A0A096N909_PAPAN Loading...

Spermatosis associated 19

AlphaFold DB , UniProt , Accession A0A096N909, Species PAPAN (Papio anubis, Olive baboon), Gene SPATA19, Length 167 aa.

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	69.4	Low	85.8	Confident	201 Å²	201	112.3 Å²	112.3	99%	0.99	57%	0.571	S	S	*	*				0	-48.3	0	-62.9	-166.7	82.8	0	0	112.3	T4 T5	M1-T4 WeakPolarHBondContact CA-OG1 3.04Å; M1-T4 PolarHBondContact O-OG1 3.06Å; M1-T5 PolarHBondContact O-N 2.76Å; M1-T5 PolarHBondContact O-OG1 2.88Å
2	I	83.7	Confident	85.6	Confident	122 Å²	122	108 Å²	108	63%	0.626	57%	0.565	S	S	*	*	H	α-helix	trans	-63.3	-47.3	-179.8	-160.2	73.5	0	0	0	112.8	T4 T5 W6	I2-T4 PolarHBondContact O-N 3.29Å; I2-T5 PolarHBondContact O-N 3.31Å; I2-W6 PolarHBondContact O-N 3.18Å; I2-W6 VanDerWaalsContact O-N 3.12Å
3	I	88.4	Confident	85	Confident	121 Å²	121	103.5 Å²	103.5	62%	0.621	54%	0.536	S	S	*	.	H	α-helix	trans	-62.7	-44.2	-177	-58.4	172.2	0	0	0	111.4	T5 W6 I7	I3-T5 VanDerWaalsContact C-N 3.31Å; I3-T5 PolarHBondContact O-N 3.03Å; I3-W6 PolarHBondContact O-N 3.36Å; I3-I7 HydrophobicContact CG2-CD1 3.84Å; I3-I7 HydrophobicContact CG2-CG1 4.45Å; I3-I7 WeakPolarHBondContact O-CG1 3.3Å; I3-I7 PolarHBondContact O-N 3.46Å
4	T	89.4	Confident	84.5	Confident	85 Å²	85	108.2 Å²	108.2	52%	0.521	55%	0.551	S	S	.	*	H	α-helix	trans	-62.4	-39	178.7	45.9	0	0	0	0	111.7	M1 I2 I7 V8	M1-T4 WeakPolarHBondContact CA-OG1 3.04Å; M1-T4 PolarHBondContact O-OG1 3.06Å; I2-T4 PolarHBondContact O-N 3.29Å; T4-I7 PolarHBondContact O-N 3.38Å; T4-V8 WeakPolarHBondContact O-CG2 3.31Å; T4-V8 PolarHBondContact O-N 2.84Å; T4-V8 VanDerWaalsContact O-N 3.07Å
5	T	88.4	Confident	83.9	Confident	94 Å²	94	105.8 Å²	105.8	58%	0.577	56%	0.563	S	S	*	*	H	α-helix	trans	-64.5	-41.8	175.6	-54.4	0	0	0	0	111.8	M1 I2 I3 Y9	M1-T5 PolarHBondContact O-N 2.76Å; M1-T5 PolarHBondContact O-OG1 2.88Å; I2-T5 PolarHBondContact O-N 3.31Å; I3-T5 VanDerWaalsContact C-N 3.31Å; I3-T5 PolarHBondContact O-N 3.03Å; T5-Y9 VanDerWaalsContact O-CB 3.28Å; T5-Y9 WeakPolarHBondContact O-CB 3.48Å; T5-Y9 PolarHBondContact O-N 3.3Å
6	W	91.9	Very high	83.4	Confident	150 Å²	150	103.1 Å²	103.1	57%	0.568	56%	0.561	S	S	*	*	H	α-helix	trans	-64.8	-41.7	176.2	-74	110.4	0	0	0	112.7	I2 I3 Y9 I10	I2-W6 PolarHBondContact O-N 3.18Å; I2-W6 VanDerWaalsContact O-N 3.12Å; I3-W6 PolarHBondContact O-N 3.36Å; W6-Y9 HydrophobicContact CE3-CD1 4.23Å; W6-Y9 HydrophobicContact CZ3-CD1 4.43Å; W6-Y9 PolarHBondContact O-N 2.93Å; W6-I10 WeakPolarHBondContact O-CD1 3.41Å; W6-I10 WeakPolarHBondContact O-CG1 3.43Å; W6-I10 PolarHBondContact O-N 2.77Å
7	I	89.4	Confident	82.4	Confident	88 Å²	88	101 Å²	101	45%	0.451	57%	0.568	S	S	.	*	H	α-helix	trans	-63.1	-46.7	178.3	-68.7	169	0	0	0	110.8	I3 T4 Y9 I10 L11	I3-I7 HydrophobicContact CG2-CD1 3.84Å; I3-I7 HydrophobicContact CG2-CG1 4.45Å; I3-I7 WeakPolarHBondContact O-CG1 3.3Å; I3-I7 PolarHBondContact O-N 3.46Å; T4-I7 PolarHBondContact O-N 3.38Å; I7-Y9 VanDerWaalsContact C-N 3.33Å; I7-Y9 PolarHBondContact O-N 2.87Å; I7-I10 PolarHBondContact O-N 2.8Å; I7-L11 HydrophobicContact CG2-CD1 3.78Å; I7-L11 WeakPolarHBondContact O-CG 3.27Å; I7-L11 PolarHBondContact O-N 2.87Å
8	V	88.2	Confident	81.7	Confident	98 Å²	98	100.7 Å²	100.7	59%	0.594	56%	0.564	S	S	*	*	H	α-helix	trans	-62.4	-42.3	177.3	172.2	0	0	0	0	111	T4 I10 L11 A12	T4-V8 WeakPolarHBondContact O-CG2 3.31Å; T4-V8 PolarHBondContact O-N 2.84Å; T4-V8 VanDerWaalsContact O-N 3.07Å; V8-I10 PolarHBondContact O-N 2.79Å; V8-L11 PolarHBondContact O-N 2.66Å; V8-A12 VanDerWaalsContact O-CB 3.3Å; V8-A12 WeakPolarHBondContact O-CB 3.29Å; V8-A12 PolarHBondContact O-N 3.27Å
9	Y	85.7	Confident	80.8	Confident	80 Å²	80	100.7 Å²	100.7	31%	0.314	57%	0.569	S	S	.	*	H	α-helix	trans	-60.4	-44.4	176.4	172.3	-103	0	0	0	112.6	T5 W6 I7 R13 F20 L21	T5-Y9 VanDerWaalsContact O-CB 3.28Å; T5-Y9 WeakPolarHBondContact O-CB 3.48Å; T5-Y9 PolarHBondContact O-N 3.3Å; W6-Y9 HydrophobicContact CE3-CD1 4.23Å; W6-Y9 HydrophobicContact CZ3-CD1 4.43Å; W6-Y9 PolarHBondContact O-N 2.93Å; I7-Y9 VanDerWaalsContact C-N 3.33Å; I7-Y9 PolarHBondContact O-N 2.87Å; Y9-R13 HydrophobicContact CD2-CG 4.35Å; Y9-R13 HydrophobicContact CE2-CG 3.97Å; Y9-R13 WeakPolarHBondContact O-CB 3.47Å; Y9-R13 VanDerWaalsContact O-CG 3.31Å; Y9-R13 WeakPolarHBondContact O-CG 3.25Å; Y9-R13 PolarHBondContact O-N 2.92Å; Y9-R13 VanDerWaalsContact O-N 3.07Å; Y9-F20 HydrophobicContact CE1-CD1 4.27Å; Y9-L21 WeakPolarHBondContact OH-CD1 3.24Å
10	I	84.3	Confident	80	Confident	82 Å²	82	101.1 Å²	101.1	42%	0.421	57%	0.565	S	S	.	*	H	α-helix	trans	-65.4	-44.6	178.5	-67.7	163.5	0	0	0	111.1	W6 I7 V8 R13 K14 F20	W6-I10 WeakPolarHBondContact O-CD1 3.41Å; W6-I10 WeakPolarHBondContact O-CG1 3.43Å; W6-I10 PolarHBondContact O-N 2.77Å; I7-I10 PolarHBondContact O-N 2.8Å; V8-I10 PolarHBondContact O-N 2.79Å; I10-R13 PolarHBondContact O-N 2.93Å; I10-K14 WeakPolarHBondContact O-CB 3.48Å; I10-K14 PolarHBondContact O-N 3.4Å; I10-F20 HydrophobicContact CG1-CE1 4.46Å; I10-F20 HydrophobicContact CG2-CZ 4.34Å
11	L	85.3	Confident	79.1	Confident	114 Å²	114	102.2 Å²	102.2	60%	0.597	57%	0.569	S	S	*	*	H	α-helix	trans	-65.2	-44.8	179.7	-77.1	162.9	0	0	0	112	I7 V8 R13 K14 G15	I7-L11 HydrophobicContact CG2-CD1 3.78Å; I7-L11 WeakPolarHBondContact O-CG 3.27Å; I7-L11 PolarHBondContact O-N 2.87Å; V8-L11 PolarHBondContact O-N 2.66Å; L11-R13 VanDerWaalsContact C-N 3.35Å; L11-R13 PolarHBondContact O-N 3.43Å; L11-K14 PolarHBondContact O-N 3.17Å; L11-G15 PolarHBondContact O-N 3.38Å
12	A	82.8	Confident	78.4	Confident	61 Å²	61	97.7 Å²	97.7	50%	0.504	56%	0.555	S	S	.	*	H	α-helix	trans	-62.3	-41.7	177.9	0	0	0	0	0	111.8	V8 G15 A16	V8-A12 VanDerWaalsContact O-CB 3.3Å; V8-A12 WeakPolarHBondContact O-CB 3.29Å; V8-A12 PolarHBondContact O-N 3.27Å; A12-G15 PolarHBondContact O-N 2.86Å; A12-A16 VanDerWaalsContact O-CB 3.32Å; A12-A16 WeakPolarHBondContact O-CB 3.18Å; A12-A16 PolarHBondContact O-N 3.4Å
13	R	78.1	Confident	76.8	Confident	49 Å²	49	99 Å²	99	19%	0.185	56%	0.561	C	S	.	*	H	α-helix	trans	-67.5	-41.8	177.5	-75.6	-73.5	-106.2	-169.6	-7.2	112.6	Y9 I10 L11 G15 A16 G17 L18 P19 F20	Y9-R13 HydrophobicContact CD2-CG 4.35Å; Y9-R13 HydrophobicContact CE2-CG 3.97Å; Y9-R13 WeakPolarHBondContact O-CB 3.47Å; Y9-R13 VanDerWaalsContact O-CG 3.31Å; Y9-R13 WeakPolarHBondContact O-CG 3.25Å; Y9-R13 PolarHBondContact O-N 2.92Å; Y9-R13 VanDerWaalsContact O-N 3.07Å; I10-R13 PolarHBondContact O-N 2.93Å; L11-R13 VanDerWaalsContact C-N 3.35Å; L11-R13 PolarHBondContact O-N 3.43Å; R13-G15 VanDerWaalsContact C-N 3.35Å; R13-A16 PolarHBondContact O-N 2.95Å; R13-G17 PolarHBondContact O-N 2.98Å; R13-L18 PolarHBondContact O-N 2.93Å; R13-P19 PolarHBondContact NH1-O 3.25Å; R13-P19 PolarHBondContact NH2-O 3.47Å; R13-F20 HydrophobicContact CB-CD1 4.22Å; R13-F20 HydrophobicContact CB-CE1 3.68Å; R13-F20 HydrophobicContact CB-CZ 4.09Å; R13-F20 HydrophobicContact CG-CD1 4.45Å; R13-F20 HydrophobicContact CG-CE1 4.27Å
14	K	77.3	Confident	74.9	Confident	170 Å²	170	99.8 Å²	99.8	74%	0.739	57%	0.572	S	S	*	*	H	α-helix	trans	-66.8	-35.3	177.4	-167.6	169.1	-178.2	171	0	112.3	I10 L11	I10-K14 WeakPolarHBondContact O-CB 3.48Å; I10-K14 PolarHBondContact O-N 3.4Å; L11-K14 PolarHBondContact O-N 3.17Å
15	G	75.8	Confident	73	Confident	72 Å²	72	99.9 Å²	99.9	74%	0.742	58%	0.576	S	S	*	*	H	α-helix	trans	-74.6	-34.6	176.1	0	0	0	0	0	114	L11 A12 R13 G17	L11-G15 PolarHBondContact O-N 3.38Å; A12-G15 PolarHBondContact O-N 2.86Å; R13-G15 VanDerWaalsContact C-N 3.35Å; G15-G17 VanDerWaalsContact C-N 3.35Å
16	A	76.6	Confident	71.3	Confident	63 Å²	63	100.8 Å²	100.8	52%	0.521	59%	0.586	S	S	.	*	H	α-helix	trans	-84.7	-4.7	179.7	0	0	0	0	0	114.1	A12 R13 L18	A12-A16 VanDerWaalsContact O-CB 3.32Å; A12-A16 WeakPolarHBondContact O-CB 3.18Å; A12-A16 PolarHBondContact O-N 3.4Å; R13-A16 PolarHBondContact O-N 2.95Å; A16-L18 HydrophobicContact CB-CD1 3.96Å; A16-L18 HydrophobicContact CB-CG 4.09Å; A16-L18 PolarHBondContact O-N 2.92Å; A16-L18 VanDerWaalsContact O-N 3.11Å
