A0A3Q0KRP1_SCHMA Loading...

RB_A domain-containing protein

AlphaFold DB (A0A5K4EV71), UniProt , Accession A0A3Q0KRP1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 212 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.7	Very low	26.7	Very low	245 Å²	245	133.4 Å²	133.4	100%	1.207	68%	0.68	S	S	*	*				0	82.8	0	-151.3	175.5	-177.2	0	0	107.5
2	T	22.1	Very low	26.7	Very low	119 Å²	119	132.2 Å²	132.2	73%	0.73	67%	0.67	S	S	*	*			trans	-157.4	97.1	165.7	-25.5	0	0	0	0	103.6	Y4	T2-Y4 PolarHBondContact O-N 2.87Å
3	A	22	Very low	26.6	Very low	90 Å²	90	133.9 Å²	133.9	74%	0.744	67%	0.674	S	S	*	*			trans	-79.1	102.9	-175.1	0	0	0	0	0	108.1	N5	A3-N5 PolarHBondContact O-N 2.89Å
4	Y	24.5	Very low	26.8	Very low	177 Å²	177	135.1 Å²	135.1	69%	0.694	68%	0.683	S	S	*	*			trans	-65.7	100.7	164.2	-66.7	-84.5	0	0	0	107	T2 I6 M36	T2-Y4 PolarHBondContact O-N 2.87Å; Y4-I6 PolarHBondContact O-N 3.25Å; Y4-M36 HydrophobicContact CE1-CE 4.14Å
5	N	25.8	Very low	27.1	Very low	114 Å²	114	140.1 Å²	140.1	61%	0.61	70%	0.699	S	S	*	*			trans	-71.3	82.7	164.5	-79.9	-31.2	0	0	0	106.9	A3 L7 L50	A3-N5 PolarHBondContact O-N 2.89Å; N5-L7 PolarHBondContact O-N 3.23Å; N5-L50 HydrophobicContact CB-CD1 3.25Å; N5-L50 WeakPolarHBondContact ND2-CD1 3.32Å
6	I	28.2	Very low	27.2	Very low	116 Å²	116	143.5 Å²	143.5	60%	0.595	71%	0.708	S	S	*	*			trans	-54.1	121.4	163.7	-64.2	172.1	0	0	0	105.4	Y4 Y8	Y4-I6 PolarHBondContact O-N 3.25Å; I6-Y8 PolarHBondContact O-N 3.34Å
7	L	29.9	Very low	27.5	Very low	86 Å²	86	139.9 Å²	139.9	45%	0.45	70%	0.699	S	S	.	*			trans	-59.4	89.3	175.6	-146.9	93.5	0	0	0	107.7	N5 I9	N5-L7 PolarHBondContact O-N 3.23Å; L7-I9 HydrophobicContact CD2-CD1 4Å; L7-I9 HydrophobicContact CD2-CG1 3.89Å; L7-I9 HydrophobicContact CG-CG1 4.48Å; L7-I9 PolarHBondContact O-N 2.89Å
8	Y	27.5	Very low	28	Very low	204 Å²	204	138.2 Å²	138.2	80%	0.8	70%	0.7	S	S	*	*			trans	-74.1	81.8	174.1	-117.8	-90	0	0	0	106.8	I6 K10	I6-Y8 PolarHBondContact O-N 3.34Å; Y8-K10 PolarHBondContact O-N 3.31Å
9	I	30.6	Very low	28.4	Very low	69 Å²	69	137.1 Å²	137.1	35%	0.354	70%	0.695	S	S	.	*			trans	-68.7	93.6	163.2	-55.4	-172.2	0	0	0	105.5	L7 S11 V21 V25	L7-I9 HydrophobicContact CD2-CD1 4Å; L7-I9 HydrophobicContact CD2-CG1 3.89Å; L7-I9 HydrophobicContact CG-CG1 4.48Å; L7-I9 PolarHBondContact O-N 2.89Å; I9-S11 VanDerWaalsContact C-N 3.25Å; I9-S11 PolarHBondContact O-N 3.23Å; I9-V21 HydrophobicContact CG2-CG1 4.46Å; I9-V25 HydrophobicContact CB-CG2 4.47Å; I9-V25 HydrophobicContact CD1-CG2 3.69Å; I9-V25 HydrophobicContact CG1-CG2 4.22Å
10	K	27.7	Very low	29.3	Very low	161 Å²	161	135.1 Å²	135.1	70%	0.7	69%	0.686	S	S	*	*			trans	-68.5	88.6	175.7	-152.3	178.4	-171.4	-177.1	0	107.1	Y8 H12	Y8-K10 PolarHBondContact O-N 3.31Å; K10-H12 PolarHBondContact O-N 2.69Å
11	S	29.6	Very low	29.9	Very low	86 Å²	86	131.7 Å²	131.7	60%	0.601	67%	0.672	S	S	*	*			trans	-65	91	165.9	175.4	0	0	0	0	107.4	I9	I9-S11 VanDerWaalsContact C-N 3.25Å; I9-S11 PolarHBondContact O-N 3.23Å
12	H	26.3	Very low	31	Very low	119 Å²	119	124.6 Å²	124.6	55%	0.551	64%	0.638	S	S	*	*			trans	-87.5	112.2	163.3	-130.3	-89.1	0	0	0	106.2	K10	K10-H12 PolarHBondContact O-N 2.69Å
13	E	25.8	Very low	32.5	Very low	155 Å²	155	122.9 Å²	122.9	72%	0.724	63%	0.625	S	S	*	*	S	Bend	trans	56.6	80.5	154.1	-62.2	170.7	139.5	0	0	116.4
14	N	29.3	Very low	33.6	Very low	150 Å²	150	121.9 Å²	121.9	80%	0.802	61%	0.612	S	S	*	*			trans	-152.8	121.7	138.5	-110.1	-41.1	0	0	0	112.8	K16	N14-K16 PolarHBondContact O-N 3.26Å
15	K	31.3	Very low	34.9	Very low	211 Å²	211	115.4 Å²	115.4	92%	0.917	59%	0.59	S	S	*	*			trans	-72.1	34	-173.8	-71.7	179.8	172.5	176.3	0	114.1
16	K	29.6	Very low	36.3	Very low	194 Å²	194	113.6 Å²	113.6	84%	0.843	58%	0.581	S	S	*	*	S	Bend	trans	-140.5	107.5	176	-70.4	-171.7	178	179.4	0	111	N14	N14-K16 PolarHBondContact O-N 3.26Å
17	C	31.7	Very low	37.4	Very low	82 Å²	82	114.1 Å²	114.1	55%	0.554	58%	0.58	S	S	*	*			trans	68.9	73.7	175.6	-79	0	0	0	0	118.9	L19	C17-L19 PolarHBondContact O-N 3.23Å
18	P	36.3	Very low	38.7	Very low	110 Å²	110	112.9 Å²	112.9	71%	0.714	57%	0.573	S	S	*	*	H	α-helix	trans	-61.6	-17.8	164.8	25.9	-34.6	0	0	0	114.1	L22	P18-L22 VanDerWaalsContact O-CB 3.31Å; P18-L22 WeakPolarHBondContact O-CB 3.31Å; P18-L22 PolarHBondContact O-N 3.35Å
19	L	36.6	Very low	40.1	Very low	116 Å²	116	106.8 Å²	106.8	61%	0.607	55%	0.552	S	S	*	*	H	α-helix	trans	-72.3	-37	-175.8	-150.5	73.3	0	0	0	112.8	C17 N23	C17-L19 PolarHBondContact O-N 3.23Å; L19-N23 VanDerWaalsContact O-CB 3.32Å; L19-N23 WeakPolarHBondContact O-CB 3.42Å; L19-N23 PolarHBondContact O-N 3.25Å; L19-N23 PolarHBondContact O-ND2 3.35Å
20	D	46.1	Very low	41.5	Very low	97 Å²	97	110.2 Å²	110.2	52%	0.519	57%	0.565	S	S	.	*	H	α-helix	trans	-76.9	-38.7	-175.2	-75.4	-25.7	0	0	0	113.1	L22 N23 C24	D20-L22 VanDerWaalsContact C-N 3.33Å; D20-N23 PolarHBondContact O-N 3.37Å; D20-C24 WeakPolarHBondContact O-CB 3.28Å; D20-C24 PolarHBondContact O-N 3.25Å
21	V	41.8	Very low	42.8	Very low	64 Å²	64	105 Å²	105	39%	0.388	55%	0.548	S	S	.	.	H	α-helix	trans	-66.4	-41.1	174.6	-179.6	0	0	0	0	109.9	I9 C24 V25	I9-V21 HydrophobicContact CG2-CG1 4.46Å; V21-C24 PolarHBondContact O-N 2.9Å; V21-V25 WeakPolarHBondContact O-CG2 3.44Å; V21-V25 PolarHBondContact O-N 2.82Å
22	L	48.1	Very low	44.3	Very low	96 Å²	96	102.8 Å²	102.8	50%	0.503	53%	0.529	S	S	.	.	H	α-helix	trans	-65.7	-39.1	176.2	-170.4	66.8	0	0	0	111.8	P18 D20 V25 N26	P18-L22 VanDerWaalsContact O-CB 3.31Å; P18-L22 WeakPolarHBondContact O-CB 3.31Å; P18-L22 PolarHBondContact O-N 3.35Å; D20-L22 VanDerWaalsContact C-N 3.33Å; L22-V25 PolarHBondContact O-N 2.95Å; L22-N26 VanDerWaalsContact O-CB 3.25Å; L22-N26 WeakPolarHBondContact O-CB 3.26Å; L22-N26 VanDerWaalsContact O-CG 3.25Å; L22-N26 PolarHBondContact O-N 3.28Å; L22-N26 PolarHBondContact O-ND2 3.45Å
23	N	52.8	Low	45.9	Very low	84 Å²	84	100.7 Å²	100.7	45%	0.449	52%	0.522	S	S	.	.	H	α-helix	trans	-63.1	-42.2	173.5	-77.7	-21	0	0	0	111.8	L19 D20 N26 H27	L19-N23 VanDerWaalsContact O-CB 3.32Å; L19-N23 WeakPolarHBondContact O-CB 3.42Å; L19-N23 PolarHBondContact O-N 3.25Å; L19-N23 PolarHBondContact O-ND2 3.35Å; D20-N23 PolarHBondContact O-N 3.37Å; N23-N26 PolarHBondContact O-N 2.93Å; N23-H27 VanDerWaalsContact O-CB 3.27Å; N23-H27 WeakPolarHBondContact O-CB 3.42Å; N23-H27 PolarHBondContact O-N 3.17Å
24	C	46.4	Very low	47.4	Very low	69 Å²	69	102 Å²	102	47%	0.466	52%	0.52	S	S	.	.	H	α-helix	trans	-63.8	-47.1	176.7	-172.3	0	0	0	0	111.6	D20 V21 N26 H27 I28	D20-C24 WeakPolarHBondContact O-CB 3.28Å; D20-C24 PolarHBondContact O-N 3.25Å; V21-C24 PolarHBondContact O-N 2.9Å; C24-N26 PolarHBondContact O-N 3.43Å; C24-H27 PolarHBondContact O-N 3.5Å; C24-I28 VanDerWaalsContact O-CG1 3.31Å; C24-I28 WeakPolarHBondContact O-CG1 3.35Å; C24-I28 PolarHBondContact O-N 3.5Å
25	V	50.8	Low	48.6	Very low	41 Å²	41	97.6 Å²	97.6	25%	0.248	50%	0.495	C	S	.	.	H	α-helix	trans	-61.2	-44.3	175.7	172.8	0	0	0	0	111.2	I9 V21 L22 H27 I28 Q29	I9-V25 HydrophobicContact CB-CG2 4.47Å; I9-V25 HydrophobicContact CD1-CG2 3.69Å; I9-V25 HydrophobicContact CG1-CG2 4.22Å; V21-V25 WeakPolarHBondContact O-CG2 3.44Å; V21-V25 PolarHBondContact O-N 2.82Å; L22-V25 PolarHBondContact O-N 2.95Å; V25-H27 VanDerWaalsContact C-N 3.3Å; V25-H27 PolarHBondContact O-N 2.92Å; V25-I28 PolarHBondContact O-N 3.38Å; V25-Q29 WeakPolarHBondContact O-CB 3.25Å; V25-Q29 PolarHBondContact O-N 3.37Å
26	N	55.3	Low	50	Low	76 Å²	76	90.4 Å²	90.4	41%	0.406	47%	0.466	S	S	.	.	H	α-helix	trans	-64.3	-36.2	176.4	-79.7	-23.5	0	0	0	112.3	L22 N23 C24 K30	L22-N26 VanDerWaalsContact O-CB 3.25Å; L22-N26 WeakPolarHBondContact O-CB 3.26Å; L22-N26 VanDerWaalsContact O-CG 3.25Å; L22-N26 PolarHBondContact O-N 3.28Å; L22-N26 PolarHBondContact O-ND2 3.45Å; N23-N26 PolarHBondContact O-N 2.93Å; C24-N26 PolarHBondContact O-N 3.43Å; N26-K30 WeakPolarHBondContact O-CB 3.38Å; N26-K30 VanDerWaalsContact O-CG 3.28Å; N26-K30 WeakPolarHBondContact O-CG 3.32Å; N26-K30 PolarHBondContact O-N 2.9Å
27	H	52.6	Low	51.3	Low	127 Å²	127	85.4 Å²	85.4	59%	0.588	46%	0.461	S	S	*	.	H	α-helix	trans	-68.1	-45.5	176.9	-171.4	75.1	0	0	0	111.1	N23 C24 V25 Q29 K30 S31	N23-H27 VanDerWaalsContact O-CB 3.27Å; N23-H27 WeakPolarHBondContact O-CB 3.42Å; N23-H27 PolarHBondContact O-N 3.17Å; C24-H27 PolarHBondContact O-N 3.5Å; V25-H27 VanDerWaalsContact C-N 3.3Å; V25-H27 PolarHBondContact O-N 2.92Å; H27-Q29 PolarHBondContact O-N 3.14Å; H27-K30 PolarHBondContact O-N 3.3Å; H27-S31 WeakPolarHBondContact O-CB 3.46Å; H27-S31 PolarHBondContact O-N 2.9Å; H27-S31 PolarHBondContact O-OG 2.89Å; H27-S31 VanDerWaalsContact O-OG 3.09Å
