; D41-L44 PolarHBondContact O-N 3.29Å; L44-L46 PolarHBondContact O-N 3.24Å; L44-R47 CarbonylContact O-C 3.41Å; L44-R47 WeakPolarHBondContact O-CA 3.27Å; L44-R47 WeakPolarHBondContact O-CB 3.27Å; L44-R47 PolarHBondContact O-N 3.06Å; L44-Q48 PolarHBondContact O-N 2.83Å; L44-Q48 VanDerWaalsContact O-N 3.11Å; L44-T49 CarbonylContact C-O 3.29Å; L44-T49 VanDerWaalsContact C-O 3.29Å; L44-T49 HydrophobicContact CB-CG2 3.99Å; L44-T49 HydrophobicContact CD2-CG2 3.6Å; L44-T49 HydrophobicContact CG-CG2 4.4Å; L44-T49 WeakPolarHBondContact O-CG2 3.17Å; L44-T49 PolarHBondContact O-N 3.38Å; L44-T49 VanDerWaalsContact O-O 3.09Å; L44-Y51 HydrophobicContact CD1-CD2 4.07Å; L44-I93 HydrophobicContact CD1-CD1 3.97Å; L44-I93 HydrophobicContact CD2-CD1 4.32Å; L44-F100 HydrophobicContact CD2-CD1 4.14Å; L44-F100 HydrophobicContact CD2-CE1 4.26Å
45	N	90.4	Very high	88.3	Confident	123 Å²	123	66.6 Å²	66.6	66%	0.658	32%	0.322	S	S	*	.	H	α-helix	trans	-61.5	-42.6	176.6	-173	49.6	0	0	0	112.3	D41 Q42 R47 Q48	D41-N45 WeakPolarHBondContact O-CB 3.22Å; D41-N45 PolarHBondContact O-N 3.47Å; Q42-N45 PolarHBondContact O-N 3.33Å; N45-R47 PolarHBondContact O-N 2.98Å; N45-Q48 PolarHBondContact O-N 3.04Å
46	L	87.4	Confident	88.8	Confident	142 Å²	142	65 Å²	65	74%	0.743	32%	0.316	S	S	*	.	H	α-helix	trans	-60.1	-29.1	174.2	-75.5	171	0	0	0	112.8	Q42 L43 L44 Q48	Q42-L46 WeakPolarHBondContact O-CB 3.47Å; Q42-L46 VanDerWaalsContact O-CG 3.26Å; Q42-L46 WeakPolarHBondContact O-CG 2.94Å; Q42-L46 PolarHBondContact O-N 2.97Å; L43-L46 PolarHBondContact O-N 3.2Å; L44-L46 PolarHBondContact O-N 3.24Å; L46-Q48 VanDerWaalsContact C-N 3.32Å
47	R	87.4	Confident	89.1	Confident	49 Å²	49	66.8 Å²	66.8	19%	0.185	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	4.2	176.6	-69.8	160.5	-177.5	-130.1	8.9	113.1	L43 L44 N45 T49 Y80 F100 E125	L43-R47 WeakPolarHBondContact O-CD 3.42Å; L43-R47 WeakPolarHBondContact O-CG 3.27Å; L43-R47 PolarHBondContact O-N 2.64Å; L44-R47 CarbonylContact O-C 3.41Å; L44-R47 WeakPolarHBondContact O-CA 3.27Å; L44-R47 WeakPolarHBondContact O-CB 3.27Å; L44-R47 PolarHBondContact O-N 3.06Å; N45-R47 PolarHBondContact O-N 2.98Å; R47-T49 HydrophobicContact CB-CG2 3.86Å; R47-T49 PolarHBondContact O-N 3.33Å; R47-Y80 VanDerWaalsContact NH1-CZ 3.29Å; R47-Y80 PolarHBondContact NH1-OH 2.77Å; R47-F100 VanDerWaalsContact CD-O 3.24Å; R47-F100 WeakPolarHBondContact CD-O 3.34Å; R47-F100 PolarHBondContact NH1-O 3.33Å; R47-E125 IonicContact CZ-OE2 3.38Å; R47-E125 IonicContact NH1-OE2 3.55Å; R47-E125 PolarHBondContact NH1-OE2 3.42Å; R47-E125 IonicContact NH2-OE2 3.6Å; R47-E125 PolarHBondContact NH2-OE2 2.83Å
48	Q	88.5	Confident	89	Confident	189 Å²	189	70 Å²	70	88%	0.883	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	37.3	-176.3	-55.5	177.5	3.4	0	0	112.2	L44 N45 L46	L44-Q48 PolarHBondContact O-N 2.83Å; L44-Q48 VanDerWaalsContact O-N 3.11Å; N45-Q48 PolarHBondContact O-N 3.04Å; L46-Q48 VanDerWaalsContact C-N 3.32Å
49	T	88.9	Confident	88.9	Confident	27 Å²	27	67.3 Å²	67.3	17%	0.166	34%	0.335	C	S	.	.			trans	-127.1	171.3	177.7	-168.1	0	0	0	0	110.1	L44 R47 S99 F100	L44-T49 CarbonylContact C-O 3.29Å; L44-T49 VanDerWaalsContact C-O 3.29Å; L44-T49 HydrophobicContact CB-CG2 3.99Å; L44-T49 HydrophobicContact CD2-CG2 3.6Å; L44-T49 HydrophobicContact CG-CG2 4.4Å; L44-T49 WeakPolarHBondContact O-CG2 3.17Å; L44-T49 PolarHBondContact O-N 3.38Å; L44-T49 VanDerWaalsContact O-O 3.09Å; R47-T49 HydrophobicContact CB-CG2 3.86Å; R47-T49 PolarHBondContact O-N 3.33Å; T49-S99 VanDerWaalsContact CB-O 3.3Å; T49-S99 WeakPolarHBondContact CB-O 3.4Å; T49-S99 PolarHBondContact OG1-O 2.95Å; T49-F100 HydrophobicContact CG2-CD1 4.09Å
50	Y	89.8	Confident	88.9	Confident	168 Å²	168	66.8 Å²	66.8	66%	0.659	33%	0.33	S	S	*	.			trans	-131	162.5	-174.2	59.8	-89.1	0	0	0	111.8	P52	Y50-P52 WeakPolarHBondContact O-CD 2.91Å
51	Y	91.1	Very high	88.7	Confident	6 Å²	6	68.3 Å²	68.3	2%	0.024	34%	0.343	C	S	.	.			trans	-68.5	122.2	174.2	-162.4	-88.2	0	0	0	109.8	A26 S27 R29 L44 Y53 V56 L91 I93	A26-Y51 HydrophobicContact CB-CE1 3.73Å; S27-Y51 PolarHBondContact O-OH 3.37Å; R29-Y51 HydrophobicContact CG-CD1 4.32Å; R29-Y51 HydrophobicContact CG-CE1 3.85Å; R29-Y51 HydrophobicContact CG-CE2 4.2Å; L44-Y51 HydrophobicContact CD1-CD2 4.07Å; Y51-Y53 HydrophobicContact CD1-CD1 4.11Å; Y51-Y53 HydrophobicContact CD1-CE1 4.04Å; Y51-Y53 HydrophobicContact CD1-CG 4.4Å; Y51-Y53 WeakPolarHBondContact O-CD2 3.34Å; Y51-Y53 WeakPolarHBondContact O-CE2 3.27Å; Y51-Y53 PolarHBondContact O-N 3.02Å; Y51-V56 HydrophobicContact CE1-CG2 3.91Å; Y51-L91 HydrophobicContact CE2-CD1 4.12Å; Y51-L91 VanDerWaalsContact OH-CD1 3.27Å; Y51-L91 WeakPolarHBondContact OH-CD1 3.24Å; Y51-I93 HydrophobicContact CD2-CD1 3.65Å; Y51-I93 HydrophobicContact CD2-CG1 4.43Å; Y51-I93 HydrophobicContact CE2-CD1 3.54Å; Y51-I93 HydrophobicContact CE2-CG1 3.89Å
52	P	91.8	Very high	88.1	Confident	6 Å²	6	72.4 Å²	72.4	4%	0.039	36%	0.358	C	S	.	.			trans	-82.8	86	-171	35.8	-37	0	0	0	110.2	A26 Y50 D54 V55 I93	A26-P52 HydrophobicContact CB-CG 3.89Å; Y50-P52 WeakPolarHBondContact O-CD 2.91Å; P52-D54 PolarHBondContact O-N 3.32Å; P52-V55 HydrophobicContact CB-CG2 3.72Å; P52-V55 HydrophobicContact CG-CG2 3.83Å; P52-V55 WeakPolarHBondContact O-CG2 3.43Å; P52-V55 PolarHBondContact O-N 3.11Å; P52-I93 HydrophobicContact CG-CG2 3.84Å
53	Y	91.4	Very high	87.4	Confident	151 Å²	151	67.8 Å²	67.8	59%	0.592	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-63.3	-25.9	-174.4	-71.7	-77.8	0	0	0	114	Y51 V55 V56	Y51-Y53 HydrophobicContact CD1-CD1 4.11Å; Y51-Y53 HydrophobicContact CD1-CE1 4.04Å; Y51-Y53 HydrophobicContact CD1-CG 4.4Å; Y51-Y53 WeakPolarHBondContact O-CD2 3.34Å; Y51-Y53 WeakPolarHBondContact O-CE2 3.27Å; Y51-Y53 PolarHBondContact O-N 3.02Å; Y53-V55 VanDerWaalsContact C-N 3.3Å; Y53-V55 PolarHBondContact O-N 3.15Å; Y53-V56 WeakPolarHBondContact O-CG2 3.42Å
54	D	91.6	Very high	86.4	Confident	100 Å²	100	69.5 Å²	69.5	54%	0.535	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-73.2	-18.1	-179	58.6	-49.4	0	0	0	113.9	P52 Q70	P52-D54 PolarHBondContact O-N 3.32Å; D54-Q70 PolarHBondContact O-NE2 2.88Å
55	V	90.3	Very high	85.4	Confident	7 Å²	7	73.5 Å²	73.5	4%	0.042	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-119.9	24.5	-177.7	-57.1	0	0	0	0	113	H24 C25 A26 P52 Y53 N57 Q70	H24-V55 WeakPolarHBondContact ND1-CG1 3.46Å; C25-V55 WeakPolarHBondContact CA-O 3.4Å; A26-V55 PolarHBondContact N-O 2.79Å; P52-V55 HydrophobicContact CB-CG2 3.72Å; P52-V55 HydrophobicContact CG-CG2 3.83Å; P52-V55 WeakPolarHBondContact O-CG2 3.43Å; P52-V55 PolarHBondContact O-N 3.11Å; Y53-V55 VanDerWaalsContact C-N 3.3Å; Y53-V55 PolarHBondContact O-N 3.15Å; V55-N57 PolarHBondContact O-N 3.33Å; V55-Q70 HydrophobicContact CG1-CB 4.17Å; V55-Q70 HydrophobicContact CG1-CG 4.26Å; V55-Q70 VanDerWaalsContact CG1-OE1 3.26Å
56	V	91.2	Very high	84.5	Confident	63 Å²	63	70.8 Å²	70.8	38%	0.382	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-69	121.8	178.2	174.4	0	0	0	0	110.6	A26 P28 Y51 Y53	A26-V56 HydrophobicContact CB-CG2 4.28Å; A26-V56 CarbonylContact O-C 3.58Å; A26-V56 VanDerWaalsContact O-CA 3.27Å; A26-V56 WeakPolarHBondContact O-CA 3.1Å; P28-V56 HydrophobicContact CB-CG1 4.3Å; P28-V56 HydrophobicContact CG-CG1 4.16Å; Y51-V56 HydrophobicContact CE1-CG2 3.91Å; Y53-V56 WeakPolarHBondContact O-CG2 3.42Å
57	N	87.1	Confident	83.8	Confident	42 Å²	42	70 Å²	70	23%	0.225	36%	0.362	C	S	.	.			trans	-145.2	129.8	179.8	-171.8	-28.2	0	0	0	110.3	A26 V55 D59 C60	A26-N57 PolarHBondContact O-N 2.84Å; V55-N57 PolarHBondContact O-N 3.33Å; N57-D59 PolarHBondContact O-N 3.32Å; N57-D59 VanDerWaalsContact O-N 3.15Å; N57-D59 PolarHBondContact OD1-N 2.04Å; N57-C60 VanDerWaalsContact O-CB 3.27Å; N57-C60 WeakPolarHBondContact O-CB 3.05Å; N57-C60 PolarHBondContact O-N 3.21Å; N57-C60 VanDerWaalsContact O-N 3.11Å
58	S	85.1	Confident	83.2	Confident	80 Å²	80	76 Å²	76	56%	0.559	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.3	176.8	53.1	0	0	0	0	114.2
59	D	84.4	Confident	82.7	Confident	32 Å²	32	67.6 Å²	67.6	17%	0.171	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-0.1	-179.5	-66.2	-26.6	0	0	0	113.6	N57 A61 K62 L63 H69	N57-D59 PolarHBondContact O-N 3.32Å; N57-D59 VanDerWaalsContact O-N 3.15Å; N57-D59 PolarHBondContact OD1-N 2.04Å; D59-A61 PolarHBondContact O-N 2.89Å; D59-A61 VanDerWaalsContact O-N 3.14Å; D59-K62 PolarHBondContact O-N 3.39Å; D59-L63 PolarHBondContact O-N 3.03Å; D59-L63 VanDerWaalsContact O-N 3.08Å; D59-H69 PolarHBondContact O-NE2 2.88Å