17	G	66.4	Low	69.3	Low	67 Å²	67	100.9 Å²	100.9	69%	0.691	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.5	14.3	-177.9	0	0	0	0	0	114.3	R13 G15	R13-G17 PolarHBondContact O-N 2.98Å; G15-G17 VanDerWaalsContact C-N 3.35Å
18	L	68.8	Low	67.4	Low	95 Å²	95	102.9 Å²	102.9	50%	0.497	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-83.1	130.6	-178.3	-67.5	166.7	0	0	0	109.5	R13 A16 F20	R13-L18 PolarHBondContact O-N 2.93Å; A16-L18 HydrophobicContact CB-CD1 3.96Å; A16-L18 HydrophobicContact CB-CG 4.09Å; A16-L18 PolarHBondContact O-N 2.92Å; A16-L18 VanDerWaalsContact O-N 3.11Å; L18-F20 PolarHBondContact O-N 2.99Å
19	P	65.6	Low	65.5	Low	101 Å²	101	105.5 Å²	105.5	66%	0.656	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-60.5	135.6	-179.2	25.7	-33.5	0	0	0	109.1	R13	R13-P19 PolarHBondContact NH1-O 3.25Å; R13-P19 PolarHBondContact NH2-O 3.47Å
20	F	63.6	Low	63.9	Low	109 Å²	109	107.9 Å²	107.9	48%	0.478	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-50.8	149.3	169.3	-67.4	-77.1	0	0	0	109.6	Y9 I10 R13 L18	Y9-F20 HydrophobicContact CE1-CD1 4.27Å; I10-F20 HydrophobicContact CG1-CE1 4.46Å; I10-F20 HydrophobicContact CG2-CZ 4.34Å; R13-F20 HydrophobicContact CB-CD1 4.22Å; R13-F20 HydrophobicContact CB-CE1 3.68Å; R13-F20 HydrophobicContact CB-CZ 4.09Å; R13-F20 HydrophobicContact CG-CD1 4.45Å; R13-F20 HydrophobicContact CG-CE1 4.27Å; L18-F20 PolarHBondContact O-N 2.99Å
21	L	62.1	Low	62.6	Low	124 Å²	124	108.3 Å²	108.3	65%	0.649	65%	0.648	S	S	*	*			trans	-44.9	123.3	-174	-91.8	89.7	0	0	0	108.7	Y9 I23	Y9-L21 WeakPolarHBondContact OH-CD1 3.24Å; L21-I23 PolarHBondContact O-N 3.22Å
22	P	54.7	Low	61.1	Low	107 Å²	107	109.1 Å²	109.1	70%	0.695	65%	0.648	S	S	*	*			trans	-57.3	123.2	176.9	22.6	-30.8	0	0	0	106.3	T24	P22-T24 PolarHBondContact O-N 2.76Å
23	I	50.9	Low	59.9	Low	149 Å²	149	110.6 Å²	110.6	76%	0.764	66%	0.655	S	S	*	*			trans	-54.8	112.6	169.7	-58.5	168	0	0	0	104	L21 S25	L21-I23 PolarHBondContact O-N 3.22Å; I23-S25 PolarHBondContact O-N 3.34Å
24	T	47.3	Very low	59	Low	138 Å²	138	114.9 Å²	114.9	85%	0.847	68%	0.677	S	S	*	*			trans	-72.7	72.3	174.2	54.4	0	0	0	0	107.3	P22	P22-T24 PolarHBondContact O-N 2.76Å
25	S	49.6	Very low	58.6	Low	86 Å²	86	109.7 Å²	109.7	60%	0.601	67%	0.666	S	S	*	*			trans	-121.1	70.6	168.3	60.6	0	0	0	0	107.1	I23	I23-S25 PolarHBondContact O-N 3.34Å
26	S	53.1	Low	58.5	Low	114 Å²	114	110.2 Å²	110.2	80%	0.797	65%	0.654	S	S	*	*			trans	-71.4	124.3	155.4	49.6	0	0	0	0	107.4
27	D	50.4	Low	58.5	Low	151 Å²	151	110.6 Å²	110.6	81%	0.807	65%	0.653	S	S	*	*	S	Bend	trans	69.3	92.5	-178.7	-70	-26.6	0	0	0	117
28	I	49.2	Very low	59.2	Low	130 Å²	130	110.6 Å²	110.6	67%	0.667	64%	0.64	S	S	*	*				-168.3	86	129.7	-93.9	142.7	0	0	0	106.6
29	D	48.7	Very low	60.1	Low	153 Å²	153	111.8 Å²	111.8	82%	0.818	65%	0.646	S	S	*	*			trans	-113.5	17.4	175.7	-155.4	16.7	0	0	0	111.3
30	V	52.2	Low	60.7	Low	130 Å²	130	113.3 Å²	113.3	79%	0.788	64%	0.644	S	S	*	*	S	Bend	trans	-125.2	-2.5	-172.6	179.8	0	0	0	0	114.3
31	V	55.2	Low	61.8	Low	92 Å²	92	113.6 Å²	113.6	56%	0.558	65%	0.647	S	S	*	*	S	Bend	trans	-131.5	18.2	-176.1	-165.8	0	0	0	0	113.4
32	E	55	Low	63.3	Low	131 Å²	131	114.5 Å²	114.5	61%	0.612	64%	0.642	S	S	*	*	H	α-helix	trans	-89.6	-27.1	172.9	-65	-163.6	159	0	0	112.4	V36	E32-V36 VanDerWaalsContact O-CB 3.24Å; E32-V36 WeakPolarHBondContact O-CB 3.38Å; E32-V36 WeakPolarHBondContact O-CG2 3.35Å; E32-V36 PolarHBondContact O-N 3.49Å
33	S	57.1	Low	64.9	Low	92 Å²	92	115.2 Å²	115.2	64%	0.643	64%	0.639	S	S	*	*	H	α-helix	trans	-69.7	-38.6	-177.2	58.9	0	0	0	0	113.6	S37	S33-S37 WeakPolarHBondContact O-CB 3.34Å; S33-S37 PolarHBondContact O-N 2.93Å
34	E	60.3	Low	66.6	Low	139 Å²	139	114.7 Å²	114.7	65%	0.65	63%	0.631	S	S	*	*	H	α-helix	trans	-72.1	-43.9	177.7	-170.3	178.5	177.3	0	0	110.8	V36 S37 V38	E34-V36 VanDerWaalsContact C-N 3.35Å; E34-V36 PolarHBondContact O-N 2.82Å; E34-S37 PolarHBondContact O-N 3.47Å; E34-V38 HydrophobicContact CG-CG2 4.39Å; E34-V38 WeakPolarHBondContact O-CB 3.32Å; E34-V38 VanDerWaalsContact O-CG2 3.24Å; E34-V38 WeakPolarHBondContact O-CG2 3.17Å; E34-V38 PolarHBondContact O-N 2.85Å
35	A	69	Low	68.5	Low	61 Å²	61	112 Å²	112	50%	0.504	61%	0.608	S	S	.	*	H	α-helix	trans	-61.8	-42.2	177	0	0	0	0	0	111.9	V38 L39	A35-V38 PolarHBondContact O-N 3.06Å; A35-L39 WeakPolarHBondContact O-CB 3.49Å; A35-L39 PolarHBondContact O-N 3.44Å
36	V	73.1	Confident	70.4	Confident	82 Å²	82	112.1 Å²	112.1	50%	0.497	61%	0.605	S	S	.	*	H	α-helix	trans	-67.5	-40.1	174.8	172.6	0	0	0	0	111.2	E32 E34 L39 Q40	E32-V36 VanDerWaalsContact O-CB 3.24Å; E32-V36 WeakPolarHBondContact O-CB 3.38Å; E32-V36 WeakPolarHBondContact O-CG2 3.35Å; E32-V36 PolarHBondContact O-N 3.49Å; E34-V36 VanDerWaalsContact C-N 3.35Å; E34-V36 PolarHBondContact O-N 2.82Å; V36-L39 PolarHBondContact O-N 3.08Å; V36-Q40 VanDerWaalsContact O-CB 3.22Å; V36-Q40 WeakPolarHBondContact O-CB 3.26Å; V36-Q40 PolarHBondContact O-N 3.32Å
37	S	76.5	Confident	71.7	Confident	71 Å²	71	113.3 Å²	113.3	50%	0.497	60%	0.598	S	S	.	*	H	α-helix	trans	-65	-41.3	176.3	-178.2	0	0	0	0	112.2	S33 E34 Q40 H41	S33-S37 WeakPolarHBondContact O-CB 3.34Å; S33-S37 PolarHBondContact O-N 2.93Å; E34-S37 PolarHBondContact O-N 3.47Å; S37-Q40 PolarHBondContact O-N 2.79Å; S37-H41 WeakPolarHBondContact O-CB 3.41Å; S37-H41 PolarHBondContact O-N 3.26Å
38	V	81.2	Confident	73	Confident	68 Å²	68	111.4 Å²	111.4	41%	0.412	58%	0.584	S	S	.	*	H	α-helix	trans	-64.5	-46	175.3	170.8	0	0	0	0	109.6	E34 A35 Q40 H41 W42	E34-V38 HydrophobicContact CG-CG2 4.39Å; E34-V38 WeakPolarHBondContact O-CB 3.32Å; E34-V38 VanDerWaalsContact O-CG2 3.24Å; E34-V38 WeakPolarHBondContact O-CG2 3.17Å; E34-V38 PolarHBondContact O-N 2.85Å; A35-V38 PolarHBondContact O-N 3.06Å; V38-Q40 PolarHBondContact O-N 3.36Å; V38-H41 PolarHBondContact O-N 3.48Å; V38-W42 PolarHBondContact O-N 3.08Å
39	L	86.4	Confident	74.2	Confident	119 Å²	119	110.8 Å²	110.8	62%	0.623	58%	0.579	S	S	*	*	H	α-helix	trans	-61.4	-45.7	177.6	-173.9	66.9	0	0	0	111.6	A35 V36 H41 W42 L43	A35-L39 WeakPolarHBondContact O-CB 3.49Å; A35-L39 PolarHBondContact O-N 3.44Å; V36-L39 PolarHBondContact O-N 3.08Å; L39-H41 VanDerWaalsContact C-N 3.35Å; L39-H41 PolarHBondContact O-N 2.98Å; L39-W42 PolarHBondContact O-N 3.5Å; L39-L43 VanDerWaalsContact O-CB 3.31Å; L39-L43 WeakPolarHBondContact O-CB 3.18Å; L39-L43 PolarHBondContact O-N 3.48Å
40	Q	79.4	Confident	75.5	Confident	134 Å²	134	106 Å²	106	63%	0.626	56%	0.56	S	S	*	*	H	α-helix	trans	-65.4	-38.8	178.6	-171.7	179	-7.7	0	0	111.7	V36 S37 V38 L43 K44	V36-Q40 VanDerWaalsContact O-CB 3.22Å; V36-Q40 WeakPolarHBondContact O-CB 3.26Å; V36-Q40 PolarHBondContact O-N 3.32Å; S37-Q40 PolarHBondContact O-N 2.79Å; V38-Q40 PolarHBondContact O-N 3.36Å; Q40-L43 PolarHBondContact O-N 2.96Å; Q40-K44 WeakPolarHBondContact O-CB 3.24Å; Q40-K44 PolarHBondContact O-N 2.9Å
41	H	86.8	Confident	76.2	Confident	114 Å²	114	103.3 Å²	103.3	53%	0.528	55%	0.547	S	S	.	.	H	α-helix	trans	-62	-47.8	174.3	176.1	76	0	0	0	111.5	S37 V38 L39 K44 K45	S37-H41 WeakPolarHBondContact O-CB 3.41Å; S37-H41 PolarHBondContact O-N 3.26Å; V38-H41 PolarHBondContact O-N 3.48Å; L39-H41 VanDerWaalsContact C-N 3.35Å; L39-H41 PolarHBondContact O-N 2.98Å; H41-K44 PolarHBondContact O-N 3.47Å; H41-K45 WeakPolarHBondContact O-CB 3.19Å; H41-K45 PolarHBondContact O-N 3.39Å
42	W	92.5	Very high	76.8	Confident	144 Å²	144	104 Å²	104	55%	0.545	54%	0.544	S	S	.	.	H	α-helix	trans	-65.5	-40.9	177.6	-81.8	107.5	0	0	0	112.2	V38 L39 K44 K45 T46	V38-W42 PolarHBondContact O-N 3.08Å; L39-W42 PolarHBondContact O-N 3.5Å; W42-K44 PolarHBondContact O-N 2.87Å; W42-K45 HydrophobicContact CE3-CD 4.3Å; W42-K45 HydrophobicContact CZ3-CD 4.19Å; W42-K45 PolarHBondContact O-N 3Å; W42-T46 WeakPolarHBondContact O-CB 3.1Å; W42-T46 PolarHBondContact O-N 2.97Å; W42-T46 PolarHBondContact O-OG1 3.34Å; W42-T46 VanDerWaalsContact O-OG1 3.05Å