28	I	57.2	Low	52.2	Low	59 Å²	59	87.4 Å²	87.4	30%	0.303	47%	0.465	S	S	.	.	H	α-helix	trans	-59.5	-47.7	174.6	-67.8	165.9	0	0	0	110.1	C24 V25 K30 S31 L32	C24-I28 VanDerWaalsContact O-CG1 3.31Å; C24-I28 WeakPolarHBondContact O-CG1 3.35Å; C24-I28 PolarHBondContact O-N 3.5Å; V25-I28 PolarHBondContact O-N 3.38Å; I28-K30 PolarHBondContact O-N 2.89Å; I28-S31 PolarHBondContact O-N 2.86Å; I28-L32 HydrophobicContact CG2-CD1 3.87Å; I28-L32 HydrophobicContact CG2-CG 4.33Å; I28-L32 WeakPolarHBondContact O-CB 3.28Å; I28-L32 VanDerWaalsContact O-CG 3.29Å; I28-L32 WeakPolarHBondContact O-CG 3.35Å; I28-L32 PolarHBondContact O-N 2.82Å
29	Q	57	Low	53.1	Low	77 Å²	77	84.5 Å²	84.5	36%	0.36	44%	0.441	S	S	.	.	H	α-helix	trans	-59.8	-48.6	178.5	-173	64.2	45.8	0	0	111.5	V25 H27 S31 L32 D33	V25-Q29 WeakPolarHBondContact O-CB 3.25Å; V25-Q29 PolarHBondContact O-N 3.37Å; H27-Q29 PolarHBondContact O-N 3.14Å; Q29-S31 VanDerWaalsContact C-N 3.3Å; Q29-S31 PolarHBondContact O-N 3.37Å; Q29-L32 PolarHBondContact O-N 2.87Å; Q29-D33 PolarHBondContact NE2-OD1 3.26Å; Q29-D33 PolarHBondContact NE2-OD2 2.93Å; Q29-D33 WeakPolarHBondContact O-CB 3.27Å; Q29-D33 PolarHBondContact O-N 3.48Å
30	K	59.1	Low	53.9	Low	141 Å²	141	80 Å²	80	61%	0.613	42%	0.423	S	S	*	.	H	α-helix	trans	-60.2	-39.8	177.4	-78.4	177.7	179.5	179.9	0	112.4	N26 H27 I28 R34	N26-K30 WeakPolarHBondContact O-CB 3.38Å; N26-K30 VanDerWaalsContact O-CG 3.28Å; N26-K30 WeakPolarHBondContact O-CG 3.32Å; N26-K30 PolarHBondContact O-N 2.9Å; H27-K30 PolarHBondContact O-N 3.3Å; I28-K30 PolarHBondContact O-N 2.89Å; K30-R34 VanDerWaalsContact O-CB 3.24Å; K30-R34 WeakPolarHBondContact O-CB 3.31Å; K30-R34 PolarHBondContact O-N 2.97Å
31	S	55.9	Low	54.3	Low	50 Å²	50	80.4 Å²	80.4	35%	0.35	43%	0.431	S	S	.	.	H	α-helix	trans	-67	-42.2	177	-67.3	0	0	0	0	111.3	H27 I28 Q29 R34 E35	H27-S31 WeakPolarHBondContact O-CB 3.46Å; H27-S31 PolarHBondContact O-N 2.9Å; H27-S31 PolarHBondContact O-OG 2.89Å; H27-S31 VanDerWaalsContact O-OG 3.09Å; I28-S31 PolarHBondContact O-N 2.86Å; Q29-S31 VanDerWaalsContact C-N 3.3Å; Q29-S31 PolarHBondContact O-N 3.37Å; S31-R34 PolarHBondContact O-N 3.17Å; S31-E35 WeakPolarHBondContact O-CG 3.45Å; S31-E35 PolarHBondContact O-N 3.34Å
32	L	60.8	Low	54.7	Low	40 Å²	40	80.4 Å²	80.4	21%	0.209	44%	0.443	C	S	.	.	H	α-helix	trans	-64.8	-43.8	175	-69.7	173.5	0	0	0	112.3	I28 Q29 R34 E35 M36 L44 F48	I28-L32 HydrophobicContact CG2-CD1 3.87Å; I28-L32 HydrophobicContact CG2-CG 4.33Å; I28-L32 WeakPolarHBondContact O-CB 3.28Å; I28-L32 VanDerWaalsContact O-CG 3.29Å; I28-L32 WeakPolarHBondContact O-CG 3.35Å; I28-L32 PolarHBondContact O-N 2.82Å; Q29-L32 PolarHBondContact O-N 2.87Å; L32-R34 VanDerWaalsContact C-N 3.28Å; L32-R34 PolarHBondContact O-N 2.9Å; L32-E35 PolarHBondContact O-N 3.18Å; L32-M36 VanDerWaalsContact O-CB 3.3Å; L32-M36 WeakPolarHBondContact O-CB 3.3Å; L32-M36 PolarHBondContact O-N 2.68Å; L32-L44 HydrophobicContact CD2-CD2 3.86Å; L32-F48 HydrophobicContact CD2-CD2 4.14Å; L32-F48 HydrophobicContact CD2-CE2 3.3Å; L32-F48 HydrophobicContact CD2-CZ 3.77Å
33	D	60.1	Low	54.6	Low	76 Å²	76	78.5 Å²	78.5	41%	0.406	43%	0.43	S	S	.	.	H	α-helix	trans	-63.3	-38.8	177.3	-67	-20.5	0	0	0	110.8	Q29 M36 A37	Q29-D33 PolarHBondContact NE2-OD1 3.26Å; Q29-D33 PolarHBondContact NE2-OD2 2.93Å; Q29-D33 WeakPolarHBondContact O-CB 3.27Å; Q29-D33 PolarHBondContact O-N 3.48Å; D33-M36 PolarHBondContact O-N 3.09Å; D33-A37 VanDerWaalsContact O-CB 3.29Å; D33-A37 WeakPolarHBondContact O-CB 3.29Å; D33-A37 PolarHBondContact O-N 2.92Å
34	R	56	Low	54.4	Low	181 Å²	181	75.6 Å²	75.6	68%	0.683	41%	0.414	S	S	*	.	H	α-helix	trans	-65.3	-46.2	175	-170.3	-175.8	-114.1	-140.1	0.6	111.4	K30 S31 L32 A37 L38	K30-R34 VanDerWaalsContact O-CB 3.24Å; K30-R34 WeakPolarHBondContact O-CB 3.31Å; K30-R34 PolarHBondContact O-N 2.97Å; S31-R34 PolarHBondContact O-N 3.17Å; L32-R34 VanDerWaalsContact C-N 3.28Å; L32-R34 PolarHBondContact O-N 2.9Å; R34-A37 PolarHBondContact O-N 3.42Å; R34-L38 HydrophobicContact CG-CD1 3.93Å; R34-L38 WeakPolarHBondContact O-CB 3.5Å; R34-L38 VanDerWaalsContact O-CG 3.23Å; R34-L38 WeakPolarHBondContact O-CG 3.24Å; R34-L38 PolarHBondContact O-N 3.45Å
35	E	56.2	Low	54.3	Low	59 Å²	59	75.7 Å²	75.7	28%	0.276	42%	0.42	S	S	.	.	H	α-helix	trans	-66.5	-36.8	176.8	-69.8	-60.7	127	0	0	111.8	S31 L32 L38 K39 Y43 L44	S31-E35 WeakPolarHBondContact O-CG 3.45Å; S31-E35 PolarHBondContact O-N 3.34Å; L32-E35 PolarHBondContact O-N 3.18Å; E35-L38 PolarHBondContact O-N 2.86Å; E35-K39 WeakPolarHBondContact O-CB 3.39Å; E35-K39 PolarHBondContact O-N 3.43Å; E35-K39 WeakPolarHBondContact OE2-CD 3.34Å; E35-K39 VanDerWaalsContact OE2-CE 3.31Å; E35-K39 WeakPolarHBondContact OE2-CE 3.29Å; E35-K39 IonicContact OE2-NZ 3.85Å; E35-K39 PolarHBondContact OE2-NZ 3.37Å; E35-Y43 WeakPolarHBondContact OE2-CE1 3.24Å; E35-L44 HydrophobicContact CB-CD2 4.22Å
36	M	60.1	Low	53.6	Low	60 Å²	60	76.8 Å²	76.8	30%	0.296	44%	0.44	S	S	.	.	H	α-helix	trans	-62.1	-45.2	173.4	-163.7	-179.7	-64.8	0	0	111.2	Y4 L32 D33 L38 G40 L44	Y4-M36 HydrophobicContact CE1-CE 4.14Å; L32-M36 VanDerWaalsContact O-CB 3.3Å; L32-M36 WeakPolarHBondContact O-CB 3.3Å; L32-M36 PolarHBondContact O-N 2.68Å; D33-M36 PolarHBondContact O-N 3.09Å; M36-L38 VanDerWaalsContact C-N 3.34Å; M36-G40 WeakPolarHBondContact O-CA 3.4Å; M36-G40 PolarHBondContact O-N 2.82Å; M36-L44 HydrophobicContact CB-CD1 3.6Å; M36-L44 HydrophobicContact CE-CD1 3.48Å; M36-L44 VanDerWaalsContact CE-CD1 3.48Å; M36-L44 HydrophobicContact CG-CD1 3.9Å
37	A	55.5	Low	52.8	Low	89 Å²	89	76.1 Å²	76.1	74%	0.736	44%	0.436	S	S	*	.	H	α-helix	trans	-67.9	-33.7	179.5	0	0	0	0	0	112.5	D33 R34	D33-A37 VanDerWaalsContact O-CB 3.29Å; D33-A37 WeakPolarHBondContact O-CB 3.29Å; D33-A37 PolarHBondContact O-N 2.92Å; R34-A37 PolarHBondContact O-N 3.42Å
38	L	51.5	Low	51.9	Low	123 Å²	123	74.6 Å²	74.6	64%	0.644	43%	0.428	S	S	*	.	H	α-helix	trans	-84.7	-40.1	-177.7	-70.5	171.9	0	0	0	113.4	R34 E35 M36	R34-L38 HydrophobicContact CG-CD1 3.93Å; R34-L38 WeakPolarHBondContact O-CB 3.5Å; R34-L38 VanDerWaalsContact O-CG 3.23Å; R34-L38 WeakPolarHBondContact O-CG 3.24Å; R34-L38 PolarHBondContact O-N 3.45Å; E35-L38 PolarHBondContact O-N 2.86Å; M36-L38 VanDerWaalsContact C-N 3.34Å
39	K	55.9	Low	50.6	Low	50 Å²	50	82.6 Å²	82.6	22%	0.217	45%	0.454	C	S	.	.	H	α-helix	trans	-118.2	-4.5	-168.9	-63.1	175.8	179.4	159.5	0	113.8	E35 Y43	E35-K39 WeakPolarHBondContact O-CB 3.39Å; E35-K39 PolarHBondContact O-N 3.43Å; E35-K39 WeakPolarHBondContact OE2-CD 3.34Å; E35-K39 VanDerWaalsContact OE2-CE 3.31Å; E35-K39 WeakPolarHBondContact OE2-CE 3.29Å; E35-K39 IonicContact OE2-NZ 3.85Å; E35-K39 PolarHBondContact OE2-NZ 3.37Å; K39-Y43 HydrophobicContact CB-CD1 3.67Å; K39-Y43 HydrophobicContact CB-CD2 4.26Å; K39-Y43 HydrophobicContact CB-CE1 4.36Å; K39-Y43 HydrophobicContact CB-CG 3.6Å; K39-Y43 HydrophobicContact CD-CD1 3.42Å; K39-Y43 VanDerWaalsContact CD-CD1 3.42Å; K39-Y43 HydrophobicContact CD-CD2 3.89Å; K39-Y43 HydrophobicContact CD-CE1 3.21Å; K39-Y43 HydrophobicContact CD-CE2 3.73Å; K39-Y43 HydrophobicContact CD-CG 3.75Å; K39-Y43 HydrophobicContact CG-CD1 4.19Å; K39-Y43 HydrophobicContact CG-CE1 4.4Å; K39-Y43 HydrophobicContact CG-CG 4.33Å; K39-Y43 VanDerWaalsContact NZ-CZ 3.33Å; K39-Y43 PolarHBondContact NZ-OH 2.88Å
40	G	53.3	Low	49.3	Very low	22 Å²	22	83.3 Å²	83.3	23%	0.227	46%	0.46	C	S	.	.			trans	78.5	169.4	177	0	0	0	0	0	114.3	M36 G42 Y43	M36-G40 WeakPolarHBondContact O-CA 3.4Å; M36-G40 PolarHBondContact O-N 2.82Å; G40-G42 VanDerWaalsContact C-N 3.28Å; G40-G42 PolarHBondContact O-N 2.96Å; G40-Y43 PolarHBondContact O-N 2.89Å
41	P	54.4	Low	47.8	Very low	105 Å²	105	82 Å²	82	68%	0.682	46%	0.464	S	S	*	.	H	α-helix	trans	-65.9	-26	-173.3	22.6	-31.7	0	0	0	114.1	Y43 L44 A45	P41-Y43 VanDerWaalsContact C-N 3.28Å; P41-Y43 PolarHBondContact O-N 3.22Å; P41-L44 PolarHBondContact O-N 3.46Å; P41-A45 PolarHBondContact O-N 2.81Å
42	G	49.4	Very low	46.4	Very low	63 Å²	63	85 Å²	85	65%	0.649	48%	0.482	S	S	*	.	H	α-helix	trans	-65.6	-28.7	177.2	0	0	0	0	0	113.7	G40	G40-G42 VanDerWaalsContact C-N 3.28Å; G40-G42 PolarHBondContact O-N 2.96Å
