A0A5K4FAS6_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4FAS6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 143 aa.

						>A0A5K4FAS6_SCHMA|A0A5K4FAS6
MTDLNVDLNNRRRLICQCLCPCSIDRTLNDVRDENVYYSEEDKEAEEEEEEEGIFLTSKAKALSNLLFLKDDIFEMETLNLYNKKAITIQLWNSEHHLNNRYWEEFQSQPQVIKRYLQNEAKQMNRYALITMLSNVSGPIVQI
					

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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	36.1	Very low	39.3	Very low	247 Å²	247	112.2 Å²	112.2	100%	1.217	59%	0.588	S	S	*	*				0	95.8	0	-89.4	172.2	170.6	0	0	107.1
2	T	35.1	Very low	39.6	Very low	145 Å²	145	114.1 Å²	114.1	89%	0.89	58%	0.581	S	S	*	*			trans	-85.1	123.2	169.3	16.4	0	0	0	0	107	L4	T2-L4 PolarHBondContact O-N 2.87Å
3	D	35.9	Very low	39.9	Very low	107 Å²	107	118.2 Å²	118.2	57%	0.572	59%	0.585	S	S	*	*			trans	-50.4	114.5	-168.5	-90.7	-49.1	0	0	0	113.2	N5 V6 D7	D3-N5 PolarHBondContact O-N 3.02Å; D3-V6 HydrophobicContact CB-CB 4.01Å; D3-V6 HydrophobicContact CB-CG2 3.55Å; D3-V6 WeakPolarHBondContact O-CB 3.37Å; D3-V6 PolarHBondContact O-N 3.29Å; D3-D7 PolarHBondContact O-N 3.07Å
4	L	34.1	Very low	39.8	Very low	133 Å²	133	116 Å²	116	70%	0.696	58%	0.576	S	S	*	*	H	α-helix	trans	-50.3	-32.4	168.1	-136.5	90.4	0	0	0	111.3	T2 D7 L8	T2-L4 PolarHBondContact O-N 2.87Å; L4-D7 PolarHBondContact O-N 3.21Å; L4-L8 PolarHBondContact O-N 3.48Å
5	N	36.5	Very low	39.8	Very low	108 Å²	108	111.5 Å²	111.5	58%	0.578	55%	0.554	S	S	*	*	H	α-helix	trans	-67.5	-30.6	176.9	-71.3	-30.1	0	0	0	113.6	D3 N9	D3-N5 PolarHBondContact O-N 3.02Å; N5-N9 WeakPolarHBondContact O-CB 3.45Å; N5-N9 PolarHBondContact O-N 2.96Å; N5-N9 PolarHBondContact O-ND2 3.43Å
6	V	34.4	Very low	39.5	Very low	76 Å²	76	110.2 Å²	110.2	46%	0.461	56%	0.558	S	S	.	*	H	α-helix	trans	-73	-39.7	176.7	172.5	0	0	0	0	110.1	D3 N9 N10	D3-V6 HydrophobicContact CB-CB 4.01Å; D3-V6 HydrophobicContact CB-CG2 3.55Å; D3-V6 WeakPolarHBondContact O-CB 3.37Å; D3-V6 PolarHBondContact O-N 3.29Å; V6-N9 PolarHBondContact O-N 2.96Å; V6-N10 WeakPolarHBondContact O-CB 3.4Å; V6-N10 VanDerWaalsContact O-CG 3.27Å; V6-N10 PolarHBondContact O-N 3.02Å; V6-N10 PolarHBondContact O-ND2 2.87Å
7	D	45.7	Very low	39.1	Very low	75 Å²	75	109.2 Å²	109.2	40%	0.401	55%	0.551	S	S	.	*	H	α-helix	trans	-66.5	-43.6	175.9	-167.6	23	0	0	0	111.3	D3 L4 N9 N10 R11	D3-D7 PolarHBondContact O-N 3.07Å; L4-D7 PolarHBondContact O-N 3.21Å; D7-N9 PolarHBondContact O-N 3.45Å; D7-N10 PolarHBondContact O-N 3.42Å; D7-R11 WeakPolarHBondContact O-CB 3.29Å; D7-R11 VanDerWaalsContact O-CG 3.25Å; D7-R11 WeakPolarHBondContact O-CG 3.46Å; D7-R11 PolarHBondContact O-N 3.39Å; D7-R11 IonicContact OD1-CZ 4Å; D7-R11 IonicContact OD1-NE 3.22Å; D7-R11 PolarHBondContact OD1-NE 3.1Å; D7-R11 IonicContact OD1-NH2 3.88Å; D7-R11 IonicContact OD2-CZ 3.25Å; D7-R11 VanDerWaalsContact OD2-CZ 3.25Å; D7-R11 IonicContact OD2-NE 3.21Å; D7-R11 PolarHBondContact OD2-NE 2.78Å; D7-R11 IonicContact OD2-NH2 2.71Å; D7-R11 PolarHBondContact OD2-NH2 3.41Å
8	L	42.1	Very low	39	Very low	49 Å²	49	106.3 Å²	106.3	26%	0.257	54%	0.542	S	S	.	.	H	α-helix	trans	-60.1	-45.3	174	-98.1	147.3	0	0	0	113.2	L4 R11 R12 E120	L4-L8 PolarHBondContact O-N 3.48Å; L8-R11 PolarHBondContact O-N 3.2Å; L8-R12 WeakPolarHBondContact O-CB 3.46Å; L8-R12 WeakPolarHBondContact O-CG 3.17Å; L8-R12 PolarHBondContact O-N 2.88Å; L8-E120 WeakPolarHBondContact CD2-OE1 3.49Å
9	N	43.8	Very low	38.9	Very low	99 Å²	99	105.9 Å²	105.9	53%	0.529	54%	0.54	S	S	.	.	H	α-helix	trans	-67.1	-37.8	177.9	-81.5	-29.8	0	0	0	112.3	N5 V6 D7 R12 R13	N5-N9 WeakPolarHBondContact O-CB 3.45Å; N5-N9 PolarHBondContact O-N 2.96Å; N5-N9 PolarHBondContact O-ND2 3.43Å; V6-N9 PolarHBondContact O-N 2.96Å; D7-N9 PolarHBondContact O-N 3.45Å; N9-R12 PolarHBondContact O-N 2.87Å; N9-R13 VanDerWaalsContact O-CB 3.31Å; N9-R13 WeakPolarHBondContact O-CB 2.78Å; N9-R13 PolarHBondContact O-N 3.26Å
10	N	45.7	Very low	38.6	Very low	82 Å²	82	102.8 Å²	102.8	44%	0.439	53%	0.528	S	S	.	.	H	α-helix	trans	-65.4	-43.3	174.4	-76.7	-21.9	0	0	0	111.6	V6 D7 R13 L14	V6-N10 WeakPolarHBondContact O-CB 3.4Å; V6-N10 VanDerWaalsContact O-CG 3.27Å; V6-N10 PolarHBondContact O-N 3.02Å; V6-N10 PolarHBondContact O-ND2 2.87Å; D7-N10 PolarHBondContact O-N 3.42Å; N10-R13 PolarHBondContact O-N 3.35Å; N10-L14 WeakPolarHBondContact O-CG 3.44Å; N10-L14 PolarHBondContact O-N 2.94Å
11	R	43.3	Very low	38.4	Very low	113 Å²	113	101.6 Å²	101.6	43%	0.426	53%	0.527	S	S	.	.	H	α-helix	trans	-61.2	-45.5	174.6	-71.7	174.5	-168.3	-158.6	4.9	111.9	D7 L8 R13 L14 I15 M124	D7-R11 WeakPolarHBondContact O-CB 3.29Å; D7-R11 VanDerWaalsContact O-CG 3.25Å; D7-R11 WeakPolarHBondContact O-CG 3.46Å; D7-R11 PolarHBondContact O-N 3.39Å; D7-R11 IonicContact OD1-CZ 4Å; D7-R11 IonicContact OD1-NE 3.22Å; D7-R11 PolarHBondContact OD1-NE 3.1Å; D7-R11 IonicContact OD1-NH2 3.88Å; D7-R11 IonicContact OD2-CZ 3.25Å; D7-R11 VanDerWaalsContact OD2-CZ 3.25Å; D7-R11 IonicContact OD2-NE 3.21Å; D7-R11 PolarHBondContact OD2-NE 2.78Å; D7-R11 IonicContact OD2-NH2 2.71Å; D7-R11 PolarHBondContact OD2-NH2 3.41Å; L8-R11 PolarHBondContact O-N 3.2Å; R11-R13 VanDerWaalsContact C-N 3.34Å; R11-R13 PolarHBondContact O-N 2.82Å; R11-L14 PolarHBondContact O-N 3.49Å; R11-I15 VanDerWaalsContact O-CG1 3.25Å; R11-I15 WeakPolarHBondContact O-CG1 3.5Å; R11-I15 PolarHBondContact O-N 2.71Å; R11-M124 PolarHBondContact NH1-SD 3.45Å
12	R	42.8	Very low	38.2	Very low	135 Å²	135	95.1 Å²	95.1	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-61.2	-40.4	174.9	-75	177.6	178.5	-173.7	-0.6	112.5	L8 N9 I15 C16	L8-R12 WeakPolarHBondContact O-CB 3.46Å; L8-R12 WeakPolarHBondContact O-CG 3.17Å; L8-R12 PolarHBondContact O-N 2.88Å; N9-R12 PolarHBondContact O-N 2.87Å; R12-I15 PolarHBondContact O-N 3.49Å; R12-C16 PolarHBondContact O-N 3.24Å
13	R	43.1	Very low	38.3	Very low	167 Å²	167	91.9 Å²	91.9	63%	0.63	49%	0.488	S	S	*	.	H	α-helix	trans	-66	-41.1	177.4	-172.2	177.5	171.2	-174.9	-1.6	111.8	N9 N10 R11 C16 Q17	N9-R13 VanDerWaalsContact O-CB 3.31Å; N9-R13 WeakPolarHBondContact O-CB 2.78Å; N9-R13 PolarHBondContact O-N 3.26Å; N10-R13 PolarHBondContact O-N 3.35Å; R11-R13 VanDerWaalsContact C-N 3.34Å; R11-R13 PolarHBondContact O-N 2.82Å; R13-C16 PolarHBondContact O-N 3.37Å; R13-Q17 WeakPolarHBondContact O-CG 3.27Å; R13-Q17 PolarHBondContact O-N 3.42Å
14	L	39	Very low	38.6	Very low	88 Å²	88	89.9 Å²	89.9	46%	0.461	48%	0.476	S	S	.	.	H	α-helix	trans	-60.6	-45.9	172.8	-78.1	161.2	0	0	0	111	N10 R11 C16 Q17 C18 Y127	N10-L14 WeakPolarHBondContact O-CG 3.44Å; N10-L14 PolarHBondContact O-N 2.94Å; R11-L14 PolarHBondContact O-N 3.49Å; L14-C16 PolarHBondContact O-N 3.42Å; L14-Q17 WeakPolarHBondContact O-CB 3.46Å; L14-Q17 PolarHBondContact O-N 3.38Å; L14-C18 PolarHBondContact O-N 3.01Å; L14-Y127 PolarHBondContact O-OH 3.45Å; L14-Y127 VanDerWaalsContact O-OH 3.08Å
15	I	39	Very low	38.9	Very low	49 Å²	49	87.3 Å²	87.3	25%	0.251	46%	0.463	S	S	.	.	H	α-helix	trans	-55.6	-49.1	175.4	-67.8	163.2	0	0	0	111.4	R11 R12 Q17 C18 L19 Y127	R11-I15 VanDerWaalsContact O-CG1 3.25Å; R11-I15 WeakPolarHBondContact O-CG1 3.5Å; R11-I15 PolarHBondContact O-N 2.71Å; R12-I15 PolarHBondContact O-N 3.49Å; I15-Q17 VanDerWaalsContact C-N 3.3Å; I15-Q17 PolarHBondContact O-N 3.4Å; I15-C18 PolarHBondContact O-N 3.44Å; I15-L19 HydrophobicContact CG2-CD1 3.6Å; I15-L19 HydrophobicContact CG2-CG 4.36Å; I15-L19 WeakPolarHBondContact O-CB 3.43Å; I15-L19 VanDerWaalsContact O-CG 3.29Å; I15-L19 WeakPolarHBondContact O-CG 3.5Å; I15-L19 PolarHBondContact O-N 3.28Å; I15-Y127 VanDerWaalsContact CA-CE2 3.48Å; I15-Y127 HydrophobicContact CB-CD2 4.24Å; I15-Y127 HydrophobicContact CB-CE2 4.03Å; I15-Y127 HydrophobicContact CD1-CG 4.47Å; I15-Y127 HydrophobicContact CG1-CD1 3.95Å; I15-Y127 HydrophobicContact CG1-CD2 3.6Å; I15-Y127 HydrophobicContact CG1-CE1 4Å; I15-Y127 HydrophobicContact CG1-CE2 3.66Å; I15-Y127 HydrophobicContact CG1-CG 3.73Å; I15-Y127 HydrophobicContact CG2-CD2 4.34Å; I15-Y127 HydrophobicContact CG2-CE2 4.42Å; I15-Y127 PolarHBondContact N-OH 3.24Å
16	C	34.9	Very low	39	Very low	90 Å²	90	90.7 Å²	90.7	61%	0.608	47%	0.468	S	S	*	.	H	α-helix	trans	-62.6	-33.6	176.1	-88.1	0	0	0	0	113.4	R12 R13 L14 C20	R12-C16 PolarHBondContact O-N 3.24Å; R13-C16 PolarHBondContact O-N 3.37Å; L14-C16 PolarHBondContact O-N 3.42Å; C16-C20 WeakPolarHBondContact O-CB 3.22Å; C16-C20 PolarHBondContact O-N 3Å
17	Q	33.5	Very low	39.3	Very low	93 Å²	93	92.6 Å²	92.6	44%	0.435	48%	0.48	S	S	.	.	H	α-helix	trans	-69.8	-39.3	179.1	-77.7	176.6	-31.4	0	0	112.3	R13 L14 I15 S23	R13-Q17 WeakPolarHBondContact O-CG 3.27Å; R13-Q17 PolarHBondContact O-N 3.42Å; L14-Q17 WeakPolarHBondContact O-CB 3.46Å; L14-Q17 PolarHBondContact O-N 3.38Å; I15-Q17 VanDerWaalsContact C-N 3.3Å; I15-Q17 PolarHBondContact O-N 3.4Å; Q17-S23 WeakPolarHBondContact O-CB 3.49Å; Q17-S23 PolarHBondContact O-OG 2.99Å
18	C	36.8	Very low	39.1	Very low	58 Å²	58	95.3 Å²	95.3	39%	0.392	49%	0.494	S	S	.	.	H	α-helix	trans	-74.5	-30.8	175.7	-69.5	0	0	0	0	113	L14 I15 C20 Y127	L14-C18 PolarHBondContact O-N 3.01Å; I15-C18 PolarHBondContact O-N 3.44Å; C18-C20 VanDerWaalsContact C-N 3.35Å; C18-Y127 HydrophobicContact CB-CE2 3.88Å; C18-Y127 PolarHBondContact SG-OH 3.33Å