60	C	86.8	Confident	82.7	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-34	-178.9	-173.7	0	0	0	0	113	C25 N57 R94	C25-C60 HydrophobicContact CB-CB 3.71Å; C25-C60 WeakPolarHBondContact CB-SG 3.47Å; C25-C60 PolarHBondContact O-SG 3.15Å; C25-C60 VanDerWaalsContact O-SG 3.32Å; C25-C60 WeakPolarHBondContact SG-CA 3.47Å; C25-C60 WeakPolarHBondContact SG-CB 3.41Å; C25-C60 CovalentContact SG-SG 2.04Å; C25-C60 PolarHBondContact SG-SG 3.26Å; N57-C60 VanDerWaalsContact O-CB 3.27Å; N57-C60 WeakPolarHBondContact O-CB 3.05Å; N57-C60 PolarHBondContact O-N 3.21Å; N57-C60 VanDerWaalsContact O-N 3.11Å; C60-R94 VanDerWaalsContact O-CZ 3.29Å; C60-R94 PolarHBondContact O-NE 3.14Å; C60-R94 PolarHBondContact O-NH2 3.07Å
61	A	82	Confident	82.6	Confident	34 Å²	34	68 Å²	68	28%	0.281	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-40.5	174.6	0	0	0	0	0	112.7	D59 P90 V92 R94	D59-A61 PolarHBondContact O-N 2.89Å; D59-A61 VanDerWaalsContact O-N 3.14Å; A61-P90 HydrophobicContact CB-CG 3.94Å; A61-V92 HydrophobicContact CB-CG2 3.77Å; A61-R94 PolarHBondContact O-NH2 3.39Å
62	K	77.6	Confident	82.6	Confident	137 Å²	137	69.6 Å²	69.6	60%	0.596	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-22.7	-170.3	-63.8	177.9	-175.8	168.4	0	113.1	D59 T64	D59-K62 PolarHBondContact O-N 3.39Å; K62-T64 HydrophobicContact CB-CG2 3.94Å; K62-T64 WeakPolarHBondContact CB-OG1 3.22Å; K62-T64 PolarHBondContact O-N 2.86Å
63	L	74.8	Confident	82.5	Confident	34 Å²	34	74.5 Å²	74.5	18%	0.178	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	53	17.3	-170.1	-70.6	174	0	0	0	113.8	V23 D59 N65 R94 Y133	V23-L63 HydrophobicContact CG1-CD2 4.39Å; D59-L63 PolarHBondContact O-N 3.03Å; D59-L63 VanDerWaalsContact O-N 3.08Å; L63-N65 PolarHBondContact O-N 2.91Å; L63-R94 VanDerWaalsContact CD1-NH1 3.31Å; L63-R94 VanDerWaalsContact CD2-NH1 3.32Å; L63-R94 VanDerWaalsContact CG-CZ 3.44Å; L63-Y133 HydrophobicContact CD1-CD2 3.38Å; L63-Y133 HydrophobicContact CD1-CE2 3.53Å; L63-Y133 HydrophobicContact CD1-CG 4.16Å
64	T	68	Low	82.4	Confident	65 Å²	65	67.3 Å²	67.3	40%	0.399	36%	0.356	S	S	.	.			trans	-71.3	129	175.4	45.2	0	0	0	0	107.8	K62 H69	K62-T64 HydrophobicContact CB-CG2 3.94Å; K62-T64 WeakPolarHBondContact CB-OG1 3.22Å; K62-T64 PolarHBondContact O-N 2.86Å; T64-H69 PolarHBondContact O-CE1 3.25Å
65	N	68.6	Low	82.1	Confident	88 Å²	88	69.1 Å²	69.1	47%	0.471	36%	0.361	S	S	.	.			trans	61.2	67.2	-177.2	-49.7	-51	0	0	0	112.9	L63 S67 R68 H69	L63-N65 PolarHBondContact O-N 2.91Å; N65-S67 PolarHBondContact O-N 3.35Å; N65-R68 HydrophobicContact CB-CB 4.36Å; N65-R68 HydrophobicContact CB-CG 3.93Å; N65-R68 WeakPolarHBondContact O-CB 3.4Å; N65-R68 PolarHBondContact O-N 3.08Å; N65-H69 PolarHBondContact O-ND1 3.07Å
66	I	71.2	Confident	81.9	Confident	66 Å²	66	72.1 Å²	72.1	34%	0.338	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-49.4	-35.6	174.8	-60.3	175.2	0	0	0	111.2	V23 R68 H69 Y133	V23-I66 HydrophobicContact CG2-CG2 3.86Å; I66-R68 PolarHBondContact O-N 2.86Å; I66-R68 VanDerWaalsContact O-N 3.08Å; I66-H69 WeakPolarHBondContact O-CB 3.23Å; I66-H69 PolarHBondContact O-N 3.19Å; I66-Y133 HydrophobicContact CD1-CD1 4.23Å; I66-Y133 HydrophobicContact CD1-CE1 3.89Å
67	S	71.1	Confident	81.7	Confident	127 Å²	127	70 Å²	70	89%	0.888	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-59.9	-18.4	176.9	-42	0	0	0	0	115.3	N65	N65-S67 PolarHBondContact O-N 3.35Å
68	R	74.8	Confident	81.8	Confident	173 Å²	173	68.1 Å²	68.1	65%	0.653	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-89.6	-9.5	175.1	-65.2	-175.3	-177.5	178.8	-0.7	113.3	N65 I66	N65-R68 HydrophobicContact CB-CB 4.36Å; N65-R68 HydrophobicContact CB-CG 3.93Å; N65-R68 WeakPolarHBondContact O-CB 3.4Å; N65-R68 PolarHBondContact O-N 3.08Å; I66-R68 PolarHBondContact O-N 2.86Å; I66-R68 VanDerWaalsContact O-N 3.08Å
69	H	79.5	Confident	82	Confident	13 Å²	13	64.4 Å²	64.4	6%	0.06	32%	0.323	C	S	.	.	S	Bend	trans	-87.4	146	179.1	-63.1	74.7	0	0	0	109.5	V23 D59 T64 N65 I66	V23-H69 HydrophobicContact CG1-CB 3.76Å; D59-H69 PolarHBondContact O-NE2 2.88Å; T64-H69 PolarHBondContact O-CE1 3.25Å; N65-H69 PolarHBondContact O-ND1 3.07Å; I66-H69 WeakPolarHBondContact O-CB 3.23Å; I66-H69 PolarHBondContact O-N 3.19Å
70	Q	87.7	Confident	82.4	Confident	104 Å²	104	63 Å²	63	49%	0.486	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	147	171.2	-63.3	-170.5	26.7	0	0	109.4	H24 D54 V55	H24-Q70 PolarHBondContact N-O 2.79Å; D54-Q70 PolarHBondContact O-NE2 2.88Å; V55-Q70 HydrophobicContact CG1-CB 4.17Å; V55-Q70 HydrophobicContact CG1-CG 4.26Å; V55-Q70 VanDerWaalsContact CG1-OE1 3.26Å
71	L	88.8	Confident	82.6	Confident	99 Å²	99	63 Å²	63	52%	0.518	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	128.3	176.7	-62.9	179.9	0	0	0	108.6	F21 C22 V23	F21-L71 HydrophobicContact CB-CB 4.29Å; F21-L71 HydrophobicContact CB-CD1 4.37Å; F21-L71 HydrophobicContact CD1-CB 4.04Å; C22-L71 WeakPolarHBondContact O-CA 3.31Å; V23-L71 HydrophobicContact CG2-CD2 4.32Å
72	Q	90.1	Very high	83	Confident	41 Å²	41	61.4 Å²	61.4	19%	0.192	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.2	172.1	-174.6	-171.3	13.9	0	0	108.6	F21 C22 H24 C96 S99	F21-Q72 WeakPolarHBondContact CA-O 3.47Å; C22-Q72 PolarHBondContact N-O 2.76Å; C22-Q72 PolarHBondContact O-N 2.77Å; H24-Q72 HydrophobicContact CB-CB 3.6Å; Q72-C96 HydrophobicContact CG-CB 4.48Å; Q72-C96 WeakPolarHBondContact CG-SG 3.33Å; Q72-C96 PolarHBondContact OE1-SG 2.62Å; Q72-C96 VanDerWaalsContact OE1-SG 3.39Å; Q72-S99 PolarHBondContact NE2-OG 2.75Å
73	H	90.6	Very high	83.5	Confident	108 Å²	108	55.6 Å²	55.6	50%	0.5	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	125	172.7	-179.2	-91.2	0	0	0	109.6	F21	F21-H73 HydrophobicContact CD1-CB 4.16Å; F21-H73 HydrophobicContact CE1-CB 3.81Å; F21-H73 AromaticContact CE1-CD2 3.95Å; F21-H73 HydrophobicContact CZ-CB 4.48Å; F21-H73 AromaticContact CZ-CD2 3.78Å
74	C	88.6	Confident	83.9	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	136.7	-175.7	-47.6	0	0	0	0	111.5	G19 I20 C22 Y76 C96	G19-C74 VanDerWaalsContact CA-O 3.26Å; G19-C74 WeakPolarHBondContact CA-O 3.49Å; I20-C74 HydrophobicContact CG1-CB 4.26Å; I20-C74 PolarHBondContact O-N 3.17Å; C22-C74 PolarHBondContact SG-SG 2.94Å; C74-Y76 WeakPolarHBondContact CB-O 3.32Å; C74-C96 WeakPolarHBondContact CA-SG 3.45Å; C74-C96 HydrophobicContact CB-CB 3.67Å; C74-C96 WeakPolarHBondContact CB-SG 3.22Å; C74-C96 PolarHBondContact N-SG 2.84Å; C74-C96 VanDerWaalsContact SG-CA 3.5Å; C74-C96 WeakPolarHBondContact SG-CB 3.43Å; C74-C96 CovalentContact SG-SG 2.01Å; C74-C96 PolarHBondContact SG-SG 2.01Å
75	H	86.3	Confident	84.2	Confident	138 Å²	138	54 Å²	54	64%	0.639	27%	0.266	S	S	*	.	S	Bend	trans	-66.6	-41.6	170.6	-177.3	76.5	0	0	0	111	E98	H75-E98 WeakPolarHBondContact CA-OE2 3.47Å; H75-E98 WeakPolarHBondContact CB-OE1 3.44Å; H75-E98 VanDerWaalsContact CB-OE2 3.25Å; H75-E98 WeakPolarHBondContact CB-OE2 3.42Å; H75-E98 VanDerWaalsContact N-CD 3.35Å; H75-E98 PolarHBondContact N-OE1 3.47Å; H75-E98 PolarHBondContact N-OE2 2.89Å; H75-E98 VanDerWaalsContact N-OE2 3.08Å
76	Y	85.4	Confident	84	Confident	70 Å²	70	53.1 Å²	53.1	28%	0.275	26%	0.264	S	S	.	.	S	Bend	trans	-96.5	142.6	170.4	-60.5	-69.5	0	0	0	112.1	C74 I78 E98 L106	C74-Y76 WeakPolarHBondContact CB-O 3.32Å; Y76-I78 PolarHBondContact O-N 2.62Å; Y76-E98 HydrophobicContact CD2-CB 4.2Å; Y76-E98 WeakPolarHBondContact CD2-OE2 3.38Å; Y76-E98 PolarHBondContact N-OE2 2.89Å; Y76-L106 HydrophobicContact CD2-CB 4.25Å; Y76-L106 HydrophobicContact CD2-CD1 3.42Å; Y76-L106 VanDerWaalsContact CD2-CD1 3.42Å; Y76-L106 HydrophobicContact CD2-CG 4.47Å; Y76-L106 HydrophobicContact CE2-CD1 3.82Å; Y76-L106 HydrophobicContact CG-CB 4.2Å; Y76-L106 HydrophobicContact CG-CD1 4.12Å
77	P	87	Confident	83.4	Confident	18 Å²	18	54.7 Å²	54.7	12%	0.117	28%	0.281	C	S	.	.	S	Bend	trans	-75.8	51.3	-180	33.1	-37.8	0	0	0	112.5	Y15 I20 P129 G130	Y15-P77 HydrophobicContact CD1-CB 3.83Å; Y15-P77 HydrophobicContact CD1-CG 3.07Å; Y15-P77 HydrophobicContact CE1-CB 4.34Å; Y15-P77 HydrophobicContact CE1-CG 3.65Å; Y15-P77 HydrophobicContact CG-CG 3.71Å; I20-P77 HydrophobicContact CD1-CB 4.33Å; I20-P77 HydrophobicContact CG1-CB 4.48Å; I20-P77 HydrophobicContact CG2-CB 3.66Å; P77-P129 WeakPolarHBondContact O-CA 3.27Å; P77-G130 PolarHBondContact O-N 3.09Å