43	Y	47.2	Very low	44.6	Very low	57 Å²	57	91.1 Å²	91.1	22%	0.224	51%	0.509	C	S	.	.	H	α-helix	trans	-71.7	-43	178.6	-177.9	-107.2	0	0	0	111.9	E35 K39 G40 P41 A45 G46 L47	E35-Y43 WeakPolarHBondContact OE2-CE1 3.24Å; K39-Y43 HydrophobicContact CB-CD1 3.67Å; K39-Y43 HydrophobicContact CB-CD2 4.26Å; K39-Y43 HydrophobicContact CB-CE1 4.36Å; K39-Y43 HydrophobicContact CB-CG 3.6Å; K39-Y43 HydrophobicContact CD-CD1 3.42Å; K39-Y43 VanDerWaalsContact CD-CD1 3.42Å; K39-Y43 HydrophobicContact CD-CD2 3.89Å; K39-Y43 HydrophobicContact CD-CE1 3.21Å; K39-Y43 HydrophobicContact CD-CE2 3.73Å; K39-Y43 HydrophobicContact CD-CG 3.75Å; K39-Y43 HydrophobicContact CG-CD1 4.19Å; K39-Y43 HydrophobicContact CG-CE1 4.4Å; K39-Y43 HydrophobicContact CG-CG 4.33Å; K39-Y43 VanDerWaalsContact NZ-CZ 3.33Å; K39-Y43 PolarHBondContact NZ-OH 2.88Å; G40-Y43 PolarHBondContact O-N 2.89Å; P41-Y43 VanDerWaalsContact C-N 3.28Å; P41-Y43 PolarHBondContact O-N 3.22Å; Y43-A45 VanDerWaalsContact C-N 3.31Å; Y43-A45 PolarHBondContact O-N 3.46Å; Y43-G46 PolarHBondContact O-N 3.12Å; Y43-G46 VanDerWaalsContact O-N 3.16Å; Y43-L47 HydrophobicContact CD1-CD1 3.64Å; Y43-L47 HydrophobicContact CD2-CD1 4.35Å; Y43-L47 HydrophobicContact CE1-CD1 3.18Å; Y43-L47 HydrophobicContact CE2-CD1 3.97Å; Y43-L47 HydrophobicContact CG-CD1 4.2Å; Y43-L47 PolarHBondContact O-N 3.36Å
44	L	48.3	Very low	42.8	Very low	22 Å²	22	93.5 Å²	93.5	12%	0.115	53%	0.527	C	S	.	.	H	α-helix	trans	-69.1	-29.3	178.7	-70	-179	0	0	0	113.2	L32 E35 M36 P41 G46 L47 F48	L32-L44 HydrophobicContact CD2-CD2 3.86Å; E35-L44 HydrophobicContact CB-CD2 4.22Å; M36-L44 HydrophobicContact CB-CD1 3.6Å; M36-L44 HydrophobicContact CE-CD1 3.48Å; M36-L44 VanDerWaalsContact CE-CD1 3.48Å; M36-L44 HydrophobicContact CG-CD1 3.9Å; P41-L44 PolarHBondContact O-N 3.46Å; L44-G46 PolarHBondContact O-N 2.82Å; L44-L47 PolarHBondContact O-N 3.49Å; L44-F48 PolarHBondContact O-N 3.2Å
45	A	44.1	Very low	41.3	Very low	71 Å²	71	93.2 Å²	93.2	59%	0.587	53%	0.525	S	S	*	.	H	α-helix	trans	-62.6	-23.5	173.8	0	0	0	0	0	113	P41 Y43	P41-A45 PolarHBondContact O-N 2.81Å; Y43-A45 VanDerWaalsContact C-N 3.31Å; Y43-A45 PolarHBondContact O-N 3.46Å
46	G	35.3	Very low	39.8	Very low	64 Å²	64	95.8 Å²	95.8	66%	0.66	55%	0.55	S	S	*	.	H	α-helix	trans	-85.5	-35.3	173.7	0	0	0	0	0	113.9	Y43 L44	Y43-G46 PolarHBondContact O-N 3.12Å; Y43-G46 VanDerWaalsContact O-N 3.16Å; L44-G46 PolarHBondContact O-N 2.82Å
47	L	38	Very low	38.1	Very low	62 Å²	62	103 Å²	103	33%	0.325	57%	0.574	S	S	.	*	H	α-helix	trans	-75.2	-32.5	179.7	-93.2	115.6	0	0	0	113.6	Y43 L44	Y43-L47 HydrophobicContact CD1-CD1 3.64Å; Y43-L47 HydrophobicContact CD2-CD1 4.35Å; Y43-L47 HydrophobicContact CE1-CD1 3.18Å; Y43-L47 HydrophobicContact CE2-CD1 3.97Å; Y43-L47 HydrophobicContact CG-CD1 4.2Å; Y43-L47 PolarHBondContact O-N 3.36Å; L44-L47 PolarHBondContact O-N 3.49Å
48	F	35.7	Very low	36.7	Very low	96 Å²	96	104.9 Å²	104.9	42%	0.421	58%	0.576	S	S	.	*			trans	-124.8	79.4	-179.7	-60.2	-86.1	0	0	0	109.8	L32 L44 L50	L32-F48 HydrophobicContact CD2-CD2 4.14Å; L32-F48 HydrophobicContact CD2-CE2 3.3Å; L32-F48 HydrophobicContact CD2-CZ 3.77Å; L44-F48 PolarHBondContact O-N 3.2Å; F48-L50 PolarHBondContact O-N 3.33Å
49	R	29.3	Very low	35.5	Very low	226 Å²	226	107.7 Å²	107.7	85%	0.853	58%	0.583	S	S	*	*			trans	-68.1	90.6	152.5	-95.5	-170.7	178.2	-148.5	1.2	107.2	T51	R49-T51 PolarHBondContact O-N 3.36Å; R49-T51 PolarHBondContact O-OG1 2.92Å
50	L	29.8	Very low	34	Very low	92 Å²	92	113.1 Å²	113.1	48%	0.482	62%	0.615	S	S	.	*			trans	-68.1	84.9	162.8	-68.7	169.5	0	0	0	107.1	N5 F48 P52	N5-L50 HydrophobicContact CB-CD1 3.25Å; N5-L50 WeakPolarHBondContact ND2-CD1 3.32Å; F48-L50 PolarHBondContact O-N 3.33Å; L50-P52 VanDerWaalsContact O-CD 3.23Å; L50-P52 WeakPolarHBondContact O-CD 3.18Å
51	T	26.7	Very low	32.8	Very low	115 Å²	115	115.9 Å²	115.9	71%	0.706	64%	0.635	S	S	*	*			trans	-63.3	116.2	162.8	-20.1	0	0	0	0	105.5	R49 Q53	R49-T51 PolarHBondContact O-N 3.36Å; R49-T51 PolarHBondContact O-OG1 2.92Å; T51-Q53 VanDerWaalsContact C-N 3.33Å; T51-Q53 PolarHBondContact O-N 3.42Å
52	P	25.9	Very low	31.4	Very low	111 Å²	111	120.4 Å²	120.4	72%	0.721	64%	0.644	S	S	*	*			trans	-62.8	100	174.2	24.2	-30.4	0	0	0	107.8	L50 V54	L50-P52 VanDerWaalsContact O-CD 3.23Å; L50-P52 WeakPolarHBondContact O-CD 3.18Å; P52-V54 PolarHBondContact O-N 2.72Å
53	Q	23.3	Very low	30.3	Very low	169 Å²	169	126.3 Å²	126.3	79%	0.79	66%	0.655	S	S	*	*			trans	-72.5	87.5	162.6	-86.2	-164.5	5.2	0	0	107	T51 R55	T51-Q53 VanDerWaalsContact C-N 3.33Å; T51-Q53 PolarHBondContact O-N 3.42Å; Q53-R55 VanDerWaalsContact C-N 3.25Å; Q53-R55 PolarHBondContact O-N 3.3Å
54	V	24	Very low	29.3	Very low	127 Å²	127	129.8 Å²	129.8	77%	0.77	68%	0.682	S	S	*	*			trans	-65.5	95.9	159.4	-175.8	0	0	0	0	105.7	P52 S56	P52-V54 PolarHBondContact O-N 2.72Å; V54-S56 PolarHBondContact O-N 3.34Å
55	R	23	Very low	28.4	Very low	174 Å²	174	137.6 Å²	137.6	66%	0.657	71%	0.714	S	S	*	*			trans	-59.2	105.1	163.1	-80.9	-170.8	176.3	-172.6	-1.7	105.9	Q53 R57 L211	Q53-R55 VanDerWaalsContact C-N 3.25Å; Q53-R55 PolarHBondContact O-N 3.3Å; R55-R57 VanDerWaalsContact C-N 3.25Å; R55-R57 PolarHBondContact O-N 3.47Å; R55-L211 PolarHBondContact NH2-O 2.73Å
56	S	25.4	Very low	27.6	Very low	113 Å²	113	139.6 Å²	139.6	79%	0.79	72%	0.721	S	S	*	*			trans	-58.7	93	168.8	177.7	0	0	0	0	107.8	V54 V58	V54-S56 PolarHBondContact O-N 3.34Å; S56-V58 PolarHBondContact O-N 2.95Å
57	R	24.7	Very low	27.3	Very low	213 Å²	213	146.4 Å²	146.4	80%	0.804	73%	0.733	S	S	*	*			trans	-77.6	114.2	159.6	-76.2	-172.2	-178.4	-166.5	-1.5	105.7	R55 F59	R55-R57 VanDerWaalsContact C-N 3.25Å; R55-R57 PolarHBondContact O-N 3.47Å; R57-F59 WeakPolarHBondContact O-CD2 3.33Å; R57-F59 PolarHBondContact O-N 3.09Å
58	V	25.8	Very low	26.7	Very low	128 Å²	128	149 Å²	149	78%	0.776	75%	0.752	S	S	*	*			trans	-15.5	97.5	155.4	-171.5	0	0	0	0	111.4	S56	S56-V58 PolarHBondContact O-N 2.95Å
59	F	26.6	Very low	26.4	Very low	182 Å²	182	149.8 Å²	149.8	80%	0.798	77%	0.769	S	S	*	*			trans	-119.8	102.2	159.4	-89.5	-78.4	0	0	0	106.3	R57 A61	R57-F59 WeakPolarHBondContact O-CD2 3.33Å; R57-F59 PolarHBondContact O-N 3.09Å; F59-A61 PolarHBondContact O-N 2.92Å
60	D	24.7	Very low	26.2	Very low	164 Å²	164	149.2 Å²	149.2	88%	0.877	77%	0.768	S	S	*	*			trans	-60.1	80.3	156.4	-79.2	-45	0	0	0	108.3
61	A	26.7	Very low	26	Very low	80 Å²	80	153.5 Å²	153.5	66%	0.661	79%	0.786	S	S	*	*			trans	-119.5	106.4	171.8	0	0	0	0	0	107.8	F59	F59-A61 PolarHBondContact O-N 2.92Å
62	K	26.2	Very low	26.1	Very low	200 Å²	200	152.7 Å²	152.7	87%	0.87	79%	0.785	S	S	*	*			trans	-40	135.2	179.9	-69	175	176.6	177.3	0	112.4	V64	K62-V64 PolarHBondContact O-N 3.25Å; K62-V64 VanDerWaalsContact O-N 3.16Å
63	H	26.3	Very low	26	Very low	187 Å²	187	154.4 Å²	154.4	87%	0.866	79%	0.787	S	S	*	*			trans	-23.4	107.7	170.9	-81.8	-80	0	0	0	115.1
64	V	25.8	Very low	26.1	Very low	130 Å²	130	154.2 Å²	154.2	79%	0.788	79%	0.786	S	S	*	*			trans	-125.9	102.4	150.8	-176.5	0	0	0	0	106.6	K62 P66	K62-V64 PolarHBondContact O-N 3.25Å; K62-V64 VanDerWaalsContact O-N 3.16Å; V64-P66 WeakPolarHBondContact O-CD 3.3Å
65	K	28.7	Very low	26.3	Very low	185 Å²	185	156.2 Å²	156.2	80%	0.804	79%	0.787	S	S	*	*			trans	-57	121.1	168.5	-86.8	179.1	174.1	177.2	0	108	K67	K65-K67 PolarHBondContact O-N 3.48Å
66	P	28.8	Very low	26.4	Very low	113 Å²	113	154.9 Å²	154.9	73%	0.734	79%	0.792	S	S	*	*			trans	-64.6	130.2	164	-10.9	26.5	0	0	0	107.5	V64 T68	V64-P66 WeakPolarHBondContact O-CD 3.3Å; P66-T68 PolarHBondContact O-N 2.73Å
67	K	27.8	Very low	26.5	Very low	207 Å²	207	156.7 Å²	156.7	90%	0.9	79%	0.788	S	S	*	*			trans	-58.9	106.7	171.8	-76.1	177.9	176	177.5	0	108.4	K65 S69	K65-K67 PolarHBondContact O-N 3.48Å; K67-S69 PolarHBondContact O-N 2.86Å
68	T	26.8	Very low	26.7	Very low	118 Å²	118	151.6 Å²	151.6	72%	0.724	79%	0.786	S	S	*	*			trans	-72	92.1	169.3	47.7	0	0	0	0	108.9	P66 Y70	P66-T68 PolarHBondContact O-N 2.73Å; T68-Y70 HydrophobicContact CG2-CD2 4.29Å; T68-Y70 HydrophobicContact CG2-CE2 4.46Å
69	S	27.3	Very low	26.7	Very low	112 Å²	112	154.6 Å²	154.6	78%	0.783	78%	0.784	S	S	*	*			trans	-95.9	81.1	148.1	62.6	0	0	0	0	107.1	K67 Q71	K67-S69 PolarHBondContact O-N 2.86Å; S69-Q71 PolarHBondContact O-N 3.18Å; S69-Q71 VanDerWaalsContact O-N 3.11Å
70	Y	25.3	Very low	26.7	Very low	213 Å²	213	154.7 Å²	154.7	84%	0.835	79%	0.789	S	S	*	*			trans	-68	99.4	161.9	-98.8	-97.6	0	0	0	106.8	T68	T68-Y70 HydrophobicContact CG2-CD2 4.29Å; T68-Y70 HydrophobicContact CG2-CE2 4.46Å
71	Q	25.3	Very low	26.8	Very low	182 Å²	182	151.7 Å²	151.7	85%	0.85	78%	0.777	S	S	*	*			trans	-78.4	113.8	149.3	-86.4	-176.9	-15.2	0	0	105.9	S69 I73	S69-Q71 PolarHBondContact O-N 3.18Å; S69-Q71 VanDerWaalsContact O-N 3.11Å; Q71-I73 PolarHBondContact O-N 3.04Å
72	S	29	Very low	26.7	Very low	99 Å²	99	156.3 Å²	156.3	69%	0.692	79%	0.79	S	S	*	*			trans	-53.4	120.3	168.8	38.4	0	0	0	0	108.8	Q74	S72-Q74 VanDerWaalsContact C-N 3.35Å; S72-Q74 PolarHBondContact O-N 3.23Å
73	I	25.5	Very low	26.8	Very low	147 Å²	147	154.9 Å²	154.9	75%	0.754	79%	0.786	S	S	*	*			trans	-67.6	104.3	161.1	-61	173	0	0	0	104.5	Q71 H75	Q71-I73 PolarHBondContact O-N 3.04Å; I73-H75 PolarHBondContact O-N 2.82Å