19	L	37.2	Very low	39	Very low	98 Å²	98	94.6 Å²	94.6	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-82.8	-10.6	175.4	-67.1	172.7	0	0	0	113.4	I15 P21 L67	I15-L19 HydrophobicContact CG2-CD1 3.6Å; I15-L19 HydrophobicContact CG2-CG 4.36Å; I15-L19 WeakPolarHBondContact O-CB 3.43Å; I15-L19 VanDerWaalsContact O-CG 3.29Å; I15-L19 WeakPolarHBondContact O-CG 3.5Å; I15-L19 PolarHBondContact O-N 3.28Å; L19-P21 WeakPolarHBondContact O-CD 3.36Å; L19-L67 HydrophobicContact CD2-CD1 3.99Å
20	C	33.4	Very low	38.7	Very low	43 Å²	43	96.2 Å²	96.2	29%	0.291	50%	0.499	S	S	.	.			trans	-71.6	113.1	178	-165.9	0	0	0	0	109	C16 C18 C22 S23	C16-C20 WeakPolarHBondContact O-CB 3.22Å; C16-C20 PolarHBondContact O-N 3Å; C18-C20 VanDerWaalsContact C-N 3.35Å; C20-C22 PolarHBondContact O-N 2.92Å; C20-S23 PolarHBondContact O-N 3.35Å
21	P	34	Very low	38.6	Very low	79 Å²	79	96 Å²	96	51%	0.513	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-7.9	178.6	-18	32.6	0	0	0	113.2	L19	L19-P21 WeakPolarHBondContact O-CD 3.36Å
22	C	32.9	Very low	38.6	Very low	110 Å²	110	99.6 Å²	99.6	74%	0.743	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-18.3	177.9	-46.4	0	0	0	0	113.1	C20	C20-C22 PolarHBondContact O-N 2.92Å
23	S	37.2	Very low	38.6	Very low	78 Å²	78	97.2 Å²	97.2	55%	0.545	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-17.1	179.8	-48.2	0	0	0	0	112.8	Q17 C20 D25	Q17-S23 WeakPolarHBondContact O-CB 3.49Å; Q17-S23 PolarHBondContact O-OG 2.99Å; C20-S23 PolarHBondContact O-N 3.35Å; S23-D25 PolarHBondContact O-N 2.91Å
24	I	41.1	Very low	38.6	Very low	64 Å²	64	95 Å²	95	33%	0.328	51%	0.509	S	S	.	.	S	Bend	trans	-71.2	111.5	170.2	-62.9	176.4	0	0	0	106.3	R26 N29	I24-R26 PolarHBondContact O-N 3.49Å; I24-N29 WeakPolarHBondContact CG2-ND2 3.35Å
25	D	40.5	Very low	38.8	Very low	79 Å²	79	94.8 Å²	94.8	42%	0.422	51%	0.508	S	S	.	.			trans	-56.2	106.4	171.7	-172.2	-9.7	0	0	0	108.3	S23 T27 L28 N29	S23-D25 PolarHBondContact O-N 2.91Å; D25-T27 PolarHBondContact O-N 3.03Å; D25-T27 WeakPolarHBondContact OD1-CB 3.38Å; D25-T27 PolarHBondContact OD1-N 3.4Å; D25-T27 PolarHBondContact OD1-OG1 3.47Å; D25-T27 PolarHBondContact OD2-OG1 3.05Å; D25-L28 HydrophobicContact CB-CB 4.46Å; D25-L28 HydrophobicContact CB-CD1 4.21Å; D25-L28 PolarHBondContact O-N 2.92Å; D25-N29 PolarHBondContact O-ND2 3.33Å
26	R	38.8	Very low	38.9	Very low	180 Å²	180	95.3 Å²	95.3	68%	0.679	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-68.2	-21.1	-179.4	-66	-172.4	-177.6	-174.5	-0.7	111.1	I24 L28 N29 D30	I24-R26 PolarHBondContact O-N 3.49Å; R26-L28 VanDerWaalsContact C-N 3.32Å; R26-N29 PolarHBondContact O-N 3.49Å; R26-D30 PolarHBondContact O-N 3.32Å
27	T	41.2	Very low	39.4	Very low	115 Å²	115	99.2 Å²	99.2	71%	0.706	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-72.7	-25.6	178.2	70	0	0	0	0	112.7	D25	D25-T27 PolarHBondContact O-N 3.03Å; D25-T27 WeakPolarHBondContact OD1-CB 3.38Å; D25-T27 PolarHBondContact OD1-N 3.4Å; D25-T27 PolarHBondContact OD1-OG1 3.47Å; D25-T27 PolarHBondContact OD2-OG1 3.05Å
28	L	41.7	Very low	40	Very low	133 Å²	133	101.4 Å²	101.4	70%	0.696	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-85.7	-10	172.6	-78.4	165.5	0	0	0	113.7	D25 R26	D25-L28 HydrophobicContact CB-CB 4.46Å; D25-L28 HydrophobicContact CB-CD1 4.21Å; D25-L28 PolarHBondContact O-N 2.92Å; R26-L28 VanDerWaalsContact C-N 3.32Å
29	N	38.3	Very low	40.4	Very low	34 Å²	34	101.4 Å²	101.4	18%	0.182	52%	0.522	C	S	.	.	S	Bend	trans	-107.7	6.2	-178.2	-74.2	-73.8	0	0	0	113.7	I24 D25 R26 V31 A60	I24-N29 WeakPolarHBondContact CG2-ND2 3.35Å; D25-N29 PolarHBondContact O-ND2 3.33Å; R26-N29 PolarHBondContact O-N 3.49Å; N29-V31 PolarHBondContact O-N 2.88Å; N29-A60 WeakPolarHBondContact OD1-CB 3.47Å; N29-A60 PolarHBondContact OD1-N 2.97Å
30	D	39.3	Very low	41	Very low	133 Å²	133	104.1 Å²	104.1	71%	0.711	53%	0.532	S	S	*	.			trans	-80.8	35.4	178.9	-137.9	12.7	0	0	0	112.1	R26 R32	R26-D30 PolarHBondContact O-N 3.32Å; D30-R32 PolarHBondContact O-N 3.42Å
31	V	42.6	Very low	41.8	Very low	78 Å²	78	110.6 Å²	110.6	47%	0.473	56%	0.558	S	S	.	*			trans	-76.6	99.6	161.6	-171.7	0	0	0	0	104.7	N29 D33	N29-V31 PolarHBondContact O-N 2.88Å; V31-D33 PolarHBondContact O-N 3.22Å
32	R	43.2	Very low	42.7	Very low	187 Å²	187	111.3 Å²	111.3	71%	0.706	56%	0.558	S	S	*	*			trans	-53	135.9	168.2	-68.6	-179.2	-177.4	-172	1.4	107.3	D30 E34	D30-R32 PolarHBondContact O-N 3.42Å; R32-E34 HydrophobicContact CB-CG 4.43Å; R32-E34 PolarHBondContact O-N 3.41Å
33	D	43.6	Very low	43.4	Very low	85 Å²	85	111.2 Å²	111.2	46%	0.455	54%	0.544	S	S	.	.			trans	-56.3	105.9	171.5	-72.5	-11.8	0	0	0	106.6	V31 L56 S58 K61	V31-D33 PolarHBondContact O-N 3.22Å; D33-L56 WeakPolarHBondContact CA-O 3.35Å; D33-S58 PolarHBondContact OD1-N 2.99Å; D33-K61 IonicContact OD2-NZ 2.73Å; D33-K61 PolarHBondContact OD2-NZ 3.2Å
34	E	41.5	Very low	44.1	Very low	122 Å²	122	116.3 Å²	116.3	57%	0.57	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.9	125.8	-179.9	-79.7	-176.2	-178.7	0	0	108.1	R32 V36	R32-E34 HydrophobicContact CB-CG 4.43Å; R32-E34 PolarHBondContact O-N 3.41Å; E34-V36 PolarHBondContact O-N 3.28Å
35	N	44.1	Very low	44.8	Very low	83 Å²	83	117.5 Å²	117.5	44%	0.444	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.7	110.8	166.4	-73.1	3.7	0	0	0	107.1	Y37 F55	N35-Y37 HydrophobicContact CB-CD2 4.25Å; N35-Y37 HydrophobicContact CB-CE2 3.65Å; N35-Y37 PolarHBondContact ND2-OH 2.98Å; N35-F55 WeakPolarHBondContact OD1-CE1 3.34Å
36	V	41.9	Very low	45.2	Very low	60 Å²	60	121.6 Å²	121.6	36%	0.364	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.4	111.5	170.1	-178.8	0	0	0	0	107.5	E34 L56	E34-V36 PolarHBondContact O-N 3.28Å; V36-L56 HydrophobicContact CB-CD1 4.45Å; V36-L56 HydrophobicContact CG2-CD1 3.38Å; V36-L56 HydrophobicContact CG2-CG 4.08Å
37	Y	44.7	Very low	45.5	Very low	171 Å²	171	122.3 Å²	122.3	67%	0.671	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-91.2	124.3	166.3	-65.3	-85.4	0	0	0	107.3	N35 S39	N35-Y37 HydrophobicContact CB-CD2 4.25Å; N35-Y37 HydrophobicContact CB-CE2 3.65Å; N35-Y37 PolarHBondContact ND2-OH 2.98Å; Y37-S39 PolarHBondContact O-N 3.43Å
38	Y	46.7	Very low	45.6	Very low	140 Å²	140	126.1 Å²	126.1	55%	0.549	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-59.2	137.7	169	-72.1	-81.5	0	0	0	109.4	I54	Y38-I54 HydrophobicContact CE2-CD1 3.68Å; Y38-I54 HydrophobicContact CE2-CG1 4.3Å; Y38-I54 VanDerWaalsContact OH-CD1 3.26Å; Y38-I54 WeakPolarHBondContact OH-CD1 3.36Å
39	S	45.2	Very low	45.6	Very low	57 Å²	57	128.4 Å²	128.4	40%	0.399	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-64.7	152	-178	70.4	0	0	0	0	110	Y37 E41 D42	Y37-S39 PolarHBondContact O-N 3.43Å; S39-E41 PolarHBondContact O-N 3.44Å; S39-D42 PolarHBondContact N-OD2 2.93Å; S39-D42 WeakPolarHBondContact O-CB 3.31Å; S39-D42 PolarHBondContact O-N 3.49Å; S39-D42 PolarHBondContact OG-OD2 3.38Å
40	E	49	Very low	45.8	Very low	156 Å²	156	135.7 Å²	135.7	73%	0.729	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	-20.6	178.5	-66.5	-178.2	160.5	0	0	112.9	D42 K43	E40-D42 VanDerWaalsContact C-N 3.32Å; E40-K43 HydrophobicContact CB-CD 4.47Å; E40-K43 HydrophobicContact CG-CD 4.21Å; E40-K43 WeakPolarHBondContact O-CB 3.41Å; E40-K43 PolarHBondContact O-N 2.89Å
41	E	51.2	Low	45.6	Very low	178 Å²	178	137.1 Å²	137.1	83%	0.832	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-20.2	175.1	-62.2	-177.6	173.9	0	0	113.2	S39	S39-E41 PolarHBondContact O-N 3.44Å
42	D	51.1	Low	45.3	Very low	95 Å²	95	141.2 Å²	141.2	51%	0.508	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87	-13.7	171.3	-56.9	-57.2	0	0	0	111.9	S39 E40	S39-D42 PolarHBondContact N-OD2 2.93Å; S39-D42 WeakPolarHBondContact O-CB 3.31Å; S39-D42 PolarHBondContact O-N 3.49Å; S39-D42 PolarHBondContact OG-OD2 3.38Å; E40-D42 VanDerWaalsContact C-N 3.32Å
43	K	49.3	Very low	44.8	Very low	107 Å²	107	134.6 Å²	134.6	47%	0.465	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.2	-11.5	-176.4	-62.2	-174	-174.9	-171	0	114.1	E40 A45 E51	E40-K43 HydrophobicContact CB-CD 4.47Å; E40-K43 HydrophobicContact CG-CD 4.21Å; E40-K43 WeakPolarHBondContact O-CB 3.41Å; E40-K43 PolarHBondContact O-N 2.89Å; K43-A45 VanDerWaalsContact C-N 3.3Å; K43-A45 PolarHBondContact O-N 3.38Å; K43-E51 IonicContact NZ-OE1 3.85Å
44	E	51.2	Low	44.5	Very low	185 Å²	185	132.9 Å²	132.9	86%	0.864	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	1.5	-178	-65.9	-168.9	165.1	0	0	113.9
45	A	56.5	Low	44.3	Very low	89 Å²	89	133.4 Å²	133.4	74%	0.736	65%	0.654	S	S	*	*	S	Bend	trans	-107.5	-11.9	-176.4	0	0	0	0	0	115.7	K43	K43-A45 VanDerWaalsContact C-N 3.3Å; K43-A45 PolarHBondContact O-N 3.38Å
46	E	48.5	Very low	44.2	Very low	166 Å²	166	131.8 Å²	131.8	78%	0.776	65%	0.645	S	S	*	*			trans	-138.4	92.6	-177	-69.8	-178.2	168.1	0	0	110.5
47	E	44.5	Very low	44.2	Very low	195 Å²	195	129.8 Å²	129.8	91%	0.911	63%	0.633	S	S	*	*			trans	-67.9	130.4	166.6	-71.8	178.5	151.2	0	0	109.7