78	I	88.7	Confident	82.9	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.015	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	116.2	-171.8	-57.9	166.2	0	0	0	109.1	Y76 A97 L106 V127 P129	Y76-I78 PolarHBondContact O-N 2.62Å; I78-A97 HydrophobicContact CB-CB 4.01Å; I78-A97 HydrophobicContact CG2-CB 3.59Å; I78-A97 WeakPolarHBondContact O-CB 3.13Å; I78-A97 PolarHBondContact O-N 2.88Å; I78-L106 HydrophobicContact CD1-CB 3.81Å; I78-L106 HydrophobicContact CD1-CD2 4.49Å; I78-L106 WeakPolarHBondContact CD1-O 3.36Å; I78-V127 HydrophobicContact CG2-CG1 3.33Å; I78-P129 HydrophobicContact CG1-CB 4.28Å
79	C	91.2	Very high	82.4	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.014	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	153.6	169	-59.9	0	0	0	0	111.4	C22 C128 K131 C134	C22-C79 VanDerWaalsContact CA-SG 3.52Å; C22-C79 HydrophobicContact CB-CB 4Å; C22-C79 WeakPolarHBondContact CB-SG 3.23Å; C22-C79 WeakPolarHBondContact SG-CA 3.41Å; C22-C79 WeakPolarHBondContact SG-CB 3.26Å; C22-C79 CovalentContact SG-SG 2.01Å; C22-C79 PolarHBondContact SG-SG 2.9Å; C79-C128 PolarHBondContact N-O 2.78Å; C79-C128 VanDerWaalsContact N-O 3.11Å; C79-C128 PolarHBondContact O-N 3.39Å; C79-K131 PolarHBondContact SG-O 2.93Å; C79-C134 PolarHBondContact O-SG 3.36Å; C79-C134 VanDerWaalsContact O-SG 3.33Å
80	Y	91.9	Very high	82.3	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.008	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	145	175.5	177.6	-89.4	0	0	0	109.8	R47 I82 R94 G95 F100 L101 E125 C126 V127	R47-Y80 VanDerWaalsContact NH1-CZ 3.29Å; R47-Y80 PolarHBondContact NH1-OH 2.77Å; Y80-I82 HydrophobicContact CE1-CB 3.74Å; Y80-I82 HydrophobicContact CE1-CG2 3.94Å; Y80-R94 WeakPolarHBondContact O-CA 3.3Å; Y80-G95 PolarHBondContact N-O 3.17Å; Y80-G95 PolarHBondContact O-N 2.82Å; Y80-F100 HydrophobicContact CD1-CB 3.57Å; Y80-F100 HydrophobicContact CD1-CD1 4.25Å; Y80-F100 AromaticContact CD1-CD2 3.45Å; Y80-F100 HydrophobicContact CD1-CD2 3.45Å; Y80-F100 VanDerWaalsContact CD1-CD2 3.45Å; Y80-F100 HydrophobicContact CD1-CE2 4.21Å; Y80-F100 AromaticContact CD1-CG 3.49Å; Y80-F100 HydrophobicContact CD1-CG 3.49Å; Y80-F100 VanDerWaalsContact CD1-CG 3.49Å; Y80-F100 HydrophobicContact CD2-CB 4.44Å; Y80-F100 HydrophobicContact CE1-CB 3.66Å; Y80-F100 HydrophobicContact CE1-CD1 4.17Å; Y80-F100 HydrophobicContact CE1-CD2 4.18Å; Y80-F100 AromaticContact CE1-CG 3.74Å; Y80-F100 HydrophobicContact CE1-CG 3.74Å; Y80-F100 HydrophobicContact CG-CB 4Å; Y80-F100 HydrophobicContact CG-CD2 4.08Å; Y80-F100 HydrophobicContact CG-CG 4.26Å; Y80-L101 HydrophobicContact CD2-CD1 4.06Å; Y80-L101 HydrophobicContact CD2-CD2 4.38Å; Y80-L101 HydrophobicContact CD2-CG 4.07Å; Y80-L101 HydrophobicContact CE2-CD1 4.44Å; Y80-L101 HydrophobicContact CE2-CD2 4.02Å; Y80-L101 HydrophobicContact CE2-CG 4.21Å; Y80-E125 HydrophobicContact CE2-CB 3.83Å; Y80-E125 VanDerWaalsContact OH-CB 3.27Å; Y80-E125 WeakPolarHBondContact OH-CB 3.49Å; Y80-E125 PolarHBondContact OH-OE2 3.49Å; Y80-C126 WeakPolarHBondContact CA-O 3.32Å; Y80-V127 HydrophobicContact CD2-CG2 3.92Å; Y80-V127 HydrophobicContact CE2-CG2 4.42Å
81	S	91.4	Very high	82.3	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	138.6	167.4	60	0	0	0	0	110.4	Y83 I93 E125 C126 C134	S81-Y83 WeakPolarHBondContact CB-OH 3.41Å; S81-Y83 WeakPolarHBondContact OG-CE2 3.48Å; S81-Y83 VanDerWaalsContact OG-CZ 3.24Å; S81-Y83 PolarHBondContact OG-OH 2.88Å; S81-I93 CarbonylContact C-O 3.59Å; S81-I93 VanDerWaalsContact CA-O 3.23Å; S81-I93 WeakPolarHBondContact CA-O 3.03Å; S81-E125 CarbonylContact O-C 3.6Å; S81-E125 WeakPolarHBondContact O-CA 3.46Å; S81-C126 PolarHBondContact N-O 2.97Å; S81-C126 PolarHBondContact O-N 3.47Å; S81-C134 WeakPolarHBondContact OG-CB 3.45Å
82	I	89.9	Confident	82.3	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134.6	170.1	-173.2	165.4	0	0	0	109.6	M40 L43 Y80 V92 I93 L117 I123 V124	M40-I82 HydrophobicContact CE-CD1 3.89Å; M40-I82 HydrophobicContact CE-CG1 3.89Å; M40-I82 HydrophobicContact CE-CG2 4.35Å; M40-I82 HydrophobicContact SD-CD1 3.72Å; M40-I82 HydrophobicContact SD-CG1 4.27Å; M40-I82 HydrophobicContact SD-CG2 4.2Å; L43-I82 HydrophobicContact CD2-CD1 3.13Å; L43-I82 HydrophobicContact CG-CD1 4.45Å; Y80-I82 HydrophobicContact CE1-CB 3.74Å; Y80-I82 HydrophobicContact CE1-CG2 3.94Å; I82-V92 CarbonylContact O-C 3.44Å; I82-V92 VanDerWaalsContact O-CA 3.31Å; I82-V92 WeakPolarHBondContact O-CA 3.05Å; I82-I93 HydrophobicContact CG2-CB 3.68Å; I82-I93 HydrophobicContact CG2-CD1 4.19Å; I82-I93 HydrophobicContact CG2-CG1 4.17Å; I82-I93 PolarHBondContact N-O 3.5Å; I82-I93 PolarHBondContact O-N 2.88Å; I82-L117 HydrophobicContact CD1-CD1 3.92Å; I82-I123 HydrophobicContact CD1-CG2 3.62Å; I82-I123 HydrophobicContact CG1-CG2 3.8Å; I82-V124 WeakPolarHBondContact CA-O 3.05Å
83	Y	87.5	Confident	82.4	Confident	15 Å²	15	38 Å²	38	6%	0.059	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.3	178.9	-50.5	-93.7	0	0	0	107.4	S81 L91 V92 R94 I123 V124 C126 C134 G135	S81-Y83 WeakPolarHBondContact CB-OH 3.41Å; S81-Y83 WeakPolarHBondContact OG-CE2 3.48Å; S81-Y83 VanDerWaalsContact OG-CZ 3.24Å; S81-Y83 PolarHBondContact OG-OH 2.88Å; Y83-L91 CarbonylContact C-O 3.51Å; Y83-L91 VanDerWaalsContact CA-O 3.3Å; Y83-L91 WeakPolarHBondContact CA-O 3.27Å; Y83-V92 HydrophobicContact CD1-CB 4.12Å; Y83-V92 HydrophobicContact CD1-CG1 3.65Å; Y83-V92 HydrophobicContact CD1-CG2 3.46Å; Y83-V92 VanDerWaalsContact CD1-CG2 3.46Å; Y83-V92 HydrophobicContact CE1-CB 4.31Å; Y83-V92 HydrophobicContact CE1-CG1 3.41Å; Y83-V92 VanDerWaalsContact CE1-CG1 3.41Å; Y83-V92 HydrophobicContact CE1-CG2 3.92Å; Y83-V92 HydrophobicContact CG-CG2 4.5Å; Y83-R94 PolarHBondContact OH-NH1 2.91Å; Y83-I123 CarbonylContact O-C 3.37Å; Y83-I123 VanDerWaalsContact O-CA 3.32Å; Y83-I123 WeakPolarHBondContact O-CA 3.39Å; Y83-V124 PolarHBondContact N-O 3.21Å; Y83-V124 PolarHBondContact O-N 3.05Å; Y83-C126 HydrophobicContact CE2-CB 4.42Å; Y83-C134 PolarHBondContact OH-O 3.33Å; Y83-G135 WeakPolarHBondContact OH-CA 3.27Å
84	A	84.1	Confident	82.5	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.3	163.9	0	0	0	0	0	105.8	M36 M40 P90 L91 I123	M36-A84 VanDerWaalsContact CE-CA 3.47Å; M36-A84 HydrophobicContact CE-CB 3.14Å; M36-A84 WeakPolarHBondContact CE-O 3.4Å; M36-A84 HydrophobicContact CG-CB 4.12Å; M36-A84 HydrophobicContact SD-CB 4.47Å; M40-A84 HydrophobicContact CE-CB 3.84Å; A84-P90 CarbonylContact O-C 3.44Å; A84-P90 WeakPolarHBondContact O-CA 3.01Å; A84-L91 HydrophobicContact CB-CB 4.39Å; A84-L91 PolarHBondContact N-O 2.93Å; A84-L91 PolarHBondContact O-N 3.08Å; A84-I123 HydrophobicContact CB-CG1 3.92Å
85	D	74.2	Confident	82.7	Confident	65 Å²	65	33.1 Å²	33.1	35%	0.348	19%	0.193	S	C	.	.			trans	-129.6	117.6	-179.1	-174.7	13.3	0	0	0	111.7	M36 S87 G88 P90 N122	M36-D85 VanDerWaalsContact CE-N 3.3Å; D85-S87 PolarHBondContact OD1-N 3.03Å; D85-G88 PolarHBondContact OD1-N 3.17Å; D85-G88 VanDerWaalsContact OD1-N 3.08Å; D85-P90 HydrophobicContact CB-CB 4.18Å; D85-N122 PolarHBondContact N-O 2.99Å; D85-N122 WeakPolarHBondContact O-CB 3.02Å; D85-N122 PolarHBondContact O-ND2 2.83Å
86	V	63.6	Low	83	Confident	70 Å²	70	26.6 Å²	26.6	42%	0.424	16%	0.162	S	C	.	.	S	Bend	trans	-117.8	-19.3	174.7	176.9	0	0	0	0	111.7	M36	M36-V86 HydrophobicContact CE-CB 4.38Å; M36-V86 HydrophobicContact CE-CG2 3.79Å; M36-V86 HydrophobicContact SD-CB 4.01Å; M36-V86 HydrophobicContact SD-CG2 3.45Å; M36-V86 WeakPolarHBondContact SD-CG2 3.26Å
87	S	60	Low	83.2	Confident	99 Å²	99	23.2 Å²	23.2	69%	0.692	15%	0.149	S	C	*	.	S	Bend	trans	-165.7	37.3	-169.3	-57.3	0	0	0	0	114.6	D85 L89	D85-S87 PolarHBondContact OD1-N 3.03Å; S87-L89 PolarHBondContact O-N 2.86Å
88	G	60	Low	83.2	Confident	59 Å²	59	25.5 Å²	25.5	61%	0.608	16%	0.158	S	C	*	.	S	Bend	trans	91.2	-1.7	165.7	0	0	0	0	0	116.5	D85	D85-G88 PolarHBondContact OD1-N 3.17Å; D85-G88 VanDerWaalsContact OD1-N 3.08Å
89	L	64.4	Low	83	Confident	112 Å²	112	27.3 Å²	27.3	59%	0.586	17%	0.171	S	C	*	.	S	Bend	trans	-127.7	99.7	163.9	-66.7	172.7	0	0	0	108.9	T31 S87	T31-L89 HydrophobicContact CG2-CB 3.42Å; T31-L89 VanDerWaalsContact CG2-CB 3.42Å; T31-L89 HydrophobicContact CG2-CD1 4.37Å; T31-L89 HydrophobicContact CG2-CG 4.42Å; S87-L89 PolarHBondContact O-N 2.86Å
90	P	77.6	Confident	82.7	Confident	34 Å²	34	27.5 Å²	27.5	22%	0.221	17%	0.171	C	C	.	.			trans	-75.2	135.7	-175.9	28.7	-33	0	0	0	110.9	S27 A61 A84 D85 V92	S27-P90 PolarHBondContact OG-O 2.9Å; A61-P90 HydrophobicContact CB-CG 3.94Å; A84-P90 CarbonylContact O-C 3.44Å; A84-P90 WeakPolarHBondContact O-CA 3.01Å; D85-P90 HydrophobicContact CB-CB 4.18Å; P90-V92 HydrophobicContact CB-CG2 3.88Å; P90-V92 HydrophobicContact CG-CG2 3.89Å; P90-V92 PolarHBondContact O-N 3.41Å
