A0A077ZI49_TRITR Loading...

Ribosomal S18 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZI49, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 134 aa.

						>A0A077ZI49_TRITR|A0A077ZI49
MGLLSKVHGELVQSDRAERLIPSNGPSKACPLCRLGLELSFMDVLILRQFMRNDGTVLPQRITGLCNRQQMIVERLVMQAHWSGLFPTLKPNDFDYKEASEGYKKYNRYWKSHTDMYSKKITVKPGSFYYIKRY
					

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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	52.6	Low	82.9	Confident	243 Å²	243	152.5 Å²	152.5	100%	1.197	86%	0.858	S	S	*	*				0	112.8	0	-73.2	-156.6	-116.3	0	0	107.7
2	G	61.4	Low	83.7	Confident	77 Å²	77	149.6 Å²	149.6	79%	0.794	85%	0.846	S	S	*	*			trans	-65.9	131.1	-172.9	0	0	0	0	0	111.7	L4	G2-L4 PolarHBondContact O-N 3.06Å
3	L	71.7	Confident	84.2	Confident	176 Å²	176	150.5 Å²	150.5	92%	0.921	84%	0.839	S	S	*	*			trans	-63.6	103.5	175.3	-78.9	151.7	0	0	0	109.4
4	L	79.8	Confident	84.4	Confident	163 Å²	163	144.1 Å²	144.1	85%	0.853	81%	0.809	S	S	*	*			trans	-92.4	104	176.3	-143	162.9	0	0	0	108.3	G2	G2-L4 PolarHBondContact O-N 3.06Å
5	S	85.3	Confident	84.5	Confident	106 Å²	106	145.2 Å²	145.2	74%	0.741	81%	0.812	S	S	*	*			trans	-90.2	116.2	178	-57.7	0	0	0	0	110
6	K	89	Confident	84.6	Confident	194 Å²	194	140 Å²	140	84%	0.843	78%	0.776	S	S	*	*			trans	-100.9	115.2	179.2	-160.2	175.6	-177.2	-178.9	0	110.1
7	V	93.7	Very high	84.7	Confident	140 Å²	140	134.1 Å²	134.1	85%	0.848	75%	0.749	S	S	*	*			trans	-100.5	130.2	176.8	-176.2	0	0	0	0	108.6
8	H	93.9	Very high	84.8	Confident	163 Å²	163	137.2 Å²	137.2	76%	0.755	76%	0.757	S	S	*	*			trans	-132	157.4	172.7	68.5	-74.9	0	0	0	109.5
9	G	94.5	Very high	85	Confident	78 Å²	78	140.4 Å²	140.4	80%	0.804	76%	0.757	S	S	*	*			trans	-120.2	143.4	176.7	0	0	0	0	0	110.4
10	E	95.8	Very high	85.1	Confident	159 Å²	159	137.5 Å²	137.5	74%	0.743	74%	0.74	S	S	*	*			trans	-120.2	138.1	176.3	-173.8	176.5	179.9	0	0	109.5	V12	E10-V12 HydrophobicContact CG-CG2 4.34Å; E10-V12 PolarHBondContact O-N 3.39Å
11	L	94.2	Very high	85.2	Confident	179 Å²	179	132.5 Å²	132.5	94%	0.937	71%	0.713	S	S	*	*			trans	-83.3	107.2	174	-66.9	175	0	0	0	108.9
12	V	93	Very high	86.7	Confident	117 Å²	117	125.2 Å²	125.2	71%	0.709	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-103.8	134.6	177.7	-176.5	0	0	0	0	109.7	E10	E10-V12 HydrophobicContact CG-CG2 4.34Å; E10-V12 PolarHBondContact O-N 3.39Å
13	Q	90.2	Very high	87.5	Confident	162 Å²	162	125.3 Å²	125.3	76%	0.757	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-70.9	139.5	175.1	-164.2	177.3	9.1	0	0	110.3	A17	Q13-A17 HydrophobicContact CG-CB 4.39Å
14	S	86.2	Confident	87.7	Confident	60 Å²	60	123.6 Å²	123.6	42%	0.42	66%	0.664	S	S	.	*	P	Polyproline II helix	trans	-69.8	132	177.1	171.1	0	0	0	0	111.4	R16 A17	S14-R16 PolarHBondContact O-N 2.97Å; S14-R16 PolarHBondContact OG-N 3.4Å; S14-R16 VanDerWaalsContact OG-N 3.15Å; S14-A17 VanDerWaalsContact O-CB 3.26Å; S14-A17 WeakPolarHBondContact O-CB 3.26Å; S14-A17 PolarHBondContact O-N 2.98Å
15	D	86.1	Confident	87.6	Confident	161 Å²	161	117.5 Å²	117.5	86%	0.861	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.7	-19.3	171	-47.3	-18.7	0	0	0	113.4
16	R	86.1	Confident	87.3	Confident	62 Å²	62	119.3 Å²	119.3	23%	0.234	65%	0.65	C	S	.	*	T	Hydrogen-bonded Turn	trans	-90.8	-6.8	-178.5	-66.9	175.8	-97.5	177.3	-5.9	113	S14 E18 R19 L20 R48 M51 N53	S14-R16 PolarHBondContact O-N 2.97Å; S14-R16 PolarHBondContact OG-N 3.4Å; S14-R16 VanDerWaalsContact OG-N 3.15Å; R16-E18 PolarHBondContact O-N 3.17Å; R16-R19 PolarHBondContact O-N 3.5Å; R16-L20 HydrophobicContact CB-CD2 4.12Å; R16-L20 WeakPolarHBondContact O-CG 3.13Å; R16-L20 PolarHBondContact O-N 3.46Å; R16-R48 PolarHBondContact NH1-O 3.18Å; R16-M51 PolarHBondContact NH1-O 3.35Å; R16-N53 PolarHBondContact NH2-OD1 3.11Å
17	A	86.5	Confident	87	Confident	39 Å²	39	112.7 Å²	112.7	32%	0.322	63%	0.628	S	S	.	*	G	3₁₀ helix	trans	-49.4	-42.1	-166.2	0	0	0	0	0	113.9	Q13 S14 R19	Q13-A17 HydrophobicContact CG-CB 4.39Å; S14-A17 VanDerWaalsContact O-CB 3.26Å; S14-A17 WeakPolarHBondContact O-CB 3.26Å; S14-A17 PolarHBondContact O-N 2.98Å; A17-R19 VanDerWaalsContact C-N 3.31Å; A17-R19 PolarHBondContact O-N 3.06Å
18	E	87.1	Confident	86.6	Confident	190 Å²	190	116.7 Å²	116.7	89%	0.888	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-72.6	-20.4	-178.4	-61	178.1	176.4	0	0	114.3	R16	R16-E18 PolarHBondContact O-N 3.17Å
19	R	87.5	Confident	86.5	Confident	199 Å²	199	110.7 Å²	110.7	75%	0.751	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-107.6	4.8	-174	-57.7	179.9	-168	154.5	5	112.9	R16 A17 Q49	R16-R19 PolarHBondContact O-N 3.5Å; A17-R19 VanDerWaalsContact C-N 3.31Å; A17-R19 PolarHBondContact O-N 3.06Å; R19-Q49 PolarHBondContact O-NE2 3.14Å
20	L	87.9	Confident	86.4	Confident	81 Å²	81	107.6 Å²	107.6	42%	0.424	58%	0.579	S	S	.	*	S	Bend	trans	-72	138.3	179.3	-66	178.7	0	0	0	110.4	R16 P22 Q49	R16-L20 HydrophobicContact CB-CD2 4.12Å; R16-L20 WeakPolarHBondContact O-CG 3.13Å; R16-L20 PolarHBondContact O-N 3.46Å; L20-P22 WeakPolarHBondContact O-CD 3.44Å; L20-Q49 HydrophobicContact CD2-CB 4.36Å; L20-Q49 HydrophobicContact CD2-CG 4.44Å
21	I	87.6	Confident	86.2	Confident	33 Å²	33	100.6 Å²	100.6	17%	0.169	55%	0.547	C	S	.	.	P	Polyproline II helix	trans	-58.9	126	167.3	-65.8	157.8	0	0	0	107.9	S23 P31 L32 L35 I46 Q49 F50	I21-S23 PolarHBondContact O-N 3.3Å; I21-P31 HydrophobicContact CG2-CB 3.89Å; I21-L32 HydrophobicContact CD1-CD2 4.1Å; I21-L35 HydrophobicContact CD1-CD1 4.02Å; I21-L35 HydrophobicContact CG1-CD1 4.22Å; I21-L35 HydrophobicContact CG2-CD1 3.97Å; I21-I46 HydrophobicContact CD1-CG2 4.07Å; I21-Q49 VanDerWaalsContact CG1-OE1 3.22Å; I21-F50 HydrophobicContact CD1-CE2 4.3Å; I21-F50 HydrophobicContact CD1-CZ 4.3Å
22	P	84	Confident	86.2	Confident	90 Å²	90	92.3 Å²	92.3	58%	0.584	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-57.3	123.2	179.7	-24.8	32.8	0	0	0	111.4	L20 N24 R34	L20-P22 WeakPolarHBondContact O-CD 3.44Å; P22-N24 VanDerWaalsContact C-N 3.31Å; P22-N24 PolarHBondContact O-N 3.19Å; P22-R34 PolarHBondContact O-NH1 2.97Å
23	S	78	Confident	86.2	Confident	80 Å²	80	89.2 Å²	89.2	56%	0.559	49%	0.487	S	S	*	.	S	Bend	trans	-63.9	-42.2	176.3	58.5	0	0	0	0	110.8	I21 R34	I21-S23 PolarHBondContact O-N 3.3Å; S23-R34 PolarHBondContact O-NH1 2.88Å; S23-R34 PolarHBondContact O-NH2 3.02Å
24	N	76.4	Confident	86.3	Confident	139 Å²	139	84.9 Å²	84.9	74%	0.743	46%	0.463	S	S	*	.			trans	-92.6	141.2	-177	-64.3	-6.3	0	0	0	110.8	P22 R34	P22-N24 VanDerWaalsContact C-N 3.31Å; P22-N24 PolarHBondContact O-N 3.19Å; N24-R34 VanDerWaalsContact C-NH1 3.34Å; N24-R34 PolarHBondContact O-NH1 3.38Å
25	G	75.9	Confident	86.4	Confident	36 Å²	36	86 Å²	86	37%	0.371	46%	0.464	S	S	.	.			trans	-164	177.8	175.5	0	0	0	0	0	109.9	S27 R34	G25-S27 PolarHBondContact O-N 2.97Å; G25-S27 VanDerWaalsContact O-N 3.14Å; G25-R34 VanDerWaalsContact CA-CZ 3.48Å
26	P	79.4	Confident	86.6	Confident	144 Å²	144	81.5 Å²	81.5	94%	0.935	46%	0.456	S	S	*	.	S	Bend	trans	-64.2	-24	-171.9	24.5	-33.8	0	0	0	113
27	S	83.4	Confident	86.7	Confident	54 Å²	54	82.8 Å²	82.8	38%	0.378	47%	0.467	S	S	.	.	S	Bend	trans	-102.8	143	178.6	135.9	0	0	0	0	111.5	G25 A29 R34	G25-S27 PolarHBondContact O-N 2.97Å; G25-S27 VanDerWaalsContact O-N 3.14Å; S27-A29 PolarHBondContact O-N 3.23Å; S27-A29 VanDerWaalsContact O-N 3.14Å; S27-A29 WeakPolarHBondContact OG-CB 3.48Å; S27-A29 PolarHBondContact OG-N 2.99Å; S27-R34 PolarHBondContact O-NH2 2.73Å
28	K	85.8	Confident	87	Confident	225 Å²	225	90.1 Å²	90.1	98%	0.978	50%	0.495	S	S	*	.	S	Bend	trans	-68.4	0.3	172.4	-64.7	-172.6	179.9	-179	0	113.7
29	A	90.5	Very high	87.5	Confident	37 Å²	37	82.4 Å²	82.4	31%	0.306	46%	0.459	S	S	.	.	S	Bend	trans	-67	153.2	175.2	0	0	0	0	0	111	S27 C33 R34	S27-A29 PolarHBondContact O-N 3.23Å; S27-A29 VanDerWaalsContact O-N 3.14Å; S27-A29 WeakPolarHBondContact OG-CB 3.48Å; S27-A29 PolarHBondContact OG-N 2.99Å; A29-C33 HydrophobicContact CB-CB 3.92Å; A29-R34 PolarHBondContact O-NH2 3.15Å
30	C	92.8	Very high	87.9	Confident	13 Å²	13	75 Å²	75	9%	0.088	44%	0.438	C	S	.	.			trans	-63.5	159.7	175.5	81.8	0	0	0	0	111.6	L32 C33 R34 G64 C66	C30-L32 VanDerWaalsContact C-N 3.28Å; C30-L32 PolarHBondContact O-N 3.16Å; C30-L32 VanDerWaalsContact O-N 3.14Å; C30-C33 PolarHBondContact O-N 3.14Å; C30-C33 PolarHBondContact SG-SG 3.11Å; C30-R34 PolarHBondContact O-N 3.25Å; C30-G64 WeakPolarHBondContact CB-O 3.31Å; C30-C66 HydrophobicContact CB-CB 4.31Å
31	P	92.4	Very high	88.3	Confident	12 Å²	12	71.3 Å²	71.3	8%	0.078	42%	0.419	C	S	.	.	H	α-helix	trans	-50.7	-44	-173.6	-29.5	35.2	0	0	0	113.9	I21 G64	I21-P31 HydrophobicContact CG2-CB 3.89Å; P31-G64 WeakPolarHBondContact CD-O 3.39Å