48	E	43.4	Very low	44.5	Very low	194 Å²	194	122.6 Å²	122.6	91%	0.907	61%	0.608	S	S	*	*	S	Bend	trans	82.9	41.1	163.5	-56.3	-170	158.5	0	0	120.9
49	E	40.9	Very low	44.8	Very low	181 Å²	181	118.5 Å²	118.5	85%	0.846	59%	0.593	S	S	*	*			trans	-124.7	133.3	158.7	-75.6	-171.3	163.9	0	0	112.4
50	E	43.7	Very low	45.2	Very low	187 Å²	187	117.4 Å²	117.4	87%	0.874	59%	0.588	S	S	*	*			trans	-53.4	140.4	178	-69.8	179.9	146.2	0	0	110.7	E52	E50-E52 VanDerWaalsContact C-N 3.31Å; E50-E52 PolarHBondContact O-N 2.98Å
51	E	35.7	Very low	45.3	Very low	164 Å²	164	114.2 Å²	114.2	77%	0.766	57%	0.571	S	S	*	*			trans	-58.4	83.4	179.8	-70.7	-174	150.6	0	0	112.3	K43 G53	K43-E51 IonicContact NZ-OE1 3.85Å; E51-G53 VanDerWaalsContact C-N 3.34Å; E51-G53 PolarHBondContact O-N 2.92Å; E51-G53 VanDerWaalsContact O-N 3.08Å
52	E	36.6	Very low	45.5	Very low	163 Å²	163	105.7 Å²	105.7	76%	0.762	53%	0.532	S	S	*	.			trans	-77.4	87.6	164.2	-80.1	-169.3	165.5	0	0	108.6	E50 I54	E50-E52 VanDerWaalsContact C-N 3.31Å; E50-E52 PolarHBondContact O-N 2.98Å; E52-I54 PolarHBondContact O-N 3.5Å; E52-I54 VanDerWaalsContact O-N 3.11Å
53	G	32.4	Very low	46	Very low	49 Å²	49	102 Å²	102	51%	0.505	51%	0.511	S	S	.	.			trans	-56.5	116.4	170.1	0	0	0	0	0	110.4	E51 F55	E51-G53 VanDerWaalsContact C-N 3.34Å; E51-G53 PolarHBondContact O-N 2.92Å; E51-G53 VanDerWaalsContact O-N 3.08Å; G53-F55 PolarHBondContact O-N 2.96Å; G53-F55 VanDerWaalsContact O-N 3.1Å
54	I	35.6	Very low	46.6	Very low	49 Å²	49	99 Å²	99	25%	0.251	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	108.7	177.1	-58.3	179.8	0	0	0	108.5	Y38 E52 L56 V141	Y38-I54 HydrophobicContact CE2-CD1 3.68Å; Y38-I54 HydrophobicContact CE2-CG1 4.3Å; Y38-I54 VanDerWaalsContact OH-CD1 3.26Å; Y38-I54 WeakPolarHBondContact OH-CD1 3.36Å; E52-I54 PolarHBondContact O-N 3.5Å; E52-I54 VanDerWaalsContact O-N 3.11Å; I54-L56 HydrophobicContact CG2-CD2 4.31Å; I54-L56 PolarHBondContact O-N 3.1Å; I54-L56 VanDerWaalsContact O-N 3.12Å; I54-V141 HydrophobicContact CG2-CG1 3.92Å
55	F	37.9	Very low	47.1	Very low	132 Å²	132	93.3 Å²	93.3	58%	0.579	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	100.2	171.4	-89.3	-85.2	0	0	0	109.9	N35 G53 T57	N35-F55 WeakPolarHBondContact OD1-CE1 3.34Å; G53-F55 PolarHBondContact O-N 2.96Å; G53-F55 VanDerWaalsContact O-N 3.1Å; F55-T57 VanDerWaalsContact C-N 3.31Å; F55-T57 PolarHBondContact O-N 2.9Å
56	L	41.8	Very low	47.5	Very low	49 Å²	49	89.8 Å²	89.8	26%	0.257	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	94	164.5	-65.5	-175	0	0	0	108.4	D33 V36 I54	D33-L56 WeakPolarHBondContact CA-O 3.35Å; V36-L56 HydrophobicContact CB-CD1 4.45Å; V36-L56 HydrophobicContact CG2-CD1 3.38Å; V36-L56 HydrophobicContact CG2-CG 4.08Å; I54-L56 HydrophobicContact CG2-CD2 4.31Å; I54-L56 PolarHBondContact O-N 3.1Å; I54-L56 VanDerWaalsContact O-N 3.12Å
57	T	42.7	Very low	48.3	Very low	18 Å²	18	83.8 Å²	83.8	11%	0.11	42%	0.421	C	S	.	.			trans	-89.4	146.9	168.8	24.4	0	0	0	0	109.9	F55 K59 K61 Q142	F55-T57 VanDerWaalsContact C-N 3.31Å; F55-T57 PolarHBondContact O-N 2.9Å; T57-K59 PolarHBondContact O-N 3.35Å; T57-K61 HydrophobicContact CG2-CB 4.46Å; T57-K61 HydrophobicContact CG2-CD 3.62Å; T57-K61 HydrophobicContact CG2-CG 3.93Å; T57-Q142 PolarHBondContact OG1-OE1 3.47Å
58	S	50.2	Low	49.4	Very low	21 Å²	21	82.3 Å²	82.3	15%	0.147	41%	0.412	C	S	.	.			trans	-50.5	143.7	172.9	65.7	0	0	0	0	111.1	D33 A60 K61 A62	D33-S58 PolarHBondContact OD1-N 2.99Å; S58-A60 PolarHBondContact O-N 3.38Å; S58-A60 VanDerWaalsContact O-N 3.13Å; S58-K61 CarbonylContact O-C 3.59Å; S58-K61 WeakPolarHBondContact O-CA 3.35Å; S58-K61 WeakPolarHBondContact O-CB 3.49Å; S58-K61 PolarHBondContact O-N 3.04Å; S58-K61 VanDerWaalsContact OG-CB 3.25Å; S58-K61 WeakPolarHBondContact OG-CB 3.03Å; S58-K61 PolarHBondContact OG-N 3.08Å; S58-A62 PolarHBondContact O-N 2.95Å
59	K	53.4	Low	50.5	Low	54 Å²	54	75.1 Å²	75.1	24%	0.235	38%	0.38	C	S	.	.	H	α-helix	trans	-51	-42.4	-179.7	-165.8	-174.1	-165.2	176.3	0	111.7	T57 K61 A62 L63 L133 S134 V136 I140	T57-K59 PolarHBondContact O-N 3.35Å; K59-K61 PolarHBondContact O-N 3.48Å; K59-A62 PolarHBondContact O-N 3.31Å; K59-L63 HydrophobicContact CG-CD1 4.06Å; K59-L63 HydrophobicContact CG-CG 4.43Å; K59-L63 VanDerWaalsContact O-CB 3.31Å; K59-L63 WeakPolarHBondContact O-CB 3.49Å; K59-L63 WeakPolarHBondContact O-CG 3.28Å; K59-L63 PolarHBondContact O-N 3.21Å; K59-L133 WeakPolarHBondContact CE-O 3.47Å; K59-L133 PolarHBondContact NZ-O 3.39Å; K59-S134 PolarHBondContact NZ-O 2.72Å; K59-V136 PolarHBondContact NZ-O 3.06Å; K59-I140 HydrophobicContact CD-CD1 4.41Å; K59-I140 HydrophobicContact CG-CD1 3.63Å; K59-I140 HydrophobicContact CG-CG1 4.24Å
60	A	53	Low	52	Low	34 Å²	34	73.6 Å²	73.6	28%	0.281	37%	0.37	S	S	.	.	H	α-helix	trans	-59	-41.8	174.2	0	0	0	0	0	113.4	N29 S58 S64	N29-A60 WeakPolarHBondContact OD1-CB 3.47Å; N29-A60 PolarHBondContact OD1-N 2.97Å; S58-A60 PolarHBondContact O-N 3.38Å; S58-A60 VanDerWaalsContact O-N 3.13Å; A60-S64 WeakPolarHBondContact O-CB 3.13Å; A60-S64 PolarHBondContact O-N 3.18Å
61	K	52.7	Low	53.2	Low	88 Å²	88	67.7 Å²	67.7	38%	0.383	35%	0.345	S	S	.	.	H	α-helix	trans	-71.4	-41.4	178.1	-174.8	167.8	167.8	-171.3	0	111.9	D33 T57 S58 K59 L63 S64 N65	D33-K61 IonicContact OD2-NZ 2.73Å; D33-K61 PolarHBondContact OD2-NZ 3.2Å; T57-K61 HydrophobicContact CG2-CB 4.46Å; T57-K61 HydrophobicContact CG2-CD 3.62Å; T57-K61 HydrophobicContact CG2-CG 3.93Å; S58-K61 CarbonylContact O-C 3.59Å; S58-K61 WeakPolarHBondContact O-CA 3.35Å; S58-K61 WeakPolarHBondContact O-CB 3.49Å; S58-K61 PolarHBondContact O-N 3.04Å; S58-K61 VanDerWaalsContact OG-CB 3.25Å; S58-K61 WeakPolarHBondContact OG-CB 3.03Å; S58-K61 PolarHBondContact OG-N 3.08Å; K59-K61 PolarHBondContact O-N 3.48Å; K61-L63 PolarHBondContact O-N 3.22Å; K61-S64 PolarHBondContact O-N 3.32Å; K61-N65 WeakPolarHBondContact O-CB 3.41Å; K61-N65 VanDerWaalsContact O-CG 3.25Å; K61-N65 PolarHBondContact O-N 2.76Å
62	A	54.6	Low	54.7	Low	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.2	-44.9	173.9	0	0	0	0	0	111.8	S58 K59 N65 L66 I140 Q142	S58-A62 PolarHBondContact O-N 2.95Å; K59-A62 PolarHBondContact O-N 3.31Å; A62-N65 PolarHBondContact O-N 2.7Å; A62-L66 WeakPolarHBondContact O-CG 3.49Å; A62-L66 PolarHBondContact O-N 3.2Å; A62-L66 VanDerWaalsContact O-N 3.1Å; A62-I140 HydrophobicContact CB-CB 4.49Å; A62-I140 HydrophobicContact CB-CG2 4.37Å; A62-Q142 HydrophobicContact CB-CG 4.04Å; A62-Q142 PolarHBondContact O-NE2 2.71Å
63	L	62.3	Low	56.1	Low	16 Å²	16	59.9 Å²	59.9	8%	0.084	31%	0.313	C	S	.	.	H	α-helix	trans	-65.6	-37.5	174.8	-68.1	175	0	0	0	112.4	K59 K61 L66 L67 I130 L133 I140	K59-L63 HydrophobicContact CG-CD1 4.06Å; K59-L63 HydrophobicContact CG-CG 4.43Å; K59-L63 VanDerWaalsContact O-CB 3.31Å; K59-L63 WeakPolarHBondContact O-CB 3.49Å; K59-L63 WeakPolarHBondContact O-CG 3.28Å; K59-L63 PolarHBondContact O-N 3.21Å; K61-L63 PolarHBondContact O-N 3.22Å; L63-L66 PolarHBondContact O-N 2.73Å; L63-L67 PolarHBondContact O-N 3.14Å; L63-I130 HydrophobicContact CB-CG2 4.31Å; L63-I130 HydrophobicContact CD1-CG2 4.43Å; L63-I130 HydrophobicContact CD2-CG2 4.23Å; L63-L133 HydrophobicContact CD2-CB 3.41Å; L63-L133 VanDerWaalsContact CD2-CB 3.41Å; L63-L133 HydrophobicContact CD2-CD1 4.07Å; L63-L133 HydrophobicContact CD2-CG 4.41Å; L63-I140 HydrophobicContact CD2-CD1 3.76Å; L63-I140 HydrophobicContact CG-CD1 4.02Å
64	S	60.9	Low	57.9	Low	44 Å²	44	57.9 Å²	57.9	31%	0.308	29%	0.29	S	S	.	.	H	α-helix	trans	-66.2	-41.5	174.3	-177.4	0	0	0	0	111.7	A60 K61 L66 L67 F68	A60-S64 WeakPolarHBondContact O-CB 3.13Å; A60-S64 PolarHBondContact O-N 3.18Å; K61-S64 PolarHBondContact O-N 3.32Å; S64-L66 VanDerWaalsContact C-N 3.3Å; S64-L66 PolarHBondContact O-N 3.34Å; S64-L67 VanDerWaalsContact O-CB 3.29Å; S64-L67 WeakPolarHBondContact O-CB 3.25Å; S64-L67 PolarHBondContact O-N 3.05Å; S64-L67 VanDerWaalsContact O-N 3.14Å; S64-F68 WeakPolarHBondContact O-CD2 3.25Å; S64-F68 PolarHBondContact O-N 3.44Å; S64-F68 WeakPolarHBondContact OG-CE2 3.29Å
65	N	61.8	Low	59.6	Low	67 Å²	67	59.3 Å²	59.3	36%	0.358	30%	0.296	S	S	.	.	H	α-helix	trans	-61.3	-43.9	177	-73.3	-11.2	0	0	0	110.3	K61 A62 L67 F68 L69 Q142	K61-N65 WeakPolarHBondContact O-CB 3.41Å; K61-N65 VanDerWaalsContact O-CG 3.25Å; K61-N65 PolarHBondContact O-N 2.76Å; A62-N65 PolarHBondContact O-N 2.7Å; N65-L67 VanDerWaalsContact C-N 3.31Å; N65-L67 PolarHBondContact O-N 2.75Å; N65-F68 PolarHBondContact O-N 2.97Å; N65-L69 WeakPolarHBondContact O-CG 3.35Å; N65-L69 PolarHBondContact O-N 3.29Å; N65-Q142 PolarHBondContact ND2-OE1 2.79Å
66	L	65.1	Low	61.1	Low	14 Å²	14	58.4 Å²	58.4	7%	0.073	30%	0.295	C	S	.	.	H	α-helix	trans	-58.5	-38.8	173.4	-73.9	166.1	0	0	0	112.8	A62 L63 S64 F68 L69 F74 L133	A62-L66 WeakPolarHBondContact O-CG 3.49Å; A62-L66 PolarHBondContact O-N 3.2Å; A62-L66 VanDerWaalsContact O-N 3.1Å; L63-L66 PolarHBondContact O-N 2.73Å; S64-L66 VanDerWaalsContact C-N 3.3Å; S64-L66 PolarHBondContact O-N 3.34Å; L66-F68 VanDerWaalsContact C-N 3.27Å; L66-F68 PolarHBondContact O-N 3.48Å; L66-L69 HydrophobicContact CD2-CD1 3.83Å; L66-F74 WeakPolarHBondContact O-CD2 3.26Å; L66-L133 HydrophobicContact CD1-CD1 3.39Å