74	Q	25.4	Very low	26.8	Very low	165 Å²	165	157.7 Å²	157.7	77%	0.771	79%	0.789	S	S	*	*			trans	-60	107.9	168.8	-79.7	-178.3	-23.6	0	0	107.4	S72 N76	S72-Q74 VanDerWaalsContact C-N 3.35Å; S72-Q74 PolarHBondContact O-N 3.23Å; Q74-N76 PolarHBondContact O-N 2.93Å
75	H	26.7	Very low	26.9	Very low	169 Å²	169	155.1 Å²	155.1	78%	0.782	79%	0.789	S	S	*	*			trans	-64.3	103.5	159.7	-74.4	-87.6	0	0	0	106.4	I73 E77	I73-H75 PolarHBondContact O-N 2.82Å; H75-E77 VanDerWaalsContact C-N 3.26Å; H75-E77 PolarHBondContact O-N 2.8Å
76	N	25.9	Very low	26.8	Very low	146 Å²	146	152.6 Å²	152.6	78%	0.781	79%	0.789	S	S	*	*			trans	-67.4	95.7	161.8	-103	-11.2	0	0	0	106.8	Q74 S78	Q74-N76 PolarHBondContact O-N 2.93Å; N76-S78 VanDerWaalsContact C-N 3.27Å; N76-S78 PolarHBondContact O-N 2.94Å
77	E	27.4	Very low	27	Very low	150 Å²	150	153 Å²	153	70%	0.701	79%	0.792	S	S	*	*			trans	-59	97.9	156.2	-70.6	-178.4	167.4	0	0	106.7	H75 Y79	H75-E77 VanDerWaalsContact C-N 3.26Å; H75-E77 PolarHBondContact O-N 2.8Å; E77-Y79 VanDerWaalsContact C-N 3.32Å; E77-Y79 PolarHBondContact O-N 2.94Å
78	S	28.8	Very low	27.1	Very low	107 Å²	107	149 Å²	149	75%	0.748	79%	0.789	S	S	*	*			trans	-73.7	95.5	169.7	5.3	0	0	0	0	106.7	N76 M80	N76-S78 VanDerWaalsContact C-N 3.27Å; N76-S78 PolarHBondContact O-N 2.94Å; S78-M80 PolarHBondContact O-N 2.6Å; S78-M80 VanDerWaalsContact O-N 3.15Å
79	Y	26.2	Very low	27.3	Very low	191 Å²	191	151.4 Å²	151.4	75%	0.749	80%	0.797	S	S	*	*			trans	-54.2	113.8	163.7	-81.3	-94.4	0	0	0	108.8	E77 T81	E77-Y79 VanDerWaalsContact C-N 3.32Å; E77-Y79 PolarHBondContact O-N 2.94Å; Y79-T81 PolarHBondContact O-N 2.75Å
80	M	26.3	Very low	27.6	Very low	184 Å²	184	151.8 Å²	151.8	91%	0.906	80%	0.799	S	S	*	*			trans	-76.2	95.4	164.3	-87.8	-81.5	147.3	0	0	108.2	S78	S78-M80 PolarHBondContact O-N 2.6Å; S78-M80 VanDerWaalsContact O-N 3.15Å
81	T	25.7	Very low	27.9	Very low	100 Å²	100	149.2 Å²	149.2	61%	0.613	80%	0.8	S	S	*	*			trans	-85.2	108.4	167.6	26.1	0	0	0	0	110.1	Y79 H83	Y79-T81 PolarHBondContact O-N 2.75Å; T81-H83 PolarHBondContact O-N 3.49Å
82	L	26.5	Very low	28	Very low	178 Å²	178	143.9 Å²	143.9	93%	0.932	79%	0.794	S	S	*	*			trans	-69.7	99.7	166.9	-101	142.8	0	0	0	109.5
83	H	26.8	Very low	28.3	Very low	169 Å²	169	145 Å²	145	78%	0.782	80%	0.799	S	S	*	*			trans	-84.2	112.8	169.1	-76.7	-69.1	0	0	0	110.6	T81	T81-H83 PolarHBondContact O-N 3.49Å
84	R	26.7	Very low	28.4	Very low	247 Å²	247	145.9 Å²	145.9	93%	0.932	81%	0.805	S	S	*	*			trans	-88.1	107.9	167.9	-170.2	-176.3	-163.9	-166.6	4.7	108.3
85	G	27.6	Very low	28.5	Very low	76 Å²	76	143 Å²	143	78%	0.784	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-93.9	122.9	173	0	0	0	0	0	111.9
86	T	28	Very low	28.6	Very low	132 Å²	132	144 Å²	144	81%	0.81	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-74.3	146.4	172.9	35.2	0	0	0	0	112.8
87	P	30.9	Very low	28.5	Very low	122 Å²	122	145.9 Å²	145.9	79%	0.792	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-83.7	138.8	175.6	32.9	-30.4	0	0	0	111.5
88	S	30.8	Very low	28.5	Very low	121 Å²	121	143.2 Å²	143.2	85%	0.846	81%	0.811	S	S	*	*			trans	-105.7	126	168.4	76.8	0	0	0	0	111.1
89	L	30.7	Very low	28.2	Very low	169 Å²	169	145.4 Å²	145.4	89%	0.885	81%	0.813	S	S	*	*			trans	-72.3	138.2	170.4	-92.7	76.5	0	0	0	111.3
90	S	33.6	Very low	28.1	Very low	120 Å²	120	144.3 Å²	144.3	84%	0.839	82%	0.815	S	S	*	*			trans	-173.8	142.7	140.9	177.7	0	0	0	0	111.8
91	D	31.6	Very low	28	Very low	159 Å²	159	141.7 Å²	141.7	85%	0.85	80%	0.803	S	S	*	*			trans	-71	128.3	-161.5	-64.1	-62.9	0	0	0	118.9
92	G	28.6	Very low	28	Very low	71 Å²	71	143.4 Å²	143.4	73%	0.732	81%	0.814	S	S	*	*				64.3	169.6	127.3	0	0	0	0	0	122.4
93	P	34.2	Very low	28.1	Very low	123 Å²	123	138.6 Å²	138.6	80%	0.799	80%	0.795	S	S	*	*	S	Bend	cis	-115.5	161.8	-21.7	36.8	-21.8	0	0	0	112.1
94	N	27.6	Very low	28.1	Very low	164 Å²	164	138.7 Å²	138.7	88%	0.877	80%	0.8	S	S	*	*	S	Bend	trans	80.2	58.5	-171.1	-59.6	-16.8	0	0	0	115.8
95	S	28	Very low	28	Very low	105 Å²	105	134.8 Å²	134.8	73%	0.734	79%	0.793	S	S	*	*			trans	-128.4	94.5	161	-57.9	0	0	0	0	107.8	E97	S95-E97 VanDerWaalsContact C-N 3.31Å; S95-E97 PolarHBondContact O-N 3.46Å
96	Q	27.8	Very low	27.9	Very low	191 Å²	191	137.7 Å²	137.7	89%	0.893	80%	0.795	S	S	*	*			trans	-61	107.3	152.6	-98.6	-175	-56.8	0	0	105.3	S98	Q96-S98 PolarHBondContact O-N 2.95Å
97	E	24.5	Very low	27.7	Very low	184 Å²	184	140.1 Å²	140.1	86%	0.86	80%	0.797	S	S	*	*			trans	-56.4	85.9	167.9	-68.5	179	147.1	0	0	108.6	S95 L99	S95-E97 VanDerWaalsContact C-N 3.31Å; S95-E97 PolarHBondContact O-N 3.46Å; E97-L99 PolarHBondContact O-N 3.36Å
98	S	26.6	Very low	27.6	Very low	94 Å²	94	139.6 Å²	139.6	66%	0.657	79%	0.788	S	S	*	*			trans	-76.9	100	160.6	-66.2	0	0	0	0	105.5	Q96 Q100	Q96-S98 PolarHBondContact O-N 2.95Å; S98-Q100 PolarHBondContact O-N 3.43Å
99	L	23.9	Very low	27.5	Very low	154 Å²	154	139.6 Å²	139.6	81%	0.806	78%	0.782	S	S	*	*			trans	-57.3	85.4	160.6	-81.6	160.1	0	0	0	108.1	E97 I101	E97-L99 PolarHBondContact O-N 3.36Å; L99-I101 HydrophobicContact CB-CG1 4.44Å; L99-I101 PolarHBondContact O-N 3.5Å
100	Q	23.4	Very low	27.2	Very low	168 Å²	168	141 Å²	141	79%	0.785	78%	0.781	S	S	*	*			trans	-75.3	84.1	163.9	-77.7	-170.5	-8.3	0	0	107.3	S98 T102	S98-Q100 PolarHBondContact O-N 3.43Å; Q100-T102 PolarHBondContact O-N 2.87Å
101	I	24.7	Very low	26.8	Very low	128 Å²	128	141.6 Å²	141.6	66%	0.656	78%	0.775	S	S	*	*			trans	-73.9	88.1	164.9	-58.6	177.1	0	0	0	106.6	L99 S103	L99-I101 HydrophobicContact CB-CG1 4.44Å; L99-I101 PolarHBondContact O-N 3.5Å; I101-S103 WeakPolarHBondContact CG2-OG 3.24Å; I101-S103 PolarHBondContact O-N 2.85Å
102	T	25.7	Very low	26.6	Very low	136 Å²	136	142.1 Å²	142.1	83%	0.834	77%	0.773	S	S	*	*			trans	-78.6	80.3	153.7	47.8	0	0	0	0	107.7	Q100	Q100-T102 PolarHBondContact O-N 2.87Å
103	S	27.7	Very low	26.4	Very low	78 Å²	78	148 Å²	148	55%	0.545	78%	0.778	S	S	.	*			trans	-150.5	104.6	160.6	63.3	0	0	0	0	108.5	I101 E105	I101-S103 WeakPolarHBondContact CG2-OG 3.24Å; I101-S103 PolarHBondContact O-N 2.85Å; S103-E105 PolarHBondContact O-N 2.79Å
104	L	26.6	Very low	26.1	Very low	170 Å²	170	149.2 Å²	149.2	89%	0.89	78%	0.776	S	S	*	*			trans	-58.2	79.8	162.7	-177.8	106.1	0	0	0	108.6
105	E	24.9	Very low	26.1	Very low	166 Å²	166	146.8 Å²	146.8	78%	0.776	77%	0.77	S	S	*	*	S	Bend	trans	176.6	134.3	162.2	-100.6	154.9	-161.4	0	0	108.5	S103	S103-E105 PolarHBondContact O-N 2.79Å
106	V	25.8	Very low	26.2	Very low	137 Å²	137	149.2 Å²	149.2	83%	0.83	77%	0.774	S	S	*	*	S	Bend	trans	80.3	49.3	170.3	-148.8	0	0	0	0	117.3
107	Q	24.1	Very low	26.1	Very low	183 Å²	183	145.7 Å²	145.7	86%	0.855	77%	0.769	S	S	*	*			trans	-152.6	65.3	149.7	-131.2	177.6	22.8	0	0	112.2
108	N	29.4	Very low	26.2	Very low	111 Å²	111	142.9 Å²	142.9	59%	0.594	76%	0.764	S	S	*	*			trans	-135.9	54.2	156.7	-95	-23	0	0	0	109.2	F110	N108-F110 PolarHBondContact O-N 3.41Å
109	V	28.1	Very low	26.3	Very low	120 Å²	120	144.8 Å²	144.8	73%	0.727	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	106.5	158.4	-162.6	0	0	0	0	104.3
110	F	25.1	Very low	26.6	Very low	198 Å²	198	140.2 Å²	140.2	87%	0.868	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	84.8	34.8	179.3	-72.2	-88.2	0	0	0	120.4	N108	N108-F110 PolarHBondContact O-N 3.41Å
111	N	24.9	Very low	26.8	Very low	133 Å²	133	137.8 Å²	137.8	71%	0.711	74%	0.742	S	S	*	*			trans	-156.8	36.6	164	-119.6	-4.6	0	0	0	117.1	K113	N111-K113 PolarHBondContact O-N 3.45Å
112	E	26.5	Very low	27.2	Very low	170 Å²	170	136.8 Å²	136.8	79%	0.794	74%	0.743	S	S	*	*			trans	-75.2	100.2	170.1	-75.9	-173.8	168.8	0	0	110.3	I114	E112-I114 PolarHBondContact O-N 3.26Å
113	K	25	Very low	27.5	Very low	195 Å²	195	133.4 Å²	133.4	85%	0.848	72%	0.719	S	S	*	*			trans	-44.3	115.5	149.9	-77.8	177.7	176.5	177.6	0	106.8	N111 P115	N111-K113 PolarHBondContact O-N 3.45Å; K113-P115 VanDerWaalsContact O-N 3.14Å
114	I	28.4	Very low	27.6	Very low	148 Å²	148	133.6 Å²	133.6	76%	0.759	72%	0.721	S	S	*	*			trans	-39	125	162.5	-60.6	167.1	0	0	0	106.2	E112 L116	E112-I114 PolarHBondContact O-N 3.26Å; I114-L116 VanDerWaalsContact C-N 3.33Å; I114-L116 PolarHBondContact O-N 3.41Å
115	P	27.4	Very low	28	Very low	114 Å²	114	132.2 Å²	132.2	74%	0.74	72%	0.715	S	S	*	*			trans	-59.8	107.2	176	23.4	-29.2	0	0	0	105.9	K113 C117	K113-P115 VanDerWaalsContact O-N 3.14Å; P115-C117 PolarHBondContact O-N 2.89Å
116	L	29.2	Very low	28.4	Very low	156 Å²	156	129.3 Å²	129.3	82%	0.817	70%	0.704	S	S	*	*			trans	-51.5	111.7	161.8	-93.7	146.5	0	0	0	104.4	I114 V118	I114-L116 VanDerWaalsContact C-N 3.33Å; I114-L116 PolarHBondContact O-N 3.41Å; L116-V118 PolarHBondContact O-N 3.29Å