32	L	94	Very high	88.8	Confident	5 Å²	5	74.8 Å²	74.8	3%	0.026	44%	0.435	C	S	.	.	H	α-helix	trans	-74.4	-39.2	179.5	-68.3	179.6	0	0	0	113.6	I21 C30 R34 L35 G36 L39 I46 F50 L65 Q69 V73	I21-L32 HydrophobicContact CD1-CD2 4.1Å; C30-L32 VanDerWaalsContact C-N 3.28Å; C30-L32 PolarHBondContact O-N 3.16Å; C30-L32 VanDerWaalsContact O-N 3.14Å; L32-R34 PolarHBondContact O-N 3.18Å; L32-L35 HydrophobicContact CD2-CD1 4.43Å; L32-L35 PolarHBondContact O-N 3.1Å; L32-G36 PolarHBondContact O-N 2.85Å; L32-L39 HydrophobicContact CD1-CD1 3.75Å; L32-L39 HydrophobicContact CD2-CD1 4.05Å; L32-L39 HydrophobicContact CG-CD1 4.48Å; L32-I46 HydrophobicContact CD2-CG2 4.01Å; L32-F50 HydrophobicContact CD1-CE2 3.97Å; L32-F50 HydrophobicContact CD1-CZ 4.04Å; L32-F50 HydrophobicContact CD2-CE2 3.91Å; L32-F50 HydrophobicContact CD2-CZ 3.96Å; L32-F50 HydrophobicContact CG-CE2 4.1Å; L32-F50 HydrophobicContact CG-CZ 3.85Å; L32-L65 HydrophobicContact CB-CD2 4.06Å; L32-L65 HydrophobicContact CD1-CD1 3.99Å; L32-L65 HydrophobicContact CD1-CD2 3.69Å; L32-L65 HydrophobicContact CG-CD2 3.67Å; L32-Q69 HydrophobicContact CB-CG 4.2Å; L32-Q69 HydrophobicContact CD1-CB 4.42Å; L32-V73 HydrophobicContact CD1-CG2 3.54Å
33	C	93.2	Very high	89.4	Confident	51 Å²	51	73.2 Å²	73.2	35%	0.345	42%	0.422	S	S	.	.	H	α-helix	trans	-61.4	-34.2	175.5	-77.9	0	0	0	0	111.8	A29 C30 L35 G36	A29-C33 HydrophobicContact CB-CB 3.92Å; C30-C33 PolarHBondContact O-N 3.14Å; C30-C33 PolarHBondContact SG-SG 3.11Å; C33-L35 VanDerWaalsContact C-N 3.3Å; C33-L35 PolarHBondContact O-N 3.32Å; C33-G36 PolarHBondContact O-N 2.87Å
34	R	91.3	Very high	90.3	Very high	71 Å²	71	71.6 Å²	71.6	27%	0.268	41%	0.408	S	S	.	.	H	α-helix	trans	-65.8	-33.5	178.1	-167.4	-175.6	-58.7	132.7	3.5	112.5	P22 S23 N24 G25 S27 A29 C30 L32 G36	P22-R34 PolarHBondContact O-NH1 2.97Å; S23-R34 PolarHBondContact O-NH1 2.88Å; S23-R34 PolarHBondContact O-NH2 3.02Å; N24-R34 VanDerWaalsContact C-NH1 3.34Å; N24-R34 PolarHBondContact O-NH1 3.38Å; G25-R34 VanDerWaalsContact CA-CZ 3.48Å; S27-R34 PolarHBondContact O-NH2 2.73Å; A29-R34 PolarHBondContact O-NH2 3.15Å; C30-R34 PolarHBondContact O-N 3.25Å; L32-R34 PolarHBondContact O-N 3.18Å; R34-G36 VanDerWaalsContact C-N 3.31Å
35	L	88.7	Confident	91.1	Very high	83 Å²	83	72 Å²	72	44%	0.435	41%	0.41	S	S	.	.	H	α-helix	trans	-75.3	-21.5	178.8	-64.4	174.2	0	0	0	112.7	I21 L32 C33 L37	I21-L35 HydrophobicContact CD1-CD1 4.02Å; I21-L35 HydrophobicContact CG1-CD1 4.22Å; I21-L35 HydrophobicContact CG2-CD1 3.97Å; L32-L35 HydrophobicContact CD2-CD1 4.43Å; L32-L35 PolarHBondContact O-N 3.1Å; C33-L35 VanDerWaalsContact C-N 3.3Å; C33-L35 PolarHBondContact O-N 3.32Å; L35-L37 HydrophobicContact CB-CD1 3.81Å; L35-L37 HydrophobicContact CB-CG 3.86Å; L35-L37 HydrophobicContact CD1-CD1 4.03Å; L35-L37 HydrophobicContact CG-CD1 4.47Å; L35-L37 PolarHBondContact O-N 3.27Å
36	G	89.3	Confident	92	Very high	67 Å²	67	72 Å²	72	69%	0.691	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	19.8	179.9	0	0	0	0	0	114.1	L32 C33 R34	L32-G36 PolarHBondContact O-N 2.85Å; C33-G36 PolarHBondContact O-N 2.87Å; R34-G36 VanDerWaalsContact C-N 3.31Å
37	L	90	Very high	92.8	Very high	90 Å²	90	65.1 Å²	65.1	47%	0.471	36%	0.356	S	S	.	.			trans	-86.2	142.7	-176.7	-61.7	169.4	0	0	0	111.4	L35 I46	L35-L37 HydrophobicContact CB-CD1 3.81Å; L35-L37 HydrophobicContact CB-CG 3.86Å; L35-L37 HydrophobicContact CD1-CD1 4.03Å; L35-L37 HydrophobicContact CG-CD1 4.47Å; L35-L37 PolarHBondContact O-N 3.27Å; L37-I46 HydrophobicContact CD1-CD1 4.33Å
38	E	93	Very high	93.4	Very high	193 Å²	193	68.5 Å²	68.5	90%	0.902	36%	0.361	S	S	*	.			trans	-89.6	113.2	163.8	-66.5	-167.4	157.9	0	0	109.1
39	L	95.8	Very high	93.7	Very high	28 Å²	28	59.7 Å²	59.7	15%	0.147	32%	0.323	C	S	.	.			trans	-86.3	139.5	-177.5	-64.4	178.8	0	0	0	112.1	L32 D43 I46 V73 L76	L32-L39 HydrophobicContact CD1-CD1 3.75Å; L32-L39 HydrophobicContact CD2-CD1 4.05Å; L32-L39 HydrophobicContact CG-CD1 4.48Å; L39-D43 WeakPolarHBondContact CA-OD2 3.28Å; L39-D43 HydrophobicContact CD2-CB 4.41Å; L39-I46 HydrophobicContact CD1-CG2 4.19Å; L39-I46 HydrophobicContact CD2-CB 4.37Å; L39-I46 HydrophobicContact CD2-CD1 3.64Å; L39-I46 HydrophobicContact CD2-CG2 3.95Å; L39-V73 HydrophobicContact CD1-CG2 4.44Å; L39-L76 HydrophobicContact CB-CD1 3.43Å; L39-L76 VanDerWaalsContact CB-CD1 3.43Å; L39-L76 WeakPolarHBondContact O-CD1 3.32Å
40	S	96.7	Very high	94	Very high	42 Å²	42	58.6 Å²	58.6	29%	0.294	31%	0.311	S	S	.	.			trans	-105.6	160.8	168.3	177.1	0	0	0	0	111	M42 D43	S40-M42 PolarHBondContact O-N 3.06Å; S40-M42 PolarHBondContact OG-N 2.95Å; S40-D43 PolarHBondContact N-OD2 2.99Å; S40-D43 PolarHBondContact O-N 2.77Å; S40-D43 VanDerWaalsContact O-N 3.1Å
41	F	97	Very high	94.1	Very high	5 Å²	5	58 Å²	58	2%	0.022	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-19.2	171.5	77.9	-82.6	0	0	0	111.7	D43 L76 Q79 A80 S83 L85 Y109 W110	F41-D43 VanDerWaalsContact C-N 3.3Å; F41-L76 HydrophobicContact CB-CD2 4.28Å; F41-Q79 HydrophobicContact CB-CB 3.67Å; F41-Q79 HydrophobicContact CG-CB 4.2Å; F41-A80 HydrophobicContact CB-CB 4.37Å; F41-A80 WeakPolarHBondContact O-CB 3.41Å; F41-S83 VanDerWaalsContact CE2-CB 3.48Å; F41-S83 VanDerWaalsContact CE2-OG 3.26Å; F41-S83 WeakPolarHBondContact CE2-OG 3.4Å; F41-L85 HydrophobicContact CD2-CD1 3.59Å; F41-L85 HydrophobicContact CE2-CD1 3.78Å; F41-L85 VanDerWaalsContact O-CD1 3.3Å; F41-L85 WeakPolarHBondContact O-CD1 3.34Å; F41-Y109 HydrophobicContact CZ-CD1 4.36Å; F41-W110 HydrophobicContact CD1-CB 3.8Å; F41-W110 AromaticContact CD1-CD1 3.83Å; F41-W110 HydrophobicContact CD1-CG 4.23Å; F41-W110 HydrophobicContact CE1-CB 3.92Å; F41-W110 AromaticContact CE1-CD1 3.91Å; F41-W110 HydrophobicContact CE1-CG 4.35Å; F41-W110 VanDerWaalsContact CE1-O 3.29Å; F41-W110 WeakPolarHBondContact CE1-O 3.38Å; F41-W110 AromaticContact CG-CD1 3.91Å
42	M	97.7	Very high	94.2	Very high	105 Å²	105	62.6 Å²	62.6	52%	0.517	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-10.6	176.1	-61.2	-175.7	-179.1	0	0	113.5	S40 V44 Y109	S40-M42 PolarHBondContact O-N 3.06Å; S40-M42 PolarHBondContact OG-N 2.95Å; M42-V44 WeakPolarHBondContact O-CG2 3.43Å; M42-V44 PolarHBondContact O-N 2.92Å; M42-Y109 HydrophobicContact CE-CD1 4.36Å
43	D	96.8	Very high	94.1	Very high	57 Å²	57	68.3 Å²	68.3	31%	0.305	35%	0.354	S	S	.	.			trans	-81	57.8	-178.8	-62.5	-38.8	0	0	0	111.8	L39 S40 F41 L45 I46 L47	L39-D43 WeakPolarHBondContact CA-OD2 3.28Å; L39-D43 HydrophobicContact CD2-CB 4.41Å; S40-D43 PolarHBondContact N-OD2 2.99Å; S40-D43 PolarHBondContact O-N 2.77Å; S40-D43 VanDerWaalsContact O-N 3.1Å; F41-D43 VanDerWaalsContact C-N 3.3Å; D43-L45 PolarHBondContact O-N 2.86Å; D43-L45 VanDerWaalsContact O-N 3.12Å; D43-I46 HydrophobicContact CB-CB 4.48Å; D43-I46 HydrophobicContact CB-CD1 4.44Å; D43-I46 PolarHBondContact O-N 2.84Å; D43-L47 WeakPolarHBondContact O-CG 3.43Å; D43-L47 PolarHBondContact O-N 3.14Å
44	V	95.8	Very high	94.1	Very high	46 Å²	46	68.5 Å²	68.5	28%	0.279	35%	0.352	S	S	.	.	H	α-helix	trans	-56	-36.4	-168.5	-152.4	0	0	0	0	112.2	M42 R48 L85 F86	M42-V44 WeakPolarHBondContact O-CG2 3.43Å; M42-V44 PolarHBondContact O-N 2.92Å; V44-R48 VanDerWaalsContact O-CB 3.24Å; V44-R48 WeakPolarHBondContact O-CB 3.08Å; V44-R48 PolarHBondContact O-N 2.64Å; V44-L85 HydrophobicContact CG2-CD1 4.3Å; V44-F86 HydrophobicContact CB-CE1 4.44Å; V44-F86 HydrophobicContact CG1-CD1 3.85Å; V44-F86 HydrophobicContact CG1-CE1 3.11Å; V44-F86 HydrophobicContact CG1-CZ 3.53Å
45	L	93.9	Very high	94.3	Very high	148 Å²	148	65.3 Å²	65.3	78%	0.775	34%	0.341	S	S	*	.	H	α-helix	trans	-68.7	-35.4	-179.2	-63	180	0	0	0	112.8	D43 Q49	D43-L45 PolarHBondContact O-N 2.86Å; D43-L45 VanDerWaalsContact O-N 3.12Å; L45-Q49 WeakPolarHBondContact O-CG 3.47Å; L45-Q49 PolarHBondContact O-NE2 3.47Å
46	I	95	Very high	94.6	Very high	35 Å²	35	63.6 Å²	63.6	18%	0.179	33%	0.334	C	S	.	.	H	α-helix	trans	-77.1	-48.7	176.8	-63.4	175.3	0	0	0	109	I21 L32 L37 L39 D43 R48 Q49 F50	I21-I46 HydrophobicContact CD1-CG2 4.07Å; L32-I46 HydrophobicContact CD2-CG2 4.01Å; L37-I46 HydrophobicContact CD1-CD1 4.33Å; L39-I46 HydrophobicContact CD1-CG2 4.19Å; L39-I46 HydrophobicContact CD2-CB 4.37Å; L39-I46 HydrophobicContact CD2-CD1 3.64Å; L39-I46 HydrophobicContact CD2-CG2 3.95Å; D43-I46 HydrophobicContact CB-CB 4.48Å; D43-I46 HydrophobicContact CB-CD1 4.44Å; D43-I46 PolarHBondContact O-N 2.84Å; I46-R48 VanDerWaalsContact C-N 3.27Å; I46-R48 PolarHBondContact O-N 3.07Å; I46-Q49 WeakPolarHBondContact O-CB 3.36Å; I46-Q49 PolarHBondContact O-N 3.23Å; I46-F50 HydrophobicContact CG2-CE2 4.05Å; I46-F50 WeakPolarHBondContact O-CD2 3.46Å