67	L	64.7	Low	62.2	Low	40 Å²	40	58.1 Å²	58.1	21%	0.209	29%	0.292	C	S	.	.	H	α-helix	trans	-58.4	-37.8	176.5	-89.4	166.1	0	0	0	113.3	L19 L63 S64 N65 R126 I130	L19-L67 HydrophobicContact CD2-CD1 3.99Å; L63-L67 PolarHBondContact O-N 3.14Å; S64-L67 VanDerWaalsContact O-CB 3.29Å; S64-L67 WeakPolarHBondContact O-CB 3.25Å; S64-L67 PolarHBondContact O-N 3.05Å; S64-L67 VanDerWaalsContact O-N 3.14Å; N65-L67 VanDerWaalsContact C-N 3.31Å; N65-L67 PolarHBondContact O-N 2.75Å; L67-R126 PolarHBondContact O-NH1 3.36Å; L67-I130 HydrophobicContact CB-CD1 4.35Å; L67-I130 HydrophobicContact CD1-CD1 3.99Å; L67-I130 HydrophobicContact CD2-CD1 3.04Å; L67-I130 HydrophobicContact CD2-CG1 4.42Å; L67-I130 HydrophobicContact CG-CD1 3.17Å; L67-I130 HydrophobicContact CG-CG1 4.16Å
68	F	68.1	Low	63.3	Low	165 Å²	165	57.4 Å²	57.4	72%	0.724	29%	0.288	S	S	*	.	H	α-helix	trans	-102.3	4.2	-171.2	-62.9	-67.6	0	0	0	114.1	S64 N65 L66	S64-F68 WeakPolarHBondContact O-CD2 3.25Å; S64-F68 PolarHBondContact O-N 3.44Å; S64-F68 WeakPolarHBondContact OG-CE2 3.29Å; N65-F68 PolarHBondContact O-N 2.97Å; L66-F68 VanDerWaalsContact C-N 3.27Å; L66-F68 PolarHBondContact O-N 3.48Å
69	L	66.9	Low	64.1	Low	43 Å²	43	59.9 Å²	59.9	23%	0.225	30%	0.299	C	S	.	.	S	Bend	trans	-56.1	148.2	171.5	-71.5	-179.3	0	0	0	110.9	N65 L66 I73 F74 E77 R126	N65-L69 WeakPolarHBondContact O-CG 3.35Å; N65-L69 PolarHBondContact O-N 3.29Å; L66-L69 HydrophobicContact CD2-CD1 3.83Å; L69-I73 HydrophobicContact CB-CB 4.43Å; L69-I73 HydrophobicContact CD1-CG2 4.1Å; L69-I73 HydrophobicContact CD2-CG2 3.88Å; L69-I73 HydrophobicContact CG-CG2 4.38Å; L69-F74 HydrophobicContact CB-CB 4.02Å; L69-E77 HydrophobicContact CD1-CB 4.41Å; L69-E77 HydrophobicContact CD1-CG 4.07Å; L69-R126 PolarHBondContact O-NH1 3.17Å; L69-R126 PolarHBondContact O-NH2 3.02Å
70	K	70.9	Confident	64.7	Low	149 Å²	149	60 Å²	60	65%	0.648	30%	0.302	S	S	*	.			trans	-62.5	153.4	167.1	-64.7	-179.2	-179.6	174.8	0	109.5	D72 I73 F74	K70-D72 VanDerWaalsContact C-N 3.28Å; K70-D72 WeakPolarHBondContact CB-OD1 3.43Å; K70-D72 PolarHBondContact O-N 2.93Å; K70-I73 HydrophobicContact CB-CD1 4.14Å; K70-I73 HydrophobicContact CB-CG1 4.25Å; K70-I73 HydrophobicContact CD-CD1 4.38Å; K70-I73 HydrophobicContact CG-CD1 4.43Å; K70-I73 PolarHBondContact O-N 3.43Å; K70-I73 VanDerWaalsContact O-N 3.16Å; K70-F74 WeakPolarHBondContact O-CB 3.49Å; K70-F74 PolarHBondContact O-N 3.41Å
71	D	68.8	Low	65.2	Low	62 Å²	62	59.8 Å²	59.8	33%	0.332	30%	0.296	S	S	.	.	H	α-helix	trans	-56.4	-41.7	-173.4	-77	-17.5	0	0	0	113.2	F74 E75 K122 R126	D71-F74 PolarHBondContact O-N 3.36Å; D71-E75 VanDerWaalsContact O-CB 3.29Å; D71-E75 WeakPolarHBondContact O-CB 3.21Å; D71-E75 PolarHBondContact O-N 3.21Å; D71-K122 WeakPolarHBondContact OD2-CD 2.99Å; D71-K122 WeakPolarHBondContact OD2-CE 3.06Å; D71-K122 IonicContact OD2-NZ 3.65Å; D71-K122 PolarHBondContact OD2-NZ 3.37Å; D71-R126 IonicContact OD1-CZ 3.56Å; D71-R126 IonicContact OD1-NE 2.71Å; D71-R126 IonicContact OD1-NH2 2.7Å; D71-R126 PolarHBondContact OD1-NH2 2.65Å
72	D	68.5	Low	65.5	Low	97 Å²	97	59.6 Å²	59.6	52%	0.519	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-43.3	176.8	55.5	-26.8	0	0	0	112.6	K70 E75 M76	K70-D72 VanDerWaalsContact C-N 3.28Å; K70-D72 WeakPolarHBondContact CB-OD1 3.43Å; K70-D72 PolarHBondContact O-N 2.93Å; D72-E75 PolarHBondContact O-N 3.24Å; D72-M76 PolarHBondContact O-N 3.36Å; D72-M76 VanDerWaalsContact O-N 3.11Å
73	I	66.3	Low	65.9	Low	66 Å²	66	64.5 Å²	64.5	34%	0.338	32%	0.32	S	S	.	.	H	α-helix	trans	-69.7	-44.6	177.7	-54.4	174.9	0	0	0	110.1	L69 K70 E75 M76 E77	L69-I73 HydrophobicContact CB-CB 4.43Å; L69-I73 HydrophobicContact CD1-CG2 4.1Å; L69-I73 HydrophobicContact CD2-CG2 3.88Å; L69-I73 HydrophobicContact CG-CG2 4.38Å; K70-I73 HydrophobicContact CB-CD1 4.14Å; K70-I73 HydrophobicContact CB-CG1 4.25Å; K70-I73 HydrophobicContact CD-CD1 4.38Å; K70-I73 HydrophobicContact CG-CD1 4.43Å; K70-I73 PolarHBondContact O-N 3.43Å; K70-I73 VanDerWaalsContact O-N 3.16Å; I73-E75 PolarHBondContact O-N 3.44Å; I73-M76 PolarHBondContact O-N 2.93Å; I73-E77 HydrophobicContact CG2-CG 4.28Å; I73-E77 WeakPolarHBondContact O-CB 3.49Å; I73-E77 WeakPolarHBondContact O-CG 3.31Å; I73-E77 PolarHBondContact O-N 2.8Å
74	F	70.4	Confident	65.9	Low	8 Å²	8	70.4 Å²	70.4	4%	0.035	35%	0.345	C	S	.	.	H	α-helix	trans	-57.2	-41.5	176.8	-179	-91.2	0	0	0	111.5	L66 L69 K70 D71 T78 R126 L129	L66-F74 WeakPolarHBondContact O-CD2 3.26Å; L69-F74 HydrophobicContact CB-CB 4.02Å; K70-F74 WeakPolarHBondContact O-CB 3.49Å; K70-F74 PolarHBondContact O-N 3.41Å; D71-F74 PolarHBondContact O-N 3.36Å; F74-T78 WeakPolarHBondContact CE1-OG1 2.81Å; F74-T78 WeakPolarHBondContact CZ-OG1 3Å; F74-T78 VanDerWaalsContact O-CB 3.3Å; F74-T78 WeakPolarHBondContact O-CB 3.39Å; F74-T78 PolarHBondContact O-N 2.99Å; F74-T78 PolarHBondContact O-OG1 3.03Å; F74-R126 HydrophobicContact CD1-CG 3.95Å; F74-R126 HydrophobicContact CD2-CG 3.9Å; F74-R126 HydrophobicContact CE1-CG 3.72Å; F74-R126 HydrophobicContact CE2-CB 4.15Å; F74-R126 HydrophobicContact CE2-CG 3.65Å; F74-R126 HydrophobicContact CG-CG 4.06Å; F74-R126 VanDerWaalsContact CZ-CA 3.44Å; F74-R126 HydrophobicContact CZ-CB 4.03Å; F74-R126 HydrophobicContact CZ-CG 3.59Å; F74-L129 HydrophobicContact CE2-CD2 3.62Å; F74-L129 HydrophobicContact CZ-CB 4.01Å; F74-L129 HydrophobicContact CZ-CD2 3.51Å; F74-L129 HydrophobicContact CZ-CG 4.41Å
75	E	69.9	Low	66.1	Low	79 Å²	79	77 Å²	77	37%	0.369	37%	0.368	S	S	.	.	H	α-helix	trans	-61	-50.5	176.5	167.1	157.4	-161.8	0	0	112.8	D71 D72 I73 T78 L79 N93	D71-E75 VanDerWaalsContact O-CB 3.29Å; D71-E75 WeakPolarHBondContact O-CB 3.21Å; D71-E75 PolarHBondContact O-N 3.21Å; D72-E75 PolarHBondContact O-N 3.24Å; I73-E75 PolarHBondContact O-N 3.44Å; E75-T78 PolarHBondContact O-N 2.85Å; E75-L79 WeakPolarHBondContact O-CB 3.36Å; E75-L79 PolarHBondContact O-N 3.25Å; E75-N93 WeakPolarHBondContact CA-ND2 3.47Å; E75-N93 HydrophobicContact CB-CB 4.48Å; E75-N93 WeakPolarHBondContact CB-ND2 3.29Å; E75-N93 VanDerWaalsContact CD-OD1 3.29Å; E75-N93 HydrophobicContact CG-CB 3.64Å; E75-N93 WeakPolarHBondContact CG-ND2 3.34Å; E75-N93 WeakPolarHBondContact OE1-CB 3.13Å; E75-N93 PolarHBondContact OE1-OD1 2.85Å; E75-N93 PolarHBondContact OE2-OD1 3.5Å
76	M	69.6	Low	65.6	Low	113 Å²	113	76.6 Å²	76.6	56%	0.557	37%	0.374	S	S	*	.	H	α-helix	trans	-60.5	-47.3	178.2	-168.2	-176.6	-53.6	0	0	111.6	D72 I73 T78 L79 N80	D72-M76 PolarHBondContact O-N 3.36Å; D72-M76 VanDerWaalsContact O-N 3.11Å; I73-M76 PolarHBondContact O-N 2.93Å; M76-T78 PolarHBondContact O-N 2.65Å; M76-L79 PolarHBondContact O-N 2.7Å; M76-N80 WeakPolarHBondContact O-CB 3.43Å; M76-N80 VanDerWaalsContact O-CG 3.28Å; M76-N80 PolarHBondContact O-N 3.33Å; M76-N80 PolarHBondContact O-ND2 2.88Å
77	E	65.9	Low	65.1	Low	43 Å²	43	76.3 Å²	76.3	20%	0.201	37%	0.372	C	S	.	.	H	α-helix	trans	-64.2	-42.9	179.4	-73.4	-50.6	129.7	0	0	112.5	L69 I73 L79 N80 L81	L69-E77 HydrophobicContact CD1-CB 4.41Å; L69-E77 HydrophobicContact CD1-CG 4.07Å; I73-E77 HydrophobicContact CG2-CG 4.28Å; I73-E77 WeakPolarHBondContact O-CB 3.49Å; I73-E77 WeakPolarHBondContact O-CG 3.31Å; I73-E77 PolarHBondContact O-N 2.8Å; E77-L79 VanDerWaalsContact C-N 3.3Å; E77-L79 PolarHBondContact O-N 2.59Å; E77-N80 WeakPolarHBondContact O-CB 3.46Å; E77-N80 PolarHBondContact O-N 3.23Å; E77-L81 VanDerWaalsContact O-CG 3.31Å; E77-L81 WeakPolarHBondContact O-CG 3.38Å; E77-L81 PolarHBondContact O-N 3.16Å
78	T	65.7	Low	64.6	Low	3 Å²	3	80.5 Å²	80.5	2%	0.018	40%	0.399	C	S	.	.	H	α-helix	trans	-62.2	-40.7	177	-56.6	0	0	0	0	111.2	F74 E75 M76 L81 Y82 I87 L91 L129	F74-T78 WeakPolarHBondContact CE1-OG1 2.81Å; F74-T78 WeakPolarHBondContact CZ-OG1 3Å; F74-T78 VanDerWaalsContact O-CB 3.3Å; F74-T78 WeakPolarHBondContact O-CB 3.39Å; F74-T78 PolarHBondContact O-N 2.99Å; F74-T78 PolarHBondContact O-OG1 3.03Å; E75-T78 PolarHBondContact O-N 2.85Å; M76-T78 PolarHBondContact O-N 2.65Å; T78-L81 PolarHBondContact O-N 3.11Å; T78-Y82 WeakPolarHBondContact O-CB 3.39Å; T78-Y82 PolarHBondContact O-N 3.48Å; T78-I87 HydrophobicContact CG2-CD1 3.93Å; T78-L91 HydrophobicContact CG2-CB 3.85Å; T78-L129 HydrophobicContact CG2-CD1 4.41Å; T78-L129 HydrophobicContact CG2-CD2 4.28Å; T78-L129 WeakPolarHBondContact OG1-CD2 3.4Å
79	L	67.2	Low	63.8	Low	73 Å²	73	76.7 Å²	76.7	38%	0.382	39%	0.386	S	S	.	.	H	α-helix	trans	-65.8	-41.9	175.9	-177.6	62.7	0	0	0	111.4	E75 M76 E77 Y82 N83	E75-L79 WeakPolarHBondContact O-CB 3.36Å; E75-L79 PolarHBondContact O-N 3.25Å; M76-L79 PolarHBondContact O-N 2.7Å; E77-L79 VanDerWaalsContact C-N 3.3Å; E77-L79 PolarHBondContact O-N 2.59Å; L79-Y82 PolarHBondContact O-N 3.3Å; L79-N83 WeakPolarHBondContact O-CB 3.34Å; L79-N83 PolarHBondContact O-N 2.96Å; L79-N83 PolarHBondContact O-ND2 2.71Å