117	C	26.5	Very low	28.6	Very low	117 Å²	117	127.6 Å²	127.6	79%	0.791	70%	0.695	S	S	*	*			trans	-45.3	111.8	174.9	-72.6	0	0	0	0	107.9	P115 I119	P115-C117 PolarHBondContact O-N 2.89Å; C117-I119 VanDerWaalsContact C-N 3.33Å; C117-I119 PolarHBondContact O-N 2.77Å
118	V	26.4	Very low	28.8	Very low	125 Å²	125	123.6 Å²	123.6	76%	0.758	69%	0.687	S	S	*	*			trans	-74.3	97.2	174.8	178.6	0	0	0	0	105.4	L116 T120	L116-V118 PolarHBondContact O-N 3.29Å; V118-T120 PolarHBondContact O-N 3.01Å; V118-T120 VanDerWaalsContact O-N 3.13Å
119	I	29.6	Very low	28.8	Very low	133 Å²	133	122.2 Å²	122.2	68%	0.682	69%	0.691	S	S	*	*			trans	-66.4	108	173.6	-57.9	176.9	0	0	0	106.5	C117 D123	C117-I119 VanDerWaalsContact C-N 3.33Å; C117-I119 PolarHBondContact O-N 2.77Å; I119-D123 HydrophobicContact CG2-CB 3.74Å
120	T	28.3	Very low	28.9	Very low	58 Å²	58	126.2 Å²	126.2	36%	0.356	70%	0.698	S	S	.	*			trans	-75.1	157.9	171.1	66.6	0	0	0	0	109.7	V118 T122 D123	V118-T120 PolarHBondContact O-N 3.01Å; V118-T120 VanDerWaalsContact O-N 3.13Å; T120-T122 PolarHBondContact O-N 3.06Å; T120-T122 PolarHBondContact OG1-OG1 2.91Å; T120-T122 VanDerWaalsContact OG1-OG1 3.06Å; T120-D123 WeakPolarHBondContact CB-OD2 3.46Å; T120-D123 PolarHBondContact N-OD2 3.29Å; T120-D123 WeakPolarHBondContact O-CA 3.23Å; T120-D123 WeakPolarHBondContact O-CB 3.49Å; T120-D123 PolarHBondContact O-N 3.16Å; T120-D123 VanDerWaalsContact OG1-CG 3.32Å; T120-D123 PolarHBondContact OG1-OD2 3.49Å
121	P	29.6	Very low	29.2	Very low	117 Å²	117	121.7 Å²	121.7	76%	0.76	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-12.9	173.5	-22.9	33	0	0	0	114.2	S124	P121-S124 PolarHBondContact O-OG 2.84Å
122	T	33	Very low	29.5	Very low	108 Å²	108	119.4 Å²	119.4	66%	0.663	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-27.9	171.6	-5.5	0	0	0	0	112.4	T120 S124 N125	T120-T122 PolarHBondContact O-N 3.06Å; T120-T122 PolarHBondContact OG1-OG1 2.91Å; T120-T122 VanDerWaalsContact OG1-OG1 3.06Å; T122-S124 VanDerWaalsContact C-N 3.32Å; T122-N125 PolarHBondContact O-N 3.44Å
123	D	31	Very low	29.6	Very low	64 Å²	64	118.9 Å²	118.9	34%	0.342	66%	0.664	S	S	.	*	G	3₁₀ helix	trans	-77.6	-16.8	179.8	-63.5	-49.2	0	0	0	112.8	I119 T120 N125 L126	I119-D123 HydrophobicContact CG2-CB 3.74Å; T120-D123 WeakPolarHBondContact CB-OD2 3.46Å; T120-D123 PolarHBondContact N-OD2 3.29Å; T120-D123 WeakPolarHBondContact O-CA 3.23Å; T120-D123 WeakPolarHBondContact O-CB 3.49Å; T120-D123 PolarHBondContact O-N 3.16Å; T120-D123 VanDerWaalsContact OG1-CG 3.32Å; T120-D123 PolarHBondContact OG1-OD2 3.49Å; D123-N125 PolarHBondContact O-N 2.69Å; D123-L126 HydrophobicContact CB-CD1 4.4Å; D123-L126 PolarHBondContact O-N 3.27Å
124	S	30	Very low	30	Very low	83 Å²	83	114.1 Å²	114.1	58%	0.58	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-70.7	-11.9	173.7	58.8	0	0	0	0	113.7	P121 T122	P121-S124 PolarHBondContact O-OG 2.84Å; T122-S124 VanDerWaalsContact C-N 3.32Å
125	N	34.9	Very low	30.2	Very low	141 Å²	141	112.1 Å²	112.1	75%	0.754	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-101.2	-0.5	174.6	-71.8	-34.7	0	0	0	113.6	T122 D123	T122-N125 PolarHBondContact O-N 3.44Å; D123-N125 PolarHBondContact O-N 2.69Å
126	L	32.4	Very low	30.3	Very low	105 Å²	105	112.8 Å²	112.8	55%	0.55	63%	0.632	S	S	.	*	S	Bend	trans	-74.1	131.9	168.6	-71.7	167.7	0	0	0	108	D123 C128	D123-L126 HydrophobicContact CB-CD1 4.4Å; D123-L126 PolarHBondContact O-N 3.27Å; L126-C128 PolarHBondContact O-N 3.49Å
127	P	30.7	Very low	30.4	Very low	101 Å²	101	111.1 Å²	111.1	66%	0.656	62%	0.62	S	S	*	*			trans	-65.1	88.4	172.5	26.2	-30	0	0	0	107.8	A129 T131	P127-A129 PolarHBondContact O-N 2.63Å; P127-T131 VanDerWaalsContact CB-OG1 3.29Å; P127-T131 WeakPolarHBondContact CB-OG1 3.4Å
128	C	28.9	Very low	30.6	Very low	99 Å²	99	112.6 Å²	112.6	67%	0.669	62%	0.616	S	S	*	*			trans	-51.8	138.3	164.4	28.7	0	0	0	0	106.5	L126 K130 T131	L126-C128 PolarHBondContact O-N 3.49Å; C128-K130 PolarHBondContact O-N 3.31Å; C128-T131 PolarHBondContact O-OG1 3.11Å
129	A	30	Very low	30.7	Very low	82 Å²	82	113.6 Å²	113.6	68%	0.678	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	19.5	-160.9	0	0	0	0	0	118.2	P127	P127-A129 PolarHBondContact O-N 2.63Å
130	K	29.3	Very low	30.8	Very low	203 Å²	203	111.8 Å²	111.8	88%	0.883	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-11.4	169	-69	-175.5	175.1	-179.4	0	114.4	C128	C128-K130 PolarHBondContact O-N 3.31Å
131	T	30.5	Very low	30.8	Very low	104 Å²	104	113.6 Å²	113.6	64%	0.638	63%	0.632	S	S	*	*			trans	-96.8	10.1	178.6	20.2	0	0	0	0	114.6	P127 C128 R133	P127-T131 VanDerWaalsContact CB-OG1 3.29Å; P127-T131 WeakPolarHBondContact CB-OG1 3.4Å; C128-T131 PolarHBondContact O-OG1 3.11Å; T131-R133 PolarHBondContact O-N 3.03Å; T131-R133 VanDerWaalsContact O-N 3.12Å
132	I	33.1	Very low	30.6	Very low	84 Å²	84	113.4 Å²	113.4	43%	0.431	63%	0.629	S	S	.	*	S	Bend	trans	-70.3	109.1	163.2	-62.9	178.5	0	0	0	106.5	F136	I132-F136 HydrophobicContact CG2-CB 3.53Å; I132-F136 HydrophobicContact CG2-CD2 4.36Å; I132-F136 HydrophobicContact CG2-CG 4.31Å
133	R	27.8	Very low	30.5	Very low	159 Å²	159	116.9 Å²	116.9	60%	0.6	64%	0.635	S	S	*	*			trans	-45.3	135.4	172.3	-89.4	163	159.6	-139.4	9.4	109.6	T131 E135 F136	T131-R133 PolarHBondContact O-N 3.03Å; T131-R133 VanDerWaalsContact O-N 3.12Å; R133-E135 HydrophobicContact CB-CB 4.4Å; R133-E135 VanDerWaalsContact CD-OE2 3.28Å; R133-E135 WeakPolarHBondContact CD-OE2 3.13Å; R133-E135 IonicContact CZ-OE2 2.92Å; R133-E135 IonicContact NE-OE2 3.75Å; R133-E135 IonicContact NH1-OE2 3.85Å; R133-E135 PolarHBondContact NH1-OE2 3.2Å; R133-E135 PolarHBondContact O-N 3.47Å; R133-F136 HydrophobicContact CB-CD2 4.04Å; R133-F136 HydrophobicContact CB-CE2 4.38Å; R133-F136 PolarHBondContact O-N 2.88Å
134	P	33.3	Very low	30.2	Very low	95 Å²	95	122 Å²	122	62%	0.617	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-51.4	-26.1	179.4	-25.6	32.2	0	0	0	113.9	F136 H137	P134-F136 PolarHBondContact O-N 2.91Å; P134-F136 VanDerWaalsContact O-N 3.17Å; P134-H137 PolarHBondContact O-N 3.34Å
135	E	31.9	Very low	30.4	Very low	106 Å²	106	122 Å²	122	50%	0.495	66%	0.662	S	S	.	*	G	3₁₀ helix	trans	-51.2	-32.7	172.8	-60.5	128.8	-126.1	0	0	113.5	R133	R133-E135 HydrophobicContact CB-CB 4.4Å; R133-E135 VanDerWaalsContact CD-OE2 3.28Å; R133-E135 WeakPolarHBondContact CD-OE2 3.13Å; R133-E135 IonicContact CZ-OE2 2.92Å; R133-E135 IonicContact NE-OE2 3.75Å; R133-E135 IonicContact NH1-OE2 3.85Å; R133-E135 PolarHBondContact NH1-OE2 3.2Å; R133-E135 PolarHBondContact O-N 3.47Å
136	F	29.8	Very low	30.3	Very low	128 Å²	128	121.2 Å²	121.2	56%	0.561	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-88.1	-5.6	179.1	-68.6	-77.8	0	0	0	114.1	I132 R133 P134	I132-F136 HydrophobicContact CG2-CB 3.53Å; I132-F136 HydrophobicContact CG2-CD2 4.36Å; I132-F136 HydrophobicContact CG2-CG 4.31Å; R133-F136 HydrophobicContact CB-CD2 4.04Å; R133-F136 HydrophobicContact CB-CE2 4.38Å; R133-F136 PolarHBondContact O-N 2.88Å; P134-F136 PolarHBondContact O-N 2.91Å; P134-F136 VanDerWaalsContact O-N 3.17Å
137	H	31.9	Very low	30.4	Very low	121 Å²	121	122.6 Å²	122.6	56%	0.56	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-21.2	171.5	-71.5	-21.7	0	0	0	112.6	P134	P134-H137 PolarHBondContact O-N 3.34Å
138	Q	29.8	Very low	30.7	Very low	149 Å²	149	126.9 Å²	126.9	70%	0.696	68%	0.679	S	S	*	*	S	Bend	trans	-85.1	-14.6	-179.5	-73.6	-174.8	-4.1	0	0	114.8	S141	Q138-S141 PolarHBondContact O-OG 3.11Å
139	Q	29.6	Very low	31	Very low	145 Å²	145	127.7 Å²	127.7	68%	0.678	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-85.5	-9.1	177.3	-83.2	-173.9	-19	0	0	114.5	S141	Q139-S141 VanDerWaalsContact C-N 3.29Å; Q139-S141 PolarHBondContact O-N 3.48Å
140	A	30.8	Very low	31.3	Very low	96 Å²	96	130 Å²	130	79%	0.793	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-81	-7	175.9	0	0	0	0	0	113.6
141	S	28.2	Very low	31.7	Very low	96 Å²	96	126.7 Å²	126.7	67%	0.671	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-104.9	5.1	-176.6	53.1	0	0	0	0	114.9	Q138 Q139	Q138-S141 PolarHBondContact O-OG 3.11Å; Q139-S141 VanDerWaalsContact C-N 3.29Å; Q139-S141 PolarHBondContact O-N 3.48Å
142	T	25.8	Very low	31.9	Very low	113 Å²	113	129 Å²	129	69%	0.693	66%	0.662	S	S	*	*			trans	-141	66.4	-177.8	0.1	0	0	0	0	110.3
143	F	30.3	Very low	32.1	Very low	180 Å²	180	128.6 Å²	128.6	79%	0.789	66%	0.663	S	S	*	*			trans	-120.7	105	154.6	-99.8	-88.4	0	0	0	107.5	S145	F143-S145 PolarHBondContact O-N 3.29Å