43	L	88.4	Confident	77.5	Confident	122 Å²	122	99.3 Å²	99.3	64%	0.639	53%	0.531	S	S	*	.	H	α-helix	trans	-58.8	-48.5	176.3	-160.5	88.6	0	0	0	111	L39 Q40 K45 T46 E47	L39-L43 VanDerWaalsContact O-CB 3.31Å; L39-L43 WeakPolarHBondContact O-CB 3.18Å; L39-L43 PolarHBondContact O-N 3.48Å; Q40-L43 PolarHBondContact O-N 2.96Å; L43-K45 VanDerWaalsContact C-N 3.35Å; L43-K45 PolarHBondContact O-N 3.05Å; L43-T46 PolarHBondContact O-N 2.85Å; L43-E47 PolarHBondContact O-N 3.43Å
44	K	86.6	Confident	78.1	Confident	138 Å²	138	100.1 Å²	100.1	60%	0.6	53%	0.527	S	S	*	.	H	α-helix	trans	-63.1	-41.6	177.5	-174.7	-179.4	178.3	-175.7	0	111.8	Q40 H41 W42 T46 E47 E48	Q40-K44 WeakPolarHBondContact O-CB 3.24Å; Q40-K44 PolarHBondContact O-N 2.9Å; H41-K44 PolarHBondContact O-N 3.47Å; W42-K44 PolarHBondContact O-N 2.87Å; K44-T46 VanDerWaalsContact C-N 3.35Å; K44-E47 PolarHBondContact O-N 3.31Å; K44-E48 PolarHBondContact O-N 2.98Å
45	K	88.6	Confident	78.3	Confident	81 Å²	81	101 Å²	101	35%	0.352	53%	0.529	S	S	.	.	H	α-helix	trans	-63.4	-41.9	177.4	-174.6	176.4	178.9	179.9	0	111.7	H41 W42 L43 E48 E49	H41-K45 WeakPolarHBondContact O-CB 3.19Å; H41-K45 PolarHBondContact O-N 3.39Å; W42-K45 HydrophobicContact CE3-CD 4.3Å; W42-K45 HydrophobicContact CZ3-CD 4.19Å; W42-K45 PolarHBondContact O-N 3Å; L43-K45 VanDerWaalsContact C-N 3.35Å; L43-K45 PolarHBondContact O-N 3.05Å; K45-E48 PolarHBondContact O-N 2.93Å; K45-E49 VanDerWaalsContact CE-OE1 3.24Å; K45-E49 WeakPolarHBondContact CE-OE1 3.22Å; K45-E49 WeakPolarHBondContact O-CG 3.24Å; K45-E49 PolarHBondContact O-N 2.98Å
46	T	88.2	Confident	77.8	Confident	88 Å²	88	104.5 Å²	104.5	54%	0.54	54%	0.535	S	S	.	.	H	α-helix	trans	-65.3	-39.6	176.1	-61.9	0	0	0	0	112	W42 L43 K44 A50	W42-T46 WeakPolarHBondContact O-CB 3.1Å; W42-T46 PolarHBondContact O-N 2.97Å; W42-T46 PolarHBondContact O-OG1 3.34Å; W42-T46 VanDerWaalsContact O-OG1 3.05Å; L43-T46 PolarHBondContact O-N 2.85Å; K44-T46 VanDerWaalsContact C-N 3.35Å; T46-A50 VanDerWaalsContact O-CB 3.26Å; T46-A50 WeakPolarHBondContact O-CB 3.43Å; T46-A50 PolarHBondContact O-N 3.21Å
47	E	81.3	Confident	77.2	Confident	140 Å²	140	107.9 Å²	107.9	65%	0.654	54%	0.542	S	S	*	.	H	α-helix	trans	-61.7	-45.4	174.3	-175.6	-177.3	176.4	0	0	111.8	L43 K44 A50 S51	L43-E47 PolarHBondContact O-N 3.43Å; K44-E47 PolarHBondContact O-N 3.31Å; E47-A50 PolarHBondContact O-N 2.91Å; E47-S51 WeakPolarHBondContact O-CB 3.23Å; E47-S51 PolarHBondContact O-N 3.44Å
48	E	78.1	Confident	76.3	Confident	110 Å²	110	109.7 Å²	109.7	51%	0.514	55%	0.546	S	S	.	.	H	α-helix	trans	-66	-44.4	179.7	-171.4	171.2	179	0	0	112.3	K44 K45 S51 Q52	K44-E48 PolarHBondContact O-N 2.98Å; K45-E48 PolarHBondContact O-N 2.93Å; E48-S51 PolarHBondContact O-N 3.35Å; E48-Q52 WeakPolarHBondContact O-CG 3.46Å; E48-Q52 PolarHBondContact O-N 2.8Å
49	E	74.3	Confident	75	Confident	118 Å²	118	110.6 Å²	110.6	55%	0.551	56%	0.555	S	S	*	*	H	α-helix	trans	-65	-39.3	176.3	-74.2	-173.5	-171.9	0	0	112	K45 Q52 G53	K45-E49 VanDerWaalsContact CE-OE1 3.24Å; K45-E49 WeakPolarHBondContact CE-OE1 3.22Å; K45-E49 WeakPolarHBondContact O-CG 3.24Å; K45-E49 PolarHBondContact O-N 2.98Å; E49-Q52 PolarHBondContact O-N 2.91Å; E49-G53 PolarHBondContact O-N 2.92Å
50	A	75.4	Confident	73.5	Confident	52 Å²	52	111.3 Å²	111.3	43%	0.43	56%	0.558	S	S	.	*	H	α-helix	trans	-64	-40.9	174	0	0	0	0	0	111.7	T46 E47 G53 I54	T46-A50 VanDerWaalsContact O-CB 3.26Å; T46-A50 WeakPolarHBondContact O-CB 3.43Å; T46-A50 PolarHBondContact O-N 3.21Å; E47-A50 PolarHBondContact O-N 2.91Å; A50-G53 PolarHBondContact O-N 3.48Å; A50-I54 VanDerWaalsContact O-CG1 3.27Å; A50-I54 WeakPolarHBondContact O-CG1 3.31Å; A50-I54 PolarHBondContact O-N 3.49Å
51	S	67.1	Low	71.9	Confident	73 Å²	73	110.8 Å²	110.8	51%	0.51	56%	0.56	S	S	.	*	H	α-helix	trans	-65.4	-39.6	176.7	-176.1	0	0	0	0	112.3	E47 E48 I54 K55	E47-S51 WeakPolarHBondContact O-CB 3.23Å; E47-S51 PolarHBondContact O-N 3.44Å; E48-S51 PolarHBondContact O-N 3.35Å; S51-I54 PolarHBondContact O-N 3.15Å; S51-K55 VanDerWaalsContact O-CB 3.3Å; S51-K55 WeakPolarHBondContact O-CB 3.48Å; S51-K55 PolarHBondContact O-N 3.46Å
52	Q	68	Low	69.8	Low	107 Å²	107	114 Å²	114	50%	0.5	57%	0.569	S	S	.	*	H	α-helix	trans	-67.3	-42.2	175.9	-71.9	-177.9	9.7	0	0	111.2	E48 E49 I54 K55 E56	E48-Q52 WeakPolarHBondContact O-CG 3.46Å; E48-Q52 PolarHBondContact O-N 2.8Å; E49-Q52 PolarHBondContact O-N 2.91Å; Q52-I54 VanDerWaalsContact C-N 3.31Å; Q52-I54 PolarHBondContact O-N 3.49Å; Q52-K55 PolarHBondContact O-N 3.5Å; Q52-E56 PolarHBondContact O-N 2.81Å
53	G	69.9	Low	67.5	Low	32 Å²	32	112.4 Å²	112.4	33%	0.33	58%	0.577	S	S	.	*	H	α-helix	trans	-61.5	-36.9	175.3	0	0	0	0	0	113.1	E49 A50 K57	E49-G53 PolarHBondContact O-N 2.92Å; A50-G53 PolarHBondContact O-N 3.48Å; G53-K57 WeakPolarHBondContact O-CB 3.31Å; G53-K57 VanDerWaalsContact O-CG 3.29Å; G53-K57 WeakPolarHBondContact O-CG 3.33Å; G53-K57 PolarHBondContact O-N 3.41Å
54	I	68.5	Low	65.4	Low	110 Å²	110	112.3 Å²	112.3	56%	0.564	59%	0.586	S	S	*	*	H	α-helix	trans	-71	-42.5	173.9	-66.3	164	0	0	0	110.8	A50 S51 Q52 K57 L58	A50-I54 VanDerWaalsContact O-CG1 3.27Å; A50-I54 WeakPolarHBondContact O-CG1 3.31Å; A50-I54 PolarHBondContact O-N 3.49Å; S51-I54 PolarHBondContact O-N 3.15Å; Q52-I54 VanDerWaalsContact C-N 3.31Å; Q52-I54 PolarHBondContact O-N 3.49Å; I54-K57 PolarHBondContact O-N 3.08Å; I54-L58 HydrophobicContact CG2-CD1 4.46Å; I54-L58 PolarHBondContact O-N 2.98Å
55	K	64.8	Low	63.2	Low	158 Å²	158	114.5 Å²	114.5	69%	0.687	60%	0.599	S	S	*	*	H	α-helix	trans	-63.6	-41.4	179.5	-172.4	-179.5	178.5	-174.7	0	112.3	S51 Q52 L58 S59	S51-K55 VanDerWaalsContact O-CB 3.3Å; S51-K55 WeakPolarHBondContact O-CB 3.48Å; S51-K55 PolarHBondContact O-N 3.46Å; Q52-K55 PolarHBondContact O-N 3.5Å; K55-L58 PolarHBondContact O-N 2.79Å; K55-S59 VanDerWaalsContact O-CB 3.31Å; K55-S59 WeakPolarHBondContact O-CB 3.42Å; K55-S59 PolarHBondContact O-N 3.25Å
56	E	59	Low	60.7	Low	134 Å²	134	113.4 Å²	113.4	63%	0.626	61%	0.61	S	S	*	*	H	α-helix	trans	-63.2	-43.9	173.2	-81.7	-172.1	152.6	0	0	111.4	Q52 L58 S59 I60	Q52-E56 PolarHBondContact O-N 2.81Å; E56-L58 VanDerWaalsContact C-N 3.27Å; E56-L58 PolarHBondContact O-N 3.32Å; E56-S59 PolarHBondContact O-N 2.84Å; E56-I60 WeakPolarHBondContact O-CD1 3.42Å; E56-I60 VanDerWaalsContact O-CG1 3.25Å; E56-I60 WeakPolarHBondContact O-CG1 3.48Å; E56-I60 PolarHBondContact O-N 3.05Å
57	K	60.5	Low	58.7	Low	152 Å²	152	116.5 Å²	116.5	66%	0.661	62%	0.622	S	S	*	*	H	α-helix	trans	-66.2	-28.1	177.6	-72.6	-167.8	-179.8	-155	0	113.5	G53 I54 N61	G53-K57 WeakPolarHBondContact O-CB 3.31Å; G53-K57 VanDerWaalsContact O-CG 3.29Å; G53-K57 WeakPolarHBondContact O-CG 3.33Å; G53-K57 PolarHBondContact O-N 3.41Å; I54-K57 PolarHBondContact O-N 3.08Å; K57-N61 PolarHBondContact O-ND2 2.81Å
58	L	57.7	Low	56.6	Low	109 Å²	109	119.9 Å²	119.9	57%	0.571	63%	0.629	S	S	*	*	H	α-helix	trans	-80.3	-33.5	172.9	-124.2	128.2	0	0	0	112.2	I54 K55 E56 N61	I54-L58 HydrophobicContact CG2-CD1 4.46Å; I54-L58 PolarHBondContact O-N 2.98Å; K55-L58 PolarHBondContact O-N 2.79Å; E56-L58 VanDerWaalsContact C-N 3.27Å; E56-L58 PolarHBondContact O-N 3.32Å; L58-N61 PolarHBondContact O-N 3.48Å
59	S	53.8	Low	54.8	Low	87 Å²	87	122.9 Å²	122.9	61%	0.608	64%	0.642	S	S	*	*	H	α-helix	trans	-70.5	-34	176.9	-175.1	0	0	0	0	113	K55 E56 N61	K55-S59 VanDerWaalsContact O-CB 3.31Å; K55-S59 WeakPolarHBondContact O-CB 3.42Å; K55-S59 PolarHBondContact O-N 3.25Å; E56-S59 PolarHBondContact O-N 2.84Å; S59-N61 PolarHBondContact O-N 3.34Å
60	I	54.4	Low	53.2	Low	134 Å²	134	125.7 Å²	125.7	69%	0.687	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-22.9	176.6	-67.5	163.8	0	0	0	111.3	E56	E56-I60 WeakPolarHBondContact O-CD1 3.42Å; E56-I60 VanDerWaalsContact O-CG1 3.25Å; E56-I60 WeakPolarHBondContact O-CG1 3.48Å; E56-I60 PolarHBondContact O-N 3.05Å
61	N	47	Very low	51.4	Low	124 Å²	124	132.3 Å²	132.3	66%	0.663	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	14.8	-176.1	-76.3	-37.1	0	0	0	114.9	K57 L58 S59 P63	K57-N61 PolarHBondContact O-ND2 2.81Å; L58-N61 PolarHBondContact O-N 3.48Å; S59-N61 PolarHBondContact O-N 3.34Å; N61-P63 WeakPolarHBondContact O-CD 3.32Å