80	N	64.3	Low	63.2	Low	56 Å²	56	78.2 Å²	78.2	30%	0.299	39%	0.392	S	S	.	.	H	α-helix	trans	-59.1	-47.5	174.6	-74.3	-19.1	0	0	0	111.3	M76 E77 Y82 N83 K84	M76-N80 WeakPolarHBondContact O-CB 3.43Å; M76-N80 VanDerWaalsContact O-CG 3.28Å; M76-N80 PolarHBondContact O-N 3.33Å; M76-N80 PolarHBondContact O-ND2 2.88Å; E77-N80 WeakPolarHBondContact O-CB 3.46Å; E77-N80 PolarHBondContact O-N 3.23Å; N80-Y82 VanDerWaalsContact C-N 3.32Å; N80-Y82 PolarHBondContact O-N 3.33Å; N80-N83 PolarHBondContact O-N 3.31Å; N80-K84 WeakPolarHBondContact O-CB 3.45Å; N80-K84 WeakPolarHBondContact O-CG 3.38Å; N80-K84 PolarHBondContact O-N 3.37Å
81	L	63.5	Low	62.5	Low	29 Å²	29	71.8 Å²	71.8	15%	0.152	37%	0.365	C	S	.	.	H	α-helix	trans	-60.7	-40.6	176.2	-70.3	172.7	0	0	0	112.1	E77 T78 K85 A86 I87 L129 L133	E77-L81 VanDerWaalsContact O-CG 3.31Å; E77-L81 WeakPolarHBondContact O-CG 3.38Å; E77-L81 PolarHBondContact O-N 3.16Å; T78-L81 PolarHBondContact O-N 3.11Å; L81-K85 PolarHBondContact O-N 2.84Å; L81-A86 HydrophobicContact CB-CB 4.47Å; L81-A86 HydrophobicContact CD2-CB 4.09Å; L81-A86 WeakPolarHBondContact O-CB 2.97Å; L81-A86 PolarHBondContact O-N 3.41Å; L81-I87 HydrophobicContact CB-CD1 3.99Å; L81-I87 HydrophobicContact CB-CG1 4.09Å; L81-I87 HydrophobicContact CB-CG2 4.44Å; L81-I87 PolarHBondContact O-N 2.81Å; L81-L129 HydrophobicContact CD1-CD1 4.35Å; L81-L129 HydrophobicContact CD1-CD2 4.4Å; L81-L133 HydrophobicContact CD1-CD1 4.32Å
82	Y	59.8	Low	61.8	Low	84 Å²	84	73.8 Å²	73.8	33%	0.329	37%	0.367	S	S	.	.	H	α-helix	trans	-66.1	-46.6	176.7	-178.6	-102.4	0	0	0	111.8	T78 L79 N80 K84 K85 I87 Q90	T78-Y82 WeakPolarHBondContact O-CB 3.39Å; T78-Y82 PolarHBondContact O-N 3.48Å; L79-Y82 PolarHBondContact O-N 3.3Å; N80-Y82 VanDerWaalsContact C-N 3.32Å; N80-Y82 PolarHBondContact O-N 3.33Å; Y82-K84 VanDerWaalsContact C-N 3.3Å; Y82-K84 PolarHBondContact O-N 2.95Å; Y82-K85 WeakPolarHBondContact O-CA 3.29Å; Y82-K85 PolarHBondContact O-N 3.5Å; Y82-I87 HydrophobicContact CD2-CG1 4.33Å; Y82-Q90 HydrophobicContact CD1-CB 4.2Å; Y82-Q90 HydrophobicContact CD1-CG 4.14Å; Y82-Q90 HydrophobicContact CD2-CB 3.78Å; Y82-Q90 HydrophobicContact CD2-CG 4.43Å; Y82-Q90 HydrophobicContact CE1-CB 4.1Å; Y82-Q90 HydrophobicContact CE1-CG 4.31Å; Y82-Q90 HydrophobicContact CE2-CB 3.67Å; Y82-Q90 VanDerWaalsContact CE2-N 3.34Å; Y82-Q90 HydrophobicContact CG-CB 4.04Å; Y82-Q90 HydrophobicContact CG-CG 4.19Å
83	N	63.1	Low	60.7	Low	103 Å²	103	72.1 Å²	72.1	55%	0.551	36%	0.359	S	S	*	.	H	α-helix	trans	-62.4	-37.8	178.5	-71.8	-20.9	0	0	0	112	L79 N80 K85	L79-N83 WeakPolarHBondContact O-CB 3.34Å; L79-N83 PolarHBondContact O-N 2.96Å; L79-N83 PolarHBondContact O-ND2 2.71Å; N80-N83 PolarHBondContact O-N 3.31Å; N83-K85 PolarHBondContact O-N 2.69Å
84	K	62.5	Low	59.6	Low	140 Å²	140	70.7 Å²	70.7	61%	0.609	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-0.7	172.4	-69.7	-175.5	179.1	-168.5	0	113.3	N80 Y82 A86	N80-K84 WeakPolarHBondContact O-CB 3.45Å; N80-K84 WeakPolarHBondContact O-CG 3.38Å; N80-K84 PolarHBondContact O-N 3.37Å; Y82-K84 VanDerWaalsContact C-N 3.3Å; Y82-K84 PolarHBondContact O-N 2.95Å; K84-A86 PolarHBondContact O-N 3.45Å; K84-A86 VanDerWaalsContact O-N 3.16Å
85	K	65	Low	58.4	Low	183 Å²	183	78.1 Å²	78.1	80%	0.796	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	20.9	-174.2	-55.8	178.1	-179	174	0	113.7	L81 Y82 N83 I87	L81-K85 PolarHBondContact O-N 2.84Å; Y82-K85 WeakPolarHBondContact O-CA 3.29Å; Y82-K85 PolarHBondContact O-N 3.5Å; N83-K85 PolarHBondContact O-N 2.69Å; K85-I87 VanDerWaalsContact C-N 3.27Å
86	A	52.1	Low	57.3	Low	58 Å²	58	82.3 Å²	82.3	48%	0.479	41%	0.408	S	S	.	.	S	Bend	trans	-71.7	-27.6	175.3	0	0	0	0	0	111.3	L81 K84	L81-A86 HydrophobicContact CB-CB 4.47Å; L81-A86 HydrophobicContact CD2-CB 4.09Å; L81-A86 WeakPolarHBondContact O-CB 2.97Å; L81-A86 PolarHBondContact O-N 3.41Å; K84-A86 PolarHBondContact O-N 3.45Å; K84-A86 VanDerWaalsContact O-N 3.16Å
87	I	54.7	Low	56.3	Low	8 Å²	8	81 Å²	81	4%	0.041	40%	0.401	C	S	.	.			trans	-121.4	139.9	168.7	63.6	-179.7	0	0	0	109.4	T78 L81 Y82 K85 L129 L133	T78-I87 HydrophobicContact CG2-CD1 3.93Å; L81-I87 HydrophobicContact CB-CD1 3.99Å; L81-I87 HydrophobicContact CB-CG1 4.09Å; L81-I87 HydrophobicContact CB-CG2 4.44Å; L81-I87 PolarHBondContact O-N 2.81Å; Y82-I87 HydrophobicContact CD2-CG1 4.33Å; K85-I87 VanDerWaalsContact C-N 3.27Å; I87-L129 HydrophobicContact CD1-CD1 3.63Å; I87-L129 HydrophobicContact CG2-CD1 3.89Å; I87-L133 HydrophobicContact CG2-CD2 4.1Å
88	T	52.6	Low	55.5	Low	128 Å²	128	81.2 Å²	81.2	79%	0.785	40%	0.403	S	S	*	.	S	Bend	trans	-89.5	-11.7	-178.3	52.6	0	0	0	0	113.2
89	I	52.7	Low	54.4	Low	86 Å²	86	86.6 Å²	86.6	44%	0.441	43%	0.432	S	S	.	.	S	Bend	trans	-113.7	121.7	-178.7	-62.6	169.5	0	0	0	107.5	L91 M132	I89-L91 HydrophobicContact CG2-CD2 4.06Å; I89-L91 HydrophobicContact CG2-CG 4.24Å; I89-L91 PolarHBondContact O-N 3.35Å; I89-M132 HydrophobicContact CB-CE 3.8Å; I89-M132 HydrophobicContact CB-SD 3.96Å; I89-M132 HydrophobicContact CD1-CE 3.57Å; I89-M132 HydrophobicContact CD1-SD 4.06Å; I89-M132 HydrophobicContact CG1-CE 4.23Å; I89-M132 HydrophobicContact CG1-SD 4.4Å; I89-M132 HydrophobicContact CG2-CE 3.98Å
90	Q	54.8	Low	53.4	Low	74 Å²	74	89.8 Å²	89.8	35%	0.346	45%	0.449	S	S	.	.			trans	-70.9	101.4	168.2	-167.2	176	5.4	0	0	107.2	Y82 W92	Y82-Q90 HydrophobicContact CD1-CB 4.2Å; Y82-Q90 HydrophobicContact CD1-CG 4.14Å; Y82-Q90 HydrophobicContact CD2-CB 3.78Å; Y82-Q90 HydrophobicContact CD2-CG 4.43Å; Y82-Q90 HydrophobicContact CE1-CB 4.1Å; Y82-Q90 HydrophobicContact CE1-CG 4.31Å; Y82-Q90 HydrophobicContact CE2-CB 3.67Å; Y82-Q90 VanDerWaalsContact CE2-N 3.34Å; Y82-Q90 HydrophobicContact CG-CB 4.04Å; Y82-Q90 HydrophobicContact CG-CG 4.19Å; Q90-W92 PolarHBondContact O-N 3.24Å
91	L	54.8	Low	52.5	Low	15 Å²	15	97.5 Å²	97.5	8%	0.079	47%	0.474	C	S	.	.			trans	-76.9	83.4	174.3	-72.2	170.5	0	0	0	108.6	T78 I89 A128 L129 M132	T78-L91 HydrophobicContact CG2-CB 3.85Å; I89-L91 HydrophobicContact CG2-CD2 4.06Å; I89-L91 HydrophobicContact CG2-CG 4.24Å; I89-L91 PolarHBondContact O-N 3.35Å; L91-A128 HydrophobicContact CD1-CB 4.1Å; L91-A128 HydrophobicContact CD2-CB 3.62Å; L91-L129 HydrophobicContact CD1-CB 3.38Å; L91-L129 HydrophobicContact CD1-CD1 3.81Å; L91-L129 HydrophobicContact CD1-CG 4.17Å; L91-M132 HydrophobicContact CD1-CE 3.69Å; L91-M132 HydrophobicContact CD1-SD 4.02Å; L91-M132 HydrophobicContact CD2-CE 3.64Å; L91-M132 HydrophobicContact CG-CE 3.84Å; L91-M132 HydrophobicContact CG-SD 4.47Å
92	W	53.9	Low	51.9	Low	103 Å²	103	103.4 Å²	103.4	39%	0.39	50%	0.495	S	S	.	.			trans	29.2	101.4	158.6	-129.1	-43.8	0	0	0	116.9	Q90 H97 L98 N125	Q90-W92 PolarHBondContact O-N 3.24Å; W92-H97 HydrophobicContact CD2-CB 4.01Å; W92-H97 HydrophobicContact CG-CB 3.98Å; W92-H97 HydrophobicContact CZ2-CB 4.05Å; W92-H97 WeakPolarHBondContact CZ2-O 3.11Å; W92-L98 HydrophobicContact CZ2-CD2 3.96Å; W92-L98 HydrophobicContact CZ2-CG 4.05Å; W92-N125 VanDerWaalsContact CB-ND2 3.34Å; W92-N125 WeakPolarHBondContact CB-ND2 3.5Å
93	N	47	Very low	51.5	Low	63 Å²	63	102.8 Å²	102.8	34%	0.337	49%	0.493	S	S	.	.			trans	-148.3	50.7	159.1	-95.4	-34.7	0	0	0	111.7	E75	E75-N93 WeakPolarHBondContact CA-ND2 3.47Å; E75-N93 HydrophobicContact CB-CB 4.48Å; E75-N93 WeakPolarHBondContact CB-ND2 3.29Å; E75-N93 VanDerWaalsContact CD-OD1 3.29Å; E75-N93 HydrophobicContact CG-CB 3.64Å; E75-N93 WeakPolarHBondContact CG-ND2 3.34Å; E75-N93 WeakPolarHBondContact OE1-CB 3.13Å; E75-N93 PolarHBondContact OE1-OD1 2.85Å; E75-N93 PolarHBondContact OE2-OD1 3.5Å
94	S	43.1	Very low	51	Low	35 Å²	35	105.5 Å²	105.5	25%	0.245	50%	0.502	C	S	.	.			trans	-135.4	133.3	160.7	61.9	0	0	0	0	107.5	H96 H97	S94-H96 PolarHBondContact O-N 2.91Å; S94-H96 WeakPolarHBondContact OG-CB 3.3Å; S94-H97 PolarHBondContact O-N 3.42Å; S94-H97 PolarHBondContact OG-CD2 2.89Å
95	E	44.5	Very low	50.6	Low	165 Å²	165	104.8 Å²	104.8	77%	0.771	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-44.9	-22.6	162.1	-74.4	-176.9	133.2	0	0	111.4
96	H	46.5	Very low	50.2	Low	166 Å²	166	97 Å²	97	77%	0.769	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-67.3	-25.4	177.5	-71	-62.7	0	0	0	116.9	S94	S94-H96 PolarHBondContact O-N 2.91Å; S94-H96 WeakPolarHBondContact OG-CB 3.3Å
97	H	49.1	Very low	50.5	Low	85 Å²	85	100.2 Å²	100.2	39%	0.394	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-90.7	-4.5	-173.5	-89.4	-59.5	0	0	0	114.7	W92 S94 N99	W92-H97 HydrophobicContact CD2-CB 4.01Å; W92-H97 HydrophobicContact CG-CB 3.98Å; W92-H97 HydrophobicContact CZ2-CB 4.05Å; W92-H97 WeakPolarHBondContact CZ2-O 3.11Å; S94-H97 PolarHBondContact O-N 3.42Å; S94-H97 PolarHBondContact OG-CD2 2.89Å; H97-N99 PolarHBondContact O-N 2.82Å
98	L	49.4	Very low	51	Low	48 Å²	48	104.4 Å²	104.4	25%	0.251	50%	0.502	S	S	.	.	S	Bend	trans	-67.6	74	162.7	-78.1	166.8	0	0	0	108.8	W92 N100 W103	W92-L98 HydrophobicContact CZ2-CD2 3.96Å; W92-L98 HydrophobicContact CZ2-CG 4.05Å; L98-N100 PolarHBondContact O-N 3.45Å; L98-W103 HydrophobicContact CB-CD2 4.39Å; L98-W103 HydrophobicContact CB-CE3 3.99Å; L98-W103 HydrophobicContact CB-CZ3 4.48Å; L98-W103 HydrophobicContact CD1-CE3 3.53Å; L98-W103 HydrophobicContact CD1-CH2 3.92Å; L98-W103 HydrophobicContact CD1-CZ3 3.2Å; L98-W103 HydrophobicContact CG-CE3 4.33Å; L98-W103 HydrophobicContact CG-CZ3 4.41Å