47	L	96.2	Very high	95	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57.7	-40.8	-178.8	-64.5	178.7	0	0	0	111.9	D43 Q49 F50 V73 L76 V77 A80 F86	D43-L47 WeakPolarHBondContact O-CG 3.43Å; D43-L47 PolarHBondContact O-N 3.14Å; L47-Q49 PolarHBondContact O-N 2.86Å; L47-Q49 VanDerWaalsContact O-N 3.12Å; L47-F50 PolarHBondContact O-N 3.08Å; L47-V73 HydrophobicContact CD2-CG1 4.38Å; L47-L76 HydrophobicContact CD1-CB 4.15Å; L47-L76 HydrophobicContact CD2-CB 3.86Å; L47-L76 HydrophobicContact CD2-CD1 4.32Å; L47-V77 HydrophobicContact CB-CG2 4.17Å; L47-V77 HydrophobicContact CD2-CG2 4.22Å; L47-A80 HydrophobicContact CD1-CB 4.29Å; L47-F86 HydrophobicContact CB-CZ 4.15Å
48	R	94.8	Very high	95.3	Very high	125 Å²	125	59.5 Å²	59.5	47%	0.472	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-60	-23	178.2	-171.1	173.1	-179.1	-166.6	-0.6	113.8	R16 V44 I46 F50 M51 L89	R16-R48 PolarHBondContact NH1-O 3.18Å; V44-R48 VanDerWaalsContact O-CB 3.24Å; V44-R48 WeakPolarHBondContact O-CB 3.08Å; V44-R48 PolarHBondContact O-N 2.64Å; I46-R48 VanDerWaalsContact C-N 3.27Å; I46-R48 PolarHBondContact O-N 3.07Å; R48-F50 VanDerWaalsContact C-N 3.25Å; R48-F50 PolarHBondContact O-N 3.01Å; R48-M51 HydrophobicContact CB-CE 4.1Å; R48-M51 HydrophobicContact CG-CE 4.39Å; R48-M51 PolarHBondContact O-N 3.32Å; R48-L89 HydrophobicContact CG-CD1 4.4Å
49	Q	93.8	Very high	95.5	Very high	41 Å²	41	52.5 Å²	52.5	19%	0.192	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-70.7	-25.5	176.8	-57	-177.1	26.9	0	0	112.3	R19 L20 I21 L45 I46 L47	R19-Q49 PolarHBondContact O-NE2 3.14Å; L20-Q49 HydrophobicContact CD2-CB 4.36Å; L20-Q49 HydrophobicContact CD2-CG 4.44Å; I21-Q49 VanDerWaalsContact CG1-OE1 3.22Å; L45-Q49 WeakPolarHBondContact O-CG 3.47Å; L45-Q49 PolarHBondContact O-NE2 3.47Å; I46-Q49 WeakPolarHBondContact O-CB 3.36Å; I46-Q49 PolarHBondContact O-N 3.23Å; L47-Q49 PolarHBondContact O-N 2.86Å; L47-Q49 VanDerWaalsContact O-N 3.12Å
50	F	95.6	Very high	95.5	Very high	13 Å²	13	54.6 Å²	54.6	6%	0.057	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-98.8	11.1	-179.8	-56.9	-75.3	0	0	0	113	I21 L32 I46 L47 R48 L58 T63 L65 V73	I21-F50 HydrophobicContact CD1-CE2 4.3Å; I21-F50 HydrophobicContact CD1-CZ 4.3Å; L32-F50 HydrophobicContact CD1-CE2 3.97Å; L32-F50 HydrophobicContact CD1-CZ 4.04Å; L32-F50 HydrophobicContact CD2-CE2 3.91Å; L32-F50 HydrophobicContact CD2-CZ 3.96Å; L32-F50 HydrophobicContact CG-CE2 4.1Å; L32-F50 HydrophobicContact CG-CZ 3.85Å; I46-F50 HydrophobicContact CG2-CE2 4.05Å; I46-F50 WeakPolarHBondContact O-CD2 3.46Å; L47-F50 PolarHBondContact O-N 3.08Å; R48-F50 VanDerWaalsContact C-N 3.25Å; R48-F50 PolarHBondContact O-N 3.01Å; F50-L58 WeakPolarHBondContact O-CB 3.48Å; F50-L58 PolarHBondContact O-N 2.78Å; F50-T63 HydrophobicContact CB-CG2 4.41Å; F50-T63 HydrophobicContact CD1-CG2 3.93Å; F50-L65 HydrophobicContact CD1-CD1 3.78Å; F50-L65 HydrophobicContact CD1-CG 4.21Å; F50-L65 HydrophobicContact CE1-CD1 3.84Å; F50-L65 HydrophobicContact CE1-CD2 3.81Å; F50-L65 HydrophobicContact CE1-CG 3.9Å; F50-L65 HydrophobicContact CG-CD1 4.27Å; F50-L65 HydrophobicContact CZ-CD1 4.38Å; F50-L65 HydrophobicContact CZ-CD2 4.08Å; F50-V73 HydrophobicContact CB-CG1 3.9Å; F50-V73 HydrophobicContact CD2-CG1 4.4Å; F50-V73 HydrophobicContact CG-CG1 4.31Å
51	M	95.6	Very high	95.4	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.005	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-117.6	149.2	-179.3	-64.3	-169.7	-59.2	0	0	112.8	R16 R48 T56 V77 F86 L89	R16-M51 PolarHBondContact NH1-O 3.35Å; R48-M51 HydrophobicContact CB-CE 4.1Å; R48-M51 HydrophobicContact CG-CE 4.39Å; R48-M51 PolarHBondContact O-N 3.32Å; M51-T56 CarbonylContact C-O 3.52Å; M51-T56 VanDerWaalsContact CA-O 3.31Å; M51-T56 WeakPolarHBondContact CA-O 3.38Å; M51-V77 HydrophobicContact CG-CG1 4.26Å; M51-V77 HydrophobicContact CG-CG2 4Å; M51-V77 HydrophobicContact SD-CB 4.28Å; M51-V77 HydrophobicContact SD-CG1 3.46Å; M51-V77 WeakPolarHBondContact SD-CG1 3.42Å; M51-V77 HydrophobicContact SD-CG2 3.8Å; M51-F86 HydrophobicContact CE-CD1 3.88Å; M51-F86 HydrophobicContact CE-CD2 4.12Å; M51-F86 HydrophobicContact CE-CE1 3.28Å; M51-F86 HydrophobicContact CE-CE2 3.58Å; M51-F86 HydrophobicContact CE-CG 4.27Å; M51-F86 HydrophobicContact CE-CZ 3.15Å; M51-F86 HydrophobicContact SD-CD2 4.4Å; M51-F86 HydrophobicContact SD-CE2 3.95Å; M51-F86 HydrophobicContact SD-CZ 4.11Å; M51-L89 HydrophobicContact CE-CD1 3.61Å
52	R	94	Very high	95.3	Very high	108 Å²	108	68.2 Å²	68.2	41%	0.408	33%	0.329	S	S	.	.			trans	-73.1	175	165.4	-67.5	-168.3	-169.2	102	-4.3	111.2	D54 G55 T56 V57 L58	R52-D54 WeakPolarHBondContact CB-OD1 3.31Å; R52-D54 PolarHBondContact O-N 2.89Å; R52-G55 PolarHBondContact O-N 3.02Å; R52-T56 WeakPolarHBondContact CD-OG1 3.44Å; R52-T56 PolarHBondContact N-O 3.46Å; R52-T56 PolarHBondContact NH1-OG1 3.49Å; R52-V57 PolarHBondContact NH1-O 2.96Å; R52-L58 HydrophobicContact CG-CD2 3.6Å; R52-L58 HydrophobicContact CG-CG 4.26Å
53	N	91.6	Very high	95.1	Very high	125 Å²	125	64 Å²	64	67%	0.668	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-22.8	178.8	-65.4	-10.3	0	0	0	112.8	R16 G55 L89	R16-N53 PolarHBondContact NH2-OD1 3.11Å; N53-G55 VanDerWaalsContact C-N 3.27Å; N53-G55 PolarHBondContact O-N 3.1Å; N53-L89 VanDerWaalsContact O-CD2 3.31Å; N53-L89 WeakPolarHBondContact O-CD2 3.35Å
54	D	93.6	Very high	94.9	Very high	56 Å²	56	63.5 Å²	63.5	30%	0.299	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	0.1	174.9	61.5	5.5	0	0	0	113.4	R52 T56 L89 K90 P91	R52-D54 WeakPolarHBondContact CB-OD1 3.31Å; R52-D54 PolarHBondContact O-N 2.89Å; D54-T56 VanDerWaalsContact C-N 3.3Å; D54-T56 VanDerWaalsContact CG-OG1 3.29Å; D54-T56 PolarHBondContact O-N 3.03Å; D54-T56 WeakPolarHBondContact OD1-CB 3.24Å; D54-T56 PolarHBondContact OD1-N 3.44Å; D54-T56 PolarHBondContact OD1-OG1 3.49Å; D54-T56 PolarHBondContact OD2-OG1 3.12Å; D54-L89 CarbonylContact O-C 3.6Å; D54-K90 CarbonylContact O-C 3.56Å; D54-K90 WeakPolarHBondContact O-CA 3.44Å; D54-K90 PolarHBondContact O-N 3.44Å; D54-P91 WeakPolarHBondContact O-CD 3.46Å
55	G	94.9	Very high	94.9	Very high	4 Å²	4	61.6 Å²	61.6	4%	0.041	31%	0.306	C	S	.	.	S	Bend	trans	81.5	3.2	-177.9	0	0	0	0	0	114.9	R52 N53 H81	R52-G55 PolarHBondContact O-N 3.02Å; N53-G55 VanDerWaalsContact C-N 3.27Å; N53-G55 PolarHBondContact O-N 3.1Å; G55-H81 PolarHBondContact O-NE2 3.45Å
56	T	95.3	Very high	94.9	Very high	46 Å²	46	56.8 Å²	56.8	28%	0.282	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-79.4	147.8	173.3	65.7	0	0	0	0	111.3	M51 R52 D54	M51-T56 CarbonylContact C-O 3.52Å; M51-T56 VanDerWaalsContact CA-O 3.31Å; M51-T56 WeakPolarHBondContact CA-O 3.38Å; R52-T56 WeakPolarHBondContact CD-OG1 3.44Å; R52-T56 PolarHBondContact N-O 3.46Å; R52-T56 PolarHBondContact NH1-OG1 3.49Å; D54-T56 VanDerWaalsContact C-N 3.3Å; D54-T56 VanDerWaalsContact CG-OG1 3.29Å; D54-T56 PolarHBondContact O-N 3.03Å; D54-T56 WeakPolarHBondContact OD1-CB 3.24Å; D54-T56 PolarHBondContact OD1-N 3.44Å; D54-T56 PolarHBondContact OD1-OG1 3.49Å; D54-T56 PolarHBondContact OD2-OG1 3.12Å
57	V	97.2	Very high	95	Very high	30 Å²	30	60.1 Å²	60.1	18%	0.182	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-73.9	137.8	178.8	-175.6	0	0	0	0	110.1	R52 V73 E74 V77	R52-V57 PolarHBondContact NH1-O 2.96Å; V57-V73 HydrophobicContact CG1-CG1 4.42Å; V57-E74 HydrophobicContact CB-CG 4.21Å; V57-E74 HydrophobicContact CG1-CG 3.93Å; V57-E74 HydrophobicContact CG2-CG 4.23Å; V57-V77 HydrophobicContact CG2-CB 3.85Å; V57-V77 HydrophobicContact CG2-CG1 3.72Å; V57-V77 HydrophobicContact CG2-CG2 3.95Å
58	L	96.4	Very high	95.1	Very high	41 Å²	41	67.9 Å²	67.9	22%	0.215	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-65.2	142.5	173.6	-74	169.8	0	0	0	110.3	F50 R52 I62 T63 Q70	F50-L58 WeakPolarHBondContact O-CB 3.48Å; F50-L58 PolarHBondContact O-N 2.78Å; R52-L58 HydrophobicContact CG-CD2 3.6Å; R52-L58 HydrophobicContact CG-CG 4.26Å; L58-I62 HydrophobicContact CD1-CG2 4.49Å; L58-I62 HydrophobicContact CD2-CG2 4.43Å; L58-T63 HydrophobicContact CB-CG2 3.47Å; L58-T63 VanDerWaalsContact CB-CG2 3.47Å; L58-T63 WeakPolarHBondContact O-CG2 3.36Å; L58-Q70 PolarHBondContact O-NE2 3.48Å; L58-Q70 VanDerWaalsContact O-NE2 3.08Å
59	P	97.4	Very high	95.1	Very high	46 Å²	46	62.6 Å²	62.6	30%	0.299	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-66.5	149.1	179.5	27.2	-32.5	0	0	0	110.4	R61 I62 T63	P59-R61 VanDerWaalsContact C-N 3.26Å; P59-R61 HydrophobicContact CB-CG 4.5Å; P59-R61 PolarHBondContact O-N 3.4Å; P59-R61 VanDerWaalsContact O-N 3.11Å; P59-I62 HydrophobicContact CG-CB 4.31Å; P59-I62 HydrophobicContact CG-CG1 3.79Å; P59-I62 WeakPolarHBondContact O-CA 3.39Å; P59-I62 WeakPolarHBondContact O-CB 3.46Å; P59-I62 PolarHBondContact O-N 3.19Å; P59-T63 PolarHBondContact O-N 3.48Å; P59-T63 VanDerWaalsContact O-N 3.16Å