144	D	26	Very low	32.6	Very low	173 Å²	173	125.3 Å²	125.3	93%	0.925	66%	0.657	S	S	*	*			trans	-62.8	71.4	154.9	-83.4	-36.8	0	0	0	107.8
145	S	33.4	Very low	32.7	Very low	81 Å²	81	123.9 Å²	123.9	57%	0.566	65%	0.65	S	S	*	*			trans	-97	97.2	172.5	69.7	0	0	0	0	108	F143	F143-S145 PolarHBondContact O-N 3.29Å
146	T	32.3	Very low	32.8	Very low	125 Å²	125	121.5 Å²	121.5	77%	0.767	64%	0.644	S	S	*	*			trans	1.7	119.4	154.7	-33.1	0	0	0	0	114.8	K148	T146-K148 PolarHBondContact O-N 3.4Å
147	D	34.9	Very low	33	Very low	135 Å²	135	121.5 Å²	121.5	72%	0.722	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-38.9	5.5	-173.8	-126.7	-10.3	0	0	0	120.4
148	K	37.6	Very low	33.3	Very low	190 Å²	190	119 Å²	119	83%	0.826	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-15.6	-172.7	-65.5	-155.4	174.7	-172.5	0	115.9	T146	T146-K148 PolarHBondContact O-N 3.4Å
149	N	34.6	Very low	33.7	Very low	117 Å²	117	115.2 Å²	115.2	63%	0.626	63%	0.626	S	S	*	*	S	Bend	trans	-100.5	-4.6	-179.4	-99.4	-19.4	0	0	0	114.6	Y152 T153	N149-Y152 PolarHBondContact O-N 2.98Å; N149-T153 PolarHBondContact O-N 2.93Å; N149-T153 PolarHBondContact O-OG1 3.36Å
150	K	35.3	Very low	33.9	Very low	131 Å²	131	114.3 Å²	114.3	57%	0.57	63%	0.625	S	S	*	*	H	α-helix	trans	-64.8	-44.7	-178.2	-157.6	175.6	-178.5	-179.1	0	111.6	Y152 T153 D154	K150-Y152 VanDerWaalsContact C-N 3.33Å; K150-Y152 PolarHBondContact O-N 2.87Å; K150-T153 PolarHBondContact O-N 2.75Å; K150-T153 PolarHBondContact O-OG1 2.93Å; K150-D154 VanDerWaalsContact O-CB 3.3Å; K150-D154 WeakPolarHBondContact O-CB 3.4Å; K150-D154 VanDerWaalsContact O-CG 3.32Å; K150-D154 PolarHBondContact O-N 2.96Å
151	D	38.5	Very low	34.2	Very low	132 Å²	132	113 Å²	113	71%	0.706	61%	0.61	S	S	*	*	H	α-helix	trans	-64.2	-34.4	179.6	-72.9	-18.4	0	0	0	113.6	S155	D151-S155 VanDerWaalsContact O-CB 3.24Å; D151-S155 WeakPolarHBondContact O-CB 3.29Å; D151-S155 PolarHBondContact O-N 3.35Å
152	Y	35.3	Very low	34.7	Very low	153 Å²	153	111.2 Å²	111.2	60%	0.6	59%	0.592	S	S	*	*	H	α-helix	trans	-77.4	-39.3	-178.3	-160.1	-92.1	0	0	0	112	N149 K150 C156	N149-Y152 PolarHBondContact O-N 2.98Å; K150-Y152 VanDerWaalsContact C-N 3.33Å; K150-Y152 PolarHBondContact O-N 2.87Å; Y152-C156 PolarHBondContact O-N 3.16Å
153	T	36.3	Very low	35.3	Very low	76 Å²	76	110.7 Å²	110.7	47%	0.466	59%	0.593	S	S	.	*	H	α-helix	trans	-70.4	-39.3	175	30.7	0	0	0	0	111.8	N149 K150 C156 H157	N149-T153 PolarHBondContact O-N 2.93Å; N149-T153 PolarHBondContact O-OG1 3.36Å; K150-T153 PolarHBondContact O-N 2.75Å; K150-T153 PolarHBondContact O-OG1 2.93Å; T153-C156 PolarHBondContact O-N 3.42Å; T153-H157 WeakPolarHBondContact O-CB 3.23Å; T153-H157 PolarHBondContact O-CD2 3.24Å; T153-H157 PolarHBondContact O-N 3.25Å
154	D	38	Very low	35.7	Very low	89 Å²	89	112.4 Å²	112.4	48%	0.476	60%	0.595	S	S	.	*	H	α-helix	trans	-66	-37.7	175	-75.1	-20.6	0	0	0	112	K150 H157 S158	K150-D154 VanDerWaalsContact O-CB 3.3Å; K150-D154 WeakPolarHBondContact O-CB 3.4Å; K150-D154 VanDerWaalsContact O-CG 3.32Å; K150-D154 PolarHBondContact O-N 2.96Å; D154-H157 PolarHBondContact O-N 3.45Å; D154-S158 WeakPolarHBondContact O-CB 3.18Å; D154-S158 PolarHBondContact O-N 2.88Å
155	S	36.8	Very low	36.1	Very low	66 Å²	66	111.7 Å²	111.7	46%	0.462	59%	0.591	S	S	.	*	H	α-helix	trans	-62.6	-45.5	175.8	179.7	0	0	0	0	112.8	D151 S158 L159	D151-S155 VanDerWaalsContact O-CB 3.24Å; D151-S155 WeakPolarHBondContact O-CB 3.29Å; D151-S155 PolarHBondContact O-N 3.35Å; S155-S158 PolarHBondContact O-N 3Å; S155-L159 PolarHBondContact O-N 3.08Å; S155-L159 VanDerWaalsContact O-N 3.11Å
156	C	32.7	Very low	36.4	Very low	56 Å²	56	118.2 Å²	118.2	38%	0.378	60%	0.603	S	S	.	*	H	α-helix	trans	-69.6	-39	177.1	-72.7	0	0	0	0	112.2	Y152 T153 L159 L160	Y152-C156 PolarHBondContact O-N 3.16Å; T153-C156 PolarHBondContact O-N 3.42Å; C156-L159 PolarHBondContact O-N 2.81Å; C156-L160 PolarHBondContact O-N 3.38Å
157	H	34	Very low	36.6	Very low	127 Å²	127	119.9 Å²	119.9	59%	0.588	60%	0.602	S	S	*	*	H	α-helix	trans	-67	-36	173.3	-88.5	-67.7	0	0	0	112.4	T153 D154 L159 L160 S161	T153-H157 WeakPolarHBondContact O-CB 3.23Å; T153-H157 PolarHBondContact O-CD2 3.24Å; T153-H157 PolarHBondContact O-N 3.25Å; D154-H157 PolarHBondContact O-N 3.45Å; H157-L159 VanDerWaalsContact C-N 3.33Å; H157-L159 PolarHBondContact O-N 3.44Å; H157-L160 PolarHBondContact O-N 3.4Å; H157-S161 WeakPolarHBondContact O-CB 3.47Å; H157-S161 PolarHBondContact O-N 3.1Å; H157-S161 PolarHBondContact O-OG 3.29Å
158	S	38.7	Very low	37.2	Very low	69 Å²	69	118.4 Å²	118.4	48%	0.483	59%	0.593	S	S	.	*	H	α-helix	trans	-66.3	-34	176.2	-155.4	0	0	0	0	112.2	D154 S155 S161	D154-S158 WeakPolarHBondContact O-CB 3.18Å; D154-S158 PolarHBondContact O-N 2.88Å; S155-S158 PolarHBondContact O-N 3Å; S158-S161 WeakPolarHBondContact CA-OG 3.45Å; S158-S161 PolarHBondContact O-OG 3.47Å
159	L	38.2	Very low	37.7	Very low	69 Å²	69	113.4 Å²	113.4	36%	0.361	58%	0.582	S	S	.	*	H	α-helix	trans	-69.2	-33.8	173.8	-77.8	168.2	0	0	0	113.3	S155 C156 H157 L183	S155-L159 PolarHBondContact O-N 3.08Å; S155-L159 VanDerWaalsContact O-N 3.11Å; C156-L159 PolarHBondContact O-N 2.81Å; H157-L159 VanDerWaalsContact C-N 3.33Å; H157-L159 PolarHBondContact O-N 3.44Å; L159-L183 HydrophobicContact CB-CD1 4.36Å; L159-L183 HydrophobicContact CD1-CD1 4.2Å; L159-L183 HydrophobicContact CD2-CD1 3.89Å; L159-L183 HydrophobicContact CG-CD1 4.38Å
160	L	35.1	Very low	38.4	Very low	126 Å²	126	114.8 Å²	114.8	66%	0.66	59%	0.589	S	S	*	*	H	α-helix	trans	-90.9	-23.5	-178	-66.7	170	0	0	0	113.9	C156 H157 S163	C156-L160 PolarHBondContact O-N 3.38Å; H157-L160 PolarHBondContact O-N 3.4Å; L160-S163 PolarHBondContact O-OG 2.68Å
161	S	35.5	Very low	39.3	Very low	68 Å²	68	110.9 Å²	110.9	48%	0.476	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-83.1	-6.5	-174	53.1	0	0	0	0	115.3	H157 S158 S163 R164	H157-S161 WeakPolarHBondContact O-CB 3.47Å; H157-S161 PolarHBondContact O-N 3.1Å; H157-S161 PolarHBondContact O-OG 3.29Å; S158-S161 WeakPolarHBondContact CA-OG 3.45Å; S158-S161 PolarHBondContact O-OG 3.47Å; S161-S163 PolarHBondContact O-N 3.43Å; S161-S163 VanDerWaalsContact O-N 3.11Å; S161-R164 PolarHBondContact O-N 2.79Å
162	I	40.3	Very low	40.1	Very low	59 Å²	59	106.9 Å²	106.9	30%	0.303	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-64.8	-15	173.4	-62.2	172.3	0	0	0	111.5	R164 I171	I162-R164 VanDerWaalsContact C-N 3.27Å; I162-R164 PolarHBondContact O-N 2.85Å; I162-I171 HydrophobicContact CG2-CD1 4.41Å
163	S	37.4	Very low	41	Very low	102 Å²	102	105 Å²	105	71%	0.713	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-74.9	-2.6	177.8	62.9	0	0	0	0	115.7	L160 S161	L160-S163 PolarHBondContact O-OG 2.68Å; S161-S163 PolarHBondContact O-N 3.43Å; S161-S163 VanDerWaalsContact O-N 3.11Å
164	R	38.8	Very low	41.9	Very low	216 Å²	216	105.1 Å²	105.1	82%	0.815	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	-28.7	-174.9	-104.3	-179.3	-177.5	168.6	1.7	118.1	S161 I162	S161-R164 PolarHBondContact O-N 2.79Å; I162-R164 VanDerWaalsContact C-N 3.27Å; I162-R164 PolarHBondContact O-N 2.85Å
165	N	35.5	Very low	42.5	Very low	159 Å²	159	104.2 Å²	104.2	85%	0.85	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.2	9.2	-167.5	-76	-39.2	0	0	0	117.8
166	R	37.8	Very low	43.1	Very low	218 Å²	218	103.5 Å²	103.5	82%	0.823	56%	0.558	S	S	*	*	S	Bend	trans	-138.2	125.7	171.1	-100.8	-176.8	177.2	172.9	-1.3	110.7	I168	R166-I168 PolarHBondContact O-N 3.3Å
167	E	37.1	Very low	44	Very low	160 Å²	160	108 Å²	108	75%	0.748	57%	0.572	S	S	*	*			trans	-53.3	123.6	174.7	-67.3	-178.7	149.9	0	0	109.2	S169	E167-S169 VanDerWaalsContact CB-OG 3.28Å; E167-S169 WeakPolarHBondContact CB-OG 3.31Å; E167-S169 PolarHBondContact O-N 3.3Å
168	I	47.3	Very low	45.1	Very low	104 Å²	104	106 Å²	106	53%	0.533	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-62.7	-7.6	-179.1	-63.8	165.8	0	0	0	111.1	R166 D170 L176	R166-I168 PolarHBondContact O-N 3.3Å; I168-D170 VanDerWaalsContact C-N 3.32Å; I168-D170 PolarHBondContact O-N 3.48Å; I168-L176 HydrophobicContact CG2-CD1 3.98Å
169	S	48.8	Very low	45.7	Very low	84 Å²	84	108.4 Å²	108.4	59%	0.587	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-61.9	-28.6	-179.9	49.7	0	0	0	0	114.9	E167	E167-S169 VanDerWaalsContact CB-OG 3.28Å; E167-S169 WeakPolarHBondContact CB-OG 3.31Å; E167-S169 PolarHBondContact O-N 3.3Å
170	D	49	Very low	46.2	Very low	146 Å²	146	112.1 Å²	112.1	78%	0.781	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-90.5	-5.5	-173.8	-69.3	-15.6	0	0	0	114	I168 A172	I168-D170 VanDerWaalsContact C-N 3.32Å; I168-D170 PolarHBondContact O-N 3.48Å; D170-A172 PolarHBondContact O-N 2.85Å