62	Y	41.3	Very low	49.8	Very low	182 Å²	182	133.9 Å²	133.9	71%	0.714	69%	0.688	S	S	*	*			trans	-89.4	100.2	162.3	-84.3	-86.1	0	0	0	109.6	S64	Y62-S64 PolarHBondContact O-N 2.91Å
63	P	44.8	Very low	48.2	Very low	109 Å²	109	134 Å²	134	71%	0.708	70%	0.697	S	S	*	*			trans	-68.7	105.9	162.4	29.6	-30.2	0	0	0	106.4	N61 Q65	N61-P63 WeakPolarHBondContact O-CD 3.32Å; P63-Q65 PolarHBondContact O-N 3.17Å
64	S	43.4	Very low	46.4	Very low	120 Å²	120	139.7 Å²	139.7	84%	0.839	72%	0.719	S	S	*	*			trans	-66.1	69.7	159.9	165.3	0	0	0	0	108.4	Y62 G66	Y62-S64 PolarHBondContact O-N 2.91Å; S64-G66 PolarHBondContact O-N 3.42Å
65	Q	42.3	Very low	44.7	Very low	185 Å²	185	139.8 Å²	139.8	86%	0.864	73%	0.73	S	S	*	*			trans	-79.1	72	160.9	-168.3	174	11.3	0	0	107	P63	P63-Q65 PolarHBondContact O-N 3.17Å
66	G	35.2	Very low	43.7	Very low	57 Å²	57	137.4 Å²	137.4	59%	0.588	73%	0.731	S	S	*	*			trans	-113.2	89.4	174.5	0	0	0	0	0	108.9	S64 R68	S64-G66 PolarHBondContact O-N 3.42Å; G66-R68 PolarHBondContact O-N 2.89Å
67	I	45.5	Very low	43	Very low	153 Å²	153	137.1 Å²	137.1	79%	0.785	74%	0.74	S	S	*	*			trans	-11.8	113.6	158.5	-59.7	167.6	0	0	0	112.3	E69	I67-E69 HydrophobicContact CG2-CG 4.14Å
68	R	37.2	Very low	41.8	Very low	212 Å²	212	136.3 Å²	136.3	80%	0.8	75%	0.748	S	S	*	*			trans	-128.9	88.3	160.4	-156.7	179.4	-81.7	-126.7	4	108.8	G66 K70	G66-R68 PolarHBondContact O-N 2.89Å; R68-K70 PolarHBondContact O-N 2.88Å
69	E	40.3	Very low	41.1	Very low	172 Å²	172	140 Å²	140	80%	0.804	76%	0.762	S	S	*	*			trans	-47.1	119.8	160.3	-65.4	174.6	154.7	0	0	109.7	I67	I67-E69 HydrophobicContact CG2-CG 4.14Å
70	K	42.1	Very low	40.1	Very low	178 Å²	178	139 Å²	139	77%	0.774	77%	0.765	S	S	*	*			trans	-137.2	88.2	160.8	-68.6	-71.8	-177.7	174.7	0	107.2	R68	R68-K70 PolarHBondContact O-N 2.88Å
71	M	36.3	Very low	39.8	Very low	190 Å²	190	141.7 Å²	141.7	94%	0.936	78%	0.775	S	S	*	*			trans	-50.2	127.6	161.7	-146.4	103.3	148	0	0	109.8
72	S	34	Very low	39	Very low	107 Å²	107	142.2 Å²	142.2	75%	0.748	78%	0.778	S	S	*	*			trans	-168.7	90.5	152.5	-170.7	0	0	0	0	111.6
73	T	34.3	Very low	39.4	Very low	110 Å²	110	139.2 Å²	139.2	68%	0.675	78%	0.778	S	S	*	*				60.1	112.6	127.9	-40.7	0	0	0	0	121.1
74	D	31.6	Very low	39	Very low	150 Å²	150	141.2 Å²	141.2	80%	0.802	78%	0.778	S	S	*	*			trans	57.8	132.1	144.4	-54	-18.9	0	0	0	119.5
75	S	33.7	Very low	39.2	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	78%	0.778	S	S	*	*			cis	-175.4	-165.1	15.8	50.9	0	0	0	0	109.2
76	P	43.5	Very low	39.2	Very low	108 Å²	108	139.1 Å²	139.1	70%	0.701	77%	0.772	S	S	*	*				-87.3	174.3	-117.8	29.2	-7.3	0	0	0	117.4
77	P	45.2	Very low	39.8	Very low	127 Å²	127	147 Å²	147	83%	0.825	79%	0.785	S	S	*	*			trans	-86.6	128.9	-169.5	34.1	-29.9	0	0	0	111.7
78	T	35.3	Very low	39.7	Very low	136 Å²	136	146.5 Å²	146.5	83%	0.834	78%	0.783	S	S	*	*			trans	-124.7	111.3	173.6	-35.3	0	0	0	0	110.5
79	H	41.9	Very low	40.2	Very low	186 Å²	186	140.9 Å²	140.9	86%	0.861	77%	0.772	S	S	*	*			trans	-53.2	139.5	166.3	175.4	79.1	0	0	0	112.2
80	G	33.2	Very low	40.5	Very low	65 Å²	65	137.7 Å²	137.7	67%	0.67	76%	0.764	S	S	*	*			trans	167.5	105.2	167.7	0	0	0	0	0	113.1
81	Q	46.9	Very low	40.6	Very low	191 Å²	191	137.3 Å²	137.3	89%	0.893	76%	0.762	S	S	*	*			trans	-63.2	133.7	161.5	-72.2	169.5	-35.8	0	0	109.1
82	D	30.8	Very low	41.1	Very low	136 Å²	136	135.3 Å²	135.3	73%	0.727	75%	0.751	S	S	*	*			trans	-155.8	140.6	135.6	-147.7	-5.3	0	0	0	112.4	H84	D82-H84 PolarHBondContact O-N 3.44Å; D82-H84 IonicContact OD2-NE2 3.99Å
83	V	50	Low	41.6	Very low	119 Å²	119	138.6 Å²	138.6	72%	0.721	75%	0.754	S	S	*	*			trans	-83.3	107.4	-176.2	171.7	0	0	0	0	108.1
84	H	35.6	Very low	42.4	Very low	151 Å²	151	139.5 Å²	139.5	70%	0.699	75%	0.754	S	S	*	*			trans	-128.9	106.6	161.5	-75.3	-65.2	0	0	0	111	D82 T86	D82-H84 PolarHBondContact O-N 3.44Å; D82-H84 IonicContact OD2-NE2 3.99Å; H84-T86 PolarHBondContact O-N 2.81Å
85	V	49.4	Very low	43.2	Very low	139 Å²	139	135.7 Å²	135.7	84%	0.842	74%	0.739	S	S	*	*			trans	-51	98.5	166.8	179.9	0	0	0	0	108.8
86	T	40.5	Very low	44.3	Very low	121 Å²	121	139 Å²	139	74%	0.742	74%	0.739	S	S	*	*			trans	-106.3	108.6	160.5	-52.4	0	0	0	0	106.1	H84 D88	H84-T86 PolarHBondContact O-N 2.81Å; T86-D88 PolarHBondContact O-N 3.41Å
87	R	49.1	Very low	44.7	Very low	224 Å²	224	137.7 Å²	137.7	85%	0.845	73%	0.732	S	S	*	*			trans	-51.3	87.3	166.3	177.6	-170	179.9	105.8	-2.1	107.9	V89	R87-V89 VanDerWaalsContact C-N 3.33Å; R87-V89 PolarHBondContact O-N 2.75Å
88	D	43.4	Very low	44.9	Very low	141 Å²	141	136 Å²	136	75%	0.754	72%	0.717	S	S	*	*			trans	-74.4	100.2	173.8	-148.6	6.3	0	0	0	105.7	T86 V90	T86-D88 PolarHBondContact O-N 3.41Å; D88-V90 VanDerWaalsContact C-N 3.26Å; D88-V90 PolarHBondContact O-N 2.85Å
89	V	46.9	Very low	45.7	Very low	94 Å²	94	136 Å²	136	57%	0.57	71%	0.708	S	S	*	*			trans	-53.5	103.6	165	171.5	0	0	0	0	104.3	R87 K91	R87-V89 VanDerWaalsContact C-N 3.33Å; R87-V89 PolarHBondContact O-N 2.75Å; V89-K91 HydrophobicContact CG1-CG 4.04Å; V89-K91 PolarHBondContact O-N 2.7Å
90	V	47	Very low	46.2	Very low	105 Å²	105	132.8 Å²	132.8	64%	0.636	70%	0.697	S	S	*	*			trans	-60.2	85.1	167.6	-177.1	0	0	0	0	106	D88 H92	D88-V90 VanDerWaalsContact C-N 3.26Å; D88-V90 PolarHBondContact O-N 2.85Å; V90-H92 WeakPolarHBondContact CG1-CD2 3.22Å; V90-H92 WeakPolarHBondContact CG1-NE2 3.25Å; V90-H92 PolarHBondContact O-N 3.23Å
91	K	44.2	Very low	47.3	Very low	170 Å²	170	132 Å²	132	74%	0.739	68%	0.684	S	S	*	*			trans	-69.2	80.8	158.1	-75.1	-175.9	177.9	178.1	0	104.2	V89 H93	V89-K91 HydrophobicContact CG1-CG 4.04Å; V89-K91 PolarHBondContact O-N 2.7Å; K91-H93 PolarHBondContact O-N 3.48Å
92	H	46.9	Very low	47.9	Very low	149 Å²	149	128 Å²	128	69%	0.69	67%	0.669	S	S	*	*			trans	-58	91.7	152.4	-82.9	-70	0	0	0	105.2	V90 L94	V90-H92 WeakPolarHBondContact CG1-CD2 3.22Å; V90-H92 WeakPolarHBondContact CG1-NE2 3.25Å; V90-H92 PolarHBondContact O-N 3.23Å; H92-L94 PolarHBondContact O-N 3.32Å
93	H	43.4	Very low	49.6	Very low	175 Å²	175	127.3 Å²	127.3	81%	0.81	66%	0.661	S	S	*	*			trans	-59.2	90.6	150.1	-98.6	-99.5	0	0	0	104.4	K91 S95	K91-H93 PolarHBondContact O-N 3.48Å; H93-S95 PolarHBondContact O-N 2.97Å
94	L	52.7	Low	50.5	Low	130 Å²	130	125.3 Å²	125.3	68%	0.681	65%	0.652	S	S	*	*			trans	-56.1	94.9	167.7	-82.4	160.9	0	0	0	105.8	H92 K96	H92-L94 PolarHBondContact O-N 3.32Å; L94-K96 PolarHBondContact O-N 2.87Å
95	S	48	Very low	52.6	Low	69 Å²	69	122.4 Å²	122.4	48%	0.483	64%	0.639	S	S	.	*			trans	-60.9	125	173.2	-173.7	0	0	0	0	105.9	H93 S97 D98	H93-S95 PolarHBondContact O-N 2.97Å; S95-S97 PolarHBondContact O-N 3.29Å; S95-D98 PolarHBondContact O-N 3.48Å
96	K	55.8	Low	54	Low	184 Å²	184	122 Å²	122	80%	0.8	63%	0.628	S	S	*	*	H	α-helix	trans	-52.9	-17	-178.7	-65.8	178.5	177.9	179.5	0	113.2	L94	L94-K96 PolarHBondContact O-N 2.87Å
97	S	51.8	Low	56	Low	79 Å²	79	120.8 Å²	120.8	55%	0.552	62%	0.62	S	S	*	*	H	α-helix	trans	-64.7	-38.8	171.7	-174.3	0	0	0	0	114.1	S95 M99 L100 A101	S95-S97 PolarHBondContact O-N 3.29Å; S97-M99 PolarHBondContact O-N 2.78Å; S97-L100 PolarHBondContact O-N 3.2Å; S97-A101 WeakPolarHBondContact O-CB 3.37Å; S97-A101 PolarHBondContact O-N 2.78Å; S97-A101 VanDerWaalsContact O-N 3.08Å
98	D	49.8	Very low	57.6	Low	93 Å²	93	114.5 Å²	114.5	50%	0.497	60%	0.603	S	S	.	*	H	α-helix	trans	-74	-27	-176.8	-84.6	-30.3	0	0	0	112.7	S95 N102	S95-D98 PolarHBondContact O-N 3.48Å; D98-N102 VanDerWaalsContact O-CB 3.31Å; D98-N102 WeakPolarHBondContact O-CB 3.23Å; D98-N102 PolarHBondContact O-N 3.29Å; D98-N102 PolarHBondContact O-ND2 2.83Å
99	M	51.8	Low	59.8	Low	135 Å²	135	113.1 Å²	113.1	67%	0.665	59%	0.592	S	S	*	*	H	α-helix	trans	-72	-37	175.1	-72.8	-158.6	69.5	0	0	112.3	S97 Q103	S97-M99 PolarHBondContact O-N 2.78Å; M99-Q103 PolarHBondContact O-N 2.87Å; M99-Q103 VanDerWaalsContact O-N 3.08Å