99	N	41	Very low	51.6	Low	116 Å²	116	101 Å²	101	62%	0.62	48%	0.477	S	S	*	.			trans	-40.5	131.1	177.8	-97.5	-35.9	0	0	0	109.4	H97 R101 Y102	H97-N99 PolarHBondContact O-N 2.82Å; N99-R101 PolarHBondContact O-N 3.33Å; N99-Y102 PolarHBondContact O-N 3.46Å; N99-Y102 VanDerWaalsContact O-N 3.1Å
100	N	47.3	Very low	52.6	Low	141 Å²	141	100.9 Å²	100.9	75%	0.754	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.5	8.5	-168.9	-74.1	-30.3	0	0	0	119	L98	L98-N100 PolarHBondContact O-N 3.45Å
101	R	45.9	Very low	53.4	Low	218 Å²	218	104.3 Å²	104.3	82%	0.823	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-35.2	167.2	-90.1	-174.2	-176.7	173.1	2.2	114.1	N99	N99-R101 PolarHBondContact O-N 3.33Å
102	Y	49.9	Very low	53.9	Low	152 Å²	152	109.1 Å²	109.1	60%	0.596	53%	0.528	S	S	*	.	H	α-helix	trans	-83.6	-20.6	-179	-71.7	-76.8	0	0	0	112.2	N99 F106	N99-Y102 PolarHBondContact O-N 3.46Å; N99-Y102 VanDerWaalsContact O-N 3.1Å; Y102-F106 WeakPolarHBondContact O-CB 3.15Å; Y102-F106 PolarHBondContact O-N 3.18Å
103	W	51.8	Low	54.5	Low	71 Å²	71	107.7 Å²	107.7	27%	0.269	53%	0.527	S	S	.	.	H	α-helix	trans	-71.9	-37.1	-173.7	-148.2	-142.6	0	0	0	113.6	L98 F106 Q107	L98-W103 HydrophobicContact CB-CD2 4.39Å; L98-W103 HydrophobicContact CB-CE3 3.99Å; L98-W103 HydrophobicContact CB-CZ3 4.48Å; L98-W103 HydrophobicContact CD1-CE3 3.53Å; L98-W103 HydrophobicContact CD1-CH2 3.92Å; L98-W103 HydrophobicContact CD1-CZ3 3.2Å; L98-W103 HydrophobicContact CG-CE3 4.33Å; L98-W103 HydrophobicContact CG-CZ3 4.41Å; W103-F106 HydrophobicContact CE3-CB 3.89Å; W103-F106 AromaticContact CE3-CD1 3.71Å; W103-F106 HydrophobicContact CE3-CD1 3.71Å; W103-F106 HydrophobicContact CE3-CE1 4.46Å; W103-F106 AromaticContact CE3-CG 3.89Å; W103-F106 HydrophobicContact CE3-CG 3.89Å; W103-F106 HydrophobicContact CH2-CD1 4Å; W103-F106 HydrophobicContact CH2-CE1 4.06Å; W103-F106 HydrophobicContact CZ3-CB 4.25Å; W103-F106 AromaticContact CZ3-CD1 3.21Å; W103-F106 HydrophobicContact CZ3-CD1 3.21Å; W103-F106 HydrophobicContact CZ3-CD2 4.44Å; W103-F106 AromaticContact CZ3-CE1 3.55Å; W103-F106 HydrophobicContact CZ3-CE1 3.55Å; W103-F106 AromaticContact CZ3-CG 3.74Å; W103-F106 HydrophobicContact CZ3-CG 3.74Å; W103-F106 HydrophobicContact CZ3-CZ 4.3Å; W103-F106 PolarHBondContact O-N 2.98Å; W103-Q107 WeakPolarHBondContact O-CB 3.03Å; W103-Q107 WeakPolarHBondContact O-CG 3.25Å; W103-Q107 PolarHBondContact O-N 2.83Å
104	E	53.5	Low	55.3	Low	160 Å²	160	107.3 Å²	107.3	75%	0.748	52%	0.523	S	S	*	.	H	α-helix	trans	-67.2	-45	175.5	-66.1	-176.7	168.3	0	0	111.6	F106 Q107 S108	E104-F106 VanDerWaalsContact C-N 3.35Å; E104-Q107 PolarHBondContact O-N 3.1Å; E104-S108 PolarHBondContact O-N 3.31Å
105	E	53.2	Low	56.3	Low	125 Å²	125	113.5 Å²	113.5	58%	0.584	54%	0.541	S	S	*	.	H	α-helix	trans	-63.9	-41.9	174.1	-71.8	-175.6	169.8	0	0	111.2	Q107 S108	E105-Q107 PolarHBondContact O-N 3.47Å; E105-S108 PolarHBondContact O-N 3.04Å; E105-S108 PolarHBondContact O-OG 2.88Å
106	F	57.6	Low	57.2	Low	20 Å²	20	111.4 Å²	111.4	9%	0.088	53%	0.526	C	S	.	.	H	α-helix	trans	-62.5	-41.6	178.9	-169.1	-87.9	0	0	0	111.6	Y102 W103 E104 S108 Q109 K114 L117 Q118	Y102-F106 WeakPolarHBondContact O-CB 3.15Å; Y102-F106 PolarHBondContact O-N 3.18Å; W103-F106 HydrophobicContact CE3-CB 3.89Å; W103-F106 AromaticContact CE3-CD1 3.71Å; W103-F106 HydrophobicContact CE3-CD1 3.71Å; W103-F106 HydrophobicContact CE3-CE1 4.46Å; W103-F106 AromaticContact CE3-CG 3.89Å; W103-F106 HydrophobicContact CE3-CG 3.89Å; W103-F106 HydrophobicContact CH2-CD1 4Å; W103-F106 HydrophobicContact CH2-CE1 4.06Å; W103-F106 HydrophobicContact CZ3-CB 4.25Å; W103-F106 AromaticContact CZ3-CD1 3.21Å; W103-F106 HydrophobicContact CZ3-CD1 3.21Å; W103-F106 HydrophobicContact CZ3-CD2 4.44Å; W103-F106 AromaticContact CZ3-CE1 3.55Å; W103-F106 HydrophobicContact CZ3-CE1 3.55Å; W103-F106 AromaticContact CZ3-CG 3.74Å; W103-F106 HydrophobicContact CZ3-CG 3.74Å; W103-F106 HydrophobicContact CZ3-CZ 4.3Å; W103-F106 PolarHBondContact O-N 2.98Å; E104-F106 VanDerWaalsContact C-N 3.35Å; F106-S108 VanDerWaalsContact C-N 3.28Å; F106-S108 PolarHBondContact O-N 3.13Å; F106-Q109 PolarHBondContact O-N 2.95Å; F106-K114 HydrophobicContact CD1-CD 4.41Å; F106-K114 HydrophobicContact CD1-CG 4.04Å; F106-K114 HydrophobicContact CE1-CB 3.78Å; F106-K114 HydrophobicContact CE1-CD 4.12Å; F106-K114 HydrophobicContact CE1-CG 3.68Å; F106-K114 HydrophobicContact CE2-CB 4.44Å; F106-K114 HydrophobicContact CZ-CB 3.67Å; F106-K114 HydrophobicContact CZ-CG 3.97Å; F106-K114 VanDerWaalsContact CZ-O 3.29Å; F106-K114 WeakPolarHBondContact CZ-O 3.4Å; F106-K114 WeakPolarHBondContact O-CE 3.44Å; F106-K114 WeakPolarHBondContact O-CG 3.41Å; F106-L117 HydrophobicContact CD2-CB 4.28Å; F106-L117 HydrophobicContact CD2-CD1 3.85Å; F106-L117 HydrophobicContact CE2-CB 3.64Å; F106-L117 HydrophobicContact CE2-CD1 4.01Å; F106-L117 HydrophobicContact CE2-CG 4.5Å; F106-Q118 HydrophobicContact CE2-CG 4.42Å; F106-Q118 HydrophobicContact CZ-CG 3.77Å
107	Q	57.1	Low	58	Low	125 Å²	125	106.2 Å²	106.2	58%	0.584	50%	0.504	S	S	*	.	H	α-helix	trans	-64.9	-29.5	178.4	-76	-161.9	20.5	0	0	113.6	W103 E104 E105 Q109 K114	W103-Q107 WeakPolarHBondContact O-CB 3.03Å; W103-Q107 WeakPolarHBondContact O-CG 3.25Å; W103-Q107 PolarHBondContact O-N 2.83Å; E104-Q107 PolarHBondContact O-N 3.1Å; E105-Q107 PolarHBondContact O-N 3.47Å; Q107-Q109 VanDerWaalsContact C-N 3.28Å; Q107-Q109 PolarHBondContact O-N 3.1Å; Q107-K114 VanDerWaalsContact O-CE 3.27Å; Q107-K114 WeakPolarHBondContact O-CE 3.47Å; Q107-K114 PolarHBondContact O-NZ 3.31Å
108	S	65.7	Low	58.8	Low	97 Å²	97	106.4 Å²	106.4	68%	0.678	51%	0.505	S	S	*	.	H	α-helix	trans	-74.8	-13.7	178.5	75.6	0	0	0	0	114.4	E104 E105 F106	E104-S108 PolarHBondContact O-N 3.31Å; E105-S108 PolarHBondContact O-N 3.04Å; E105-S108 PolarHBondContact O-OG 2.88Å; F106-S108 VanDerWaalsContact C-N 3.28Å; F106-S108 PolarHBondContact O-N 3.13Å
109	Q	64.1	Low	59.6	Low	56 Å²	56	108.4 Å²	108.4	26%	0.262	52%	0.516	S	S	.	.	S	Bend	trans	-82	148.9	-173.9	-71.3	-174.2	0.2	0	0	113.7	F106 Q107 I113 K114	F106-Q109 PolarHBondContact O-N 2.95Å; Q107-Q109 VanDerWaalsContact C-N 3.28Å; Q107-Q109 PolarHBondContact O-N 3.1Å; Q109-I113 HydrophobicContact CB-CB 4.18Å; Q109-K114 HydrophobicContact CB-CG 4.2Å; Q109-K114 WeakPolarHBondContact O-CE 3.35Å
110	P	74.8	Confident	60.8	Low	83 Å²	83	104.9 Å²	104.9	54%	0.539	50%	0.496	S	S	.	.			trans	-52.2	144.5	168.5	-23.6	31.5	0	0	0	111.8	V112 I113 K114	P110-V112 PolarHBondContact O-N 2.88Å; P110-I113 HydrophobicContact CB-CG1 4.24Å; P110-I113 HydrophobicContact CG-CD1 4.04Å; P110-I113 HydrophobicContact CG-CG1 4.3Å; P110-I113 PolarHBondContact O-N 3.4Å; P110-K114 PolarHBondContact O-N 2.91Å; P110-K114 VanDerWaalsContact O-N 3.1Å
111	Q	70.6	Confident	61.6	Low	147 Å²	147	99.9 Å²	99.9	69%	0.687	47%	0.474	S	S	*	.	H	α-helix	trans	-52.5	-32.9	-176.8	-69.6	-175.6	-6.1	0	0	113.7	K114 R115	Q111-K114 PolarHBondContact O-N 3.33Å; Q111-R115 WeakPolarHBondContact O-CG 3.44Å; Q111-R115 PolarHBondContact O-N 3.29Å
112	V	66.4	Low	62.7	Low	116 Å²	116	93.2 Å²	93.2	70%	0.703	45%	0.451	S	S	*	.	H	α-helix	trans	-63.5	-43.4	176.4	-179.4	0	0	0	0	111.3	P110 R115 Y116	P110-V112 PolarHBondContact O-N 2.88Å; V112-R115 PolarHBondContact O-N 3.15Å; V112-Y116 WeakPolarHBondContact O-CB 3.45Å; V112-Y116 PolarHBondContact O-N 2.7Å
113	I	65.4	Low	63.6	Low	72 Å²	72	91.2 Å²	91.2	37%	0.369	45%	0.447	S	S	.	.	H	α-helix	trans	-71.9	-39	-179.4	-46.1	-171.4	0	0	0	110	Q109 P110 R115 Y116 L117	Q109-I113 HydrophobicContact CB-CB 4.18Å; P110-I113 HydrophobicContact CB-CG1 4.24Å; P110-I113 HydrophobicContact CG-CD1 4.04Å; P110-I113 HydrophobicContact CG-CG1 4.3Å; P110-I113 PolarHBondContact O-N 3.4Å; I113-R115 PolarHBondContact O-N 3.31Å; I113-Y116 WeakPolarHBondContact O-CB 3.13Å; I113-Y116 PolarHBondContact O-N 2.72Å; I113-L117 HydrophobicContact CG2-CD1 4.42Å; I113-L117 HydrophobicContact CG2-CG 4.4Å; I113-L117 WeakPolarHBondContact O-CB 3.31Å; I113-L117 WeakPolarHBondContact O-CG 3.48Å; I113-L117 PolarHBondContact O-N 2.93Å
114	K	64.2	Low	64.2	Low	56 Å²	56	91.1 Å²	91.1	24%	0.243	45%	0.451	C	S	.	.	H	α-helix	trans	-55.1	-49.5	171.7	-70.9	178.1	172.2	167.4	0	112	F106 Q107 Q109 P110 Q111 L117 Q118	F106-K114 HydrophobicContact CD1-CD 4.41Å; F106-K114 HydrophobicContact CD1-CG 4.04Å; F106-K114 HydrophobicContact CE1-CB 3.78Å; F106-K114 HydrophobicContact CE1-CD 4.12Å; F106-K114 HydrophobicContact CE1-CG 3.68Å; F106-K114 HydrophobicContact CE2-CB 4.44Å; F106-K114 HydrophobicContact CZ-CB 3.67Å; F106-K114 HydrophobicContact CZ-CG 3.97Å; F106-K114 VanDerWaalsContact CZ-O 3.29Å; F106-K114 WeakPolarHBondContact CZ-O 3.4Å; F106-K114 WeakPolarHBondContact O-CE 3.44Å; F106-K114 WeakPolarHBondContact O-CG 3.41Å; Q107-K114 VanDerWaalsContact O-CE 3.27Å; Q107-K114 WeakPolarHBondContact O-CE 3.47Å; Q107-K114 PolarHBondContact O-NZ 3.31Å; Q109-K114 HydrophobicContact CB-CG 4.2Å; Q109-K114 WeakPolarHBondContact O-CE 3.35Å; P110-K114 PolarHBondContact O-N 2.91Å; P110-K114 VanDerWaalsContact O-N 3.1Å; Q111-K114 PolarHBondContact O-N 3.33Å; K114-L117 PolarHBondContact O-N 3.25Å; K114-Q118 WeakPolarHBondContact O-CB 3.44Å; K114-Q118 PolarHBondContact O-N 2.91Å