60	Q	96.2	Very high	95.3	Very high	73 Å²	73	61 Å²	61	34%	0.341	31%	0.305	S	S	.	.	H	α-helix	trans	-52.3	-40.2	-173.2	-170.4	-175.4	15.1	0	0	114.5	I62 T63 G64 L65 N67 Q70	Q60-I62 PolarHBondContact O-N 3.32Å; Q60-I62 VanDerWaalsContact O-N 3.1Å; Q60-T63 WeakPolarHBondContact CA-OG1 3.35Å; Q60-T63 PolarHBondContact O-N 3.28Å; Q60-T63 PolarHBondContact O-OG1 3.25Å; Q60-G64 PolarHBondContact O-N 3.42Å; Q60-L65 VanDerWaalsContact CG-O 3.28Å; Q60-L65 WeakPolarHBondContact CG-O 3.37Å; Q60-L65 PolarHBondContact NE2-O 2.88Å; Q60-N67 VanDerWaalsContact CD-OD1 3.26Å; Q60-N67 PolarHBondContact NE2-OD1 3Å; Q60-N67 PolarHBondContact OE1-OD1 3.27Å; Q60-Q70 HydrophobicContact CB-CG 4.06Å; Q60-Q70 HydrophobicContact CG-CB 4.33Å; Q60-Q70 HydrophobicContact CG-CG 4.2Å
61	R	95	Very high	95.4	Very high	225 Å²	225	64.6 Å²	64.6	85%	0.849	32%	0.323	S	S	*	.	H	α-helix	trans	-59	-22.3	178.1	68.6	-179.4	179.9	147.5	-0.8	113.7	P59	P59-R61 VanDerWaalsContact C-N 3.26Å; P59-R61 HydrophobicContact CB-CG 4.5Å; P59-R61 PolarHBondContact O-N 3.4Å; P59-R61 VanDerWaalsContact O-N 3.11Å
62	I	94	Very high	95.5	Very high	108 Å²	108	65.2 Å²	65.2	55%	0.554	33%	0.326	S	S	*	.	H	α-helix	trans	-96.7	-40.2	178.3	-57.1	-58.2	0	0	0	110.9	L58 P59 Q60 G64	L58-I62 HydrophobicContact CD1-CG2 4.49Å; L58-I62 HydrophobicContact CD2-CG2 4.43Å; P59-I62 HydrophobicContact CG-CB 4.31Å; P59-I62 HydrophobicContact CG-CG1 3.79Å; P59-I62 WeakPolarHBondContact O-CA 3.39Å; P59-I62 WeakPolarHBondContact O-CB 3.46Å; P59-I62 PolarHBondContact O-N 3.19Å; Q60-I62 PolarHBondContact O-N 3.32Å; Q60-I62 VanDerWaalsContact O-N 3.1Å; I62-G64 VanDerWaalsContact C-N 3.31Å; I62-G64 PolarHBondContact O-N 3.19Å
63	T	94.3	Very high	95.6	Very high	16 Å²	16	60.1 Å²	60.1	10%	0.098	31%	0.307	C	S	.	.	H	α-helix	trans	-70.3	-27.3	-180	62	0	0	0	0	113.1	F50 L58 P59 Q60 L65 Q70	F50-T63 HydrophobicContact CB-CG2 4.41Å; F50-T63 HydrophobicContact CD1-CG2 3.93Å; L58-T63 HydrophobicContact CB-CG2 3.47Å; L58-T63 VanDerWaalsContact CB-CG2 3.47Å; L58-T63 WeakPolarHBondContact O-CG2 3.36Å; P59-T63 PolarHBondContact O-N 3.48Å; P59-T63 VanDerWaalsContact O-N 3.16Å; Q60-T63 WeakPolarHBondContact CA-OG1 3.35Å; Q60-T63 PolarHBondContact O-N 3.28Å; Q60-T63 PolarHBondContact O-OG1 3.25Å; T63-L65 PolarHBondContact O-N 3.16Å; T63-L65 PolarHBondContact OG1-N 2.96Å; T63-Q70 PolarHBondContact OG1-OE1 3.14Å
64	G	92.7	Very high	95.9	Very high	47 Å²	47	58.3 Å²	58.3	49%	0.485	30%	0.295	S	S	.	.			trans	69	14.2	-174.8	0	0	0	0	0	113.6	C30 P31 Q60 I62	C30-G64 WeakPolarHBondContact CB-O 3.31Å; P31-G64 WeakPolarHBondContact CD-O 3.39Å; Q60-G64 PolarHBondContact O-N 3.42Å; I62-G64 VanDerWaalsContact C-N 3.31Å; I62-G64 PolarHBondContact O-N 3.19Å
65	L	95.1	Very high	96.1	Very high	5 Å²	5	58.3 Å²	58.3	3%	0.026	29%	0.29	C	S	.	.			trans	-76.8	147.7	177.6	-64.3	179.8	0	0	0	111.4	L32 F50 Q60 T63 Q69 Q70 V73	L32-L65 HydrophobicContact CB-CD2 4.06Å; L32-L65 HydrophobicContact CD1-CD1 3.99Å; L32-L65 HydrophobicContact CD1-CD2 3.69Å; L32-L65 HydrophobicContact CG-CD2 3.67Å; F50-L65 HydrophobicContact CD1-CD1 3.78Å; F50-L65 HydrophobicContact CD1-CG 4.21Å; F50-L65 HydrophobicContact CE1-CD1 3.84Å; F50-L65 HydrophobicContact CE1-CD2 3.81Å; F50-L65 HydrophobicContact CE1-CG 3.9Å; F50-L65 HydrophobicContact CG-CD1 4.27Å; F50-L65 HydrophobicContact CZ-CD1 4.38Å; F50-L65 HydrophobicContact CZ-CD2 4.08Å; Q60-L65 VanDerWaalsContact CG-O 3.28Å; Q60-L65 WeakPolarHBondContact CG-O 3.37Å; Q60-L65 PolarHBondContact NE2-O 2.88Å; T63-L65 PolarHBondContact O-N 3.16Å; T63-L65 PolarHBondContact OG1-N 2.96Å; L65-Q69 HydrophobicContact CB-CB 4.27Å; L65-Q69 HydrophobicContact CD2-CB 4.35Å; L65-Q70 HydrophobicContact CB-CB 4.24Å; L65-V73 HydrophobicContact CD1-CB 4.37Å; L65-V73 HydrophobicContact CD1-CG2 3.88Å
66	C	95.3	Very high	96.2	Very high	47 Å²	47	58.1 Å²	58.1	32%	0.318	29%	0.289	S	S	.	.			trans	-69.1	158.5	167.7	71.3	0	0	0	0	110.3	C30 R68 Q69 Q70	C30-C66 HydrophobicContact CB-CB 4.31Å; C66-R68 PolarHBondContact O-N 2.95Å; C66-R68 VanDerWaalsContact O-N 3.1Å; C66-Q69 PolarHBondContact O-N 3.32Å; C66-Q70 PolarHBondContact O-N 3.22Å
67	N	97.2	Very high	96.3	Very high	106 Å²	106	56.1 Å²	56.1	57%	0.567	28%	0.276	S	S	*	.	H	α-helix	trans	-50.6	-42.1	-177.7	-77.5	-12.1	0	0	0	112.7	Q60 M71	Q60-N67 VanDerWaalsContact CD-OD1 3.26Å; Q60-N67 PolarHBondContact NE2-OD1 3Å; Q60-N67 PolarHBondContact OE1-OD1 3.27Å; N67-M71 WeakPolarHBondContact O-CE 3.23Å; N67-M71 WeakPolarHBondContact O-CG 3.07Å; N67-M71 PolarHBondContact O-N 3.47Å; N67-M71 VanDerWaalsContact O-N 3.11Å
68	R	96.5	Very high	96.2	Very high	162 Å²	162	57.7 Å²	57.7	61%	0.611	28%	0.282	S	S	*	.	H	α-helix	trans	-60.7	-51.8	178.8	-179.3	177.8	177.7	-108.6	-1.1	111.5	C66 M71 I72	C66-R68 PolarHBondContact O-N 2.95Å; C66-R68 VanDerWaalsContact O-N 3.1Å; R68-M71 PolarHBondContact O-N 3.46Å; R68-I72 HydrophobicContact CG-CD1 4Å; R68-I72 VanDerWaalsContact O-CG1 3.29Å; R68-I72 WeakPolarHBondContact O-CG1 3.5Å; R68-I72 PolarHBondContact O-N 3.37Å; R68-I72 VanDerWaalsContact O-N 3.14Å
69	Q	96.6	Very high	96.1	Very high	15 Å²	15	55.9 Å²	55.9	7%	0.07	27%	0.273	C	S	.	.	H	α-helix	trans	-69.2	-36.7	-177.7	-70.5	-65.7	-1.1	0	0	111.9	L32 L65 C66 M71 I72 V73	L32-Q69 HydrophobicContact CB-CG 4.2Å; L32-Q69 HydrophobicContact CD1-CB 4.42Å; L65-Q69 HydrophobicContact CB-CB 4.27Å; L65-Q69 HydrophobicContact CD2-CB 4.35Å; C66-Q69 PolarHBondContact O-N 3.32Å; Q69-M71 PolarHBondContact O-N 3.38Å; Q69-I72 PolarHBondContact O-N 3.19Å; Q69-V73 WeakPolarHBondContact O-CB 3.39Å; Q69-V73 WeakPolarHBondContact O-CG2 3.27Å; Q69-V73 PolarHBondContact O-N 3.02Å
70	Q	97.6	Very high	96.1	Very high	8 Å²	8	53.7 Å²	53.7	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-57.1	-50.2	174.7	-175.5	69.8	23.8	0	0	111.1	L58 Q60 T63 L65 C66 I72 V73 E74	L58-Q70 PolarHBondContact O-NE2 3.48Å; L58-Q70 VanDerWaalsContact O-NE2 3.08Å; Q60-Q70 HydrophobicContact CB-CG 4.06Å; Q60-Q70 HydrophobicContact CG-CB 4.33Å; Q60-Q70 HydrophobicContact CG-CG 4.2Å; T63-Q70 PolarHBondContact OG1-OE1 3.14Å; L65-Q70 HydrophobicContact CB-CB 4.24Å; C66-Q70 PolarHBondContact O-N 3.22Å; Q70-I72 VanDerWaalsContact C-N 3.32Å; Q70-I72 PolarHBondContact O-N 3.38Å; Q70-V73 PolarHBondContact O-N 3.12Å; Q70-E74 WeakPolarHBondContact CG-OE1 3.42Å; Q70-E74 PolarHBondContact NE2-OE1 3.02Å; Q70-E74 WeakPolarHBondContact O-CG 3.29Å; Q70-E74 PolarHBondContact O-N 2.83Å
71	M	96.9	Very high	96	Very high	88 Å²	88	53 Å²	53	43%	0.433	26%	0.255	S	S	.	.	H	α-helix	trans	-62.5	-36.5	177.1	-73.7	-174.1	-73.9	0	0	113.3	N67 R68 Q69 R75	N67-M71 WeakPolarHBondContact O-CE 3.23Å; N67-M71 WeakPolarHBondContact O-CG 3.07Å; N67-M71 PolarHBondContact O-N 3.47Å; N67-M71 VanDerWaalsContact O-N 3.11Å; R68-M71 PolarHBondContact O-N 3.46Å; Q69-M71 PolarHBondContact O-N 3.38Å; M71-R75 WeakPolarHBondContact O-CD 3.34Å; M71-R75 VanDerWaalsContact O-CG 3.27Å; M71-R75 WeakPolarHBondContact O-CG 3.35Å; M71-R75 PolarHBondContact O-N 3.29Å
72	I	97	Very high	95.8	Very high	14 Å²	14	45.6 Å²	45.6	7%	0.072	23%	0.227	C	C	.	.	H	α-helix	trans	-65.5	-50.6	177.1	-68.8	169	0	0	0	109.4	R68 Q69 Q70 E74 R75 L76 H113	R68-I72 HydrophobicContact CG-CD1 4Å; R68-I72 VanDerWaalsContact O-CG1 3.29Å; R68-I72 WeakPolarHBondContact O-CG1 3.5Å; R68-I72 PolarHBondContact O-N 3.37Å; R68-I72 VanDerWaalsContact O-N 3.14Å; Q69-I72 PolarHBondContact O-N 3.19Å; Q70-I72 VanDerWaalsContact C-N 3.32Å; Q70-I72 PolarHBondContact O-N 3.38Å; I72-E74 VanDerWaalsContact C-N 3.32Å; I72-E74 PolarHBondContact O-N 3.26Å; I72-R75 PolarHBondContact O-N 3.29Å; I72-R75 VanDerWaalsContact O-N 3.16Å; I72-L76 HydrophobicContact CG2-CD1 3.81Å; I72-L76 HydrophobicContact CG2-CG 4.16Å; I72-L76 WeakPolarHBondContact O-CG 3.4Å; I72-L76 PolarHBondContact O-N 3.31Å; I72-H113 HydrophobicContact CG2-CB 4.25Å