100	L	54	Low	61.9	Low	119 Å²	119	112.4 Å²	112.4	62%	0.623	58%	0.583	S	S	*	*	H	α-helix	trans	-74.9	-38.9	178.1	-73.6	166.8	0	0	0	111.7	S97 Q103 S104	S97-L100 PolarHBondContact O-N 3.2Å; L100-Q103 PolarHBondContact O-N 3.48Å; L100-S104 PolarHBondContact O-N 2.94Å
101	A	56	Low	64	Low	48 Å²	48	115.3 Å²	115.3	40%	0.397	58%	0.582	S	S	.	*	H	α-helix	trans	-63.1	-44.2	173.7	0	0	0	0	0	111.3	S97 Q103 S104 Q105	S97-A101 WeakPolarHBondContact O-CB 3.37Å; S97-A101 PolarHBondContact O-N 2.78Å; S97-A101 VanDerWaalsContact O-N 3.08Å; A101-Q103 PolarHBondContact O-N 3.18Å; A101-S104 PolarHBondContact O-N 3.06Å; A101-S104 PolarHBondContact O-OG 2.96Å; A101-Q105 WeakPolarHBondContact O-CB 3.27Å; A101-Q105 PolarHBondContact O-N 2.86Å
102	N	59	Low	66.3	Low	106 Å²	106	111.3 Å²	111.3	57%	0.567	57%	0.572	S	S	*	*	H	α-helix	trans	-59.7	-44.4	173.6	-93.9	-69.5	0	0	0	112.5	D98 S104 Q105 E106	D98-N102 VanDerWaalsContact O-CB 3.31Å; D98-N102 WeakPolarHBondContact O-CB 3.23Å; D98-N102 PolarHBondContact O-N 3.29Å; D98-N102 PolarHBondContact O-ND2 2.83Å; N102-S104 VanDerWaalsContact C-N 3.33Å; N102-S104 PolarHBondContact O-N 3.26Å; N102-Q105 PolarHBondContact O-N 3.28Å; N102-E106 VanDerWaalsContact O-CB 3.23Å; N102-E106 WeakPolarHBondContact O-CB 3.45Å; N102-E106 PolarHBondContact O-N 3.5Å
103	Q	65.3	Low	68.5	Low	122 Å²	122	110.2 Å²	110.2	57%	0.57	56%	0.562	S	S	*	*	H	α-helix	trans	-63.5	-40.1	179.6	-172.1	177.1	82.5	0	0	111.8	M99 L100 A101 Q105 V107	M99-Q103 PolarHBondContact O-N 2.87Å; M99-Q103 VanDerWaalsContact O-N 3.08Å; L100-Q103 PolarHBondContact O-N 3.48Å; A101-Q103 PolarHBondContact O-N 3.18Å; Q103-Q105 VanDerWaalsContact C-N 3.35Å; Q103-V107 WeakPolarHBondContact O-CB 3.32Å; Q103-V107 WeakPolarHBondContact O-CG2 3.47Å; Q103-V107 PolarHBondContact O-N 2.97Å
104	S	69.3	Low	70.8	Confident	77 Å²	77	106.4 Å²	106.4	54%	0.538	55%	0.546	S	S	.	.	H	α-helix	trans	-66.3	-37.9	176.7	72.3	0	0	0	0	112.7	L100 A101 N102 L108	L100-S104 PolarHBondContact O-N 2.94Å; A101-S104 PolarHBondContact O-N 3.06Å; A101-S104 PolarHBondContact O-OG 2.96Å; N102-S104 VanDerWaalsContact C-N 3.33Å; N102-S104 PolarHBondContact O-N 3.26Å; S104-L108 WeakPolarHBondContact O-CB 3.47Å; S104-L108 PolarHBondContact O-N 2.94Å; S104-L108 VanDerWaalsContact O-N 3.08Å
105	Q	80.3	Confident	72.5	Confident	90 Å²	90	103 Å²	103	42%	0.421	53%	0.527	S	S	.	.	H	α-helix	trans	-69.7	-44.5	177.3	-179.6	64.1	10.4	0	0	111.2	A101 N102 Q103 V107 L108 E109	A101-Q105 WeakPolarHBondContact O-CB 3.27Å; A101-Q105 PolarHBondContact O-N 2.86Å; N102-Q105 PolarHBondContact O-N 3.28Å; Q103-Q105 VanDerWaalsContact C-N 3.35Å; Q105-V107 VanDerWaalsContact C-N 3.35Å; Q105-V107 PolarHBondContact O-N 3.28Å; Q105-L108 WeakPolarHBondContact O-CB 3.41Å; Q105-L108 PolarHBondContact O-N 3.07Å; Q105-L108 VanDerWaalsContact O-N 3.15Å; Q105-E109 WeakPolarHBondContact CG-OE1 3.42Å; Q105-E109 PolarHBondContact NE2-OE1 2.83Å; Q105-E109 WeakPolarHBondContact O-CB 3.49Å; Q105-E109 WeakPolarHBondContact O-CG 3.37Å; Q105-E109 PolarHBondContact O-N 3.42Å
106	E	78.3	Confident	74.4	Confident	131 Å²	131	106.4 Å²	106.4	61%	0.612	53%	0.533	S	S	*	.	H	α-helix	trans	-62	-40.9	176.5	-174.8	179	-163	0	0	111.4	N102 L108 E109 E110	N102-E106 VanDerWaalsContact O-CB 3.23Å; N102-E106 WeakPolarHBondContact O-CB 3.45Å; N102-E106 PolarHBondContact O-N 3.5Å; E106-L108 VanDerWaalsContact C-N 3.34Å; E106-L108 PolarHBondContact O-N 3.27Å; E106-E109 PolarHBondContact O-N 3.41Å; E106-E110 VanDerWaalsContact O-CB 3.25Å; E106-E110 WeakPolarHBondContact O-CB 3.48Å; E106-E110 PolarHBondContact O-N 3.39Å
107	V	82.8	Confident	76	Confident	95 Å²	95	100.9 Å²	100.9	58%	0.576	51%	0.512	S	S	*	.	H	α-helix	trans	-66.1	-37	174.6	170.8	0	0	0	0	111.6	Q103 Q105 R111	Q103-V107 WeakPolarHBondContact O-CB 3.32Å; Q103-V107 WeakPolarHBondContact O-CG2 3.47Å; Q103-V107 PolarHBondContact O-N 2.97Å; Q105-V107 VanDerWaalsContact C-N 3.35Å; Q105-V107 PolarHBondContact O-N 3.28Å; V107-R111 VanDerWaalsContact O-CB 3.22Å; V107-R111 WeakPolarHBondContact O-CB 3.45Å; V107-R111 PolarHBondContact O-N 3.43Å
108	L	83.9	Confident	77.7	Confident	92 Å²	92	104.3 Å²	104.3	48%	0.482	51%	0.513	S	S	.	.	H	α-helix	trans	-70	-40.9	176.3	-175.4	64.8	0	0	0	111.8	S104 Q105 E106 R111 T112	S104-L108 WeakPolarHBondContact O-CB 3.47Å; S104-L108 PolarHBondContact O-N 2.94Å; S104-L108 VanDerWaalsContact O-N 3.08Å; Q105-L108 WeakPolarHBondContact O-CB 3.41Å; Q105-L108 PolarHBondContact O-N 3.07Å; Q105-L108 VanDerWaalsContact O-N 3.15Å; E106-L108 VanDerWaalsContact C-N 3.34Å; E106-L108 PolarHBondContact O-N 3.27Å; L108-R111 PolarHBondContact O-N 3.45Å; L108-T112 WeakPolarHBondContact O-CB 3.41Å; L108-T112 PolarHBondContact O-N 3.01Å; L108-T112 PolarHBondContact O-OG1 3.46Å
109	E	89.2	Confident	79.3	Confident	113 Å²	113	107 Å²	107	53%	0.528	52%	0.516	S	S	.	.	H	α-helix	trans	-63.8	-44.6	174.2	-75	175.9	-168.5	0	0	110.9	Q105 E106 T112 R113	Q105-E109 WeakPolarHBondContact CG-OE1 3.42Å; Q105-E109 PolarHBondContact NE2-OE1 2.83Å; Q105-E109 WeakPolarHBondContact O-CB 3.49Å; Q105-E109 WeakPolarHBondContact O-CG 3.37Å; Q105-E109 PolarHBondContact O-N 3.42Å; E106-E109 PolarHBondContact O-N 3.41Å; E109-T112 CarbonylContact O-C 3.59Å; E109-T112 WeakPolarHBondContact O-CB 3.43Å; E109-T112 PolarHBondContact O-N 3.38Å; E109-T112 VanDerWaalsContact O-N 3.17Å; E109-R113 WeakPolarHBondContact O-CB 3.32Å; E109-R113 PolarHBondContact O-N 3.07Å
110	E	91	Very high	80.6	Confident	79 Å²	79	103 Å²	103	37%	0.369	50%	0.502	S	S	.	.	H	α-helix	trans	-66.2	-40.1	176.9	-173.9	57.2	-157.4	0	0	111.4	E106 T112 R113 I114	E106-E110 VanDerWaalsContact O-CB 3.25Å; E106-E110 WeakPolarHBondContact O-CB 3.48Å; E106-E110 PolarHBondContact O-N 3.39Å; E110-T112 VanDerWaalsContact C-N 3.3Å; E110-T112 PolarHBondContact O-N 2.97Å; E110-R113 WeakPolarHBondContact O-CB 3.31Å; E110-R113 PolarHBondContact O-N 2.63Å; E110-R113 IonicContact OE1-CZ 2.83Å; E110-R113 IonicContact OE1-NE 3.72Å; E110-R113 PolarHBondContact OE1-NE 3.38Å; E110-R113 IonicContact OE1-NH2 3.71Å; E110-R113 PolarHBondContact OE1-NH2 3.11Å; E110-R113 IonicContact OE2-CZ 3.54Å; E110-R113 IonicContact OE2-NE 3.38Å; E110-R113 PolarHBondContact OE2-NE 3.41Å; E110-R113 IonicContact OE2-NH2 3.58Å; E110-I114 HydrophobicContact CG-CD1 4.16Å; E110-I114 WeakPolarHBondContact O-CB 3.4Å; E110-I114 VanDerWaalsContact O-CG1 3.27Å; E110-I114 WeakPolarHBondContact O-CG1 3.45Å; E110-I114 PolarHBondContact O-N 3.01Å
111	R	90.1	Very high	81.7	Confident	166 Å²	166	104.6 Å²	104.6	63%	0.626	51%	0.505	S	S	*	.	H	α-helix	trans	-60.3	-42.6	172	-175.9	179.4	-175.1	-178.7	1.3	111.3	V107 L108 I114 Q115	V107-R111 VanDerWaalsContact O-CB 3.22Å; V107-R111 WeakPolarHBondContact O-CB 3.45Å; V107-R111 PolarHBondContact O-N 3.43Å; L108-R111 PolarHBondContact O-N 3.45Å; R111-I114 PolarHBondContact O-N 2.94Å; R111-Q115 VanDerWaalsContact O-CG 3.23Å; R111-Q115 WeakPolarHBondContact O-CG 3.46Å; R111-Q115 PolarHBondContact O-N 3.35Å
112	T	93.6	Very high	82.4	Confident	86 Å²	86	106.9 Å²	106.9	53%	0.528	52%	0.515	S	S	.	.	H	α-helix	trans	-66.4	-41.6	178.2	-58.4	0	0	0	0	110.9	L108 E109 E110 Q115 F116	L108-T112 WeakPolarHBondContact O-CB 3.41Å; L108-T112 PolarHBondContact O-N 3.01Å; L108-T112 PolarHBondContact O-OG1 3.46Å; E109-T112 CarbonylContact O-C 3.59Å; E109-T112 WeakPolarHBondContact O-CB 3.43Å; E109-T112 PolarHBondContact O-N 3.38Å; E109-T112 VanDerWaalsContact O-N 3.17Å; E110-T112 VanDerWaalsContact C-N 3.3Å; E110-T112 PolarHBondContact O-N 2.97Å; T112-Q115 PolarHBondContact O-N 2.87Å; T112-F116 WeakPolarHBondContact O-CB 3.47Å; T112-F116 PolarHBondContact O-N 3.46Å