91	L	86.7	Confident	82.2	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	121	158.1	-177.7	76.5	0	0	0	106.6	V32 L37 M40 Y51 Y83 A84	V32-L91 HydrophobicContact CB-CB 4.38Å; V32-L91 HydrophobicContact CG1-CB 3.6Å; V32-L91 HydrophobicContact CG2-CB 3.87Å; V32-L91 HydrophobicContact CG2-CD1 4.01Å; V32-L91 HydrophobicContact CG2-CD2 4.05Å; V32-L91 HydrophobicContact CG2-CG 4.21Å; L37-L91 HydrophobicContact CD2-CD1 4.33Å; L37-L91 HydrophobicContact CD2-CD2 4.16Å; M40-L91 HydrophobicContact CB-CD2 3.96Å; M40-L91 HydrophobicContact CE-CD2 3.8Å; M40-L91 HydrophobicContact CG-CD2 3.77Å; Y51-L91 HydrophobicContact CE2-CD1 4.12Å; Y51-L91 VanDerWaalsContact OH-CD1 3.27Å; Y51-L91 WeakPolarHBondContact OH-CD1 3.24Å; Y83-L91 CarbonylContact C-O 3.51Å; Y83-L91 VanDerWaalsContact CA-O 3.3Å; Y83-L91 WeakPolarHBondContact CA-O 3.27Å; A84-L91 HydrophobicContact CB-CB 4.39Å; A84-L91 PolarHBondContact N-O 2.93Å; A84-L91 PolarHBondContact O-N 3.08Å
92	V	90.1	Very high	81.3	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.6	-178.9	-173.9	0	0	0	0	109	A26 S27 A61 I82 Y83 P90 R94	A26-V92 CarbonylContact C-O 3.53Å; A26-V92 VanDerWaalsContact CA-O 3.27Å; A26-V92 WeakPolarHBondContact CA-O 3.05Å; S27-V92 PolarHBondContact N-O 3.23Å; S27-V92 PolarHBondContact OG-N 2.91Å; S27-V92 VanDerWaalsContact OG-N 3.07Å; A61-V92 HydrophobicContact CB-CG2 3.77Å; I82-V92 CarbonylContact O-C 3.44Å; I82-V92 VanDerWaalsContact O-CA 3.31Å; I82-V92 WeakPolarHBondContact O-CA 3.05Å; Y83-V92 HydrophobicContact CD1-CB 4.12Å; Y83-V92 HydrophobicContact CD1-CG1 3.65Å; Y83-V92 HydrophobicContact CD1-CG2 3.46Å; Y83-V92 VanDerWaalsContact CD1-CG2 3.46Å; Y83-V92 HydrophobicContact CE1-CB 4.31Å; Y83-V92 HydrophobicContact CE1-CG1 3.41Å; Y83-V92 VanDerWaalsContact CE1-CG1 3.41Å; Y83-V92 HydrophobicContact CE1-CG2 3.92Å; Y83-V92 HydrophobicContact CG-CG2 4.5Å; P90-V92 HydrophobicContact CB-CG2 3.88Å; P90-V92 HydrophobicContact CG-CG2 3.89Å; P90-V92 PolarHBondContact O-N 3.41Å; V92-R94 HydrophobicContact CG1-CG 3.79Å
93	I	91.8	Very high	80	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	132.8	167.9	-49.4	170.5	0	0	0	107.1	C25 A26 M40 L44 Y51 P52 S81 I82 F100	C25-I93 CarbonylContact O-C 3.56Å; C25-I93 WeakPolarHBondContact O-CA 3.47Å; A26-I93 HydrophobicContact CB-CG1 4.29Å; A26-I93 HydrophobicContact CB-CG2 4.45Å; M40-I93 HydrophobicContact CG-CD1 4.1Å; M40-I93 HydrophobicContact SD-CD1 4.09Å; L44-I93 HydrophobicContact CD1-CD1 3.97Å; L44-I93 HydrophobicContact CD2-CD1 4.32Å; Y51-I93 HydrophobicContact CD2-CD1 3.65Å; Y51-I93 HydrophobicContact CD2-CG1 4.43Å; Y51-I93 HydrophobicContact CE2-CD1 3.54Å; Y51-I93 HydrophobicContact CE2-CG1 3.89Å; P52-I93 HydrophobicContact CG-CG2 3.84Å; S81-I93 CarbonylContact C-O 3.59Å; S81-I93 VanDerWaalsContact CA-O 3.23Å; S81-I93 WeakPolarHBondContact CA-O 3.03Å; I82-I93 HydrophobicContact CG2-CB 3.68Å; I82-I93 HydrophobicContact CG2-CD1 4.19Å; I82-I93 HydrophobicContact CG2-CG1 4.17Å; I82-I93 PolarHBondContact N-O 3.5Å; I82-I93 PolarHBondContact O-N 2.88Å; I93-F100 HydrophobicContact CG2-CE1 3.69Å; I93-F100 HydrophobicContact CG2-CZ 3.6Å
94	R	92.4	Very high	78.9	Confident	7 Å²	7	43.6 Å²	43.6	3%	0.026	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	147.6	-178.3	-51.6	179.7	-173.9	-110.2	-4	110.1	V23 H24 C25 C60 A61 L63 Y80 Y83 V92 C134	V23-R94 CarbonylContact O-C 3.5Å; V23-R94 WeakPolarHBondContact O-CB 3.44Å; H24-R94 WeakPolarHBondContact CA-O 3.47Å; H24-R94 PolarHBondContact CD2-O 3.38Å; C25-R94 PolarHBondContact N-O 3.49Å; C25-R94 PolarHBondContact O-N 2.96Å; C25-R94 VanDerWaalsContact SG-CD 3.57Å; C60-R94 VanDerWaalsContact O-CZ 3.29Å; C60-R94 PolarHBondContact O-NE 3.14Å; C60-R94 PolarHBondContact O-NH2 3.07Å; A61-R94 PolarHBondContact O-NH2 3.39Å; L63-R94 VanDerWaalsContact CD1-NH1 3.31Å; L63-R94 VanDerWaalsContact CD2-NH1 3.32Å; L63-R94 VanDerWaalsContact CG-CZ 3.44Å; Y80-R94 WeakPolarHBondContact O-CA 3.3Å; Y83-R94 PolarHBondContact OH-NH1 2.91Å; V92-R94 HydrophobicContact CG1-CG 3.79Å; R94-C134 PolarHBondContact NH1-O 3.05Å
95	G	92.6	Very high	77.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.1	-161.1	171.4	0	0	0	0	0	112.1	V23 Y80	V23-G95 PolarHBondContact O-N 2.01Å; Y80-G95 PolarHBondContact N-O 3.17Å; Y80-G95 PolarHBondContact O-N 2.82Å
96	C	92.2	Very high	77.3	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	139.3	173.8	-59.9	0	0	0	0	110.9	Q72 C74 E98 S99 F100	Q72-C96 HydrophobicContact CG-CB 4.48Å; Q72-C96 WeakPolarHBondContact CG-SG 3.33Å; Q72-C96 PolarHBondContact OE1-SG 2.62Å; Q72-C96 VanDerWaalsContact OE1-SG 3.39Å; C74-C96 WeakPolarHBondContact CA-SG 3.45Å; C74-C96 HydrophobicContact CB-CB 3.67Å; C74-C96 WeakPolarHBondContact CB-SG 3.22Å; C74-C96 PolarHBondContact N-SG 2.84Å; C74-C96 VanDerWaalsContact SG-CA 3.5Å; C74-C96 WeakPolarHBondContact SG-CB 3.43Å; C74-C96 CovalentContact SG-SG 2.01Å; C74-C96 PolarHBondContact SG-SG 2.01Å; C96-E98 HydrophobicContact CB-CG 3.92Å; C96-E98 PolarHBondContact O-N 2.72Å; C96-S99 WeakPolarHBondContact O-CB 3.03Å; C96-S99 PolarHBondContact O-N 3.08Å; C96-F100 WeakPolarHBondContact O-CD2 2.9Å
97	A	90.5	Very high	77.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-61.9	-32.3	-178.5	0	0	0	0	0	113.8	I78 S99 F100 L101 L106	I78-A97 HydrophobicContact CB-CB 4.01Å; I78-A97 HydrophobicContact CG2-CB 3.59Å; I78-A97 WeakPolarHBondContact O-CB 3.13Å; I78-A97 PolarHBondContact O-N 2.88Å; A97-S99 PolarHBondContact O-N 2.77Å; A97-F100 PolarHBondContact O-N 3.11Å; A97-L101 HydrophobicContact CB-CD1 4.29Å; A97-L101 WeakPolarHBondContact O-CB 3.25Å; A97-L101 PolarHBondContact O-N 2.64Å; A97-L106 HydrophobicContact CB-CD2 3.91Å
98	E	86.5	Confident	77.6	Confident	66 Å²	66	49.5 Å²	49.5	31%	0.308	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-61.7	-20	175.4	66.6	-154.5	-156	0	0	114.4	H75 Y76 C96 F100 L106	H75-E98 WeakPolarHBondContact CA-OE2 3.47Å; H75-E98 WeakPolarHBondContact CB-OE1 3.44Å; H75-E98 VanDerWaalsContact CB-OE2 3.25Å; H75-E98 WeakPolarHBondContact CB-OE2 3.42Å; H75-E98 VanDerWaalsContact N-CD 3.35Å; H75-E98 PolarHBondContact N-OE1 3.47Å; H75-E98 PolarHBondContact N-OE2 2.89Å; H75-E98 VanDerWaalsContact N-OE2 3.08Å; Y76-E98 HydrophobicContact CD2-CB 4.2Å; Y76-E98 WeakPolarHBondContact CD2-OE2 3.38Å; Y76-E98 PolarHBondContact N-OE2 2.89Å; C96-E98 HydrophobicContact CB-CG 3.92Å; C96-E98 PolarHBondContact O-N 2.72Å; E98-F100 VanDerWaalsContact C-N 3.35Å; E98-L106 HydrophobicContact CB-CD1 4.14Å
99	S	84.8	Confident	78.3	Confident	41 Å²	41	50.1 Å²	50.1	29%	0.287	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-81.2	-15.1	175.7	-54.9	0	0	0	0	113.4	T49 Q72 C96 A97	T49-S99 VanDerWaalsContact CB-O 3.3Å; T49-S99 WeakPolarHBondContact CB-O 3.4Å; T49-S99 PolarHBondContact OG1-O 2.95Å; Q72-S99 PolarHBondContact NE2-OG 2.75Å; C96-S99 WeakPolarHBondContact O-CB 3.03Å; C96-S99 PolarHBondContact O-N 3.08Å; A97-S99 PolarHBondContact O-N 2.77Å
100	F	85.2	Confident	78.8	Confident	5 Å²	5	48.7 Å²	48.7	2%	0.022	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.9	-15.6	-172.2	-60.1	-80.6	0	0	0	114.4	L44 R47 T49 Y80 I93 C96 A97 E98	L44-F100 HydrophobicContact CD2-CD1 4.14Å; L44-F100 HydrophobicContact CD2-CE1 4.26Å; R47-F100 VanDerWaalsContact CD-O 3.24Å; R47-F100 WeakPolarHBondContact CD-O 3.34Å; R47-F100 PolarHBondContact NH1-O 3.33Å; T49-F100 HydrophobicContact CG2-CD1 4.09Å; Y80-F100 HydrophobicContact CD1-CB 3.57Å; Y80-F100 HydrophobicContact CD1-CD1 4.25Å; Y80-F100 AromaticContact CD1-CD2 3.45Å; Y80-F100 HydrophobicContact CD1-CD2 3.45Å; Y80-F100 VanDerWaalsContact CD1-CD2 3.45Å; Y80-F100 HydrophobicContact CD1-CE2 4.21Å; Y80-F100 AromaticContact CD1-CG 3.49Å; Y80-F100 HydrophobicContact CD1-CG 3.49Å; Y80-F100 VanDerWaalsContact CD1-CG 3.49Å; Y80-F100 HydrophobicContact CD2-CB 4.44Å; Y80-F100 HydrophobicContact CE1-CB 3.66Å; Y80-F100 HydrophobicContact CE1-CD1 4.17Å; Y80-F100 HydrophobicContact CE1-CD2 4.18Å; Y80-F100 AromaticContact CE1-CG 3.74Å; Y80-F100 HydrophobicContact CE1-CG 3.74Å; Y80-F100 HydrophobicContact CG-CB 4Å; Y80-F100 HydrophobicContact CG-CD2 4.08Å; Y80-F100 HydrophobicContact CG-CG 4.26Å; I93-F100 HydrophobicContact CG2-CE1 3.69Å; I93-F100 HydrophobicContact CG2-CZ 3.6Å; C96-F100 WeakPolarHBondContact O-CD2 2.9Å; A97-F100 PolarHBondContact O-N 3.11Å; E98-F100 VanDerWaalsContact C-N 3.35Å