73	V	97.3	Very high	95.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.1	-44.3	178.6	170	0	0	0	0	111.2	L32 L39 L47 F50 V57 L65 Q69 Q70 R75 L76 V77	L32-V73 HydrophobicContact CD1-CG2 3.54Å; L39-V73 HydrophobicContact CD1-CG2 4.44Å; L47-V73 HydrophobicContact CD2-CG1 4.38Å; F50-V73 HydrophobicContact CB-CG1 3.9Å; F50-V73 HydrophobicContact CD2-CG1 4.4Å; F50-V73 HydrophobicContact CG-CG1 4.31Å; V57-V73 HydrophobicContact CG1-CG1 4.42Å; L65-V73 HydrophobicContact CD1-CB 4.37Å; L65-V73 HydrophobicContact CD1-CG2 3.88Å; Q69-V73 WeakPolarHBondContact O-CB 3.39Å; Q69-V73 WeakPolarHBondContact O-CG2 3.27Å; Q69-V73 PolarHBondContact O-N 3.02Å; Q70-V73 PolarHBondContact O-N 3.12Å; V73-R75 VanDerWaalsContact C-N 3.33Å; V73-R75 PolarHBondContact O-N 2.98Å; V73-L76 PolarHBondContact O-N 3.2Å; V73-V77 HydrophobicContact CG1-CG2 4.17Å; V73-V77 WeakPolarHBondContact O-CB 3.5Å; V73-V77 VanDerWaalsContact O-CG2 3.29Å; V73-V77 WeakPolarHBondContact O-CG2 3.44Å; V73-V77 PolarHBondContact O-N 2.93Å
74	E	97.3	Very high	95.7	Very high	87 Å²	87	43.3 Å²	43.3	41%	0.407	23%	0.23	S	C	.	.	H	α-helix	trans	-57.9	-43.9	176.9	-74.9	169.5	-171.7	0	0	112.6	V57 Q70 I72 M78	V57-E74 HydrophobicContact CB-CG 4.21Å; V57-E74 HydrophobicContact CG1-CG 3.93Å; V57-E74 HydrophobicContact CG2-CG 4.23Å; Q70-E74 WeakPolarHBondContact CG-OE1 3.42Å; Q70-E74 PolarHBondContact NE2-OE1 3.02Å; Q70-E74 WeakPolarHBondContact O-CG 3.29Å; Q70-E74 PolarHBondContact O-N 2.83Å; I72-E74 VanDerWaalsContact C-N 3.32Å; I72-E74 PolarHBondContact O-N 3.26Å; E74-M78 WeakPolarHBondContact O-CB 3.17Å; E74-M78 PolarHBondContact O-N 2.85Å
75	R	97	Very high	95.9	Very high	56 Å²	56	44.1 Å²	44.1	21%	0.211	22%	0.223	C	C	.	.	H	α-helix	trans	-67.1	-44.3	176.9	-69	165.2	-175.4	163.9	-2.5	111.9	M71 I72 V73 M78 Q79 H113 Y117	M71-R75 WeakPolarHBondContact O-CD 3.34Å; M71-R75 VanDerWaalsContact O-CG 3.27Å; M71-R75 WeakPolarHBondContact O-CG 3.35Å; M71-R75 PolarHBondContact O-N 3.29Å; I72-R75 PolarHBondContact O-N 3.29Å; I72-R75 VanDerWaalsContact O-N 3.16Å; V73-R75 VanDerWaalsContact C-N 3.33Å; V73-R75 PolarHBondContact O-N 2.98Å; R75-M78 PolarHBondContact O-N 3.37Å; R75-Q79 WeakPolarHBondContact O-CB 3.26Å; R75-Q79 VanDerWaalsContact O-CG 3.26Å; R75-Q79 WeakPolarHBondContact O-CG 3.43Å; R75-Q79 PolarHBondContact O-N 3.26Å; R75-H113 HydrophobicContact CB-CB 4.35Å; R75-H113 WeakPolarHBondContact CD-O 3.48Å; R75-H113 PolarHBondContact NH1-CE1 2.97Å; R75-Y117 PolarHBondContact NE-OH 3.21Å
76	L	97.6	Very high	95.9	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-65.1	-39.1	179.3	-67.8	-178.4	0	0	0	111.9	L39 F41 L47 I72 V73 Q79 A80 H113	L39-L76 HydrophobicContact CB-CD1 3.43Å; L39-L76 VanDerWaalsContact CB-CD1 3.43Å; L39-L76 WeakPolarHBondContact O-CD1 3.32Å; F41-L76 HydrophobicContact CB-CD2 4.28Å; L47-L76 HydrophobicContact CD1-CB 4.15Å; L47-L76 HydrophobicContact CD2-CB 3.86Å; L47-L76 HydrophobicContact CD2-CD1 4.32Å; I72-L76 HydrophobicContact CG2-CD1 3.81Å; I72-L76 HydrophobicContact CG2-CG 4.16Å; I72-L76 WeakPolarHBondContact O-CG 3.4Å; I72-L76 PolarHBondContact O-N 3.31Å; V73-L76 PolarHBondContact O-N 3.2Å; L76-Q79 WeakPolarHBondContact O-CB 3.29Å; L76-Q79 PolarHBondContact O-N 3.07Å; L76-A80 VanDerWaalsContact O-CB 3.3Å; L76-A80 WeakPolarHBondContact O-CB 3.3Å; L76-A80 PolarHBondContact O-N 3.32Å; L76-H113 HydrophobicContact CD2-CB 3.59Å; L76-H113 HydrophobicContact CG-CB 4.02Å
77	V	97.3	Very high	95.7	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.024	24%	0.235	C	C	.	.	H	α-helix	trans	-62.7	-45.8	174.2	166.5	0	0	0	0	110.7	L47 M51 V57 V73 Q79 A80 H81	L47-V77 HydrophobicContact CB-CG2 4.17Å; L47-V77 HydrophobicContact CD2-CG2 4.22Å; M51-V77 HydrophobicContact CG-CG1 4.26Å; M51-V77 HydrophobicContact CG-CG2 4Å; M51-V77 HydrophobicContact SD-CB 4.28Å; M51-V77 HydrophobicContact SD-CG1 3.46Å; M51-V77 WeakPolarHBondContact SD-CG1 3.42Å; M51-V77 HydrophobicContact SD-CG2 3.8Å; V57-V77 HydrophobicContact CG2-CB 3.85Å; V57-V77 HydrophobicContact CG2-CG1 3.72Å; V57-V77 HydrophobicContact CG2-CG2 3.95Å; V73-V77 HydrophobicContact CG1-CG2 4.17Å; V73-V77 WeakPolarHBondContact O-CB 3.5Å; V73-V77 VanDerWaalsContact O-CG2 3.29Å; V73-V77 WeakPolarHBondContact O-CG2 3.44Å; V73-V77 PolarHBondContact O-N 2.93Å; V77-Q79 PolarHBondContact O-N 3.23Å; V77-A80 PolarHBondContact O-N 3.48Å; V77-H81 PolarHBondContact O-CD2 3.1Å; V77-H81 PolarHBondContact O-N 2.83Å
78	M	94.9	Very high	95.5	Very high	63 Å²	63	46.9 Å²	46.9	31%	0.31	24%	0.244	S	C	.	.	H	α-helix	trans	-62.2	-43.2	176.1	-179.7	167.5	45.1	0	0	112.1	E74 R75 A80 H81 W82 M116	E74-M78 WeakPolarHBondContact O-CB 3.17Å; E74-M78 PolarHBondContact O-N 2.85Å; R75-M78 PolarHBondContact O-N 3.37Å; M78-A80 VanDerWaalsContact C-N 3.34Å; M78-A80 PolarHBondContact O-N 3.47Å; M78-H81 PolarHBondContact O-N 3.31Å; M78-W82 HydrophobicContact CE-CH2 4.41Å; M78-W82 HydrophobicContact CG-CD2 3.91Å; M78-W82 HydrophobicContact CG-CE3 4.01Å; M78-W82 HydrophobicContact CG-CH2 3.84Å; M78-W82 HydrophobicContact CG-CZ2 3.64Å; M78-W82 HydrophobicContact CG-CZ3 4Å; M78-W82 WeakPolarHBondContact O-CB 3.47Å; M78-W82 VanDerWaalsContact O-CG 3.25Å; M78-W82 PolarHBondContact O-N 3.26Å; M78-W82 HydrophobicContact SD-CH2 3.66Å; M78-W82 HydrophobicContact SD-CZ2 3.61Å; M78-W82 HydrophobicContact SD-CZ3 4.28Å; M78-M116 HydrophobicContact CE-CE 3.55Å; M78-M116 HydrophobicContact CE-SD 3.17Å; M78-M116 WeakPolarHBondContact CE-SD 3.45Å; M78-M116 HydrophobicContact SD-SD 3.95Å
79	Q	95.5	Very high	95.3	Very high	2 Å²	2	40 Å²	40	1%	0.009	22%	0.218	C	C	.	.	H	α-helix	trans	-58.8	-44	173.4	-76.2	179.9	-14.3	0	0	111.9	F41 R75 L76 V77 W82 S83 W110 S112	F41-Q79 HydrophobicContact CB-CB 3.67Å; F41-Q79 HydrophobicContact CG-CB 4.2Å; R75-Q79 WeakPolarHBondContact O-CB 3.26Å; R75-Q79 VanDerWaalsContact O-CG 3.26Å; R75-Q79 WeakPolarHBondContact O-CG 3.43Å; R75-Q79 PolarHBondContact O-N 3.26Å; L76-Q79 WeakPolarHBondContact O-CB 3.29Å; L76-Q79 PolarHBondContact O-N 3.07Å; V77-Q79 PolarHBondContact O-N 3.23Å; Q79-W82 WeakPolarHBondContact O-CB 3.43Å; Q79-W82 PolarHBondContact O-N 3.18Å; Q79-S83 WeakPolarHBondContact O-CB 3.09Å; Q79-S83 PolarHBondContact O-N 2.9Å; Q79-S83 PolarHBondContact O-OG 3.38Å; Q79-W110 HydrophobicContact CB-CD2 4.26Å; Q79-W110 HydrophobicContact CB-CG 3.97Å; Q79-W110 HydrophobicContact CG-CB 4.41Å; Q79-W110 HydrophobicContact CG-CD2 3.65Å; Q79-W110 HydrophobicContact CG-CE3 4.22Å; Q79-W110 HydrophobicContact CG-CG 3.71Å; Q79-W110 HydrophobicContact CG-CZ2 4.31Å; Q79-W110 PolarHBondContact O-NE1 3.16Å; Q79-S112 PolarHBondContact NE2-O 3.44Å
80	A	96.6	Very high	95.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.8	-41.6	178.7	0	0	0	0	0	112.7	F41 L47 L76 V77 M78 W82 S83 G84 L85 F86	F41-A80 HydrophobicContact CB-CB 4.37Å; F41-A80 WeakPolarHBondContact O-CB 3.41Å; L47-A80 HydrophobicContact CD1-CB 4.29Å; L76-A80 VanDerWaalsContact O-CB 3.3Å; L76-A80 WeakPolarHBondContact O-CB 3.3Å; L76-A80 PolarHBondContact O-N 3.32Å; V77-A80 PolarHBondContact O-N 3.48Å; M78-A80 VanDerWaalsContact C-N 3.34Å; M78-A80 PolarHBondContact O-N 3.47Å; A80-W82 VanDerWaalsContact C-N 3.34Å; A80-S83 CarbonylContact O-C 3.2Å; A80-S83 PolarHBondContact O-N 3.43Å; A80-G84 PolarHBondContact O-N 2.93Å; A80-G84 VanDerWaalsContact O-N 3.11Å; A80-L85 HydrophobicContact CB-CB 4.25Å; A80-L85 HydrophobicContact CB-CD1 4.16Å; A80-L85 PolarHBondContact O-N 3.11Å; A80-F86 HydrophobicContact CB-CD2 3.78Å; A80-F86 HydrophobicContact CB-CE2 3.39Å; A80-F86 HydrophobicContact CB-CZ 4.31Å
81	H	94.2	Very high	94.8	Very high	58 Å²	58	43.6 Å²	43.6	27%	0.269	24%	0.239	S	C	.	.	H	α-helix	trans	-58.1	-48.1	171.2	-81.3	-58	0	0	0	111.4	G55 V77 M78 S83 G84 F86 L89	G55-H81 PolarHBondContact O-NE2 3.45Å; V77-H81 PolarHBondContact O-CD2 3.1Å; V77-H81 PolarHBondContact O-N 2.83Å; M78-H81 PolarHBondContact O-N 3.31Å; H81-S83 VanDerWaalsContact C-N 3.27Å; H81-S83 PolarHBondContact O-N 3.11Å; H81-G84 PolarHBondContact O-N 2.83Å; H81-F86 AromaticContact CE1-CD2 3.85Å; H81-F86 AromaticContact ND1-CD2 3.9Å; H81-L89 PolarHBondContact CE1-O 3.37Å; H81-L89 VanDerWaalsContact CE1-O 3.26Å
82	W	91.8	Very high	94.5	Very high	70 Å²	70	48 Å²	48	27%	0.265	27%	0.265	S	S	.	.	H	α-helix	trans	-65.8	-27.7	179.2	-77	-7.5	0	0	0	114.8	M78 Q79 A80 G84 R108 W110 M116 Y134	M78-W82 HydrophobicContact CE-CH2 4.41Å; M78-W82 HydrophobicContact CG-CD2 3.91Å; M78-W82 HydrophobicContact CG-CE3 4.01Å; M78-W82 HydrophobicContact CG-CH2 3.84Å; M78-W82 HydrophobicContact CG-CZ2 3.64Å; M78-W82 HydrophobicContact CG-CZ3 4Å; M78-W82 WeakPolarHBondContact O-CB 3.47Å; M78-W82 VanDerWaalsContact O-CG 3.25Å; M78-W82 PolarHBondContact O-N 3.26Å; M78-W82 HydrophobicContact SD-CH2 3.66Å; M78-W82 HydrophobicContact SD-CZ2 3.61Å; M78-W82 HydrophobicContact SD-CZ3 4.28Å; Q79-W82 WeakPolarHBondContact O-CB 3.43Å; Q79-W82 PolarHBondContact O-N 3.18Å; A80-W82 VanDerWaalsContact C-N 3.34Å; W82-G84 VanDerWaalsContact C-N 3.33Å; W82-R108 VanDerWaalsContact CA-NH2 3.28Å; W82-R108 VanDerWaalsContact CB-NH2 3.32Å; W82-R108 VanDerWaalsContact CG-CZ 3.42Å; W82-R108 PolarHBondContact O-NE 2.77Å; W82-R108 VanDerWaalsContact O-NE 3.08Å; W82-R108 PolarHBondContact O-NH2 3.44Å; W82-R108 VanDerWaalsContact O-NH2 3.07Å; W82-W110 HydrophobicContact CB-CZ2 4.39Å; W82-W110 HydrophobicContact CD2-CZ2 4.44Å; W82-W110 AromaticContact CE3-CH2 3.7Å; W82-W110 HydrophobicContact CE3-CH2 3.7Å; W82-W110 AromaticContact CE3-CZ2 3.45Å; W82-W110 HydrophobicContact CE3-CZ2 3.45Å; W82-W110 VanDerWaalsContact CE3-CZ2 3.45Å; W82-W110 AromaticContact CZ3-CH2 3.82Å; W82-W110 HydrophobicContact CZ3-CH2 3.82Å; W82-W110 HydrophobicContact CZ3-CZ2 4.06Å; W82-M116 HydrophobicContact CH2-CG 4.01Å; W82-M116 HydrophobicContact CH2-SD 3.43Å; W82-M116 WeakPolarHBondContact CH2-SD 3.3Å; W82-M116 HydrophobicContact CZ3-CG 3.76Å; W82-M116 HydrophobicContact CZ3-SD 3.5Å; W82-M116 VanDerWaalsContact CZ3-SD 3.5Å; W82-Y134 WeakPolarHBondContact CH2-OXT 3.45Å