113	R	92.6	Very high	82.5	Confident	125 Å²	125	111 Å²	111	47%	0.472	52%	0.522	S	S	.	.	H	α-helix	trans	-61.1	-47.1	175.6	-164.5	-172.4	75.2	78.1	2.2	111.3	E109 E110 Q115 F116 I117	E109-R113 WeakPolarHBondContact O-CB 3.32Å; E109-R113 PolarHBondContact O-N 3.07Å; E110-R113 WeakPolarHBondContact O-CB 3.31Å; E110-R113 PolarHBondContact O-N 2.63Å; E110-R113 IonicContact OE1-CZ 2.83Å; E110-R113 IonicContact OE1-NE 3.72Å; E110-R113 PolarHBondContact OE1-NE 3.38Å; E110-R113 IonicContact OE1-NH2 3.71Å; E110-R113 PolarHBondContact OE1-NH2 3.11Å; E110-R113 IonicContact OE2-CZ 3.54Å; E110-R113 IonicContact OE2-NE 3.38Å; E110-R113 PolarHBondContact OE2-NE 3.41Å; E110-R113 IonicContact OE2-NH2 3.58Å; R113-Q115 PolarHBondContact O-N 3.16Å; R113-F116 PolarHBondContact O-N 2.93Å; R113-I117 WeakPolarHBondContact O-CG1 3.09Å; R113-I117 PolarHBondContact O-N 3.03Å
114	I	91.5	Very high	82.4	Confident	95 Å²	95	112.8 Å²	112.8	49%	0.487	53%	0.534	S	S	.	.	H	α-helix	trans	-62.3	-43.2	177	-69.2	170	0	0	0	110.8	E110 R111 F116 I117 R118	E110-I114 HydrophobicContact CG-CD1 4.16Å; E110-I114 WeakPolarHBondContact O-CB 3.4Å; E110-I114 VanDerWaalsContact O-CG1 3.27Å; E110-I114 WeakPolarHBondContact O-CG1 3.45Å; E110-I114 PolarHBondContact O-N 3.01Å; R111-I114 PolarHBondContact O-N 2.94Å; I114-F116 PolarHBondContact O-N 3.33Å; I114-I117 PolarHBondContact O-N 3.49Å; I114-R118 WeakPolarHBondContact O-CB 3.32Å; I114-R118 PolarHBondContact O-N 3.47Å
115	Q	89.4	Confident	81.8	Confident	58 Å²	58	117.5 Å²	117.5	27%	0.271	55%	0.545	S	S	.	.	H	α-helix	trans	-62.7	-42.2	176.2	-71.4	-125.2	55.6	0	0	112	R111 T112 R113 R118 W119	R111-Q115 VanDerWaalsContact O-CG 3.23Å; R111-Q115 WeakPolarHBondContact O-CG 3.46Å; R111-Q115 PolarHBondContact O-N 3.35Å; T112-Q115 PolarHBondContact O-N 2.87Å; R113-Q115 PolarHBondContact O-N 3.16Å; Q115-R118 PolarHBondContact O-N 3.43Å; Q115-W119 WeakPolarHBondContact O-CB 3.22Å; Q115-W119 VanDerWaalsContact O-CG 3.25Å; Q115-W119 PolarHBondContact O-N 3.22Å
116	F	87.3	Confident	80.9	Confident	141 Å²	141	122 Å²	122	62%	0.618	57%	0.566	S	S	*	*	H	α-helix	trans	-61.3	-47	176.9	-177.4	-94.4	0	0	0	111.8	T112 R113 I114 R118 W119 S120	T112-F116 WeakPolarHBondContact O-CB 3.47Å; T112-F116 PolarHBondContact O-N 3.46Å; R113-F116 PolarHBondContact O-N 2.93Å; I114-F116 PolarHBondContact O-N 3.33Å; F116-R118 VanDerWaalsContact C-N 3.31Å; F116-R118 PolarHBondContact O-N 3Å; F116-W119 PolarHBondContact O-N 3.07Å; F116-S120 WeakPolarHBondContact O-CB 3.35Å; F116-S120 PolarHBondContact O-N 2.89Å; F116-S120 PolarHBondContact O-OG 3.48Å
117	I	89.1	Confident	79.8	Confident	69 Å²	69	120.7 Å²	120.7	35%	0.354	57%	0.567	S	S	.	*	H	α-helix	trans	-60.8	-41.4	175.7	-68.7	-158.4	0	0	0	111.2	R113 I114 S120 H121	R113-I117 WeakPolarHBondContact O-CG1 3.09Å; R113-I117 PolarHBondContact O-N 3.03Å; I114-I117 PolarHBondContact O-N 3.49Å; I117-S120 WeakPolarHBondContact CA-OG 3.43Å; I117-S120 PolarHBondContact O-N 3.02Å; I117-S120 PolarHBondContact O-OG 2.97Å; I117-H121 VanDerWaalsContact CG2-CE1 3.41Å; I117-H121 WeakPolarHBondContact CG2-CE1 3.28Å; I117-H121 WeakPolarHBondContact CG2-ND1 3.3Å; I117-H121 PolarHBondContact O-N 3.25Å; I117-H121 VanDerWaalsContact O-N 3.16Å; I117-H121 PolarHBondContact O-ND1 3.42Å
118	R	87.1	Confident	78.7	Confident	151 Å²	151	120.9 Å²	120.9	57%	0.57	57%	0.57	S	S	*	*	H	α-helix	trans	-64.2	-46.2	177.5	-165.6	175.1	71.2	-174	2	111.2	I114 Q115 F116 H121 T122	I114-R118 WeakPolarHBondContact O-CB 3.32Å; I114-R118 PolarHBondContact O-N 3.47Å; Q115-R118 PolarHBondContact O-N 3.43Å; F116-R118 VanDerWaalsContact C-N 3.31Å; F116-R118 PolarHBondContact O-N 3Å; R118-H121 PolarHBondContact O-N 3.23Å; R118-T122 PolarHBondContact O-N 3.12Å; R118-T122 PolarHBondContact O-OG1 3.42Å
119	W	83.8	Confident	77.4	Confident	150 Å²	150	119.4 Å²	119.4	57%	0.568	57%	0.567	S	S	*	*	H	α-helix	trans	-66.3	-34.5	178.5	-69.6	-18.8	0	0	0	113.3	Q115 F116 H121 R123	Q115-W119 WeakPolarHBondContact O-CB 3.22Å; Q115-W119 VanDerWaalsContact O-CG 3.25Å; Q115-W119 PolarHBondContact O-N 3.22Å; F116-W119 PolarHBondContact O-N 3.07Å; W119-H121 VanDerWaalsContact C-N 3.32Å; W119-R123 WeakPolarHBondContact O-CG 3.45Å; W119-R123 PolarHBondContact O-N 3.21Å
120	S	79.6	Confident	76	Confident	51 Å²	51	121.2 Å²	121.2	36%	0.357	58%	0.576	S	S	.	*	H	α-helix	trans	-68	-33.8	175.2	62.5	0	0	0	0	112.1	F116 I117	F116-S120 WeakPolarHBondContact O-CB 3.35Å; F116-S120 PolarHBondContact O-N 2.89Å; F116-S120 PolarHBondContact O-OG 3.48Å; I117-S120 WeakPolarHBondContact CA-OG 3.43Å; I117-S120 PolarHBondContact O-N 3.02Å; I117-S120 PolarHBondContact O-OG 2.97Å
121	H	76.3	Confident	74.5	Confident	151 Å²	151	123.8 Å²	123.8	70%	0.699	59%	0.589	S	S	*	*	H	α-helix	trans	-77.3	-29.4	176.8	-70.3	129.1	0	0	0	113.6	I117 R118 W119	I117-H121 VanDerWaalsContact CG2-CE1 3.41Å; I117-H121 WeakPolarHBondContact CG2-CE1 3.28Å; I117-H121 WeakPolarHBondContact CG2-ND1 3.3Å; I117-H121 PolarHBondContact O-N 3.25Å; I117-H121 VanDerWaalsContact O-N 3.16Å; I117-H121 PolarHBondContact O-ND1 3.42Å; R118-H121 PolarHBondContact O-N 3.23Å; W119-H121 VanDerWaalsContact C-N 3.32Å
122	T	70.3	Confident	73.3	Confident	97 Å²	97	119 Å²	119	60%	0.595	58%	0.579	S	S	*	*	S	Bend	trans	-92.9	0.8	176.1	60.2	0	0	0	0	113.4	R118 I124	R118-T122 PolarHBondContact O-N 3.12Å; R118-T122 PolarHBondContact O-OG1 3.42Å; T122-I124 PolarHBondContact O-N 3Å
123	R	62.7	Low	72.2	Confident	193 Å²	193	119 Å²	119	73%	0.728	57%	0.573	S	S	*	*			trans	-67.4	106.5	170.3	-97	-172.1	-173.2	-173	3.7	108.1	W119 F125	W119-R123 WeakPolarHBondContact O-CG 3.45Å; W119-R123 PolarHBondContact O-N 3.21Å; R123-F125 PolarHBondContact O-N 2.8Å
124	I	61.9	Low	71.5	Confident	158 Å²	158	117.3 Å²	117.3	81%	0.81	57%	0.573	S	S	*	*			trans	-65.7	104	170.9	-58	175.8	0	0	0	106.5	T122 Q126	T122-I124 PolarHBondContact O-N 3Å; I124-Q126 PolarHBondContact O-N 2.93Å
125	F	57.5	Low	70.9	Confident	177 Å²	177	117 Å²	117	78%	0.776	57%	0.571	S	S	*	*			trans	-60.9	117.4	157.9	-72.2	-90.7	0	0	0	105.8	R123 V127	R123-F125 PolarHBondContact O-N 2.8Å; F125-V127 VanDerWaalsContact C-N 3.32Å; F125-V127 PolarHBondContact O-N 2.89Å
126	Q	61.3	Low	70.5	Confident	184 Å²	184	119.3 Å²	119.3	86%	0.86	58%	0.583	S	S	*	*			trans	-59.9	106.3	164.5	-67.5	-175.5	32.2	0	0	105.8	I124 P128	I124-Q126 PolarHBondContact O-N 2.93Å; Q126-P128 WeakPolarHBondContact O-CD 3.43Å
127	V	55.3	Low	70.3	Confident	104 Å²	104	120 Å²	120	63%	0.63	58%	0.582	S	S	*	*			trans	-62.2	125.2	174.5	176.5	0	0	0	0	106.3	F125 S129	F125-V127 VanDerWaalsContact C-N 3.32Å; F125-V127 PolarHBondContact O-N 2.89Å; V127-S129 PolarHBondContact O-N 2.63Å
128	P	58.1	Low	70.2	Confident	98 Å²	98	121.4 Å²	121.4	64%	0.636	59%	0.59	S	S	*	*			trans	-53.1	133.7	175.8	-26.1	34.5	0	0	0	111	Q126 E130	Q126-P128 WeakPolarHBondContact O-CD 3.43Å; P128-E130 PolarHBondContact O-N 2.75Å
129	S	57.8	Low	70.2	Confident	61 Å²	61	122.6 Å²	122.6	43%	0.427	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-49.6	-23.5	-172.9	-165.2	0	0	0	0	115.5	V127 M131 T132 E133	V127-S129 PolarHBondContact O-N 2.63Å; S129-M131 PolarHBondContact O-N 2.95Å; S129-T132 WeakPolarHBondContact CA-OG1 3.48Å; S129-T132 PolarHBondContact O-N 3.34Å; S129-T132 VanDerWaalsContact O-N 3.07Å; S129-T132 PolarHBondContact O-OG1 3.02Å; S129-E133 WeakPolarHBondContact CB-OE1 3.49Å; S129-E133 WeakPolarHBondContact O-CG 3.29Å; S129-E133 PolarHBondContact O-N 3.45Å; S129-E133 PolarHBondContact OG-OE1 3.36Å
130	E	59	Low	70.6	Confident	151 Å²	151	120.6 Å²	120.6	71%	0.706	59%	0.594	S	S	*	*	H	α-helix	trans	-56	-44.6	-171	-78.2	177	148.7	0	0	113.3	P128 T132 D134	P128-E130 PolarHBondContact O-N 2.75Å; E130-T132 PolarHBondContact O-N 2.95Å; E130-D134 PolarHBondContact O-N 3.34Å
131	M	60.5	Low	71	Confident	134 Å²	134	121.3 Å²	121.3	66%	0.66	59%	0.592	S	S	*	*	H	α-helix	trans	-74.3	-29.3	-179.8	-173.6	162.7	164.3	0	0	112.7	S129 I135	S129-M131 PolarHBondContact O-N 2.95Å; M131-I135 HydrophobicContact CE-CD1 4.38Å; M131-I135 HydrophobicContact CG-CD1 4.08Å; M131-I135 VanDerWaalsContact O-CD1 3.29Å; M131-I135 WeakPolarHBondContact O-CD1 3.43Å; M131-I135 WeakPolarHBondContact O-CG1 3.28Å; M131-I135 PolarHBondContact O-N 3.5Å