101	L	81.7	Confident	79	Confident	18 Å²	18	56.9 Å²	56.9	9%	0.094	29%	0.293	C	S	.	.	S	Bend	trans	-118.4	143.1	-177.3	-65.2	179.5	0	0	0	110.2	Y80 A97 L106 V127	Y80-L101 HydrophobicContact CD2-CD1 4.06Å; Y80-L101 HydrophobicContact CD2-CD2 4.38Å; Y80-L101 HydrophobicContact CD2-CG 4.07Å; Y80-L101 HydrophobicContact CE2-CD1 4.44Å; Y80-L101 HydrophobicContact CE2-CD2 4.02Å; Y80-L101 HydrophobicContact CE2-CG 4.21Å; A97-L101 HydrophobicContact CB-CD1 4.29Å; A97-L101 WeakPolarHBondContact O-CB 3.25Å; A97-L101 PolarHBondContact O-N 2.64Å; L101-L106 HydrophobicContact CB-CD2 4.28Å; L101-L106 HydrophobicContact CD1-CD2 4.01Å; L101-V127 HydrophobicContact CD1-CG2 3.9Å
102	P	72	Confident	78.9	Confident	72 Å²	72	60 Å²	60	47%	0.468	31%	0.308	S	S	.	.			trans	-60.4	153.6	175.2	26.8	-34.3	0	0	0	110.5	Q104	P102-Q104 HydrophobicContact CG-CG 4.49Å; P102-Q104 PolarHBondContact O-N 2.03Å
103	P	62.7	Low	78.7	Confident	122 Å²	122	62.6 Å²	62.6	79%	0.792	32%	0.318	S	S	*	.	S	Bend	trans	-68.7	16.9	-174.8	29.1	-36.6	0	0	0	114.9
104	Q	64.3	Low	78.4	Confident	144 Å²	144	65.2 Å²	65.2	67%	0.673	34%	0.336	S	S	*	.	S	Bend	trans	-50.6	144	164.3	-67.1	-169.8	21.4	0	0	108.4	P102 L106	P102-Q104 HydrophobicContact CG-CG 4.49Å; P102-Q104 PolarHBondContact O-N 2.03Å; Q104-L106 VanDerWaalsContact C-N 3.3Å; Q104-L106 PolarHBondContact O-N 3.12Å
105	P	59.5	Low	78.1	Confident	76 Å²	76	70.9 Å²	70.9	49%	0.494	36%	0.357	S	S	.	.			trans	-58.7	94.2	-161.7	21.1	-32.1	0	0	0	110.6	K107 N108	P105-K107 PolarHBondContact O-N 2.93Å; P105-N108 WeakPolarHBondContact O-CB 3.46Å; P105-N108 PolarHBondContact O-N 2.91Å
106	L	65.7	Low	77.7	Confident	4 Å²	4	73.9 Å²	73.9	2%	0.021	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-54	-25	175.6	-80	162.1	0	0	0	109.4	Y76 I78 A97 E98 L101 Q104 N108 Y109	Y76-L106 HydrophobicContact CD2-CB 4.25Å; Y76-L106 HydrophobicContact CD2-CD1 3.42Å; Y76-L106 VanDerWaalsContact CD2-CD1 3.42Å; Y76-L106 HydrophobicContact CD2-CG 4.47Å; Y76-L106 HydrophobicContact CE2-CD1 3.82Å; Y76-L106 HydrophobicContact CG-CB 4.2Å; Y76-L106 HydrophobicContact CG-CD1 4.12Å; I78-L106 HydrophobicContact CD1-CB 3.81Å; I78-L106 HydrophobicContact CD1-CD2 4.49Å; I78-L106 WeakPolarHBondContact CD1-O 3.36Å; A97-L106 HydrophobicContact CB-CD2 3.91Å; E98-L106 HydrophobicContact CB-CD1 4.14Å; L101-L106 HydrophobicContact CB-CD2 4.28Å; L101-L106 HydrophobicContact CD1-CD2 4.01Å; Q104-L106 VanDerWaalsContact C-N 3.3Å; Q104-L106 PolarHBondContact O-N 3.12Å; L106-N108 PolarHBondContact O-N 2.04Å; L106-Y109 HydrophobicContact CD2-CD2 4.17Å; L106-Y109 HydrophobicContact CD2-CE2 4.06Å; L106-Y109 WeakPolarHBondContact O-CD2 2.96Å; L106-Y109 PolarHBondContact O-N 2.94Å; L106-Y109 VanDerWaalsContact O-N 3.11Å
107	K	61.1	Low	77.2	Confident	153 Å²	153	76.2 Å²	76.2	67%	0.665	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-49.6	-23.2	168.7	-64.9	-175.9	178.8	-177.3	0	115.4	P105 Y109	P105-K107 PolarHBondContact O-N 2.93Å; K107-Y109 VanDerWaalsContact C-N 3.34Å
108	N	68.4	Low	76.2	Confident	125 Å²	125	80.8 Å²	80.8	67%	0.668	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-80.2	-14	-179.2	-71.8	-7.3	0	0	0	113.6	P105 L106 S110	P105-N108 WeakPolarHBondContact O-CB 3.46Å; P105-N108 PolarHBondContact O-N 2.91Å; L106-N108 PolarHBondContact O-N 2.04Å; N108-S110 PolarHBondContact O-N 2.87Å
109	Y	73.3	Confident	75.2	Confident	72 Å²	72	86.5 Å²	86.5	28%	0.282	44%	0.438	S	S	.	.			trans	-79.6	104.9	177.4	-62.5	-64.9	0	0	0	110.1	Y15 L106 K107 Y113 V127 P129	Y15-Y109 PolarHBondContact OH-O 3.11Å; L106-Y109 HydrophobicContact CD2-CD2 4.17Å; L106-Y109 HydrophobicContact CD2-CE2 4.06Å; L106-Y109 WeakPolarHBondContact O-CD2 2.96Å; L106-Y109 PolarHBondContact O-N 2.94Å; L106-Y109 VanDerWaalsContact O-N 3.11Å; K107-Y109 VanDerWaalsContact C-N 3.34Å; Y109-Y113 AromaticContact CD1-CD1 3.95Å; Y109-Y113 HydrophobicContact CD1-CD1 3.95Å; Y109-Y113 AromaticContact CD1-CE1 3.29Å; Y109-Y113 HydrophobicContact CD1-CE1 3.29Å; Y109-Y113 HydrophobicContact CE1-CD1 4.14Å; Y109-Y113 AromaticContact CE1-CE1 3.17Å; Y109-Y113 HydrophobicContact CE1-CE1 3.17Å; Y109-Y113 AromaticContact CE1-CZ 3.66Å; Y109-Y113 WeakPolarHBondContact CE1-OH 2.95Å; Y109-Y113 HydrophobicContact CG-CE1 4.2Å; Y109-Y113 PolarHBondContact OH-OH 2.97Å; Y109-V127 HydrophobicContact CD2-CG1 4.32Å; Y109-V127 HydrophobicContact CG-CG1 4.19Å; Y109-P129 WeakPolarHBondContact O-CG 3.47Å
110	S	75	Confident	74.3	Confident	82 Å²	82	89.6 Å²	89.6	57%	0.573	46%	0.46	S	S	*	.			trans	-104.2	-11.1	177.5	58.2	0	0	0	0	113.7	N108	N108-S110 PolarHBondContact O-N 2.87Å
111	R	81.6	Confident	73.5	Confident	207 Å²	207	91.1 Å²	91.1	78%	0.781	47%	0.468	S	S	*	.	S	Bend	trans	-133.6	150.1	-178.5	-64.1	-175.1	-177.7	175.9	1.2	109.8	Y113	R111-Y113 PolarHBondContact O-N 3.05Å
112	E	86.4	Confident	73.4	Confident	64 Å²	64	94.3 Å²	94.3	30%	0.299	49%	0.485	S	S	.	.			trans	-60.5	134.3	165.3	177.3	176.3	151.4	0	0	109.3	V127 C128 K131	E112-V127 VanDerWaalsContact CA-O 3.26Å; E112-V127 WeakPolarHBondContact CA-O 3.4Å; E112-C128 HydrophobicContact CG-CB 4.37Å; E112-K131 WeakPolarHBondContact OE2-CE 3.26Å; E112-K131 IonicContact OE2-NZ 2.74Å; E112-K131 PolarHBondContact OE2-NZ 3.22Å
113	Y	85	Confident	74	Confident	57 Å²	57	91 Å²	91	22%	0.224	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	150	167.4	75.4	-88	0	0	0	109.7	Y109 R111 R115 C126 V127	Y109-Y113 AromaticContact CD1-CD1 3.95Å; Y109-Y113 HydrophobicContact CD1-CD1 3.95Å; Y109-Y113 AromaticContact CD1-CE1 3.29Å; Y109-Y113 HydrophobicContact CD1-CE1 3.29Å; Y109-Y113 HydrophobicContact CE1-CD1 4.14Å; Y109-Y113 AromaticContact CE1-CE1 3.17Å; Y109-Y113 HydrophobicContact CE1-CE1 3.17Å; Y109-Y113 AromaticContact CE1-CZ 3.66Å; Y109-Y113 WeakPolarHBondContact CE1-OH 2.95Å; Y109-Y113 HydrophobicContact CG-CE1 4.2Å; Y109-Y113 PolarHBondContact OH-OH 2.97Å; R111-Y113 PolarHBondContact O-N 3.05Å; Y113-R115 HydrophobicContact CD2-CG 4.45Å; Y113-R115 HydrophobicContact CE2-CG 4.11Å; Y113-C126 CarbonylContact O-C 3.55Å; Y113-C126 WeakPolarHBondContact O-CA 3.21Å; Y113-V127 HydrophobicContact CD1-CB 3.9Å; Y113-V127 HydrophobicContact CD1-CG2 4.5Å; Y113-V127 HydrophobicContact CE1-CB 3.36Å; Y113-V127 HydrophobicContact CE1-CG1 3.93Å; Y113-V127 HydrophobicContact CE1-CG2 3.6Å; Y113-V127 HydrophobicContact CE2-CG2 4.22Å; Y113-V127 VanDerWaalsContact CZ-CG2 3.43Å; Y113-V127 PolarHBondContact N-O 2.82Å; Y113-V127 VanDerWaalsContact N-O 3.09Å; Y113-V127 PolarHBondContact O-N 2.95Å; Y113-V127 VanDerWaalsContact OH-CG2 3.24Å; Y113-V127 WeakPolarHBondContact OH-CG2 3.33Å
114	C	86.4	Confident	75.1	Confident	55 Å²	55	85.9 Å²	85.9	37%	0.372	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.9	167	-64.8	0	0	0	0	108.3	V124 E125 C126	C114-V124 HydrophobicContact CB-CG1 4.09Å; C114-E125 CarbonylContact C-O 3.52Å; C114-E125 WeakPolarHBondContact CA-O 3.05Å; C114-C126 HydrophobicContact CB-CB 4.1Å; C114-C126 WeakPolarHBondContact CB-SG 3.26Å; C114-C126 WeakPolarHBondContact SG-CB 3.45Å; C114-C126 CovalentContact SG-SG 2.04Å; C114-C126 PolarHBondContact SG-SG 3.5Å
115	R	85	Confident	76.3	Confident	126 Å²	126	79 Å²	79	48%	0.475	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	144.9	174.7	68.4	175.3	175.7	167	1.1	111.2	Y113 V124 E125	Y113-R115 HydrophobicContact CD2-CG 4.45Å; Y113-R115 HydrophobicContact CE2-CG 4.11Å; R115-V124 WeakPolarHBondContact O-CA 3.24Å; R115-E125 HydrophobicContact CG-CG 3.61Å; R115-E125 IonicContact CZ-OE1 2.62Å; R115-E125 PolarHBondContact N-O 2.93Å; R115-E125 IonicContact NE-OE1 3.85Å; R115-E125 PolarHBondContact NE-OE1 2.7Å; R115-E125 IonicContact NH2-OE1 3.11Å; R115-E125 PolarHBondContact NH2-OE1 3.4Å; R115-E125 IonicContact NH2-OE2 2.63Å; R115-E125 PolarHBondContact O-N 2.84Å
116	S	84.9	Confident	77.7	Confident	62 Å²	62	75.4 Å²	75.4	43%	0.434	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	124.9	167.7	-173.9	0	0	0	0	108.7	Q118 I123	S116-Q118 PolarHBondContact OG-O 3.11Å; S116-I123 CarbonylContact C-O 3.52Å; S116-I123 WeakPolarHBondContact CA-O 3.04Å
117	L	82.3	Confident	78.9	Confident	50 Å²	50	75.2 Å²	75.2	26%	0.262	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-35.7	176.5	-70.4	175.9	0	0	0	111.2	L43 I82 I123 E125	L43-L117 HydrophobicContact CD1-CD1 4.11Å; L43-L117 HydrophobicContact CD2-CD1 3.4Å; L43-L117 HydrophobicContact CG-CD1 4.39Å; I82-L117 HydrophobicContact CD1-CD1 3.92Å; L117-I123 HydrophobicContact CB-CB 4.48Å; L117-I123 HydrophobicContact CB-CG2 4.41Å; L117-I123 HydrophobicContact CD1-CG2 3.98Å; L117-I123 PolarHBondContact N-O 2.89Å; L117-E125 HydrophobicContact CD1-CB 4.22Å; L117-E125 HydrophobicContact CD1-CG 4.25Å; L117-E125 HydrophobicContact CD2-CG 3.98Å; L117-E125 HydrophobicContact CG-CB 4.42Å; L117-E125 HydrophobicContact CG-CG 4Å