171	I	53.6	Low	46.9	Very low	49 Å²	49	111.5 Å²	111.5	25%	0.251	58%	0.577	S	S	.	*	S	Bend	trans	-87	116.1	-179.8	-58.4	174.6	0	0	0	108.6	I162 V175 L176	I162-I171 HydrophobicContact CG2-CD1 4.41Å; I171-V175 HydrophobicContact CG2-CB 4.09Å; I171-V175 HydrophobicContact CG2-CG1 4.18Å; I171-L176 HydrophobicContact CB-CD1 3.79Å; I171-L176 HydrophobicContact CB-CG 4.42Å; I171-L176 HydrophobicContact CG2-CB 4.35Å; I171-L176 HydrophobicContact CG2-CD1 3.79Å; I171-L176 HydrophobicContact CG2-CG 3.91Å
172	A	56.7	Low	47.7	Very low	49 Å²	49	115.8 Å²	115.8	41%	0.405	59%	0.587	S	S	.	*			trans	-48.1	129.6	175.6	0	0	0	0	0	110.8	D170 S174 V175 L176	D170-A172 PolarHBondContact O-N 2.85Å; A172-S174 PolarHBondContact O-N 3.28Å; A172-V175 HydrophobicContact CB-CG2 4.19Å; A172-V175 WeakPolarHBondContact O-CB 3.4Å; A172-V175 PolarHBondContact O-N 3.39Å; A172-L176 PolarHBondContact O-N 3.39Å
173	P	53.2	Low	48.1	Very low	112 Å²	112	117.2 Å²	117.2	73%	0.727	60%	0.595	S	S	*	*	H	α-helix	trans	-53.7	-30.2	-175.2	-29.5	34.3	0	0	0	114.2	L176 K177	P173-L176 PolarHBondContact O-N 2.97Å; P173-K177 WeakPolarHBondContact O-CB 3.35Å; P173-K177 PolarHBondContact O-N 2.82Å
174	S	55.7	Low	48.5	Very low	79 Å²	79	116.7 Å²	116.7	55%	0.552	58%	0.584	S	S	*	*	H	α-helix	trans	-64.3	-42.3	175.5	55	0	0	0	0	112.9	A172 K177 S178	A172-S174 PolarHBondContact O-N 3.28Å; S174-K177 PolarHBondContact O-N 3.27Å; S174-S178 PolarHBondContact O-N 3.23Å; S174-S178 PolarHBondContact O-OG 3.34Å
175	V	51.5	Low	49.2	Very low	70 Å²	70	109.1 Å²	109.1	42%	0.424	56%	0.562	S	S	.	*	H	α-helix	trans	-68.1	-39.6	178.3	179.7	0	0	0	0	110.6	I171 A172 R179	I171-V175 HydrophobicContact CG2-CB 4.09Å; I171-V175 HydrophobicContact CG2-CG1 4.18Å; A172-V175 HydrophobicContact CB-CG2 4.19Å; A172-V175 WeakPolarHBondContact O-CB 3.4Å; A172-V175 PolarHBondContact O-N 3.39Å; V175-R179 WeakPolarHBondContact O-CB 3.45Å; V175-R179 PolarHBondContact O-N 3.47Å
176	L	49.3	Very low	49.9	Very low	51 Å²	51	106 Å²	106	27%	0.267	54%	0.542	S	S	.	.	H	α-helix	trans	-63.2	-42.2	173.9	-112.7	150.8	0	0	0	111.8	I168 I171 A172 P173 R179 K180	I168-L176 HydrophobicContact CG2-CD1 3.98Å; I171-L176 HydrophobicContact CB-CD1 3.79Å; I171-L176 HydrophobicContact CB-CG 4.42Å; I171-L176 HydrophobicContact CG2-CB 4.35Å; I171-L176 HydrophobicContact CG2-CD1 3.79Å; I171-L176 HydrophobicContact CG2-CG 3.91Å; A172-L176 PolarHBondContact O-N 3.39Å; P173-L176 PolarHBondContact O-N 2.97Å; L176-R179 PolarHBondContact O-N 3.44Å; L176-K180 WeakPolarHBondContact O-CB 3.39Å; L176-K180 WeakPolarHBondContact O-CG 3.38Å; L176-K180 PolarHBondContact O-N 3.03Å
177	K	50.9	Low	50.1	Low	152 Å²	152	101.2 Å²	101.2	66%	0.661	53%	0.525	S	S	*	.	H	α-helix	trans	-64	-48.3	176.6	-170.2	177.4	-179.1	-179.7	0	111.6	P173 S174 R179 K180 Q181	P173-K177 WeakPolarHBondContact O-CB 3.35Å; P173-K177 PolarHBondContact O-N 2.82Å; S174-K177 PolarHBondContact O-N 3.27Å; K177-R179 VanDerWaalsContact C-N 3.34Å; K177-R179 PolarHBondContact O-N 3.48Å; K177-K180 PolarHBondContact O-N 3.47Å; K177-Q181 WeakPolarHBondContact O-CB 3.16Å; K177-Q181 PolarHBondContact O-N 2.86Å
178	S	56.2	Low	50.5	Low	84 Å²	84	99.3 Å²	99.3	59%	0.587	52%	0.516	S	S	*	.	H	α-helix	trans	-62.7	-39.3	177.5	-64.6	0	0	0	0	112.4	S174 Q181 K182	S174-S178 PolarHBondContact O-N 3.23Å; S174-S178 PolarHBondContact O-OG 3.34Å; S178-Q181 PolarHBondContact O-N 3.35Å; S178-K182 PolarHBondContact O-N 2.94Å
179	R	51.4	Low	50.4	Low	120 Å²	120	100.3 Å²	100.3	45%	0.453	52%	0.516	S	S	.	.	H	α-helix	trans	-67.1	-43.7	175.8	-87.6	-177.8	168.4	174.9	-4.2	112.6	V175 L176 K177 Q181 K182 L183	V175-R179 WeakPolarHBondContact O-CB 3.45Å; V175-R179 PolarHBondContact O-N 3.47Å; L176-R179 PolarHBondContact O-N 3.44Å; K177-R179 VanDerWaalsContact C-N 3.34Å; K177-R179 PolarHBondContact O-N 3.48Å; R179-Q181 VanDerWaalsContact C-N 3.33Å; R179-Q181 PolarHBondContact O-N 3.27Å; R179-K182 PolarHBondContact O-N 2.95Å; R179-L183 PolarHBondContact O-N 2.95Å
180	K	50	Low	50.1	Low	146 Å²	146	99.4 Å²	99.4	64%	0.635	51%	0.51	S	S	*	.	H	α-helix	trans	-59.9	-43	174.4	-78.3	-178.1	178.1	-176.3	0	111.7	L176 K177 K182 L183 L184	L176-K180 WeakPolarHBondContact O-CB 3.39Å; L176-K180 WeakPolarHBondContact O-CG 3.38Å; L176-K180 PolarHBondContact O-N 3.03Å; K177-K180 PolarHBondContact O-N 3.47Å; K180-K182 VanDerWaalsContact C-N 3.34Å; K180-K182 PolarHBondContact O-N 3.47Å; K180-L183 PolarHBondContact O-N 2.97Å; K180-L184 WeakPolarHBondContact O-CB 3.5Å; K180-L184 PolarHBondContact O-N 3.06Å
181	Q	48.6	Very low	49.6	Very low	114 Å²	114	95.5 Å²	95.5	53%	0.533	49%	0.488	S	S	.	.	H	α-helix	trans	-60.3	-44.5	176	-163	83.1	25.7	0	0	111.4	K177 S178 R179 L184 V185	K177-Q181 WeakPolarHBondContact O-CB 3.16Å; K177-Q181 PolarHBondContact O-N 2.86Å; S178-Q181 PolarHBondContact O-N 3.35Å; R179-Q181 VanDerWaalsContact C-N 3.33Å; R179-Q181 PolarHBondContact O-N 3.27Å; Q181-L184 PolarHBondContact O-N 2.94Å; Q181-V185 WeakPolarHBondContact O-CG2 3.4Å; Q181-V185 PolarHBondContact O-N 3.34Å
182	K	52.8	Low	48.9	Very low	158 Å²	158	100 Å²	100	69%	0.687	51%	0.508	S	S	*	.	H	α-helix	trans	-63.8	-42.4	178.8	-137.9	175.5	-173.4	-176.9	0	111.6	S178 R179 K180 L184 V185 E186	S178-K182 PolarHBondContact O-N 2.94Å; R179-K182 PolarHBondContact O-N 2.95Å; K180-K182 VanDerWaalsContact C-N 3.34Å; K180-K182 PolarHBondContact O-N 3.47Å; K182-L184 VanDerWaalsContact C-N 3.35Å; K182-V185 PolarHBondContact O-N 3.23Å; K182-E186 WeakPolarHBondContact O-CG 3.49Å; K182-E186 PolarHBondContact O-N 3.46Å
183	L	48.5	Very low	48	Very low	89 Å²	89	101.9 Å²	101.9	47%	0.466	52%	0.516	S	S	.	.	H	α-helix	trans	-64	-39.6	175.1	-124.6	139.4	0	0	0	111.9	L159 R179 K180 Y187	L159-L183 HydrophobicContact CB-CD1 4.36Å; L159-L183 HydrophobicContact CD1-CD1 4.2Å; L159-L183 HydrophobicContact CD2-CD1 3.89Å; L159-L183 HydrophobicContact CG-CD1 4.38Å; R179-L183 PolarHBondContact O-N 2.95Å; K180-L183 PolarHBondContact O-N 2.97Å; L183-Y187 WeakPolarHBondContact O-CB 3.49Å; L183-Y187 PolarHBondContact O-N 2.96Å
184	L	46.3	Very low	47.3	Very low	90 Å²	90	102.3 Å²	102.3	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-66.1	-39.9	176.5	-163.3	83	0	0	0	111.8	K180 Q181 K182 Y187 Q188	K180-L184 WeakPolarHBondContact O-CB 3.5Å; K180-L184 PolarHBondContact O-N 3.06Å; Q181-L184 PolarHBondContact O-N 2.94Å; K182-L184 VanDerWaalsContact C-N 3.35Å; L184-Y187 PolarHBondContact O-N 3.13Å; L184-Q188 WeakPolarHBondContact O-CB 3.33Å; L184-Q188 PolarHBondContact O-N 2.88Å
185	V	53.4	Low	46.4	Very low	58 Å²	58	104.7 Å²	104.7	35%	0.352	52%	0.523	S	S	.	.	H	α-helix	trans	-67.7	-45.4	176.6	169.8	0	0	0	0	111.2	Q181 K182 Y187 Q188 K189	Q181-V185 WeakPolarHBondContact O-CG2 3.4Å; Q181-V185 PolarHBondContact O-N 3.34Å; K182-V185 PolarHBondContact O-N 3.23Å; V185-Y187 VanDerWaalsContact C-N 3.31Å; V185-Q188 PolarHBondContact O-N 3.21Å; V185-K189 HydrophobicContact CG1-CD 4.46Å; V185-K189 WeakPolarHBondContact O-CG 3.08Å; V185-K189 PolarHBondContact O-N 2.99Å
186	E	50	Low	45.6	Very low	92 Å²	92	105.3 Å²	105.3	43%	0.43	53%	0.53	S	S	.	.	H	α-helix	trans	-64.6	-38.8	174.9	-69.8	-60.3	134.5	0	0	111.1	K182 K189 S190	K182-E186 WeakPolarHBondContact O-CG 3.49Å; K182-E186 PolarHBondContact O-N 3.46Å; E186-K189 PolarHBondContact O-N 2.7Å; E186-K189 IonicContact OE1-NZ 2.75Å; E186-S190 WeakPolarHBondContact O-CB 3.34Å; E186-S190 PolarHBondContact O-N 2.77Å; E186-S190 PolarHBondContact O-OG 3.06Å
187	Y	42	Very low	45.5	Very low	119 Å²	119	109 Å²	109	47%	0.467	55%	0.548	S	S	.	.	H	α-helix	trans	-60.5	-48.3	172.2	-175.9	-109.9	0	0	0	110.9	L183 L184 V185 K189 S190 I191	L183-Y187 WeakPolarHBondContact O-CB 3.49Å; L183-Y187 PolarHBondContact O-N 2.96Å; L184-Y187 PolarHBondContact O-N 3.13Å; V185-Y187 VanDerWaalsContact C-N 3.31Å; Y187-K189 PolarHBondContact O-N 2.96Å; Y187-S190 WeakPolarHBondContact CA-OG 3.42Å; Y187-S190 CarbonylContact O-C 3.48Å; Y187-S190 WeakPolarHBondContact O-CA 3.38Å; Y187-S190 PolarHBondContact O-N 3.47Å; Y187-S190 VanDerWaalsContact O-N 3.1Å; Y187-S190 PolarHBondContact O-OG 3.26Å; Y187-I191 HydrophobicContact CD1-CD1 3.36Å; Y187-I191 HydrophobicContact CD1-CG1 4.38Å; Y187-I191 HydrophobicContact CE1-CD1 3.23Å; Y187-I191 HydrophobicContact CE1-CG1 4.23Å; Y187-I191 HydrophobicContact CE2-CD1 4.41Å; Y187-I191 HydrophobicContact CG-CD1 4.02Å; Y187-I191 WeakPolarHBondContact O-CD1 3.38Å; Y187-I191 WeakPolarHBondContact O-CG1 3.43Å; Y187-I191 PolarHBondContact O-N 2.91Å