83	S	93.5	Very high	94.2	Very high	24 Å²	24	54.2 Å²	54.2	17%	0.168	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-0.3	173.7	-64.2	0	0	0	0	113.2	F41 Q79 A80 H81 R108 W110	F41-S83 VanDerWaalsContact CE2-CB 3.48Å; F41-S83 VanDerWaalsContact CE2-OG 3.26Å; F41-S83 WeakPolarHBondContact CE2-OG 3.4Å; Q79-S83 WeakPolarHBondContact O-CB 3.09Å; Q79-S83 PolarHBondContact O-N 2.9Å; Q79-S83 PolarHBondContact O-OG 3.38Å; A80-S83 CarbonylContact O-C 3.2Å; A80-S83 PolarHBondContact O-N 3.43Å; H81-S83 VanDerWaalsContact C-N 3.27Å; H81-S83 PolarHBondContact O-N 3.11Å; S83-R108 WeakPolarHBondContact CB-O 3.43Å; S83-R108 PolarHBondContact OG-O 2.63Å; S83-W110 PolarHBondContact OG-NE1 3.14Å
84	G	92.8	Very high	93.9	Very high	53 Å²	53	57.6 Å²	57.6	55%	0.546	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.4	18.6	176.1	0	0	0	0	0	115.1	A80 H81 W82 F86	A80-G84 PolarHBondContact O-N 2.93Å; A80-G84 VanDerWaalsContact O-N 3.11Å; H81-G84 PolarHBondContact O-N 2.83Å; W82-G84 VanDerWaalsContact C-N 3.33Å; G84-F86 VanDerWaalsContact C-N 3.28Å; G84-F86 PolarHBondContact O-N 3.26Å
85	L	95.9	Very high	93.6	Very high	63 Å²	63	57.5 Å²	57.5	33%	0.33	32%	0.315	S	S	.	.	S	Bend	trans	-78.4	-11.4	-178.1	-61	-179.2	0	0	0	113.7	F41 V44 A80 P87	F41-L85 HydrophobicContact CD2-CD1 3.59Å; F41-L85 HydrophobicContact CE2-CD1 3.78Å; F41-L85 VanDerWaalsContact O-CD1 3.3Å; F41-L85 WeakPolarHBondContact O-CD1 3.34Å; V44-L85 HydrophobicContact CG2-CD1 4.3Å; A80-L85 HydrophobicContact CB-CB 4.25Å; A80-L85 HydrophobicContact CB-CD1 4.16Å; A80-L85 PolarHBondContact O-N 3.11Å; L85-P87 VanDerWaalsContact C-CD 3.46Å; L85-P87 WeakPolarHBondContact O-CD 3.47Å
86	F	95	Very high	93.3	Very high	9 Å²	9	61.5 Å²	61.5	4%	0.039	33%	0.331	C	S	.	.			trans	-123.6	67.8	179.9	-65.5	-54.1	0	0	0	112	V44 L47 M51 A80 H81 G84 T88 L89	V44-F86 HydrophobicContact CB-CE1 4.44Å; V44-F86 HydrophobicContact CG1-CD1 3.85Å; V44-F86 HydrophobicContact CG1-CE1 3.11Å; V44-F86 HydrophobicContact CG1-CZ 3.53Å; L47-F86 HydrophobicContact CB-CZ 4.15Å; M51-F86 HydrophobicContact CE-CD1 3.88Å; M51-F86 HydrophobicContact CE-CD2 4.12Å; M51-F86 HydrophobicContact CE-CE1 3.28Å; M51-F86 HydrophobicContact CE-CE2 3.58Å; M51-F86 HydrophobicContact CE-CG 4.27Å; M51-F86 HydrophobicContact CE-CZ 3.15Å; M51-F86 HydrophobicContact SD-CD2 4.4Å; M51-F86 HydrophobicContact SD-CE2 3.95Å; M51-F86 HydrophobicContact SD-CZ 4.11Å; A80-F86 HydrophobicContact CB-CD2 3.78Å; A80-F86 HydrophobicContact CB-CE2 3.39Å; A80-F86 HydrophobicContact CB-CZ 4.31Å; H81-F86 AromaticContact CE1-CD2 3.85Å; H81-F86 AromaticContact ND1-CD2 3.9Å; G84-F86 VanDerWaalsContact C-N 3.28Å; G84-F86 PolarHBondContact O-N 3.26Å; F86-T88 VanDerWaalsContact C-N 3.31Å; F86-T88 PolarHBondContact O-N 2.98Å; F86-L89 HydrophobicContact CB-CB 4.25Å; F86-L89 HydrophobicContact CD1-CD1 3.68Å; F86-L89 HydrophobicContact CE1-CD1 4.1Å; F86-L89 HydrophobicContact CG-CD1 4.31Å
87	P	91.3	Very high	92.9	Very high	86 Å²	86	68.5 Å²	68.5	56%	0.558	36%	0.361	S	S	*	.	S	Bend	trans	-66.7	-31.5	-176.1	25.9	-34	0	0	0	113.3	L85	L85-P87 VanDerWaalsContact C-CD 3.46Å; L85-P87 WeakPolarHBondContact O-CD 3.47Å
88	T	92	Very high	92.5	Very high	122 Å²	122	73.3 Å²	73.3	75%	0.748	38%	0.384	S	S	*	.	S	Bend	trans	-96.9	-18.7	-175.1	51.8	0	0	0	0	114.4	F86 K90	F86-T88 VanDerWaalsContact C-N 3.31Å; F86-T88 PolarHBondContact O-N 2.98Å; T88-K90 PolarHBondContact O-N 3.35Å
89	L	93	Very high	92	Very high	16 Å²	16	72 Å²	72	8%	0.084	38%	0.383	C	S	.	.			trans	-94.4	81.2	-177.2	-58.9	177.1	0	0	0	109.3	R48 M51 N53 D54 H81 F86	R48-L89 HydrophobicContact CG-CD1 4.4Å; M51-L89 HydrophobicContact CE-CD1 3.61Å; N53-L89 VanDerWaalsContact O-CD2 3.31Å; N53-L89 WeakPolarHBondContact O-CD2 3.35Å; D54-L89 CarbonylContact O-C 3.6Å; H81-L89 PolarHBondContact CE1-O 3.37Å; H81-L89 VanDerWaalsContact CE1-O 3.26Å; F86-L89 HydrophobicContact CB-CB 4.25Å; F86-L89 HydrophobicContact CD1-CD1 3.68Å; F86-L89 HydrophobicContact CE1-CD1 4.1Å; F86-L89 HydrophobicContact CG-CD1 4.31Å
90	K	91.6	Very high	91.5	Very high	50 Å²	50	75.3 Å²	75.3	22%	0.217	41%	0.406	C	S	.	.			trans	-134	150	-179.1	-68.9	173.1	175.8	178.3	0	110.7	D54 T88 F94 Y96	D54-K90 CarbonylContact O-C 3.56Å; D54-K90 WeakPolarHBondContact O-CA 3.44Å; D54-K90 PolarHBondContact O-N 3.44Å; T88-K90 PolarHBondContact O-N 3.35Å; K90-F94 HydrophobicContact CB-CB 4.03Å; K90-F94 HydrophobicContact CB-CD2 4.34Å; K90-F94 HydrophobicContact CB-CG 4.06Å; K90-F94 HydrophobicContact CD-CD1 3.66Å; K90-F94 HydrophobicContact CD-CD2 4.36Å; K90-F94 HydrophobicContact CD-CE1 3.8Å; K90-F94 HydrophobicContact CD-CE2 4.47Å; K90-F94 HydrophobicContact CD-CG 3.95Å; K90-F94 HydrophobicContact CD-CZ 4.2Å; K90-F94 HydrophobicContact CG-CD1 4.4Å; K90-F94 HydrophobicContact CG-CD2 4.28Å; K90-F94 HydrophobicContact CG-CG 4.2Å; K90-Y96 HydrophobicContact CD-CE1 3.89Å; K90-Y96 WeakPolarHBondContact CD-OH 3.32Å
91	P	91.5	Very high	91	Very high	49 Å²	49	80.1 Å²	80.1	32%	0.318	43%	0.428	S	S	.	.			trans	-58.6	154.2	168.5	-22.6	33.8	0	0	0	111.7	D54 D93 F94	D54-P91 WeakPolarHBondContact O-CD 3.46Å; P91-D93 WeakPolarHBondContact CB-OD1 3.29Å; P91-D93 PolarHBondContact O-N 3.42Å; P91-F94 VanDerWaalsContact O-CB 3.23Å; P91-F94 WeakPolarHBondContact O-CB 3.43Å; P91-F94 PolarHBondContact O-N 3.46Å; P91-F94 VanDerWaalsContact O-N 3.16Å
92	N	90.6	Very high	90.6	Very high	182 Å²	182	80 Å²	80	97%	0.973	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.4	179.2	-70.4	-14.2	0	0	0	112.7	F94	N92-F94 VanDerWaalsContact C-N 3.35Å
93	D	91.5	Very high	90.2	Very high	144 Å²	144	81 Å²	81	77%	0.77	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	14.9	179	60.6	-31.9	0	0	0	113.2	P91 D95	P91-D93 WeakPolarHBondContact CB-OD1 3.29Å; P91-D93 PolarHBondContact O-N 3.42Å; D93-D95 PolarHBondContact O-N 2.86Å
94	F	90.1	Very high	89.7	Confident	71 Å²	71	83 Å²	83	31%	0.311	45%	0.453	S	S	.	.			trans	-67.3	120.1	-178.7	-173.7	-89.8	0	0	0	112.7	K90 P91 N92 Y96 A99	K90-F94 HydrophobicContact CB-CB 4.03Å; K90-F94 HydrophobicContact CB-CD2 4.34Å; K90-F94 HydrophobicContact CB-CG 4.06Å; K90-F94 HydrophobicContact CD-CD1 3.66Å; K90-F94 HydrophobicContact CD-CD2 4.36Å; K90-F94 HydrophobicContact CD-CE1 3.8Å; K90-F94 HydrophobicContact CD-CE2 4.47Å; K90-F94 HydrophobicContact CD-CG 3.95Å; K90-F94 HydrophobicContact CD-CZ 4.2Å; K90-F94 HydrophobicContact CG-CD1 4.4Å; K90-F94 HydrophobicContact CG-CD2 4.28Å; K90-F94 HydrophobicContact CG-CG 4.2Å; P91-F94 VanDerWaalsContact O-CB 3.23Å; P91-F94 WeakPolarHBondContact O-CB 3.43Å; P91-F94 PolarHBondContact O-N 3.46Å; P91-F94 VanDerWaalsContact O-N 3.16Å; N92-F94 VanDerWaalsContact C-N 3.35Å; F94-Y96 HydrophobicContact CD1-CD1 4.2Å; F94-Y96 AromaticContact CD1-CD2 3.83Å; F94-Y96 HydrophobicContact CD1-CD2 3.83Å; F94-Y96 HydrophobicContact CD1-CE1 4.27Å; F94-Y96 AromaticContact CD1-CE2 3.86Å; F94-Y96 HydrophobicContact CD1-CE2 3.86Å; F94-Y96 AromaticContact CD1-CG 3.99Å; F94-Y96 HydrophobicContact CD1-CG 3.99Å; F94-Y96 HydrophobicContact CE1-CD1 4.1Å; F94-Y96 HydrophobicContact CE1-CD2 4.46Å; F94-Y96 HydrophobicContact CE1-CE1 4.37Å; F94-Y96 HydrophobicContact CE1-CG 4.16Å; F94-Y96 WeakPolarHBondContact O-CD2 3.33Å; F94-Y96 PolarHBondContact O-N 3.03Å; F94-A99 HydrophobicContact CE1-CB 3.77Å; F94-A99 HydrophobicContact CZ-CB 3.55Å
95	D	92.6	Very high	89.3	Confident	84 Å²	84	86.1 Å²	86.1	45%	0.449	45%	0.452	S	S	.	.			trans	-83.5	101.7	175	-168.1	-22.4	0	0	0	111.8	D93 K97 E98 A99	D93-D95 PolarHBondContact O-N 2.86Å; D95-K97 VanDerWaalsContact C-N 3.3Å; D95-K97 PolarHBondContact O-N 3.03Å; D95-K97 WeakPolarHBondContact OD1-CA 3.4Å; D95-K97 VanDerWaalsContact OD1-CB 3.29Å; D95-K97 WeakPolarHBondContact OD1-CB 3.43Å; D95-K97 PolarHBondContact OD1-N 2.92Å; D95-E98 HydrophobicContact CB-CB 3.9Å; D95-E98 PolarHBondContact OD1-N 3.07Å; D95-A99 WeakPolarHBondContact O-CB 3.33Å; D95-A99 PolarHBondContact O-N 2.87Å; D95-A99 VanDerWaalsContact O-N 3.11Å