132	T	65.3	Low	71.7	Confident	65 Å²	65	119.9 Å²	119.9	40%	0.399	59%	0.585	S	S	.	*	H	α-helix	trans	-74.6	-35.4	177	49.5	0	0	0	0	112.5	S129 E130 M136	S129-T132 WeakPolarHBondContact CA-OG1 3.48Å; S129-T132 PolarHBondContact O-N 3.34Å; S129-T132 VanDerWaalsContact O-N 3.07Å; S129-T132 PolarHBondContact O-OG1 3.02Å; E130-T132 PolarHBondContact O-N 2.95Å; T132-M136 WeakPolarHBondContact O-CB 3.41Å; T132-M136 VanDerWaalsContact O-CG 3.28Å; T132-M136 WeakPolarHBondContact O-CG 3.43Å; T132-M136 PolarHBondContact O-N 3.31Å
133	E	70.4	Confident	72.6	Confident	86 Å²	86	119.1 Å²	119.1	40%	0.402	58%	0.58	S	S	.	*	H	α-helix	trans	-66	-41.1	177	-75.1	175.8	-153.8	0	0	111.9	S129 M136 R137	S129-E133 WeakPolarHBondContact CB-OE1 3.49Å; S129-E133 WeakPolarHBondContact O-CG 3.29Å; S129-E133 PolarHBondContact O-N 3.45Å; S129-E133 PolarHBondContact OG-OE1 3.36Å; E133-M136 HydrophobicContact CG-CE 4.35Å; E133-M136 PolarHBondContact O-N 3.09Å; E133-R137 WeakPolarHBondContact O-CB 3.33Å; E133-R137 WeakPolarHBondContact O-CG 3.21Å; E133-R137 PolarHBondContact O-N 3.28Å
134	D	76.2	Confident	73.7	Confident	89 Å²	89	117.2 Å²	117.2	48%	0.476	57%	0.573	S	S	.	*	H	α-helix	trans	-68.6	-39.2	177.9	-70.5	-21.7	0	0	0	112.3	E130 R137 D138	E130-D134 PolarHBondContact O-N 3.34Å; D134-R137 PolarHBondContact O-N 2.85Å; D134-R137 IonicContact OD1-CZ 2.79Å; D134-R137 IonicContact OD1-NE 2.7Å; D134-R137 IonicContact OD1-NH2 3.98Å; D134-R137 PolarHBondContact OD1-NH2 2.95Å; D134-D138 WeakPolarHBondContact O-CB 3.35Å; D134-D138 PolarHBondContact O-N 2.91Å
135	I	80.6	Confident	74.8	Confident	89 Å²	89	115.8 Å²	115.8	46%	0.456	56%	0.558	S	S	.	*	H	α-helix	trans	-64.3	-41.5	173.1	-66.7	164.9	0	0	0	110.9	M131 D138 R139	M131-I135 HydrophobicContact CE-CD1 4.38Å; M131-I135 HydrophobicContact CG-CD1 4.08Å; M131-I135 VanDerWaalsContact O-CD1 3.29Å; M131-I135 WeakPolarHBondContact O-CD1 3.43Å; M131-I135 WeakPolarHBondContact O-CG1 3.28Å; M131-I135 PolarHBondContact O-N 3.5Å; I135-D138 PolarHBondContact O-N 3.07Å; I135-R139 WeakPolarHBondContact O-CG 3.35Å; I135-R139 PolarHBondContact O-N 3.27Å
136	M	80.6	Confident	76	Confident	106 Å²	106	109.7 Å²	109.7	52%	0.522	54%	0.537	S	S	.	.	H	α-helix	trans	-65.6	-41.7	176.5	-74.7	-171.6	-68	0	0	111.8	T132 E133 R139 I140	T132-M136 WeakPolarHBondContact O-CB 3.41Å; T132-M136 VanDerWaalsContact O-CG 3.28Å; T132-M136 WeakPolarHBondContact O-CG 3.43Å; T132-M136 PolarHBondContact O-N 3.31Å; E133-M136 HydrophobicContact CG-CE 4.35Å; E133-M136 PolarHBondContact O-N 3.09Å; M136-R139 PolarHBondContact O-N 2.92Å; M136-I140 VanDerWaalsContact O-CG1 3.28Å; M136-I140 WeakPolarHBondContact O-CG1 3.28Å; M136-I140 PolarHBondContact O-N 3Å
137	R	83.5	Confident	76.9	Confident	156 Å²	156	105.8 Å²	105.8	59%	0.589	52%	0.521	S	S	*	.	H	α-helix	trans	-62	-43.7	174.7	-79.6	-164.7	-78	-148.8	-2.5	111.9	E133 D134 R139 I140 E141	E133-R137 WeakPolarHBondContact O-CB 3.33Å; E133-R137 WeakPolarHBondContact O-CG 3.21Å; E133-R137 PolarHBondContact O-N 3.28Å; D134-R137 PolarHBondContact O-N 2.85Å; D134-R137 IonicContact OD1-CZ 2.79Å; D134-R137 IonicContact OD1-NE 2.7Å; D134-R137 IonicContact OD1-NH2 3.98Å; D134-R137 PolarHBondContact OD1-NH2 2.95Å; R137-R139 PolarHBondContact O-N 3.48Å; R137-I140 PolarHBondContact O-N 3.45Å; R137-E141 WeakPolarHBondContact O-CB 3.5Å; R137-E141 PolarHBondContact O-N 2.82Å
138	D	87.2	Confident	77.9	Confident	99 Å²	99	103.8 Å²	103.8	53%	0.529	51%	0.512	S	S	.	.	H	α-helix	trans	-64.2	-40.6	178.4	-168	49.7	0	0	0	111.8	D134 I135 I140 E141 Q142	D134-D138 WeakPolarHBondContact O-CB 3.35Å; D134-D138 PolarHBondContact O-N 2.91Å; I135-D138 PolarHBondContact O-N 3.07Å; D138-I140 PolarHBondContact O-N 3.48Å; D138-E141 PolarHBondContact O-N 2.89Å; D138-Q142 WeakPolarHBondContact O-CB 3.41Å; D138-Q142 PolarHBondContact O-N 3.27Å
139	R	87	Confident	78.4	Confident	176 Å²	176	106.7 Å²	106.7	66%	0.664	51%	0.51	S	S	*	.	H	α-helix	trans	-63.2	-42	174.1	-71.4	-177.6	96	-161.6	6.9	112.6	I135 M136 R137 E141 Q142 V143	I135-R139 WeakPolarHBondContact O-CG 3.35Å; I135-R139 PolarHBondContact O-N 3.27Å; M136-R139 PolarHBondContact O-N 2.92Å; R137-R139 PolarHBondContact O-N 3.48Å; R139-E141 VanDerWaalsContact C-N 3.33Å; R139-Q142 PolarHBondContact O-N 3.28Å; R139-V143 WeakPolarHBondContact O-CG2 3.42Å; R139-V143 PolarHBondContact O-N 3.37Å; R139-V143 VanDerWaalsContact O-N 3.09Å
140	I	90.8	Very high	78.8	Confident	108 Å²	108	109.6 Å²	109.6	55%	0.554	52%	0.52	S	S	*	.	H	α-helix	trans	-63.1	-43	176.1	-70.1	164.1	0	0	0	110.3	M136 R137 D138 V143 R144	M136-I140 VanDerWaalsContact O-CG1 3.28Å; M136-I140 WeakPolarHBondContact O-CG1 3.28Å; M136-I140 PolarHBondContact O-N 3Å; R137-I140 PolarHBondContact O-N 3.45Å; D138-I140 PolarHBondContact O-N 3.48Å; I140-V143 PolarHBondContact O-N 2.79Å; I140-R144 PolarHBondContact O-N 3.39Å
141	E	89.6	Confident	79	Confident	65 Å²	65	104.7 Å²	104.7	30%	0.304	51%	0.505	S	S	.	.	H	α-helix	trans	-71	-34.4	-179.1	-166	59	-151.4	0	0	112	R137 D138 R139 R144 R145	R137-E141 WeakPolarHBondContact O-CB 3.5Å; R137-E141 PolarHBondContact O-N 2.82Å; D138-E141 PolarHBondContact O-N 2.89Å; R139-E141 VanDerWaalsContact C-N 3.33Å; E141-R144 PolarHBondContact O-N 3.06Å; E141-R144 IonicContact OE2-NH1 3.23Å; E141-R145 VanDerWaalsContact CG-CZ 3.43Å; E141-R145 WeakPolarHBondContact O-CG 3.4Å; E141-R145 PolarHBondContact O-N 2.99Å; E141-R145 IonicContact OE1-CZ 3.84Å; E141-R145 IonicContact OE1-NH2 3.87Å
142	Q	90.1	Very high	78.9	Confident	121 Å²	121	103.6 Å²	103.6	57%	0.565	50%	0.502	S	S	*	.	H	α-helix	trans	-61.3	-43.1	171.5	-173.1	-178.8	7	0	0	111.8	D138 R139 R145 S146	D138-Q142 WeakPolarHBondContact O-CB 3.41Å; D138-Q142 PolarHBondContact O-N 3.27Å; R139-Q142 PolarHBondContact O-N 3.28Å; Q142-R145 PolarHBondContact O-N 2.86Å; Q142-S146 PolarHBondContact O-N 3.26Å
143	V	88.6	Confident	78.5	Confident	81 Å²	81	104.3 Å²	104.3	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-66.1	-40.7	175.1	171.4	0	0	0	0	111	R139 I140 R145 S146 I147	R139-V143 WeakPolarHBondContact O-CG2 3.42Å; R139-V143 PolarHBondContact O-N 3.37Å; R139-V143 VanDerWaalsContact O-N 3.09Å; I140-V143 PolarHBondContact O-N 2.79Å; V143-R145 VanDerWaalsContact C-N 3.35Å; V143-R145 PolarHBondContact O-N 3.47Å; V143-S146 PolarHBondContact O-N 2.98Å; V143-S146 PolarHBondContact O-OG 2.93Å; V143-I147 HydrophobicContact CG1-CD1 3.71Å; V143-I147 HydrophobicContact CG1-CG1 4.38Å; V143-I147 VanDerWaalsContact O-CG1 3.3Å; V143-I147 WeakPolarHBondContact O-CG1 3.3Å; V143-I147 PolarHBondContact O-N 3.12Å
144	R	86.6	Confident	77.8	Confident	153 Å²	153	103.1 Å²	103.1	58%	0.577	51%	0.507	S	S	*	.	H	α-helix	trans	-59.5	-46.4	175.4	-165.5	-179.4	-126	133.5	1.8	111.3	I140 E141 S146 I147 S148	I140-R144 PolarHBondContact O-N 3.39Å; E141-R144 PolarHBondContact O-N 3.06Å; E141-R144 IonicContact OE2-NH1 3.23Å; R144-S146 PolarHBondContact O-N 3.44Å; R144-I147 PolarHBondContact O-N 3.3Å; R144-S148 PolarHBondContact O-N 3.34Å; R144-S148 PolarHBondContact O-OG 3.36Å; R144-S148 VanDerWaalsContact O-OG 3.12Å
145	R	84	Confident	76.8	Confident	129 Å²	129	101.9 Å²	101.9	49%	0.487	51%	0.51	S	S	.	.	H	α-helix	trans	-66.9	-31	176.8	-69.9	-176.8	-169.2	110.9	3.1	113.9	E141 Q142 V143 R149	E141-R145 VanDerWaalsContact CG-CZ 3.43Å; E141-R145 WeakPolarHBondContact O-CG 3.4Å; E141-R145 PolarHBondContact O-N 2.99Å; E141-R145 IonicContact OE1-CZ 3.84Å; E141-R145 IonicContact OE1-NH2 3.87Å; Q142-R145 PolarHBondContact O-N 2.86Å; V143-R145 VanDerWaalsContact C-N 3.35Å; V143-R145 PolarHBondContact O-N 3.47Å; R145-R149 WeakPolarHBondContact O-CG 3.27Å; R145-R149 PolarHBondContact O-N 2.72Å; R145-R149 PolarHBondContact O-NE 3.48Å; R145-R149 VanDerWaalsContact O-NE 3.07Å
146	S	82.8	Confident	75.5	Confident	49 Å²	49	104.1 Å²	104.1	34%	0.343	52%	0.518	S	S	.	.	H	α-helix	trans	-71.2	-42.4	174.4	67.1	0	0	0	0	111.2	Q142 V143 R144 R149 L150	Q142-S146 PolarHBondContact O-N 3.26Å; V143-S146 PolarHBondContact O-N 2.98Å; V143-S146 PolarHBondContact O-OG 2.93Å; R144-S146 PolarHBondContact O-N 3.44Å; S146-R149 PolarHBondContact O-N 3.43Å; S146-L150 WeakPolarHBondContact O-CG 3.45Å; S146-L150 PolarHBondContact O-N 2.94Å