118	Q	68.4	Low	80.2	Confident	96 Å²	96	67.9 Å²	67.9	45%	0.449	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	123.2	178.1	-73.4	-176	-29.7	0	0	109.6	S116 S120 L121 N122	S116-Q118 PolarHBondContact OG-O 3.11Å; Q118-S120 PolarHBondContact O-N 3.08Å; Q118-L121 HydrophobicContact CB-CB 4.35Å; Q118-L121 PolarHBondContact O-N 2.88Å; Q118-N122 PolarHBondContact O-N 3.42Å
119	Q	65	Low	81.1	Confident	185 Å²	185	63 Å²	63	86%	0.864	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-29	-179.1	-67.6	178.8	-5.7	0	0	112.6
120	S	66.4	Low	81.5	Confident	106 Å²	106	62.3 Å²	62.3	74%	0.741	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-25	-179.2	53.1	0	0	0	0	114.3	Q118	Q118-S120 PolarHBondContact O-N 3.08Å
121	L	67.9	Low	81.9	Confident	37 Å²	37	63.3 Å²	63.3	19%	0.194	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	4.6	-170.7	-77.6	158.3	0	0	0	113.5	A39 Q118 I123	A39-L121 HydrophobicContact CB-CD1 3.79Å; A39-L121 HydrophobicContact CB-CD2 4.35Å; Q118-L121 HydrophobicContact CB-CB 4.35Å; Q118-L121 PolarHBondContact O-N 2.88Å; L121-I123 HydrophobicContact CB-CD1 3.97Å; L121-I123 HydrophobicContact CB-CG1 3.83Å; L121-I123 WeakPolarHBondContact O-CG1 2.96Å; L121-I123 PolarHBondContact O-N 3.05Å
122	N	80.1	Confident	82	Confident	85 Å²	85	56.3 Å²	56.3	46%	0.455	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.2	34	-179.1	-73.9	-19.5	0	0	0	113.3	D85 Q118	D85-N122 PolarHBondContact N-O 2.99Å; D85-N122 WeakPolarHBondContact O-CB 3.02Å; D85-N122 PolarHBondContact O-ND2 2.83Å; Q118-N122 PolarHBondContact O-N 3.42Å
123	I	83.6	Confident	81.8	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.015	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115.9	176.4	-54.4	-178.8	0	0	0	107.3	A39 M40 L43 I82 Y83 A84 S116 L117 L121	A39-I123 HydrophobicContact CB-CD1 4.09Å; M40-I123 HydrophobicContact CE-CG2 4.36Å; L43-I123 HydrophobicContact CD2-CG2 4.28Å; I82-I123 HydrophobicContact CD1-CG2 3.62Å; I82-I123 HydrophobicContact CG1-CG2 3.8Å; Y83-I123 CarbonylContact O-C 3.37Å; Y83-I123 VanDerWaalsContact O-CA 3.32Å; Y83-I123 WeakPolarHBondContact O-CA 3.39Å; A84-I123 HydrophobicContact CB-CG1 3.92Å; S116-I123 CarbonylContact C-O 3.52Å; S116-I123 WeakPolarHBondContact CA-O 3.04Å; L117-I123 HydrophobicContact CB-CB 4.48Å; L117-I123 HydrophobicContact CB-CG2 4.41Å; L117-I123 HydrophobicContact CD1-CG2 3.98Å; L117-I123 PolarHBondContact N-O 2.89Å; L121-I123 HydrophobicContact CB-CD1 3.97Å; L121-I123 HydrophobicContact CB-CG1 3.83Å; L121-I123 WeakPolarHBondContact O-CG1 2.96Å; L121-I123 PolarHBondContact O-N 3.05Å
124	V	87.2	Confident	81.7	Confident	14 Å²	14	55.1 Å²	55.1	9%	0.085	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126.7	179.2	178.5	0	0	0	0	108.8	I82 Y83 C114 R115 R136	I82-V124 WeakPolarHBondContact CA-O 3.05Å; Y83-V124 PolarHBondContact N-O 3.21Å; Y83-V124 PolarHBondContact O-N 3.05Å; C114-V124 HydrophobicContact CB-CG1 4.09Å; R115-V124 WeakPolarHBondContact O-CA 3.24Å; V124-R136 VanDerWaalsContact CG2-NH1 3.34Å
125	E	88.8	Confident	81	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	148.7	167	66	169.9	-146.8	0	0	110.4	R47 Y80 S81 C114 R115 L117	R47-E125 IonicContact CZ-OE2 3.38Å; R47-E125 IonicContact NH1-OE2 3.55Å; R47-E125 PolarHBondContact NH1-OE2 3.42Å; R47-E125 IonicContact NH2-OE2 3.6Å; R47-E125 PolarHBondContact NH2-OE2 2.83Å; Y80-E125 HydrophobicContact CE2-CB 3.83Å; Y80-E125 VanDerWaalsContact OH-CB 3.27Å; Y80-E125 WeakPolarHBondContact OH-CB 3.49Å; Y80-E125 PolarHBondContact OH-OE2 3.49Å; S81-E125 CarbonylContact O-C 3.6Å; S81-E125 WeakPolarHBondContact O-CA 3.46Å; C114-E125 CarbonylContact C-O 3.52Å; C114-E125 WeakPolarHBondContact CA-O 3.05Å; R115-E125 HydrophobicContact CG-CG 3.61Å; R115-E125 IonicContact CZ-OE1 2.62Å; R115-E125 PolarHBondContact N-O 2.93Å; R115-E125 IonicContact NE-OE1 3.85Å; R115-E125 PolarHBondContact NE-OE1 2.7Å; R115-E125 IonicContact NH2-OE1 3.11Å; R115-E125 PolarHBondContact NH2-OE1 3.4Å; R115-E125 IonicContact NH2-OE2 2.63Å; R115-E125 PolarHBondContact O-N 2.84Å; L117-E125 HydrophobicContact CD1-CB 4.22Å; L117-E125 HydrophobicContact CD1-CG 4.25Å; L117-E125 HydrophobicContact CD2-CG 3.98Å; L117-E125 HydrophobicContact CG-CB 4.42Å; L117-E125 HydrophobicContact CG-CG 4Å
126	C	89.6	Confident	80	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	142.6	172.7	-58.8	0	0	0	0	110.1	Y80 S81 Y83 Y113 C114 C134	Y80-C126 WeakPolarHBondContact CA-O 3.32Å; S81-C126 PolarHBondContact N-O 2.97Å; S81-C126 PolarHBondContact O-N 3.47Å; Y83-C126 HydrophobicContact CE2-CB 4.42Å; Y113-C126 CarbonylContact O-C 3.55Å; Y113-C126 WeakPolarHBondContact O-CA 3.21Å; C114-C126 HydrophobicContact CB-CB 4.1Å; C114-C126 WeakPolarHBondContact CB-SG 3.26Å; C114-C126 WeakPolarHBondContact SG-CB 3.45Å; C114-C126 CovalentContact SG-SG 2.04Å; C114-C126 PolarHBondContact SG-SG 3.5Å; C126-C134 HydrophobicContact CB-CB 4.11Å
127	V	89.6	Confident	78	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129	176.3	178.3	0	0	0	0	108.1	I78 Y80 L101 Y109 E112 Y113 C134	I78-V127 HydrophobicContact CG2-CG1 3.33Å; Y80-V127 HydrophobicContact CD2-CG2 3.92Å; Y80-V127 HydrophobicContact CE2-CG2 4.42Å; L101-V127 HydrophobicContact CD1-CG2 3.9Å; Y109-V127 HydrophobicContact CD2-CG1 4.32Å; Y109-V127 HydrophobicContact CG-CG1 4.19Å; E112-V127 VanDerWaalsContact CA-O 3.26Å; E112-V127 WeakPolarHBondContact CA-O 3.4Å; Y113-V127 HydrophobicContact CD1-CB 3.9Å; Y113-V127 HydrophobicContact CD1-CG2 4.5Å; Y113-V127 HydrophobicContact CE1-CB 3.36Å; Y113-V127 HydrophobicContact CE1-CG1 3.93Å; Y113-V127 HydrophobicContact CE1-CG2 3.6Å; Y113-V127 HydrophobicContact CE2-CG2 4.22Å; Y113-V127 VanDerWaalsContact CZ-CG2 3.43Å; Y113-V127 PolarHBondContact N-O 2.82Å; Y113-V127 VanDerWaalsContact N-O 3.09Å; Y113-V127 PolarHBondContact O-N 2.95Å; Y113-V127 VanDerWaalsContact OH-CG2 3.24Å; Y113-V127 WeakPolarHBondContact OH-CG2 3.33Å; V127-C134 VanDerWaalsContact C-SG 3.55Å
128	C	89	Confident	75.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	98.8	-172	-42.9	0	0	0	0	110.1	C79 E112 K131 C134	C79-C128 PolarHBondContact N-O 2.78Å; C79-C128 VanDerWaalsContact N-O 3.11Å; C79-C128 PolarHBondContact O-N 3.39Å; E112-C128 HydrophobicContact CG-CB 4.37Å; C128-K131 HydrophobicContact CB-CB 4.12Å; C128-K131 HydrophobicContact CB-CD 4.13Å; C128-K131 HydrophobicContact CB-CG 4.3Å; C128-C134 VanDerWaalsContact CA-SG 3.59Å; C128-C134 HydrophobicContact CB-CB 4.16Å; C128-C134 WeakPolarHBondContact CB-SG 3.21Å; C128-C134 PolarHBondContact N-SG 3.07Å; C128-C134 WeakPolarHBondContact SG-CA 3.36Å; C128-C134 WeakPolarHBondContact SG-CB 3.3Å; C128-C134 CovalentContact SG-SG 2.03Å; C128-C134 PolarHBondContact SG-SG 2.63Å
129	P	87	Confident	74.5	Confident	22 Å²	22	54.9 Å²	54.9	14%	0.143	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	136.1	171.9	-18.8	32.2	0	0	0	111.1	Y15 P77 I78 Y109 K131	Y15-P129 HydrophobicContact CE1-CB 4.28Å; P77-P129 WeakPolarHBondContact O-CA 3.27Å; I78-P129 HydrophobicContact CG1-CB 4.28Å; Y109-P129 WeakPolarHBondContact O-CG 3.47Å; P129-K131 VanDerWaalsContact C-N 3.25Å; P129-K131 PolarHBondContact O-N 3.46Å
130	G	82.7	Confident	73.5	Confident	57 Å²	57	51.3 Å²	51.3	59%	0.588	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	9.3	171.9	0	0	0	0	0	116.3	P77	P77-G130 PolarHBondContact O-N 3.09Å
131	K	83.9	Confident	72.5	Confident	103 Å²	103	50.8 Å²	50.8	45%	0.448	29%	0.29	S	S	.	.			trans	-106.5	153.9	173.5	-62.1	-168.4	177.7	-177.7	0	110	I20 C79 E112 C128 P129 Y133	I20-K131 WeakPolarHBondContact CD1-O 3.44Å; C79-K131 PolarHBondContact SG-O 2.93Å; E112-K131 WeakPolarHBondContact OE2-CE 3.26Å; E112-K131 IonicContact OE2-NZ 2.74Å; E112-K131 PolarHBondContact OE2-NZ 3.22Å; C128-K131 HydrophobicContact CB-CB 4.12Å; C128-K131 HydrophobicContact CB-CD 4.13Å; C128-K131 HydrophobicContact CB-CG 4.3Å; P129-K131 VanDerWaalsContact C-N 3.25Å; P129-K131 PolarHBondContact O-N 3.46Å; K131-Y133 VanDerWaalsContact C-N 3.32Å; K131-Y133 WeakPolarHBondContact CB-O 3.19Å
132	S	83.3	Confident	71.7	Confident	60 Å²	60	51.7 Å²	51.7	42%	0.42	30%	0.303	S	S	.	.	S	Bend	trans	-82.3	-10.7	173.2	55.6	0	0	0	0	113.6	F21 C22 V23	F21-S132 WeakPolarHBondContact O-CA 3.36Å; F21-S132 WeakPolarHBondContact O-CB 3.49Å; C22-S132 CarbonylContact C-O 3.53Å; C22-S132 VanDerWaalsContact CA-O 3.3Å; C22-S132 WeakPolarHBondContact CA-O 3.21Å; V23-S132 PolarHBondContact N-O 3.48Å