96	Y	89.9	Confident	88.9	Confident	141 Å²	141	90.1 Å²	90.1	55%	0.553	46%	0.464	S	S	*	.	H	α-helix	trans	-65.6	-31.2	176.7	-72.4	-95.8	0	0	0	113.4	K90 F94 S100	K90-Y96 HydrophobicContact CD-CE1 3.89Å; K90-Y96 WeakPolarHBondContact CD-OH 3.32Å; F94-Y96 HydrophobicContact CD1-CD1 4.2Å; F94-Y96 AromaticContact CD1-CD2 3.83Å; F94-Y96 HydrophobicContact CD1-CD2 3.83Å; F94-Y96 HydrophobicContact CD1-CE1 4.27Å; F94-Y96 AromaticContact CD1-CE2 3.86Å; F94-Y96 HydrophobicContact CD1-CE2 3.86Å; F94-Y96 AromaticContact CD1-CG 3.99Å; F94-Y96 HydrophobicContact CD1-CG 3.99Å; F94-Y96 HydrophobicContact CE1-CD1 4.1Å; F94-Y96 HydrophobicContact CE1-CD2 4.46Å; F94-Y96 HydrophobicContact CE1-CE1 4.37Å; F94-Y96 HydrophobicContact CE1-CG 4.16Å; F94-Y96 WeakPolarHBondContact O-CD2 3.33Å; F94-Y96 PolarHBondContact O-N 3.03Å; Y96-S100 WeakPolarHBondContact O-CB 3.39Å; Y96-S100 PolarHBondContact O-N 3.28Å
97	K	89.9	Confident	88.6	Confident	148 Å²	148	95.6 Å²	95.6	64%	0.643	49%	0.494	S	S	*	.	H	α-helix	trans	-70.3	-49.8	-179.9	-173.9	-176.1	173.8	-172.4	0	109	D95 A99 S100 E101	D95-K97 VanDerWaalsContact C-N 3.3Å; D95-K97 PolarHBondContact O-N 3.03Å; D95-K97 WeakPolarHBondContact OD1-CA 3.4Å; D95-K97 VanDerWaalsContact OD1-CB 3.29Å; D95-K97 WeakPolarHBondContact OD1-CB 3.43Å; D95-K97 PolarHBondContact OD1-N 2.92Å; K97-A99 PolarHBondContact O-N 2.88Å; K97-S100 CarbonylContact O-C 3.56Å; K97-S100 PolarHBondContact O-N 3.1Å; K97-E101 WeakPolarHBondContact CE-OE1 3.29Å; K97-E101 WeakPolarHBondContact O-CG 3.26Å; K97-E101 PolarHBondContact O-N 3.26Å; K97-E101 VanDerWaalsContact O-N 3.14Å
98	E	87.9	Confident	88.5	Confident	105 Å²	105	93 Å²	93	49%	0.491	47%	0.472	S	S	.	.	H	α-helix	trans	-60.5	-36.1	178	-159.5	-140.4	130.1	0	0	112.2	D95 S100 K104	D95-E98 HydrophobicContact CB-CB 3.9Å; D95-E98 PolarHBondContact OD1-N 3.07Å; E98-S100 VanDerWaalsContact C-N 3.28Å; E98-S100 PolarHBondContact O-N 2.82Å; E98-K104 WeakPolarHBondContact O-CD 3.42Å; E98-K104 PolarHBondContact O-NZ 3.02Å; E98-K104 IonicContact OE1-NZ 2.88Å; E98-K104 PolarHBondContact OE1-NZ 3.45Å
99	A	85.2	Confident	88.4	Confident	36 Å²	36	94.9 Å²	94.9	30%	0.298	47%	0.467	S	S	.	.	H	α-helix	trans	-70.3	-21.5	176.1	0	0	0	0	0	113.7	F94 D95 K97 K104	F94-A99 HydrophobicContact CE1-CB 3.77Å; F94-A99 HydrophobicContact CZ-CB 3.55Å; D95-A99 WeakPolarHBondContact O-CB 3.33Å; D95-A99 PolarHBondContact O-N 2.87Å; D95-A99 VanDerWaalsContact O-N 3.11Å; K97-A99 PolarHBondContact O-N 2.88Å; A99-K104 WeakPolarHBondContact O-CB 3.43Å
100	S	85.2	Confident	88.3	Confident	71 Å²	71	95.1 Å²	95.1	50%	0.497	47%	0.467	S	S	.	.	H	α-helix	trans	-102.6	1.6	-179.6	-156.2	0	0	0	0	113.4	Y96 K97 E98 K105	Y96-S100 WeakPolarHBondContact O-CB 3.39Å; Y96-S100 PolarHBondContact O-N 3.28Å; K97-S100 CarbonylContact O-C 3.56Å; K97-S100 PolarHBondContact O-N 3.1Å; E98-S100 VanDerWaalsContact C-N 3.28Å; E98-S100 PolarHBondContact O-N 2.82Å; S100-K105 WeakPolarHBondContact O-CB 3.4Å
101	E	86	Confident	88.4	Confident	100 Å²	100	102.2 Å²	102.2	47%	0.467	50%	0.498	S	S	.	.	S	Bend	trans	-79.9	144.3	-176.6	-87.6	178	-171.4	0	0	114	K97 Y103 K104	K97-E101 WeakPolarHBondContact CE-OE1 3.29Å; K97-E101 WeakPolarHBondContact O-CG 3.26Å; K97-E101 PolarHBondContact O-N 3.26Å; K97-E101 VanDerWaalsContact O-N 3.14Å; E101-Y103 PolarHBondContact O-N 2.9Å; E101-K104 WeakPolarHBondContact O-CB 3.35Å; E101-K104 PolarHBondContact O-N 3.06Å; E101-K104 VanDerWaalsContact O-N 3.09Å
102	G	86.3	Confident	88.5	Confident	57 Å²	57	102 Å²	102	59%	0.588	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	-119.8	172.8	0	0	0	0	0	113.3	K105	G102-K105 WeakPolarHBondContact O-CE 3.41Å; G102-K105 WeakPolarHBondContact O-CG 3.22Å
103	Y	82.1	Confident	88.7	Confident	91 Å²	91	95.4 Å²	95.4	36%	0.357	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-13.7	-178.7	75.3	-87.6	0	0	0	113.4	E101 K105 Y106	E101-Y103 PolarHBondContact O-N 2.9Å; Y103-K105 PolarHBondContact O-N 3.04Å; Y103-Y106 WeakPolarHBondContact O-CD2 3.35Å; Y103-Y106 PolarHBondContact O-N 3.18Å
104	K	84	Confident	88.7	Confident	64 Å²	64	91.5 Å²	91.5	28%	0.278	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-23.2	-175.6	-62.6	176.2	-179.1	174.3	0	112.6	E98 A99 E101 Y106	E98-K104 WeakPolarHBondContact O-CD 3.42Å; E98-K104 PolarHBondContact O-NZ 3.02Å; E98-K104 IonicContact OE1-NZ 2.88Å; E98-K104 PolarHBondContact OE1-NZ 3.45Å; A99-K104 WeakPolarHBondContact O-CB 3.43Å; E101-K104 WeakPolarHBondContact O-CB 3.35Å; E101-K104 PolarHBondContact O-N 3.06Å; E101-K104 VanDerWaalsContact O-N 3.09Å; K104-Y106 VanDerWaalsContact C-N 3.28Å; K104-Y106 PolarHBondContact O-N 3.07Å
105	K	83.6	Confident	88.7	Confident	119 Å²	119	89.4 Å²	89.4	52%	0.517	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-19.6	176	69.7	-171.8	180	178.5	0	115.3	S100 G102 Y103	S100-K105 WeakPolarHBondContact O-CB 3.4Å; G102-K105 WeakPolarHBondContact O-CE 3.41Å; G102-K105 WeakPolarHBondContact O-CG 3.22Å; Y103-K105 PolarHBondContact O-N 3.04Å
106	Y	87.6	Confident	88.2	Confident	147 Å²	147	86.4 Å²	86.4	58%	0.576	42%	0.418	S	S	*	.	S	Bend	trans	-83	145.8	-176.2	-61.6	-68.3	0	0	0	110.9	Y103 K104 R108	Y103-Y106 WeakPolarHBondContact O-CD2 3.35Å; Y103-Y106 PolarHBondContact O-N 3.18Å; K104-Y106 VanDerWaalsContact C-N 3.28Å; K104-Y106 PolarHBondContact O-N 3.07Å; Y106-R108 PolarHBondContact O-N 3.08Å
107	N	88.7	Confident	87.9	Confident	125 Å²	125	86.2 Å²	86.2	67%	0.668	42%	0.417	S	S	*	.			trans	-57.9	129.4	177.5	-66.4	-9.3	0	0	0	110.7	Y109	N107-Y109 HydrophobicContact CB-CE2 3.68Å; N107-Y109 PolarHBondContact ND2-OH 3.18Å
108	R	88.3	Confident	87.3	Confident	30 Å²	30	81 Å²	81	11%	0.113	40%	0.399	C	S	.	.			trans	-111.3	136	177.4	-71.3	178.3	-78	-177.3	-6.6	109.5	W82 S83 Y106 W110	W82-R108 VanDerWaalsContact CA-NH2 3.28Å; W82-R108 VanDerWaalsContact CB-NH2 3.32Å; W82-R108 VanDerWaalsContact CG-CZ 3.42Å; W82-R108 PolarHBondContact O-NE 2.77Å; W82-R108 VanDerWaalsContact O-NE 3.08Å; W82-R108 PolarHBondContact O-NH2 3.44Å; W82-R108 VanDerWaalsContact O-NH2 3.07Å; S83-R108 WeakPolarHBondContact CB-O 3.43Å; S83-R108 PolarHBondContact OG-O 2.63Å; Y106-R108 PolarHBondContact O-N 3.08Å; R108-W110 HydrophobicContact CB-CZ2 4.18Å
109	Y	90.4	Very high	86.4	Confident	162 Å²	162	81.9 Å²	81.9	64%	0.635	40%	0.401	S	S	*	.			trans	-132	143.7	177.2	-56.6	-82.4	0	0	0	109.7	F41 M42 N107	F41-Y109 HydrophobicContact CZ-CD1 4.36Å; M42-Y109 HydrophobicContact CE-CD1 4.36Å; N107-Y109 HydrophobicContact CB-CE2 3.68Å; N107-Y109 PolarHBondContact ND2-OH 3.18Å
110	W	92.5	Very high	85.5	Confident	21 Å²	21	85.9 Å²	85.9	8%	0.08	41%	0.412	C	S	.	.			trans	-126.6	139.1	-173.2	-45.1	91.4	0	0	0	109.2	F41 Q79 W82 S83 R108 D115 M116 Y134	F41-W110 HydrophobicContact CD1-CB 3.8Å; F41-W110 AromaticContact CD1-CD1 3.83Å; F41-W110 HydrophobicContact CD1-CG 4.23Å; F41-W110 HydrophobicContact CE1-CB 3.92Å; F41-W110 AromaticContact CE1-CD1 3.91Å; F41-W110 HydrophobicContact CE1-CG 4.35Å; F41-W110 VanDerWaalsContact CE1-O 3.29Å; F41-W110 WeakPolarHBondContact CE1-O 3.38Å; F41-W110 AromaticContact CG-CD1 3.91Å; Q79-W110 HydrophobicContact CB-CD2 4.26Å; Q79-W110 HydrophobicContact CB-CG 3.97Å; Q79-W110 HydrophobicContact CG-CB 4.41Å; Q79-W110 HydrophobicContact CG-CD2 3.65Å; Q79-W110 HydrophobicContact CG-CE3 4.22Å; Q79-W110 HydrophobicContact CG-CG 3.71Å; Q79-W110 HydrophobicContact CG-CZ2 4.31Å; Q79-W110 PolarHBondContact O-NE1 3.16Å; W82-W110 HydrophobicContact CB-CZ2 4.39Å; W82-W110 HydrophobicContact CD2-CZ2 4.44Å; W82-W110 AromaticContact CE3-CH2 3.7Å; W82-W110 HydrophobicContact CE3-CH2 3.7Å; W82-W110 AromaticContact CE3-CZ2 3.45Å; W82-W110 HydrophobicContact CE3-CZ2 3.45Å; W82-W110 VanDerWaalsContact CE3-CZ2 3.45Å; W82-W110 AromaticContact CZ3-CH2 3.82Å; W82-W110 HydrophobicContact CZ3-CH2 3.82Å; W82-W110 HydrophobicContact CZ3-CZ2 4.06Å; S83-W110 PolarHBondContact OG-NE1 3.14Å; R108-W110 HydrophobicContact CB-CZ2 4.18Å; W110-D115 HydrophobicContact CE3-CB 3.69Å; W110-D115 HydrophobicContact CZ3-CB 4.34Å; W110-M116 HydrophobicContact CZ3-CB 4.26Å; W110-Y134 VanDerWaalsContact CH2-CB 3.49Å; W110-Y134 HydrophobicContact CH2-CD1 4.49Å; W110-Y134 HydrophobicContact CH2-CG 4.01Å; W110-Y134 HydrophobicContact CZ3-CD2 4.4Å; W110-Y134 HydrophobicContact CZ3-CG 4.21Å