115	R	64.1	Low	64.7	Low	165 Å²	165	84.7 Å²	84.7	62%	0.623	42%	0.421	S	S	*	.	H	α-helix	trans	-62.4	-42.4	177.1	-74.8	179.9	-178.9	-179.9	1.7	112	Q111 V112 I113 Q118 N119	Q111-R115 WeakPolarHBondContact O-CG 3.44Å; Q111-R115 PolarHBondContact O-N 3.29Å; V112-R115 PolarHBondContact O-N 3.15Å; I113-R115 PolarHBondContact O-N 3.31Å; R115-Q118 PolarHBondContact O-N 3.23Å; R115-N119 WeakPolarHBondContact O-CB 3.49Å; R115-N119 VanDerWaalsContact O-CG 3.24Å; R115-N119 PolarHBondContact O-N 2.89Å; R115-N119 PolarHBondContact O-ND2 3.41Å
116	Y	64.2	Low	65.5	Low	120 Å²	120	79.2 Å²	79.2	47%	0.471	40%	0.395	S	S	.	.	H	α-helix	trans	-59.3	-49.2	176.5	172.8	-90.8	0	0	0	111.5	V112 I113 Q118 N119 E120	V112-Y116 WeakPolarHBondContact O-CB 3.45Å; V112-Y116 PolarHBondContact O-N 2.7Å; I113-Y116 WeakPolarHBondContact O-CB 3.13Å; I113-Y116 PolarHBondContact O-N 2.72Å; Y116-Q118 PolarHBondContact O-N 3.47Å; Y116-N119 PolarHBondContact O-N 3.33Å; Y116-E120 VanDerWaalsContact CE1-OE2 3.22Å; Y116-E120 WeakPolarHBondContact CE1-OE2 3.31Å; Y116-E120 WeakPolarHBondContact O-CB 3.39Å; Y116-E120 PolarHBondContact O-N 3.44Å
117	L	63.9	Low	65.8	Low	57 Å²	57	80.2 Å²	80.2	30%	0.298	40%	0.399	S	S	.	.	H	α-helix	trans	-65.9	-38.1	179.6	-72.8	-179.1	0	0	0	112.7	F106 I113 K114 E120 A121	F106-L117 HydrophobicContact CD2-CB 4.28Å; F106-L117 HydrophobicContact CD2-CD1 3.85Å; F106-L117 HydrophobicContact CE2-CB 3.64Å; F106-L117 HydrophobicContact CE2-CD1 4.01Å; F106-L117 HydrophobicContact CE2-CG 4.5Å; I113-L117 HydrophobicContact CG2-CD1 4.42Å; I113-L117 HydrophobicContact CG2-CG 4.4Å; I113-L117 WeakPolarHBondContact O-CB 3.31Å; I113-L117 WeakPolarHBondContact O-CG 3.48Å; I113-L117 PolarHBondContact O-N 2.93Å; K114-L117 PolarHBondContact O-N 3.25Å; L117-E120 PolarHBondContact O-N 2.91Å; L117-A121 WeakPolarHBondContact O-CB 3.33Å; L117-A121 PolarHBondContact O-N 3.27Å
118	Q	65.4	Low	66.1	Low	89 Å²	89	75.6 Å²	75.6	42%	0.416	38%	0.382	S	S	.	.	H	α-helix	trans	-60.3	-45.5	171.7	-85.9	166.4	-11.7	0	0	111.6	F106 K114 R115 Y116 A121 K122	F106-Q118 HydrophobicContact CE2-CG 4.42Å; F106-Q118 HydrophobicContact CZ-CG 3.77Å; K114-Q118 WeakPolarHBondContact O-CB 3.44Å; K114-Q118 PolarHBondContact O-N 2.91Å; R115-Q118 PolarHBondContact O-N 3.23Å; Y116-Q118 PolarHBondContact O-N 3.47Å; Q118-A121 PolarHBondContact O-N 3.5Å; Q118-K122 WeakPolarHBondContact O-CB 3.42Å; Q118-K122 VanDerWaalsContact O-CG 3.26Å; Q118-K122 WeakPolarHBondContact O-CG 3.36Å; Q118-K122 PolarHBondContact O-N 3.12Å
119	N	66.4	Low	66.2	Low	90 Å²	90	71 Å²	71	48%	0.481	35%	0.35	S	S	.	.	H	α-helix	trans	-64.8	-41.4	177.5	-71.6	-13.6	0	0	0	111.5	R115 Y116 K122 Q123	R115-N119 WeakPolarHBondContact O-CB 3.49Å; R115-N119 VanDerWaalsContact O-CG 3.24Å; R115-N119 PolarHBondContact O-N 2.89Å; R115-N119 PolarHBondContact O-ND2 3.41Å; Y116-N119 PolarHBondContact O-N 3.33Å; N119-K122 PolarHBondContact O-N 3.21Å; N119-Q123 VanDerWaalsContact O-CG 3.28Å; N119-Q123 WeakPolarHBondContact O-CG 3.42Å; N119-Q123 PolarHBondContact O-N 3.41Å
120	E	66	Low	66.3	Low	43 Å²	43	69.2 Å²	69.2	20%	0.201	34%	0.342	C	S	.	.	H	α-helix	trans	-63.7	-43.8	177	-173.9	168.3	-153.3	0	0	111.9	L8 Y116 L117 K122 Q123 M124	L8-E120 WeakPolarHBondContact CD2-OE1 3.49Å; Y116-E120 VanDerWaalsContact CE1-OE2 3.22Å; Y116-E120 WeakPolarHBondContact CE1-OE2 3.31Å; Y116-E120 WeakPolarHBondContact O-CB 3.39Å; Y116-E120 PolarHBondContact O-N 3.44Å; L117-E120 PolarHBondContact O-N 2.91Å; E120-K122 PolarHBondContact O-N 3.24Å; E120-Q123 PolarHBondContact O-N 2.88Å; E120-M124 HydrophobicContact CG-CE 4.45Å; E120-M124 WeakPolarHBondContact O-CG 3.19Å; E120-M124 PolarHBondContact O-N 2.88Å
121	A	64.2	Low	65.8	Low	36 Å²	36	67.2 Å²	67.2	30%	0.298	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-45.3	175	0	0	0	0	0	111.8	L117 Q118 Q123 M124 N125	L117-A121 WeakPolarHBondContact O-CB 3.33Å; L117-A121 PolarHBondContact O-N 3.27Å; Q118-A121 PolarHBondContact O-N 3.5Å; A121-Q123 VanDerWaalsContact C-N 3.35Å; A121-Q123 PolarHBondContact O-N 3.43Å; A121-M124 PolarHBondContact O-N 3.49Å; A121-N125 VanDerWaalsContact O-CG 3.28Å; A121-N125 PolarHBondContact O-N 3.01Å; A121-N125 PolarHBondContact O-ND2 2.92Å
122	K	68.9	Low	65.4	Low	77 Å²	77	62.4 Å²	62.4	34%	0.335	31%	0.306	S	S	.	.	H	α-helix	trans	-57.8	-45.5	174.8	-74.8	172	169.9	-170.7	0	112.1	D71 Q118 N119 E120 N125 R126	D71-K122 WeakPolarHBondContact OD2-CD 2.99Å; D71-K122 WeakPolarHBondContact OD2-CE 3.06Å; D71-K122 IonicContact OD2-NZ 3.65Å; D71-K122 PolarHBondContact OD2-NZ 3.37Å; Q118-K122 WeakPolarHBondContact O-CB 3.42Å; Q118-K122 VanDerWaalsContact O-CG 3.26Å; Q118-K122 WeakPolarHBondContact O-CG 3.36Å; Q118-K122 PolarHBondContact O-N 3.12Å; N119-K122 PolarHBondContact O-N 3.21Å; E120-K122 PolarHBondContact O-N 3.24Å; K122-N125 PolarHBondContact O-N 3.44Å; K122-R126 WeakPolarHBondContact O-CG 3.47Å; K122-R126 PolarHBondContact O-N 2.88Å
123	Q	67.5	Low	65.2	Low	110 Å²	110	57.2 Å²	57.2	51%	0.514	28%	0.275	S	S	.	.	H	α-helix	trans	-64.8	-39.3	178	-68.9	-62.1	-31.1	0	0	112.2	N119 E120 A121 R126 Y127	N119-Q123 VanDerWaalsContact O-CG 3.28Å; N119-Q123 WeakPolarHBondContact O-CG 3.42Å; N119-Q123 PolarHBondContact O-N 3.41Å; E120-Q123 PolarHBondContact O-N 2.88Å; A121-Q123 VanDerWaalsContact C-N 3.35Å; A121-Q123 PolarHBondContact O-N 3.43Å; Q123-R126 PolarHBondContact O-N 3.22Å; Q123-Y127 WeakPolarHBondContact O-CB 3.31Å; Q123-Y127 PolarHBondContact O-N 3.45Å
124	M	64.8	Low	65.1	Low	69 Å²	69	55.9 Å²	55.9	34%	0.34	27%	0.272	S	S	.	.	H	α-helix	trans	-64.8	-39.2	174.2	-74	-164.9	-68.2	0	0	112.4	R11 E120 A121 Y127 A128	R11-M124 PolarHBondContact NH1-SD 3.45Å; E120-M124 HydrophobicContact CG-CE 4.45Å; E120-M124 WeakPolarHBondContact O-CG 3.19Å; E120-M124 PolarHBondContact O-N 2.88Å; A121-M124 PolarHBondContact O-N 3.49Å; M124-Y127 WeakPolarHBondContact O-CB 3.45Å; M124-Y127 PolarHBondContact O-N 3.3Å; M124-A128 WeakPolarHBondContact O-CB 3.48Å; M124-A128 PolarHBondContact O-N 2.85Å
125	N	64.3	Low	64.8	Low	25 Å²	25	59.1 Å²	59.1	13%	0.134	29%	0.292	C	S	.	.	H	α-helix	trans	-66.4	-44	177.3	-68.8	-22.7	0	0	0	111.7	W92 A121 K122 Y127 A128 L129	W92-N125 VanDerWaalsContact CB-ND2 3.34Å; W92-N125 WeakPolarHBondContact CB-ND2 3.5Å; A121-N125 VanDerWaalsContact O-CG 3.28Å; A121-N125 PolarHBondContact O-N 3.01Å; A121-N125 PolarHBondContact O-ND2 2.92Å; K122-N125 PolarHBondContact O-N 3.44Å; N125-Y127 VanDerWaalsContact C-N 3.29Å; N125-Y127 PolarHBondContact O-N 3.19Å; N125-A128 PolarHBondContact O-N 2.92Å; N125-L129 PolarHBondContact O-N 3.43Å
126	R	69.3	Low	64.5	Low	11 Å²	11	54.1 Å²	54.1	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-52.9	-51.8	171.7	-72.8	171.9	179.2	-106.2	-1.6	110.6	L67 L69 D71 F74 K122 Q123 A128 L129 I130	L67-R126 PolarHBondContact O-NH1 3.36Å; L69-R126 PolarHBondContact O-NH1 3.17Å; L69-R126 PolarHBondContact O-NH2 3.02Å; D71-R126 IonicContact OD1-CZ 3.56Å; D71-R126 IonicContact OD1-NE 2.71Å; D71-R126 IonicContact OD1-NH2 2.7Å; D71-R126 PolarHBondContact OD1-NH2 2.65Å; F74-R126 HydrophobicContact CD1-CG 3.95Å; F74-R126 HydrophobicContact CD2-CG 3.9Å; F74-R126 HydrophobicContact CE1-CG 3.72Å; F74-R126 HydrophobicContact CE2-CB 4.15Å; F74-R126 HydrophobicContact CE2-CG 3.65Å; F74-R126 HydrophobicContact CG-CG 4.06Å; F74-R126 VanDerWaalsContact CZ-CA 3.44Å; F74-R126 HydrophobicContact CZ-CB 4.03Å; F74-R126 HydrophobicContact CZ-CG 3.59Å; K122-R126 WeakPolarHBondContact O-CG 3.47Å; K122-R126 PolarHBondContact O-N 2.88Å; Q123-R126 PolarHBondContact O-N 3.22Å; R126-A128 PolarHBondContact O-N 3.4Å; R126-L129 PolarHBondContact O-N 3.45Å; R126-I130 WeakPolarHBondContact O-CD1 3.38Å; R126-I130 VanDerWaalsContact O-CG1 3.31Å; R126-I130 WeakPolarHBondContact O-CG1 3.42Å; R126-I130 PolarHBondContact O-N 2.97Å
127	Y	64.4	Low	63.6	Low	41 Å²	41	54.8 Å²	54.8	16%	0.161	30%	0.302	C	S	.	.	H	α-helix	trans	-59.8	-44.6	179.1	-178.7	-100.4	0	0	0	113.4	L14 I15 C18 Q123 M124 N125 L129 I130 T131	L14-Y127 PolarHBondContact O-OH 3.45Å; L14-Y127 VanDerWaalsContact O-OH 3.08Å; I15-Y127 VanDerWaalsContact CA-CE2 3.48Å; I15-Y127 HydrophobicContact CB-CD2 4.24Å; I15-Y127 HydrophobicContact CB-CE2 4.03Å; I15-Y127 HydrophobicContact CD1-CG 4.47Å; I15-Y127 HydrophobicContact CG1-CD1 3.95Å; I15-Y127 HydrophobicContact CG1-CD2 3.6Å; I15-Y127 HydrophobicContact CG1-CE1 4Å; I15-Y127 HydrophobicContact CG1-CE2 3.66Å; I15-Y127 HydrophobicContact CG1-CG 3.73Å; I15-Y127 HydrophobicContact CG2-CD2 4.34Å; I15-Y127 HydrophobicContact CG2-CE2 4.42Å; I15-Y127 PolarHBondContact N-OH 3.24Å; C18-Y127 HydrophobicContact CB-CE2 3.88Å; C18-Y127 PolarHBondContact SG-OH 3.33Å; Q123-Y127 WeakPolarHBondContact O-CB 3.31Å; Q123-Y127 PolarHBondContact O-N 3.45Å; M124-Y127 WeakPolarHBondContact O-CB 3.45Å; M124-Y127 PolarHBondContact O-N 3.3Å; N125-Y127 VanDerWaalsContact C-N 3.29Å; N125-Y127 PolarHBondContact O-N 3.19Å; Y127-L129 VanDerWaalsContact C-N 3.3Å; Y127-L129 PolarHBondContact O-N 3.37Å; Y127-I130 PolarHBondContact O-N 3.36Å; Y127-T131 WeakPolarHBondContact O-CB 3.12Å; Y127-T131 PolarHBondContact O-N 3.1Å; Y127-T131 PolarHBondContact O-OG1 3.12Å