147	I	81.8	Confident	74	Confident	102 Å²	102	104.7 Å²	104.7	52%	0.523	52%	0.523	S	S	.	.	H	α-helix	trans	-65.2	-43.7	177.3	-65.9	169.1	0	0	0	111.1	V143 R144 R149 L150 A151	V143-I147 HydrophobicContact CG1-CD1 3.71Å; V143-I147 HydrophobicContact CG1-CG1 4.38Å; V143-I147 VanDerWaalsContact O-CG1 3.3Å; V143-I147 WeakPolarHBondContact O-CG1 3.3Å; V143-I147 PolarHBondContact O-N 3.12Å; R144-I147 PolarHBondContact O-N 3.3Å; I147-R149 VanDerWaalsContact C-N 3.31Å; I147-R149 PolarHBondContact O-N 2.98Å; I147-L150 PolarHBondContact O-N 3.16Å; I147-L150 VanDerWaalsContact O-N 3.16Å; I147-A151 PolarHBondContact O-N 3.07Å
148	S	74.8	Confident	72.5	Confident	62 Å²	62	106 Å²	106	43%	0.434	53%	0.533	S	S	.	.	H	α-helix	trans	-59	-41.3	176	-65	0	0	0	0	112.3	R144 L150 A151 D152	R144-S148 PolarHBondContact O-N 3.34Å; R144-S148 PolarHBondContact O-OG 3.36Å; R144-S148 VanDerWaalsContact O-OG 3.12Å; S148-L150 PolarHBondContact O-N 3.1Å; S148-A151 PolarHBondContact O-N 3.26Å; S148-D152 PolarHBondContact O-N 2.88Å
149	R	69.8	Low	70.8	Confident	159 Å²	159	106 Å²	106	60%	0.6	54%	0.541	S	S	*	.	H	α-helix	trans	-66.4	-35.6	175.8	-75.4	-178.3	-74.6	-159.8	2.1	113.1	R145 S146 I147 V153	R145-R149 WeakPolarHBondContact O-CG 3.27Å; R145-R149 PolarHBondContact O-N 2.72Å; R145-R149 PolarHBondContact O-NE 3.48Å; R145-R149 VanDerWaalsContact O-NE 3.07Å; S146-R149 PolarHBondContact O-N 3.43Å; I147-R149 VanDerWaalsContact C-N 3.31Å; I147-R149 PolarHBondContact O-N 2.98Å; R149-V153 VanDerWaalsContact O-CG2 3.27Å; R149-V153 WeakPolarHBondContact O-CG2 3.37Å; R149-V153 PolarHBondContact O-N 3.31Å; R149-V153 VanDerWaalsContact O-N 3.1Å
150	L	66.8	Low	69	Low	121 Å²	121	105 Å²	105	63%	0.634	55%	0.546	S	S	*	.	H	α-helix	trans	-69	-37	173.9	-69.7	169.2	0	0	0	111.8	S146 I147 S148 S154	S146-L150 WeakPolarHBondContact O-CG 3.45Å; S146-L150 PolarHBondContact O-N 2.94Å; I147-L150 PolarHBondContact O-N 3.16Å; I147-L150 VanDerWaalsContact O-N 3.16Å; S148-L150 PolarHBondContact O-N 3.1Å; L150-S154 WeakPolarHBondContact O-CB 3.39Å; L150-S154 PolarHBondContact O-N 2.96Å
151	A	62.7	Low	67	Low	49 Å²	49	110.5 Å²	110.5	41%	0.405	56%	0.56	S	S	.	*	H	α-helix	trans	-65	-42.8	175.2	0	0	0	0	0	111.6	I147 S148 S154 A155	I147-A151 PolarHBondContact O-N 3.07Å; S148-A151 PolarHBondContact O-N 3.26Å; A151-S154 PolarHBondContact O-N 3.38Å; A151-S154 PolarHBondContact O-OG 3.28Å; A151-A155 PolarHBondContact O-N 3.39Å
152	D	57.8	Low	65.1	Low	111 Å²	111	111.7 Å²	111.7	59%	0.594	57%	0.573	S	S	*	*	H	α-helix	trans	-64.5	-41.9	176.4	-72.6	-25.3	0	0	0	112.4	S148 S154 A155 Q156	S148-D152 PolarHBondContact O-N 2.88Å; D152-S154 VanDerWaalsContact C-N 3.35Å; D152-A155 PolarHBondContact O-N 3.48Å; D152-Q156 WeakPolarHBondContact O-CB 3.43Å; D152-Q156 PolarHBondContact O-N 3.38Å
153	V	56.9	Low	63.2	Low	79 Å²	79	111.7 Å²	111.7	48%	0.479	59%	0.587	S	S	.	*	H	α-helix	trans	-64.2	-40.2	174.8	173.1	0	0	0	0	111	R149 A155 Q156 D157	R149-V153 VanDerWaalsContact O-CG2 3.27Å; R149-V153 WeakPolarHBondContact O-CG2 3.37Å; R149-V153 PolarHBondContact O-N 3.31Å; R149-V153 VanDerWaalsContact O-N 3.1Å; V153-A155 VanDerWaalsContact C-N 3.34Å; V153-A155 PolarHBondContact O-N 3.01Å; V153-Q156 PolarHBondContact O-N 3.18Å; V153-D157 PolarHBondContact O-N 3.44Å
154	S	55	Low	61.6	Low	61 Å²	61	117.4 Å²	117.4	43%	0.427	60%	0.601	S	S	.	*	H	α-helix	trans	-64.1	-37.8	175.8	79.5	0	0	0	0	112.6	L150 A151 D152 Q156 F158	L150-S154 WeakPolarHBondContact O-CB 3.39Å; L150-S154 PolarHBondContact O-N 2.96Å; A151-S154 PolarHBondContact O-N 3.38Å; A151-S154 PolarHBondContact O-OG 3.28Å; D152-S154 VanDerWaalsContact C-N 3.35Å; S154-Q156 VanDerWaalsContact C-N 3.32Å; S154-F158 VanDerWaalsContact O-CD2 3.29Å; S154-F158 WeakPolarHBondContact O-CD2 3.48Å; S154-F158 PolarHBondContact O-N 3.29Å
155	A	55.3	Low	59.9	Low	64 Å²	64	115.1 Å²	115.1	53%	0.529	61%	0.608	S	S	.	*	H	α-helix	trans	-70.3	-30.4	176.9	0	0	0	0	0	112.1	A151 D152 V153	A151-A155 PolarHBondContact O-N 3.39Å; D152-A155 PolarHBondContact O-N 3.48Å; V153-A155 VanDerWaalsContact C-N 3.34Å; V153-A155 PolarHBondContact O-N 3.01Å
156	Q	53.3	Low	58.1	Low	136 Å²	136	116.2 Å²	116.2	64%	0.636	62%	0.624	S	S	*	*	H	α-helix	trans	-76.3	-34.2	177.7	-157.5	158.9	30.7	0	0	112.4	D152 V153 S154 F158 S159 M160	D152-Q156 WeakPolarHBondContact O-CB 3.43Å; D152-Q156 PolarHBondContact O-N 3.38Å; V153-Q156 PolarHBondContact O-N 3.18Å; S154-Q156 VanDerWaalsContact C-N 3.32Å; Q156-F158 VanDerWaalsContact C-N 3.35Å; Q156-F158 PolarHBondContact O-N 2.98Å; Q156-S159 WeakPolarHBondContact O-CB 3.29Å; Q156-S159 PolarHBondContact O-N 3.22Å; Q156-M160 PolarHBondContact O-N 3.02Å
157	D	49.2	Very low	56.1	Low	118 Å²	118	123.5 Å²	123.5	63%	0.631	67%	0.673	S	S	*	*	H	α-helix	trans	-69	-28.6	175.3	-77	-24.7	0	0	0	113.1	V153 S159	V153-D157 PolarHBondContact O-N 3.44Å; D157-S159 VanDerWaalsContact C-N 3.31Å
158	F	52.8	Low	54.8	Low	182 Å²	182	124.6 Å²	124.6	80%	0.798	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-19.8	171.7	-85.7	-75.6	0	0	0	113.8	S154 Q156	S154-F158 VanDerWaalsContact O-CD2 3.29Å; S154-F158 WeakPolarHBondContact O-CD2 3.48Å; S154-F158 PolarHBondContact O-N 3.29Å; Q156-F158 VanDerWaalsContact C-N 3.35Å; Q156-F158 PolarHBondContact O-N 2.98Å
159	S	51.4	Low	53.8	Low	99 Å²	99	127.9 Å²	127.9	69%	0.692	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-27	178.3	179.9	0	0	0	0	112.5	Q156 D157 R161	Q156-S159 WeakPolarHBondContact O-CB 3.29Å; Q156-S159 PolarHBondContact O-N 3.22Å; D157-S159 VanDerWaalsContact C-N 3.31Å; S159-R161 VanDerWaalsContact C-N 3.34Å; S159-R161 PolarHBondContact O-N 2.91Å
160	M	49.6	Very low	52.9	Low	156 Å²	156	126.2 Å²	126.2	77%	0.768	70%	0.698	S	S	*	*			trans	-92.3	55.4	179.1	-76.2	-76.7	-174.4	0	0	112	Q156 P162	Q156-M160 PolarHBondContact O-N 3.02Å; M160-P162 WeakPolarHBondContact O-CD 3.5Å
161	R	48.1	Very low	52.1	Low	223 Å²	223	126.5 Å²	126.5	84%	0.842	70%	0.702	S	S	*	*			trans	-92.2	111.9	162.7	-161.4	175.8	-160.4	175	4.6	108	S159 S163	S159-R161 VanDerWaalsContact C-N 3.34Å; S159-R161 PolarHBondContact O-N 2.91Å; R161-S163 PolarHBondContact O-N 3.29Å; R161-S163 VanDerWaalsContact O-N 3.15Å
162	P	50	Low	51.4	Low	90 Å²	90	131.3 Å²	131.3	58%	0.584	72%	0.721	S	S	*	*			trans	-68.5	116.6	172.9	11.3	-1.8	0	0	0	107.9	M160 Y164	M160-P162 WeakPolarHBondContact O-CD 3.5Å; P162-Y164 VanDerWaalsContact C-N 3.27Å; P162-Y164 HydrophobicContact CB-CD2 4.08Å; P162-Y164 HydrophobicContact CB-CE2 3.89Å; P162-Y164 HydrophobicContact CG-CD2 4.39Å; P162-Y164 HydrophobicContact CG-CE2 4.01Å; P162-Y164 PolarHBondContact O-N 3.23Å
163	S	50	Low	51	Low	122 Å²	122	132.7 Å²	132.7	85%	0.853	73%	0.729	S	S	*	*			trans	-63	92.3	163.7	-88	0	0	0	0	108.4	R161 S165	R161-S163 PolarHBondContact O-N 3.29Å; R161-S163 VanDerWaalsContact O-N 3.15Å; S163-S165 PolarHBondContact O-N 3.15Å
164	Y	55.8	Low	50.6	Low	201 Å²	201	136.5 Å²	136.5	79%	0.788	75%	0.747	S	S	*	*			trans	-77.1	101	157.2	-77.5	-84.5	0	0	0	107.2	P162	P162-Y164 VanDerWaalsContact C-N 3.27Å; P162-Y164 HydrophobicContact CB-CD2 4.08Å; P162-Y164 HydrophobicContact CB-CE2 3.89Å; P162-Y164 HydrophobicContact CG-CD2 4.39Å; P162-Y164 HydrophobicContact CG-CE2 4.01Å; P162-Y164 PolarHBondContact O-N 3.23Å
165	S	50.6	Low	50.2	Low	104 Å²	104	142.3 Å²	142.3	73%	0.727	77%	0.772	S	S	*	*			trans	-123.7	80.6	167.6	174.5	0	0	0	0	107.1	S163	S163-S165 PolarHBondContact O-N 3.15Å
166	D	44.8	Very low	49.8	Very low	153 Å²	153	148.8 Å²	148.8	82%	0.818	79%	0.792	S	S	*	*			trans	-94.6	110.6	166.1	-75	-34	0	0	0	108.5
167	C	42.2	Very low	49.5	Very low	202 Å²	202	150 Å²	150	100%	1.365	81%	0.806	S	S	*	*			trans	-132.7	0	155.7	-84.2	0	0	0	0	107.2

Retrieved 167 of 167 residues in 79.4 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).