111	K	92.3	Very high	84.7	Confident	200 Å²	200	88.5 Å²	88.5	87%	0.87	42%	0.419	S	S	*	.	S	Bend	trans	-93	-35.4	171.9	-64.6	-172.5	175.3	-170.5	0	111.2	D115	K111-D115 WeakPolarHBondContact CA-OD2 3.4Å; K111-D115 WeakPolarHBondContact CB-OD2 3.44Å; K111-D115 PolarHBondContact N-OD2 2.7Å
112	S	93.8	Very high	83.5	Confident	45 Å²	45	87.5 Å²	87.5	32%	0.315	42%	0.42	S	S	.	.	S	Bend	trans	-132.8	152.4	-178.5	172.5	0	0	0	0	111.5	Q79 T114 D115	Q79-S112 PolarHBondContact NE2-O 3.44Å; S112-T114 PolarHBondContact O-N 3.09Å; S112-T114 PolarHBondContact OG-N 3.23Å; S112-T114 VanDerWaalsContact OG-N 3.1Å; S112-T114 PolarHBondContact OG-OG1 3.43Å; S112-D115 PolarHBondContact N-OD2 2.7Å; S112-D115 VanDerWaalsContact N-OD2 3.08Å; S112-D115 WeakPolarHBondContact O-CB 3.43Å; S112-D115 PolarHBondContact O-N 3.24Å
113	H	94.3	Very high	82.4	Confident	43 Å²	43	89.2 Å²	89.2	20%	0.199	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.2	170	79.4	73	0	0	0	112.8	I72 R75 L76	I72-H113 HydrophobicContact CG2-CB 4.25Å; R75-H113 HydrophobicContact CB-CB 4.35Å; R75-H113 WeakPolarHBondContact CD-O 3.48Å; R75-H113 PolarHBondContact NH1-CE1 2.97Å; L76-H113 HydrophobicContact CD2-CB 3.59Å; L76-H113 HydrophobicContact CG-CB 4.02Å
114	T	92.6	Very high	81.6	Confident	62 Å²	62	91.7 Å²	91.7	38%	0.38	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-9.1	176.9	55.9	0	0	0	0	113.9	S112 M116 Y117 S118	S112-T114 PolarHBondContact O-N 3.09Å; S112-T114 PolarHBondContact OG-N 3.23Å; S112-T114 VanDerWaalsContact OG-N 3.1Å; S112-T114 PolarHBondContact OG-OG1 3.43Å; T114-M116 PolarHBondContact O-N 3.01Å; T114-Y117 PolarHBondContact O-N 3.37Å; T114-S118 PolarHBondContact O-N 3.08Å
115	D	89.5	Confident	81	Confident	26 Å²	26	94.9 Å²	94.9	14%	0.139	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-61.1	-24.4	-172.6	-81.8	-5.4	0	0	0	113.4	W110 K111 S112 Y117 S118	W110-D115 HydrophobicContact CE3-CB 3.69Å; W110-D115 HydrophobicContact CZ3-CB 4.34Å; K111-D115 WeakPolarHBondContact CA-OD2 3.4Å; K111-D115 WeakPolarHBondContact CB-OD2 3.44Å; K111-D115 PolarHBondContact N-OD2 2.7Å; S112-D115 PolarHBondContact N-OD2 2.7Å; S112-D115 VanDerWaalsContact N-OD2 3.08Å; S112-D115 WeakPolarHBondContact O-CB 3.43Å; S112-D115 PolarHBondContact O-N 3.24Å; D115-Y117 PolarHBondContact O-N 3.21Å; D115-S118 WeakPolarHBondContact O-CB 3.42Å; D115-S118 PolarHBondContact O-N 3.45Å; D115-S118 PolarHBondContact O-OG 3.31Å
116	M	83.1	Confident	80.3	Confident	21 Å²	21	93.7 Å²	93.7	10%	0.103	48%	0.48	C	S	.	.	G	3₁₀ helix	trans	-55.6	-35.4	171.9	-175.2	177.9	74.7	0	0	112.6	M78 W82 W110 T114 Y134	M78-M116 HydrophobicContact CE-CE 3.55Å; M78-M116 HydrophobicContact CE-SD 3.17Å; M78-M116 WeakPolarHBondContact CE-SD 3.45Å; M78-M116 HydrophobicContact SD-SD 3.95Å; W82-M116 HydrophobicContact CH2-CG 4.01Å; W82-M116 HydrophobicContact CH2-SD 3.43Å; W82-M116 WeakPolarHBondContact CH2-SD 3.3Å; W82-M116 HydrophobicContact CZ3-CG 3.76Å; W82-M116 HydrophobicContact CZ3-SD 3.5Å; W82-M116 VanDerWaalsContact CZ3-SD 3.5Å; W110-M116 HydrophobicContact CZ3-CB 4.26Å; T114-M116 PolarHBondContact O-N 3.01Å; M116-Y134 WeakPolarHBondContact CG-O 3.16Å
117	Y	82.8	Confident	79	Confident	138 Å²	138	89.6 Å²	89.6	54%	0.541	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-92.4	-8.1	177.9	-49.4	-69.9	0	0	0	112.9	R75 T114 D115 K119	R75-Y117 PolarHBondContact NE-OH 3.21Å; T114-Y117 PolarHBondContact O-N 3.37Å; D115-Y117 PolarHBondContact O-N 3.21Å; Y117-K119 PolarHBondContact O-N 3.38Å
118	S	77.9	Confident	77.4	Confident	38 Å²	38	93 Å²	93	27%	0.266	48%	0.482	S	S	.	.			trans	-69.1	117.7	-177.9	74.5	0	0	0	0	110	T114 D115 K120	T114-S118 PolarHBondContact O-N 3.08Å; D115-S118 WeakPolarHBondContact O-CB 3.42Å; D115-S118 PolarHBondContact O-N 3.45Å; D115-S118 PolarHBondContact O-OG 3.31Å; S118-K120 PolarHBondContact O-N 3.32Å
119	K	68.2	Low	75.7	Confident	124 Å²	124	100 Å²	100	54%	0.539	51%	0.51	S	S	.	.			trans	-79.2	101.4	171.2	-67.1	-178.3	-176.2	175	0	108.1	Y117 I121 I131	Y117-K119 PolarHBondContact O-N 3.38Å; K119-I121 PolarHBondContact O-N 3.49Å; K119-I131 HydrophobicContact CB-CG2 4.34Å; K119-I131 HydrophobicContact CD-CD1 4.37Å; K119-I131 HydrophobicContact CD-CG2 4.04Å; K119-I131 HydrophobicContact CG-CG2 3.86Å
120	K	66.4	Low	74.1	Confident	119 Å²	119	99 Å²	99	52%	0.517	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	103.6	165.8	-73.2	-176.3	-178.3	172.4	0	108.9	S118 T122	S118-K120 PolarHBondContact O-N 3.32Å; K120-T122 PolarHBondContact O-N 3.32Å; K120-T122 VanDerWaalsContact O-N 3.15Å
121	I	67.5	Low	72.3	Confident	126 Å²	126	102.8 Å²	102.8	65%	0.646	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	110.8	168.6	-59.2	174.3	0	0	0	106.4	K119 V123	K119-I121 PolarHBondContact O-N 3.49Å; I121-V123 HydrophobicContact CG2-CG2 3.83Å
122	T	60.8	Low	70.4	Confident	80 Å²	80	96.7 Å²	96.7	49%	0.491	50%	0.5	S	S	.	.			trans	-94.4	102.7	173.5	-46.6	0	0	0	0	107.3	K120 K124	K120-T122 PolarHBondContact O-N 3.32Å; K120-T122 VanDerWaalsContact O-N 3.15Å; T122-K124 PolarHBondContact O-N 3.39Å
123	V	64.5	Low	68.2	Low	93 Å²	93	103.3 Å²	103.3	56%	0.564	52%	0.518	S	S	*	.			trans	-85	108.3	174.6	-175.8	0	0	0	0	107.5	I121 Y129	I121-V123 HydrophobicContact CG2-CG2 3.83Å; V123-Y129 HydrophobicContact CG1-CE1 4.23Å; V123-Y129 HydrophobicContact CG2-CE1 4.23Å
124	K	65.4	Low	66.2	Low	142 Å²	142	105.7 Å²	105.7	62%	0.617	53%	0.526	S	S	*	.			trans	-98.7	117.8	164.6	-79.1	-158.5	-179.6	-166	0	107.7	T122 G126 S127	T122-K124 PolarHBondContact O-N 3.39Å; K124-G126 PolarHBondContact O-N 3.15Å; K124-S127 WeakPolarHBondContact CB-OG 3.42Å; K124-S127 PolarHBondContact O-N 3.44Å; K124-S127 PolarHBondContact O-OG 3.21Å
125	P	70.7	Confident	64.9	Low	131 Å²	131	107.9 Å²	107.9	85%	0.851	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	126.7	178.4	-20.5	30.2	0	0	0	110.1
126	G	69.7	Low	63.6	Low	94 Å²	94	112.2 Å²	112.2	97%	0.969	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	82	16.1	177.9	0	0	0	0	0	116.6	K124	K124-G126 PolarHBondContact O-N 3.15Å
127	S	59.7	Low	62.5	Low	61 Å²	61	117.3 Å²	117.3	43%	0.427	58%	0.579	S	S	.	*	S	Bend	trans	-135.4	162.1	176.2	73.5	0	0	0	0	113.5	K124	K124-S127 WeakPolarHBondContact CB-OG 3.42Å; K124-S127 PolarHBondContact O-N 3.44Å; K124-S127 PolarHBondContact O-OG 3.21Å
128	F	55.2	Low	61.3	Low	198 Å²	198	116.1 Å²	116.1	87%	0.868	58%	0.582	S	S	*	*			trans	-64	142.2	177.6	-63.9	-82.6	0	0	0	112.5
129	Y	53	Low	60.2	Low	177 Å²	177	120.9 Å²	120.9	69%	0.694	60%	0.601	S	S	*	*			trans	-74.9	138.8	174.3	-51.6	-82.1	0	0	0	110.8	V123	V123-Y129 HydrophobicContact CG1-CE1 4.23Å; V123-Y129 HydrophobicContact CG2-CE1 4.23Å
130	Y	55.4	Low	59.7	Low	140 Å²	140	120.7 Å²	120.7	55%	0.549	61%	0.605	S	S	.	*			trans	-136.1	140.7	162.9	68.8	-87.6	0	0	0	110.9	K132	Y130-K132 HydrophobicContact CD2-CB 4.31Å; Y130-K132 HydrophobicContact CD2-CG 4.24Å; Y130-K132 HydrophobicContact CE2-CB 4.04Å; Y130-K132 HydrophobicContact CE2-CD 3.77Å; Y130-K132 HydrophobicContact CE2-CG 3.74Å; Y130-K132 PolarHBondContact O-N 3.22Å
131	I	54.9	Low	59.2	Low	100 Å²	100	120.9 Å²	120.9	51%	0.513	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.2	106.2	173.9	-61.2	170.6	0	0	0	106.9	K119 R133	K119-I131 HydrophobicContact CB-CG2 4.34Å; K119-I131 HydrophobicContact CD-CD1 4.37Å; K119-I131 HydrophobicContact CD-CG2 4.04Å; K119-I131 HydrophobicContact CG-CG2 3.86Å; I131-R133 HydrophobicContact CG2-CG 4.39Å; I131-R133 PolarHBondContact O-N 3.24Å
132	K	53.5	Low	58.6	Low	72 Å²	72	120.5 Å²	120.5	31%	0.313	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.3	109.9	168.1	-126.6	175.1	-166.4	172.2	0	108	Y130	Y130-K132 HydrophobicContact CD2-CB 4.31Å; Y130-K132 HydrophobicContact CD2-CG 4.24Å; Y130-K132 HydrophobicContact CE2-CB 4.04Å; Y130-K132 HydrophobicContact CE2-CD 3.77Å; Y130-K132 HydrophobicContact CE2-CG 3.74Å; Y130-K132 PolarHBondContact O-N 3.22Å
133	R	46.3	Very low	58.4	Low	184 Å²	184	123.8 Å²	123.8	69%	0.694	62%	0.619	S	S	*	*			trans	-86.7	131.7	160.6	-69.8	-172.8	-176.5	-168.8	2.6	106.9	I131	I131-R133 HydrophobicContact CG2-CG 4.39Å; I131-R133 PolarHBondContact O-N 3.24Å
134	Y	52.7	Low	57.9	Low	94 Å²	94	126.6 Å²	126.6	37%	0.369	62%	0.624	S	S	.	*			trans	-89.6	0	173.6	-63.4	-84.3	0	0	0	110.8	W82 W110 M116	W82-Y134 WeakPolarHBondContact CH2-OXT 3.45Å; W110-Y134 VanDerWaalsContact CH2-CB 3.49Å; W110-Y134 HydrophobicContact CH2-CD1 4.49Å; W110-Y134 HydrophobicContact CH2-CG 4.01Å; W110-Y134 HydrophobicContact CZ3-CD2 4.4Å; W110-Y134 HydrophobicContact CZ3-CG 4.21Å; M116-Y134 WeakPolarHBondContact CG-O 3.16Å

Retrieved 134 of 134 residues in 111.2 ms (Link to these results)

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