133	Y	82.1	Confident	70.5	Confident	94 Å²	94	53.7 Å²	53.7	37%	0.369	31%	0.311	S	S	.	.			trans	-154.1	149.7	171.5	62.3	-86.6	0	0	0	109.9	L63 I66 K131	L63-Y133 HydrophobicContact CD1-CD2 3.38Å; L63-Y133 HydrophobicContact CD1-CE2 3.53Å; L63-Y133 HydrophobicContact CD1-CG 4.16Å; I66-Y133 HydrophobicContact CD1-CD1 4.23Å; I66-Y133 HydrophobicContact CD1-CE1 3.89Å; K131-Y133 VanDerWaalsContact C-N 3.32Å; K131-Y133 WeakPolarHBondContact CB-O 3.19Å
134	C	82.9	Confident	69.3	Low	2 Å²	2	57.4 Å²	57.4	1%	0.014	33%	0.33	C	S	.	.			trans	-89.9	133.7	161.7	-78.7	0	0	0	0	108.9	C79 S81 Y83 R94 C126 V127 C128	C79-C134 PolarHBondContact O-SG 3.36Å; C79-C134 VanDerWaalsContact O-SG 3.33Å; S81-C134 WeakPolarHBondContact OG-CB 3.45Å; Y83-C134 PolarHBondContact OH-O 3.33Å; R94-C134 PolarHBondContact NH1-O 3.05Å; C126-C134 HydrophobicContact CB-CB 4.11Å; V127-C134 VanDerWaalsContact C-SG 3.55Å; C128-C134 VanDerWaalsContact CA-SG 3.59Å; C128-C134 HydrophobicContact CB-CB 4.16Å; C128-C134 WeakPolarHBondContact CB-SG 3.21Å; C128-C134 PolarHBondContact N-SG 3.07Å; C128-C134 WeakPolarHBondContact SG-CA 3.36Å; C128-C134 WeakPolarHBondContact SG-CB 3.3Å; C128-C134 CovalentContact SG-SG 2.03Å; C128-C134 PolarHBondContact SG-SG 2.63Å
135	G	72	Confident	68.1	Low	17 Å²	17	60.4 Å²	60.4	18%	0.175	35%	0.348	C	S	.	.			trans	-119.5	151.5	166	0	0	0	0	0	107.9	Y83 S137	Y83-G135 WeakPolarHBondContact OH-CA 3.27Å; G135-S137 VanDerWaalsContact C-N 3.29Å; G135-S137 PolarHBondContact O-N 3.34Å
136	R	63.2	Low	66.9	Low	147 Å²	147	65.1 Å²	65.1	56%	0.555	37%	0.373	S	S	*	.			trans	-60	108.4	152.4	-149.2	-177.4	178.3	112.4	-1.2	104.1	V124 S138	V124-R136 VanDerWaalsContact CG2-NH1 3.34Å; R136-S138 PolarHBondContact O-N 3.38Å
137	S	44.1	Very low	66	Low	90 Å²	90	67.8 Å²	67.8	63%	0.629	39%	0.392	S	S	*	.			trans	-58.4	94.3	168.2	35.8	0	0	0	0	104.7	G135 P139	G135-S137 VanDerWaalsContact C-N 3.29Å; G135-S137 PolarHBondContact O-N 3.34Å; S137-P139 WeakPolarHBondContact O-CD 3.36Å
138	S	37.9	Very low	65	Low	45 Å²	45	75.1 Å²	75.1	32%	0.315	42%	0.421	S	S	.	.			trans	-61.9	117.9	-175.8	-179.2	0	0	0	0	104.8	R136 I140 V141 A142	R136-S138 PolarHBondContact O-N 3.38Å; S138-I140 PolarHBondContact O-N 2.88Å; S138-I140 VanDerWaalsContact OG-CB 3.3Å; S138-I140 WeakPolarHBondContact OG-CB 3.26Å; S138-I140 WeakPolarHBondContact OG-CG1 3.4Å; S138-I140 PolarHBondContact OG-N 3.46Å; S138-V141 PolarHBondContact O-N 3.48Å; S138-A142 PolarHBondContact O-N 3.47Å
139	P	37.5	Very low	64.1	Low	85 Å²	85	80 Å²	80	55%	0.552	45%	0.445	S	S	*	.	H	α-helix	trans	-56.1	-21.5	175.4	23.3	-32.2	0	0	0	109.8	S137 V141 A142 M143	S137-P139 WeakPolarHBondContact O-CD 3.36Å; P139-V141 PolarHBondContact O-N 3Å; P139-A142 PolarHBondContact O-N 3.41Å; P139-M143 WeakPolarHBondContact O-CB 3.45Å; P139-M143 WeakPolarHBondContact O-CG 3.14Å; P139-M143 PolarHBondContact O-N 2.77Å
140	I	44.1	Very low	63.3	Low	111 Å²	111	83.4 Å²	83.4	57%	0.569	47%	0.466	S	S	*	.	H	α-helix	trans	-60.9	-41.8	175.1	-52	173.8	0	0	0	111.9	S138 M143 I144	S138-I140 PolarHBondContact O-N 2.88Å; S138-I140 VanDerWaalsContact OG-CB 3.3Å; S138-I140 WeakPolarHBondContact OG-CB 3.26Å; S138-I140 WeakPolarHBondContact OG-CG1 3.4Å; S138-I140 PolarHBondContact OG-N 3.46Å; I140-M143 PolarHBondContact O-N 2.95Å; I140-I144 HydrophobicContact CG2-CD1 3.79Å; I140-I144 HydrophobicContact CG2-CG1 4.41Å; I140-I144 WeakPolarHBondContact O-CB 3.16Å; I140-I144 WeakPolarHBondContact O-CD1 3.35Å; I140-I144 WeakPolarHBondContact O-CG1 3.5Å; I140-I144 PolarHBondContact O-N 3.29Å
141	V	47.1	Very low	62.5	Low	95 Å²	95	86.1 Å²	86.1	58%	0.576	47%	0.466	S	S	*	.	H	α-helix	trans	-71.5	-40.5	178.2	179.7	0	0	0	0	110.6	S138 P139 M143 I144 V145	S138-V141 PolarHBondContact O-N 3.48Å; P139-V141 PolarHBondContact O-N 3Å; V141-M143 VanDerWaalsContact C-N 3.34Å; V141-M143 PolarHBondContact O-N 2.88Å; V141-I144 PolarHBondContact O-N 3.31Å; V141-V145 HydrophobicContact CG1-CG2 4.44Å; V141-V145 WeakPolarHBondContact O-CB 3.39Å; V141-V145 VanDerWaalsContact O-CG2 3.28Å; V141-V145 WeakPolarHBondContact O-CG2 3.34Å; V141-V145 PolarHBondContact O-N 3.01Å
142	A	49.5	Very low	61.6	Low	55 Å²	55	87.6 Å²	87.6	46%	0.455	47%	0.473	S	S	.	.	H	α-helix	trans	-62.8	-41.5	174.9	0	0	0	0	0	111.7	S138 P139 V145 L146	S138-A142 PolarHBondContact O-N 3.47Å; P139-A142 PolarHBondContact O-N 3.41Å; A142-V145 PolarHBondContact O-N 2.76Å; A142-L146 VanDerWaalsContact O-CB 3.32Å; A142-L146 WeakPolarHBondContact O-CB 3.5Å; A142-L146 WeakPolarHBondContact O-CD1 3.2Å; A142-L146 WeakPolarHBondContact O-CG 3.05Å; A142-L146 PolarHBondContact O-N 2.92Å
143	M	55.1	Low	60.6	Low	128 Å²	128	87 Å²	87	63%	0.631	47%	0.469	S	S	*	.	H	α-helix	trans	-68.3	-37.6	177.6	-71.6	-70.4	-75.8	0	0	112.2	P139 I140 V141 S147	P139-M143 WeakPolarHBondContact O-CB 3.45Å; P139-M143 WeakPolarHBondContact O-CG 3.14Å; P139-M143 PolarHBondContact O-N 2.77Å; I140-M143 PolarHBondContact O-N 2.95Å; V141-M143 VanDerWaalsContact C-N 3.34Å; V141-M143 PolarHBondContact O-N 2.88Å; M143-S147 WeakPolarHBondContact O-CB 3.28Å; M143-S147 PolarHBondContact O-N 2.86Å; M143-S147 PolarHBondContact O-OG 3.35Å
144	I	59.4	Low	59.6	Low	81 Å²	81	84.7 Å²	84.7	42%	0.415	47%	0.469	S	S	.	.	H	α-helix	trans	-66.2	-45.3	173.4	-71.4	167.1	0	0	0	110.2	I140 V141 L146 S147 Y148	I140-I144 HydrophobicContact CG2-CD1 3.79Å; I140-I144 HydrophobicContact CG2-CG1 4.41Å; I140-I144 WeakPolarHBondContact O-CB 3.16Å; I140-I144 WeakPolarHBondContact O-CD1 3.35Å; I140-I144 WeakPolarHBondContact O-CG1 3.5Å; I140-I144 PolarHBondContact O-N 3.29Å; V141-I144 PolarHBondContact O-N 3.31Å; I144-L146 VanDerWaalsContact C-N 3.34Å; I144-L146 PolarHBondContact O-N 3.45Å; I144-S147 WeakPolarHBondContact CA-OG 3.39Å; I144-S147 PolarHBondContact O-N 2.86Å; I144-S147 PolarHBondContact O-OG 3.4Å; I144-Y148 HydrophobicContact CG2-CD2 3.63Å; I144-Y148 HydrophobicContact CG2-CE2 3.51Å; I144-Y148 WeakPolarHBondContact O-CD2 3.27Å; I144-Y148 PolarHBondContact O-N 2.86Å
145	V	61.4	Low	58.6	Low	77 Å²	77	88.1 Å²	88.1	47%	0.467	50%	0.498	S	S	.	.	H	α-helix	trans	-63.3	-41.8	176.9	172.9	0	0	0	0	111	V141 A142 Y148 I149	V141-V145 HydrophobicContact CG1-CG2 4.44Å; V141-V145 WeakPolarHBondContact O-CB 3.39Å; V141-V145 VanDerWaalsContact O-CG2 3.28Å; V141-V145 WeakPolarHBondContact O-CG2 3.34Å; V141-V145 PolarHBondContact O-N 3.01Å; A142-V145 PolarHBondContact O-N 2.76Å; V145-Y148 PolarHBondContact O-N 3.41Å; V145-I149 HydrophobicContact CG1-CD1 3.86Å; V145-I149 VanDerWaalsContact O-CG1 3.26Å; V145-I149 WeakPolarHBondContact O-CG1 3.43Å; V145-I149 PolarHBondContact O-N 3.29Å
146	L	63.9	Low	58.1	Low	99 Å²	99	93.4 Å²	93.4	52%	0.518	52%	0.518	S	S	.	.	H	α-helix	trans	-62.3	-43.4	174.5	-82.4	155.7	0	0	0	112.2	A142 I144 I149 V150	A142-L146 VanDerWaalsContact O-CB 3.32Å; A142-L146 WeakPolarHBondContact O-CB 3.5Å; A142-L146 WeakPolarHBondContact O-CD1 3.2Å; A142-L146 WeakPolarHBondContact O-CG 3.05Å; A142-L146 PolarHBondContact O-N 2.92Å; I144-L146 VanDerWaalsContact C-N 3.34Å; I144-L146 PolarHBondContact O-N 3.45Å; L146-I149 PolarHBondContact O-N 2.99Å; L146-V150 WeakPolarHBondContact O-CG2 3.32Å; L146-V150 PolarHBondContact O-N 2.94Å
147	S	69.6	Low	57.7	Low	56 Å²	56	88.5 Å²	88.5	39%	0.392	51%	0.505	S	S	.	.	H	α-helix	trans	-65.8	-39.1	178.1	68.7	0	0	0	0	111.8	M143 I144 V150 L151	M143-S147 WeakPolarHBondContact O-CB 3.28Å; M143-S147 PolarHBondContact O-N 2.86Å; M143-S147 PolarHBondContact O-OG 3.35Å; I144-S147 WeakPolarHBondContact CA-OG 3.39Å; I144-S147 PolarHBondContact O-N 2.86Å; I144-S147 PolarHBondContact O-OG 3.4Å; S147-V150 PolarHBondContact O-N 3.33Å; S147-L151 WeakPolarHBondContact O-CB 3.38Å; S147-L151 VanDerWaalsContact O-CG 3.27Å; S147-L151 WeakPolarHBondContact O-CG 3.34Å; S147-L151 PolarHBondContact O-N 2.64Å
148	Y	69.9	Low	58.3	Low	154 Å²	154	89.7 Å²	89.7	60%	0.604	51%	0.511	S	S	*	.	H	α-helix	trans	-62.8	-42.6	172.6	-84.8	-69.6	0	0	0	112.4	I144 V145 L151 F152	I144-Y148 HydrophobicContact CG2-CD2 3.63Å; I144-Y148 HydrophobicContact CG2-CE2 3.51Å; I144-Y148 WeakPolarHBondContact O-CD2 3.27Å; I144-Y148 PolarHBondContact O-N 2.86Å; V145-Y148 PolarHBondContact O-N 3.41Å; Y148-L151 PolarHBondContact O-N 2.97Å; Y148-F152 WeakPolarHBondContact O-CB 3.38Å; Y148-F152 PolarHBondContact O-N 3.42Å