128	A	64.4	Low	62.6	Low	28 Å²	28	53.5 Å²	53.5	23%	0.231	30%	0.302	C	S	.	.	H	α-helix	trans	-61.6	-40.4	177.7	0	0	0	0	0	111.4	L91 M124 N125 R126 T131 M132	L91-A128 HydrophobicContact CD1-CB 4.1Å; L91-A128 HydrophobicContact CD2-CB 3.62Å; M124-A128 WeakPolarHBondContact O-CB 3.48Å; M124-A128 PolarHBondContact O-N 2.85Å; N125-A128 PolarHBondContact O-N 2.92Å; R126-A128 PolarHBondContact O-N 3.4Å; A128-T131 PolarHBondContact O-N 3.42Å; A128-M132 HydrophobicContact CB-CE 4.27Å; A128-M132 WeakPolarHBondContact O-CG 3.44Å; A128-M132 PolarHBondContact O-N 3.32Å
129	L	67.4	Low	61.4	Low	0 Å²	0	54.5 Å²	54.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.7	-48.9	177.8	-176	63.3	0	0	0	110.7	F74 T78 L81 I87 L91 N125 R126 Y127 T131 M132 L133	F74-L129 HydrophobicContact CE2-CD2 3.62Å; F74-L129 HydrophobicContact CZ-CB 4.01Å; F74-L129 HydrophobicContact CZ-CD2 3.51Å; F74-L129 HydrophobicContact CZ-CG 4.41Å; T78-L129 HydrophobicContact CG2-CD1 4.41Å; T78-L129 HydrophobicContact CG2-CD2 4.28Å; T78-L129 WeakPolarHBondContact OG1-CD2 3.4Å; L81-L129 HydrophobicContact CD1-CD1 4.35Å; L81-L129 HydrophobicContact CD1-CD2 4.4Å; I87-L129 HydrophobicContact CD1-CD1 3.63Å; I87-L129 HydrophobicContact CG2-CD1 3.89Å; L91-L129 HydrophobicContact CD1-CB 3.38Å; L91-L129 HydrophobicContact CD1-CD1 3.81Å; L91-L129 HydrophobicContact CD1-CG 4.17Å; N125-L129 PolarHBondContact O-N 3.43Å; R126-L129 PolarHBondContact O-N 3.45Å; Y127-L129 VanDerWaalsContact C-N 3.3Å; Y127-L129 PolarHBondContact O-N 3.37Å; L129-T131 PolarHBondContact O-N 3.26Å; L129-M132 WeakPolarHBondContact O-CB 3.49Å; L129-M132 PolarHBondContact O-N 3.33Å; L129-M132 VanDerWaalsContact O-N 3.1Å; L129-L133 HydrophobicContact CD1-CD1 4.09Å; L129-L133 HydrophobicContact CD1-CG 4.15Å; L129-L133 HydrophobicContact CD2-CD1 4.27Å; L129-L133 HydrophobicContact CG-CD1 3.77Å; L129-L133 HydrophobicContact CG-CG 4.22Å; L129-L133 WeakPolarHBondContact O-CB 3.47Å; L129-L133 VanDerWaalsContact O-CG 3.31Å; L129-L133 WeakPolarHBondContact O-CG 3.34Å; L129-L133 PolarHBondContact O-N 3.16Å
130	I	66.4	Low	60.3	Low	18 Å²	18	51.6 Å²	51.6	9%	0.092	30%	0.3	C	S	.	.	H	α-helix	trans	-60.3	-38.9	179.2	-66.5	149.1	0	0	0	110.8	L63 L67 R126 Y127 L133 S134	L63-I130 HydrophobicContact CB-CG2 4.31Å; L63-I130 HydrophobicContact CD1-CG2 4.43Å; L63-I130 HydrophobicContact CD2-CG2 4.23Å; L67-I130 HydrophobicContact CB-CD1 4.35Å; L67-I130 HydrophobicContact CD1-CD1 3.99Å; L67-I130 HydrophobicContact CD2-CD1 3.04Å; L67-I130 HydrophobicContact CD2-CG1 4.42Å; L67-I130 HydrophobicContact CG-CD1 3.17Å; L67-I130 HydrophobicContact CG-CG1 4.16Å; R126-I130 WeakPolarHBondContact O-CD1 3.38Å; R126-I130 VanDerWaalsContact O-CG1 3.31Å; R126-I130 WeakPolarHBondContact O-CG1 3.42Å; R126-I130 PolarHBondContact O-N 2.97Å; Y127-I130 PolarHBondContact O-N 3.36Å; I130-L133 PolarHBondContact O-N 2.91Å; I130-S134 WeakPolarHBondContact O-CA 3.36Å; I130-S134 WeakPolarHBondContact O-CB 3.26Å; I130-S134 PolarHBondContact O-N 3.5Å; I130-S134 PolarHBondContact O-OG 3.11Å
131	T	63.2	Low	58.9	Low	41 Å²	41	53.5 Å²	53.5	25%	0.252	32%	0.315	S	S	.	.	H	α-helix	trans	-66.2	-41	176.9	-55.6	0	0	0	0	111.4	Y127 A128 L129 S134 N135	Y127-T131 WeakPolarHBondContact O-CB 3.12Å; Y127-T131 PolarHBondContact O-N 3.1Å; Y127-T131 PolarHBondContact O-OG1 3.12Å; A128-T131 PolarHBondContact O-N 3.42Å; L129-T131 PolarHBondContact O-N 3.26Å; T131-S134 WeakPolarHBondContact CA-OG 3.49Å; T131-S134 PolarHBondContact O-OG 3.4Å; T131-N135 VanDerWaalsContact O-CG 3.26Å; T131-N135 PolarHBondContact O-N 3.23Å; T131-N135 PolarHBondContact O-ND2 2.89Å; T131-N135 VanDerWaalsContact O-ND2 3.12Å
132	M	62.5	Low	57.6	Low	46 Å²	46	54.7 Å²	54.7	23%	0.227	31%	0.314	C	S	.	.	H	α-helix	trans	-63	-49.3	174.5	-70.7	178.3	-147.1	0	0	110.8	I89 L91 A128 L129 S134 N135 V136	I89-M132 HydrophobicContact CB-CE 3.8Å; I89-M132 HydrophobicContact CB-SD 3.96Å; I89-M132 HydrophobicContact CD1-CE 3.57Å; I89-M132 HydrophobicContact CD1-SD 4.06Å; I89-M132 HydrophobicContact CG1-CE 4.23Å; I89-M132 HydrophobicContact CG1-SD 4.4Å; I89-M132 HydrophobicContact CG2-CE 3.98Å; L91-M132 HydrophobicContact CD1-CE 3.69Å; L91-M132 HydrophobicContact CD1-SD 4.02Å; L91-M132 HydrophobicContact CD2-CE 3.64Å; L91-M132 HydrophobicContact CG-CE 3.84Å; L91-M132 HydrophobicContact CG-SD 4.47Å; A128-M132 HydrophobicContact CB-CE 4.27Å; A128-M132 WeakPolarHBondContact O-CG 3.44Å; A128-M132 PolarHBondContact O-N 3.32Å; L129-M132 WeakPolarHBondContact O-CB 3.49Å; L129-M132 PolarHBondContact O-N 3.33Å; L129-M132 VanDerWaalsContact O-N 3.1Å; M132-S134 PolarHBondContact O-N 3.08Å; M132-N135 PolarHBondContact O-N 3.5Å; M132-N135 VanDerWaalsContact O-N 3.15Å; M132-V136 PolarHBondContact O-N 2.91Å
133	L	62.7	Low	55.9	Low	8 Å²	8	57.5 Å²	57.5	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-66.8	-34.2	-179.7	-67.5	176.7	0	0	0	112.4	K59 L63 L66 L81 I87 L129 I130 N135 V136 I140	K59-L133 WeakPolarHBondContact CE-O 3.47Å; K59-L133 PolarHBondContact NZ-O 3.39Å; L63-L133 HydrophobicContact CD2-CB 3.41Å; L63-L133 VanDerWaalsContact CD2-CB 3.41Å; L63-L133 HydrophobicContact CD2-CD1 4.07Å; L63-L133 HydrophobicContact CD2-CG 4.41Å; L66-L133 HydrophobicContact CD1-CD1 3.39Å; L81-L133 HydrophobicContact CD1-CD1 4.32Å; I87-L133 HydrophobicContact CG2-CD2 4.1Å; L129-L133 HydrophobicContact CD1-CD1 4.09Å; L129-L133 HydrophobicContact CD1-CG 4.15Å; L129-L133 HydrophobicContact CD2-CD1 4.27Å; L129-L133 HydrophobicContact CG-CD1 3.77Å; L129-L133 HydrophobicContact CG-CG 4.22Å; L129-L133 WeakPolarHBondContact O-CB 3.47Å; L129-L133 VanDerWaalsContact O-CG 3.31Å; L129-L133 WeakPolarHBondContact O-CG 3.34Å; L129-L133 PolarHBondContact O-N 3.16Å; I130-L133 PolarHBondContact O-N 2.91Å; L133-N135 PolarHBondContact O-N 3.36Å; L133-V136 WeakPolarHBondContact O-CB 3.4Å; L133-V136 PolarHBondContact O-N 3.23Å; L133-I140 HydrophobicContact CB-CD1 3.99Å
134	S	62.5	Low	55.3	Low	44 Å²	44	54.9 Å²	54.9	31%	0.308	32%	0.322	S	S	.	.	H	α-helix	trans	-64.7	-26	174.6	69.2	0	0	0	0	112.3	K59 I130 T131 M132	K59-S134 PolarHBondContact NZ-O 2.72Å; I130-S134 WeakPolarHBondContact O-CA 3.36Å; I130-S134 WeakPolarHBondContact O-CB 3.26Å; I130-S134 PolarHBondContact O-N 3.5Å; I130-S134 PolarHBondContact O-OG 3.11Å; T131-S134 WeakPolarHBondContact CA-OG 3.49Å; T131-S134 PolarHBondContact O-OG 3.4Å; M132-S134 PolarHBondContact O-N 3.08Å
135	N	58.3	Low	54.8	Low	124 Å²	124	54.2 Å²	54.2	66%	0.663	32%	0.322	S	S	*	.	H	α-helix	trans	-88.4	-10.3	177.7	-66.7	-23.3	0	0	0	113.6	T131 M132 L133 S137	T131-N135 VanDerWaalsContact O-CG 3.26Å; T131-N135 PolarHBondContact O-N 3.23Å; T131-N135 PolarHBondContact O-ND2 2.89Å; T131-N135 VanDerWaalsContact O-ND2 3.12Å; M132-N135 PolarHBondContact O-N 3.5Å; M132-N135 VanDerWaalsContact O-N 3.15Å; L133-N135 PolarHBondContact O-N 3.36Å; N135-S137 PolarHBondContact O-N 3.05Å
136	V	57.6	Low	54.3	Low	59 Å²	59	55.8 Å²	55.8	36%	0.358	33%	0.332	S	S	.	.			trans	-68.3	122.4	174.7	177	0	0	0	0	109.2	K59 M132 L133 G138	K59-V136 PolarHBondContact NZ-O 3.06Å; M132-V136 PolarHBondContact O-N 2.91Å; L133-V136 WeakPolarHBondContact O-CB 3.4Å; L133-V136 PolarHBondContact O-N 3.23Å; V136-G138 PolarHBondContact O-N 2.79Å
137	S	45.6	Very low	53.4	Low	135 Å²	135	58.4 Å²	58.4	94%	0.944	35%	0.349	S	S	*	.	S	Bend	trans	-83	12.7	-176.7	50.7	0	0	0	0	114.7	N135	N135-S137 PolarHBondContact O-N 3.05Å
138	G	43	Very low	52.8	Low	30 Å²	30	59.5 Å²	59.5	31%	0.309	36%	0.361	S	S	.	.	S	Bend	trans	-118.7	169.3	176.7	0	0	0	0	0	112.9	V136	V136-G138 PolarHBondContact O-N 2.79Å
139	P	40.8	Very low	52	Low	110 Å²	110	61.6 Å²	61.6	71%	0.714	37%	0.369	S	S	*	.			trans	-60.2	137.8	174.3	25.2	-32.1	0	0	0	110.6
140	I	43.5	Very low	50.9	Low	28 Å²	28	66 Å²	66	14%	0.144	40%	0.396	C	S	.	.			trans	-90.3	107.8	171.7	-58.1	175.6	0	0	0	106.3	K59 A62 L63 L133	K59-I140 HydrophobicContact CD-CD1 4.41Å; K59-I140 HydrophobicContact CG-CD1 3.63Å; K59-I140 HydrophobicContact CG-CG1 4.24Å; A62-I140 HydrophobicContact CB-CB 4.49Å; A62-I140 HydrophobicContact CB-CG2 4.37Å; L63-I140 HydrophobicContact CD2-CD1 3.76Å; L63-I140 HydrophobicContact CG-CD1 4.02Å; L133-I140 HydrophobicContact CB-CD1 3.99Å
141	V	36.7	Very low	49.7	Very low	83 Å²	83	69.7 Å²	69.7	50%	0.503	42%	0.419	S	S	.	.			trans	-81	118.5	172.7	-177.8	0	0	0	0	107.6	I54	I54-V141 HydrophobicContact CG2-CG1 3.92Å
142	Q	36.5	Very low	48.6	Very low	62 Å²	62	72.1 Å²	72.1	29%	0.29	43%	0.433	S	S	.	.			trans	-74.2	131.7	165.8	-57	-158.4	-66.7	0	0	107.3	T57 A62 N65	T57-Q142 PolarHBondContact OG1-OE1 3.47Å; A62-Q142 HydrophobicContact CB-CG 4.04Å; A62-Q142 PolarHBondContact O-NE2 2.71Å; N65-Q142 PolarHBondContact ND2-OE1 2.79Å
143	I	33.1	Very low	47.3	Very low	136 Å²	136	74.5 Å²	74.5	70%	0.697	45%	0.452	S	S	*	.			trans	-77.8	0	159.5	-49.3	166.5	0	0	0	106

Retrieved 143 of 143 residues in 63.7 ms (Link to these results)

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