149	I	69.3	Low	59.2	Low	102 Å²	102	92.5 Å²	92.5	52%	0.523	53%	0.53	S	S	.	.	H	α-helix	trans	-63.6	-43.2	177.5	-68.1	164.7	0	0	0	111.2	V145 L146 F152 S153	V145-I149 HydrophobicContact CG1-CD1 3.86Å; V145-I149 VanDerWaalsContact O-CG1 3.26Å; V145-I149 WeakPolarHBondContact O-CG1 3.43Å; V145-I149 PolarHBondContact O-N 3.29Å; L146-I149 PolarHBondContact O-N 2.99Å; I149-F152 PolarHBondContact O-N 3.29Å; I149-S153 WeakPolarHBondContact O-CB 3.39Å; I149-S153 PolarHBondContact O-N 2.73Å; I149-S153 PolarHBondContact O-OG 2.99Å
150	V	70.3	Confident	60	Low	94 Å²	94	92.1 Å²	92.1	57%	0.57	52%	0.522	S	S	*	.	H	α-helix	trans	-63.2	-42.5	176.1	173	0	0	0	0	111.4	L146 S147 S153 A154	L146-V150 WeakPolarHBondContact O-CG2 3.32Å; L146-V150 PolarHBondContact O-N 2.94Å; S147-V150 PolarHBondContact O-N 3.33Å; V150-S153 WeakPolarHBondContact CA-OG 3.26Å; V150-S153 PolarHBondContact O-OG 2.96Å; V150-A154 VanDerWaalsContact O-CB 3.3Å; V150-A154 WeakPolarHBondContact O-CB 3.37Å; V150-A154 PolarHBondContact O-N 3Å
151	L	67	Low	60.4	Low	113 Å²	113	90.6 Å²	90.6	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-66.9	-40.5	176.3	-72.1	167.7	0	0	0	112.2	S147 Y148 A154 A155	S147-L151 WeakPolarHBondContact O-CB 3.38Å; S147-L151 VanDerWaalsContact O-CG 3.27Å; S147-L151 WeakPolarHBondContact O-CG 3.34Å; S147-L151 PolarHBondContact O-N 2.64Å; Y148-L151 PolarHBondContact O-N 2.97Å; L151-A154 PolarHBondContact O-N 3.05Å; L151-A155 WeakPolarHBondContact O-CB 3.3Å; L151-A155 PolarHBondContact O-N 3.04Å
152	F	64.1	Low	60.7	Low	134 Å²	134	89.1 Å²	89.1	59%	0.588	51%	0.512	S	S	*	.	H	α-helix	trans	-67.2	-41.7	179.4	-127.2	-93.9	0	0	0	112.2	Y148 I149 A155 H156	Y148-F152 WeakPolarHBondContact O-CB 3.38Å; Y148-F152 PolarHBondContact O-N 3.42Å; I149-F152 PolarHBondContact O-N 3.29Å; F152-A155 PolarHBondContact O-N 3.39Å; F152-H156 AromaticContact CD1-CE1 3.55Å; F152-H156 AromaticContact CD1-ND1 3.47Å; F152-H156 WeakPolarHBondContact CD1-ND1 3.26Å; F152-H156 AromaticContact CE1-CE1 3.26Å; F152-H156 WeakPolarHBondContact CE1-CE1 3.47Å; F152-H156 AromaticContact CE1-ND1 3.69Å; F152-H156 AromaticContact CE1-NE2 3.93Å; F152-H156 AromaticContact CZ-CE1 3.9Å; F152-H156 PolarHBondContact O-N 2.98Å; F152-H156 PolarHBondContact O-ND1 3.4Å
153	S	63	Low	61	Low	48 Å²	48	94.3 Å²	94.3	34%	0.336	52%	0.524	S	S	.	.	H	α-helix	trans	-68.2	-33.4	175.9	51.3	0	0	0	0	112.7	I149 V150 S157	I149-S153 WeakPolarHBondContact O-CB 3.39Å; I149-S153 PolarHBondContact O-N 2.73Å; I149-S153 PolarHBondContact O-OG 2.99Å; V150-S153 WeakPolarHBondContact CA-OG 3.26Å; V150-S153 PolarHBondContact O-OG 2.96Å; S153-S157 PolarHBondContact O-N 3.3Å
154	A	60.3	Low	61.1	Low	45 Å²	45	92.9 Å²	92.9	37%	0.372	52%	0.519	S	S	.	.	H	α-helix	trans	-69.7	-33.6	171.6	0	0	0	0	0	112.6	V150 L151 I161	V150-A154 VanDerWaalsContact O-CB 3.3Å; V150-A154 WeakPolarHBondContact O-CB 3.37Å; V150-A154 PolarHBondContact O-N 3Å; L151-A154 PolarHBondContact O-N 3.05Å; A154-I161 HydrophobicContact CB-CD1 4.29Å
155	A	62.5	Low	60.8	Low	75 Å²	75	98.5 Å²	98.5	62%	0.62	54%	0.535	S	S	*	.	H	α-helix	trans	-79.2	-30	-179.9	0	0	0	0	0	114.2	L151 F152	L151-A155 WeakPolarHBondContact O-CB 3.3Å; L151-A155 PolarHBondContact O-N 3.04Å; F152-A155 PolarHBondContact O-N 3.39Å
156	H	60	Low	60.4	Low	128 Å²	128	101 Å²	101	59%	0.593	55%	0.545	S	S	*	.	S	Bend	trans	-102.8	4.8	-173.7	-71	79	0	0	0	114.6	F152	F152-H156 AromaticContact CD1-CE1 3.55Å; F152-H156 AromaticContact CD1-ND1 3.47Å; F152-H156 WeakPolarHBondContact CD1-ND1 3.26Å; F152-H156 AromaticContact CE1-CE1 3.26Å; F152-H156 WeakPolarHBondContact CE1-CE1 3.47Å; F152-H156 AromaticContact CE1-ND1 3.69Å; F152-H156 AromaticContact CE1-NE2 3.93Å; F152-H156 AromaticContact CZ-CE1 3.9Å; F152-H156 PolarHBondContact O-N 2.98Å; F152-H156 PolarHBondContact O-ND1 3.4Å
157	S	55.2	Low	59.9	Low	43 Å²	43	103 Å²	103	30%	0.301	55%	0.551	S	S	.	*			trans	-157	91.5	177.1	-77.3	0	0	0	0	111.9	S153 C159 I160	S153-S157 PolarHBondContact O-N 3.3Å; S157-C159 PolarHBondContact O-N 3.45Å; S157-I160 PolarHBondContact O-N 3.27Å
158	P	57.5	Low	59.3	Low	116 Å²	116	105 Å²	105	75%	0.753	56%	0.556	S	S	*	*	H	α-helix	trans	-58.4	-14.3	170.3	22.8	-31.6	0	0	0	113
159	C	56.4	Low	58.5	Low	103 Å²	103	100.6 Å²	100.6	70%	0.696	55%	0.552	S	S	*	*	H	α-helix	trans	-76	-25.3	174.8	-111.5	0	0	0	0	115.1	S157	S157-C159 PolarHBondContact O-N 3.45Å
160	I	54.1	Low	57.7	Low	77 Å²	77	100.5 Å²	100.5	40%	0.395	56%	0.559	S	S	.	*	H	α-helix	trans	-79.3	-32.1	-176.8	-65	179.2	0	0	0	111.2	S157 A162 K163 I164	S157-I160 PolarHBondContact O-N 3.27Å; I160-A162 PolarHBondContact O-N 3.4Å; I160-K163 PolarHBondContact O-N 3.33Å; I160-K163 VanDerWaalsContact O-N 3.16Å; I160-I164 HydrophobicContact CG2-CD1 3.86Å; I160-I164 HydrophobicContact CG2-CG1 4.42Å; I160-I164 PolarHBondContact O-N 3.25Å
161	I	53.4	Low	57.2	Low	79 Å²	79	102.6 Å²	102.6	41%	0.405	57%	0.566	S	S	.	*	H	α-helix	trans	-63.2	-30.1	177.6	-60.2	170.6	0	0	0	111.1	A154 R165	A154-I161 HydrophobicContact CB-CD1 4.29Å; I161-R165 PolarHBondContact O-N 3.16Å
162	A	53.3	Low	56.5	Low	65 Å²	65	104.9 Å²	104.9	54%	0.537	57%	0.573	S	S	.	*	H	α-helix	trans	-71	-35.3	176.2	0	0	0	0	0	113.2	I160 L166	I160-A162 PolarHBondContact O-N 3.4Å; A162-L166 PolarHBondContact O-N 3.4Å
163	K	54.8	Low	55.9	Low	163 Å²	163	110.7 Å²	110.7	71%	0.709	60%	0.599	S	S	*	*	H	α-helix	trans	-76.9	-33.2	179.4	-85.5	-174.8	172.9	-178	0	113.5	I160 L166 H167	I160-K163 PolarHBondContact O-N 3.33Å; I160-K163 VanDerWaalsContact O-N 3.16Å; K163-L166 PolarHBondContact O-N 3.49Å; K163-H167 PolarHBondContact O-N 2.97Å
164	I	57.7	Low	55.5	Low	99 Å²	99	113.9 Å²	113.9	51%	0.508	61%	0.612	S	S	.	*	H	α-helix	trans	-73.8	-37.2	178.1	-63.2	171.6	0	0	0	110.9	I160 L166 H167 I168	I160-I164 HydrophobicContact CG2-CD1 3.86Å; I160-I164 HydrophobicContact CG2-CG1 4.42Å; I160-I164 PolarHBondContact O-N 3.25Å; I164-L166 VanDerWaalsContact C-N 3.32Å; I164-L166 PolarHBondContact O-N 3.05Å; I164-H167 PolarHBondContact O-N 3.49Å; I164-I168 HydrophobicContact CG2-CD1 3.97Å; I164-I168 WeakPolarHBondContact O-CG1 3.42Å; I164-I168 PolarHBondContact O-N 3.24Å
165	R	54.2	Low	55.2	Low	199 Å²	199	117.5 Å²	117.5	75%	0.751	63%	0.625	S	S	*	*	H	α-helix	trans	-65	-32.9	173.3	-82.8	-172.2	170.1	-175.4	-1.9	113.3	I161 A169	I161-R165 PolarHBondContact O-N 3.16Å; R165-A169 PolarHBondContact O-N 3.35Å
166	L	51.8	Low	54.8	Low	130 Å²	130	119.8 Å²	119.8	68%	0.681	63%	0.625	S	S	*	*	H	α-helix	trans	-72.4	-36.4	177.2	-142.2	78.2	0	0	0	112.4	A162 K163 I164 C170	A162-L166 PolarHBondContact O-N 3.4Å; K163-L166 PolarHBondContact O-N 3.49Å; I164-L166 VanDerWaalsContact C-N 3.32Å; I164-L166 PolarHBondContact O-N 3.05Å; L166-C170 PolarHBondContact O-N 3.27Å
167	H	53.2	Low	54.5	Low	140 Å²	140	119.4 Å²	119.4	65%	0.648	63%	0.627	S	S	*	*	H	α-helix	trans	-72.7	-28.8	179.5	-107.3	-77	0	0	0	113.9	K163 I164 I171	K163-H167 PolarHBondContact O-N 2.97Å; I164-H167 PolarHBondContact O-N 3.49Å; H167-I171 WeakPolarHBondContact O-CD1 3.5Å
168	I	57	Low	54.5	Low	98 Å²	98	124.1 Å²	124.1	50%	0.503	65%	0.647	S	S	.	*	H	α-helix	trans	-78.9	-33.6	176.6	-64	167.1	0	0	0	110.8	I164 C170 I171	I164-I168 HydrophobicContact CG2-CD1 3.97Å; I164-I168 WeakPolarHBondContact O-CG1 3.42Å; I164-I168 PolarHBondContact O-N 3.24Å; I168-C170 VanDerWaalsContact C-N 3.28Å; I168-C170 PolarHBondContact O-N 3.5Å; I168-I171 PolarHBondContact O-N 3.26Å
169	A	54.4	Low	54.3	Low	62 Å²	62	124.7 Å²	124.7	51%	0.512	64%	0.64	S	S	.	*	H	α-helix	trans	-66.2	-27.7	174.4	0	0	0	0	0	113.2	R165 I171	R165-A169 PolarHBondContact O-N 3.35Å; A169-I171 VanDerWaalsContact C-N 3.32Å; A169-I171 PolarHBondContact O-N 3.35Å
170	C	52.6	Low	54.1	Low	99 Å²	99	126.2 Å²	126.2	67%	0.669	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-4	175.4	-89.4	0	0	0	0	115	L166 I168	L166-C170 PolarHBondContact O-N 3.27Å; I168-C170 VanDerWaalsContact C-N 3.28Å; I168-C170 PolarHBondContact O-N 3.5Å
171	I	59.6	Low	54.1	Low	139 Å²	139	130 Å²	130	71%	0.713	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-8.8	179.1	-64.7	169.1	0	0	0	111.3	H167 I168 A169	H167-I171 WeakPolarHBondContact O-CD1 3.5Å; I168-I171 PolarHBondContact O-N 3.26Å; A169-I171 VanDerWaalsContact C-N 3.32Å; A169-I171 PolarHBondContact O-N 3.35Å
172	Q	52.3	Low	54.2	Low	160 Å²	160	134.3 Å²	134.3	75%	0.748	68%	0.675	S	S	*	*			trans	-111.5	12.6	-178.6	-70.4	-162.1	-86.7	0	0	115.1
173	F	49.8	Very low	54.3	Low	257 Å²	257	140.5 Å²	140.5	100%	1.127	69%	0.688	S	S	*	*			trans	-137.8	0	172.4	-102.2	-88.2	0	0	0	109.7

Retrieved 173 of 173 residues in 140.5 ms (Link to these results)

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