188	Q	44.7	Very low	44.9	Very low	119 Å²	119	109 Å²	109	56%	0.556	56%	0.556	S	S	*	*	H	α-helix	trans	-62	-41	175.9	-93	172.5	-41.7	0	0	113.1	L184 V185 S190 I191 E192	L184-Q188 WeakPolarHBondContact O-CB 3.33Å; L184-Q188 PolarHBondContact O-N 2.88Å; V185-Q188 PolarHBondContact O-N 3.21Å; Q188-S190 VanDerWaalsContact C-N 3.27Å; Q188-S190 PolarHBondContact O-N 3.49Å; Q188-I191 WeakPolarHBondContact O-CB 3.34Å; Q188-I191 PolarHBondContact O-N 3.26Å; Q188-I191 VanDerWaalsContact O-N 3.08Å; Q188-E192 PolarHBondContact O-N 3.37Å
189	K	46.5	Very low	44.5	Very low	126 Å²	126	108.2 Å²	108.2	55%	0.548	54%	0.544	S	S	.	.	H	α-helix	trans	-62.4	-35.7	172.5	-75.1	179.7	179.4	179.1	0	112.1	V185 E186 Y187 I191 E192	V185-K189 HydrophobicContact CG1-CD 4.46Å; V185-K189 WeakPolarHBondContact O-CG 3.08Å; V185-K189 PolarHBondContact O-N 2.99Å; E186-K189 PolarHBondContact O-N 2.7Å; E186-K189 IonicContact OE1-NZ 2.75Å; Y187-K189 PolarHBondContact O-N 2.96Å; K189-I191 VanDerWaalsContact C-N 3.26Å; K189-I191 PolarHBondContact O-N 2.97Å; K189-E192 PolarHBondContact O-N 2.98Å
190	S	42.1	Very low	44.1	Very low	64 Å²	64	105.8 Å²	105.8	45%	0.448	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-8.1	174.9	77.9	0	0	0	0	114.4	E186 Y187 Q188	E186-S190 WeakPolarHBondContact O-CB 3.34Å; E186-S190 PolarHBondContact O-N 2.77Å; E186-S190 PolarHBondContact O-OG 3.06Å; Y187-S190 WeakPolarHBondContact CA-OG 3.42Å; Y187-S190 CarbonylContact O-C 3.48Å; Y187-S190 WeakPolarHBondContact O-CA 3.38Å; Y187-S190 PolarHBondContact O-N 3.47Å; Y187-S190 VanDerWaalsContact O-N 3.1Å; Y187-S190 PolarHBondContact O-OG 3.26Å; Q188-S190 VanDerWaalsContact C-N 3.27Å; Q188-S190 PolarHBondContact O-N 3.49Å
191	I	37.3	Very low	44.2	Very low	64 Å²	64	103.2 Å²	103.2	33%	0.328	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-15.2	174.3	-65.3	158.5	0	0	0	111.2	Y187 Q188 K189 P193	Y187-I191 HydrophobicContact CD1-CD1 3.36Å; Y187-I191 HydrophobicContact CD1-CG1 4.38Å; Y187-I191 HydrophobicContact CE1-CD1 3.23Å; Y187-I191 HydrophobicContact CE1-CG1 4.23Å; Y187-I191 HydrophobicContact CE2-CD1 4.41Å; Y187-I191 HydrophobicContact CG-CD1 4.02Å; Y187-I191 WeakPolarHBondContact O-CD1 3.38Å; Y187-I191 WeakPolarHBondContact O-CG1 3.43Å; Y187-I191 PolarHBondContact O-N 2.91Å; Q188-I191 WeakPolarHBondContact O-CB 3.34Å; Q188-I191 PolarHBondContact O-N 3.26Å; Q188-I191 VanDerWaalsContact O-N 3.08Å; K189-I191 VanDerWaalsContact C-N 3.26Å; K189-I191 PolarHBondContact O-N 2.97Å; I191-P193 VanDerWaalsContact O-N 3.13Å
192	E	39	Very low	44.3	Very low	145 Å²	145	103.8 Å²	103.8	68%	0.678	55%	0.547	S	S	*	.	S	Bend	trans	-54.8	124.7	169.8	-88.2	-175.3	158.9	0	0	108.5	Q188 K189 I194	Q188-E192 PolarHBondContact O-N 3.37Å; K189-E192 PolarHBondContact O-N 2.98Å; E192-I194 PolarHBondContact O-N 3.32Å
193	P	37.9	Very low	43.9	Very low	88 Å²	88	101.7 Å²	101.7	57%	0.571	54%	0.536	S	S	*	.			trans	-56	135.6	-179.4	20.2	-28.7	0	0	0	108	I191 T195	I191-P193 VanDerWaalsContact O-N 3.13Å; P193-T195 HydrophobicContact CB-CG2 4.46Å; P193-T195 HydrophobicContact CG-CG2 4.15Å; P193-T195 WeakPolarHBondContact O-CG2 3.28Å; P193-T195 PolarHBondContact O-N 3Å
194	I	40.1	Very low	43.9	Very low	121 Å²	121	102.3 Å²	102.3	62%	0.621	54%	0.536	S	S	*	.			trans	-62.9	93.9	169	-58.9	173.2	0	0	0	105.9	E192 S196 I197	E192-I194 PolarHBondContact O-N 3.32Å; I194-S196 WeakPolarHBondContact CG2-O 3.37Å; I194-I197 HydrophobicContact CG2-CD1 4.38Å; I194-I197 HydrophobicContact CG2-CG1 3.58Å
195	T	35.3	Very low	44.3	Very low	129 Å²	129	105.4 Å²	105.4	79%	0.791	55%	0.548	S	S	*	.			trans	-82.3	-21.4	-177.8	47.1	0	0	0	0	111.6	P193	P193-T195 HydrophobicContact CB-CG2 4.46Å; P193-T195 HydrophobicContact CG-CG2 4.15Å; P193-T195 WeakPolarHBondContact O-CG2 3.28Å; P193-T195 PolarHBondContact O-N 3Å
196	S	35.7	Very low	44	Very low	83 Å²	83	109.1 Å²	109.1	58%	0.58	56%	0.56	S	S	*	*			trans	-145.2	141.9	170.6	64.3	0	0	0	0	110.2	I194	I194-S196 WeakPolarHBondContact CG2-O 3.37Å
197	I	45.8	Very low	44	Very low	128 Å²	128	108.7 Å²	108.7	66%	0.656	56%	0.56	S	S	*	*			trans	-106.7	118	164	-65.6	173.8	0	0	0	104.7	I194 I199	I194-I197 HydrophobicContact CG2-CD1 4.38Å; I194-I197 HydrophobicContact CG2-CG1 3.58Å; I197-I199 HydrophobicContact CG2-CG1 4.04Å; I197-I199 PolarHBondContact O-N 2.93Å; I197-I199 VanDerWaalsContact O-N 3.09Å
198	D	39.7	Very low	44.6	Very low	153 Å²	153	107.1 Å²	107.1	82%	0.818	56%	0.559	S	S	*	*			trans	-69.3	106.1	169.7	-81.2	-26.2	0	0	0	107.9
199	I	46.8	Very low	45	Very low	66 Å²	66	105 Å²	105	34%	0.338	56%	0.557	S	S	.	*			trans	-91.4	121.8	174.9	-58.1	-177.1	0	0	0	106.3	I197 S201 E204 L207	I197-I199 HydrophobicContact CG2-CG1 4.04Å; I197-I199 PolarHBondContact O-N 2.93Å; I197-I199 VanDerWaalsContact O-N 3.09Å; I199-S201 PolarHBondContact O-N 3.11Å; I199-E204 HydrophobicContact CG2-CB 4.27Å; I199-L207 HydrophobicContact CD1-CD1 3.64Å; I199-L207 HydrophobicContact CG2-CD1 4.17Å
200	P	42.6	Very low	45	Very low	70 Å²	70	103.6 Å²	103.6	46%	0.455	56%	0.555	S	S	.	*			trans	-54.1	138	173.4	-21.5	29.9	0	0	0	109.9	E202 Y203 E204	P200-E202 HydrophobicContact CB-CG 4.03Å; P200-E202 PolarHBondContact O-N 3.06Å; P200-Y203 HydrophobicContact CB-CD2 3.87Å; P200-Y203 HydrophobicContact CB-CE2 4.32Å; P200-Y203 HydrophobicContact CG-CD2 3.91Å; P200-Y203 HydrophobicContact CG-CE2 4.24Å; P200-Y203 PolarHBondContact O-N 3.03Å; P200-E204 PolarHBondContact O-N 3.02Å
201	S	52.9	Low	45.2	Very low	92 Å²	92	106.2 Å²	106.2	64%	0.643	56%	0.563	S	S	*	*	H	α-helix	trans	-52.5	-32.5	-169.1	-37.4	0	0	0	0	113.3	I199 Y203 E204 E205	I199-S201 PolarHBondContact O-N 3.11Å; S201-Y203 VanDerWaalsContact C-N 3.28Å; S201-Y203 PolarHBondContact O-N 3.21Å; S201-E204 PolarHBondContact O-N 3.04Å; S201-E205 PolarHBondContact O-N 2.78Å
202	E	50.3	Low	45.4	Very low	126 Å²	126	114.1 Å²	114.1	59%	0.589	60%	0.595	S	S	*	*	H	α-helix	trans	-63	-26.7	176.6	58.1	-178.3	-168	0	0	114.8	P200	P200-E202 HydrophobicContact CB-CG 4.03Å; P200-E202 PolarHBondContact O-N 3.06Å
203	Y	44.5	Very low	45.7	Very low	114 Å²	114	112.6 Å²	112.6	45%	0.447	59%	0.591	S	S	.	*	H	α-helix	trans	-95.4	-24	175	-60.9	-68.2	0	0	0	112.1	P200 S201 K206 L207	P200-Y203 HydrophobicContact CB-CD2 3.87Å; P200-Y203 HydrophobicContact CB-CE2 4.32Å; P200-Y203 HydrophobicContact CG-CD2 3.91Å; P200-Y203 HydrophobicContact CG-CE2 4.24Å; P200-Y203 PolarHBondContact O-N 3.03Å; S201-Y203 VanDerWaalsContact C-N 3.28Å; S201-Y203 PolarHBondContact O-N 3.21Å; Y203-K206 PolarHBondContact O-N 2.97Å; Y203-L207 WeakPolarHBondContact O-CB 3.38Å; Y203-L207 PolarHBondContact O-N 3.18Å
204	E	49	Very low	46.1	Very low	102 Å²	102	113.8 Å²	113.8	48%	0.477	59%	0.592	S	S	.	*	H	α-helix	trans	-65.1	-46.3	177.8	-154.8	177.8	-164.7	0	0	110.9	I199 P200 S201 K206 L207 I208	I199-E204 HydrophobicContact CG2-CB 4.27Å; P200-E204 PolarHBondContact O-N 3.02Å; S201-E204 PolarHBondContact O-N 3.04Å; E204-K206 VanDerWaalsContact C-N 3.33Å; E204-K206 PolarHBondContact O-N 2.88Å; E204-L207 PolarHBondContact O-N 3.01Å; E204-I208 HydrophobicContact CG-CD1 4.29Å; E204-I208 VanDerWaalsContact O-CG1 3.26Å; E204-I208 WeakPolarHBondContact O-CG1 3.48Å; E204-I208 PolarHBondContact O-N 3.33Å
205	E	54	Low	46.5	Very low	155 Å²	155	113.4 Å²	113.4	72%	0.724	59%	0.591	S	S	*	*	H	α-helix	trans	-60.6	-40.2	174.5	-73.8	-166.8	160.3	0	0	112.6	S201 I208 S209	S201-E205 PolarHBondContact O-N 2.78Å; E205-I208 PolarHBondContact O-N 3.06Å; E205-S209 WeakPolarHBondContact O-CB 3.44Å; E205-S209 PolarHBondContact O-N 2.96Å
206	K	47.9	Very low	47.1	Very low	135 Å²	135	112.5 Å²	112.5	59%	0.587	58%	0.579	S	S	*	*	H	α-helix	trans	-66.3	-41.9	177	-79.8	176.5	-179.4	168	0	111.7	Y203 E204 S209 L210	Y203-K206 PolarHBondContact O-N 2.97Å; E204-K206 VanDerWaalsContact C-N 3.33Å; E204-K206 PolarHBondContact O-N 2.88Å; K206-S209 PolarHBondContact O-N 3.15Å; K206-S209 PolarHBondContact O-OG 3.2Å; K206-L210 WeakPolarHBondContact O-CG 3.2Å; K206-L210 PolarHBondContact O-N 3.01Å
207	L	50.4	Low	47.9	Very low	83 Å²	83	114.4 Å²	114.4	44%	0.435	58%	0.579	S	S	.	*	H	α-helix	trans	-64.3	-42.1	175.5	-90.3	158.4	0	0	0	112	I199 Y203 E204 S209 L210	I199-L207 HydrophobicContact CD1-CD1 3.64Å; I199-L207 HydrophobicContact CG2-CD1 4.17Å; Y203-L207 WeakPolarHBondContact O-CB 3.38Å; Y203-L207 PolarHBondContact O-N 3.18Å; E204-L207 PolarHBondContact O-N 3.01Å; L207-S209 VanDerWaalsContact C-N 3.31Å; L207-S209 PolarHBondContact O-N 2.76Å; L207-L210 PolarHBondContact O-N 3.24Å
208	I	53.3	Low	48	Very low	87 Å²	87	113.5 Å²	113.5	45%	0.446	57%	0.574	S	S	.	*	H	α-helix	trans	-63.6	-38.5	175.5	-67.7	166	0	0	0	110.8	E204 E205 L210 L211 K212	E204-I208 HydrophobicContact CG-CD1 4.29Å; E204-I208 VanDerWaalsContact O-CG1 3.26Å; E204-I208 WeakPolarHBondContact O-CG1 3.48Å; E204-I208 PolarHBondContact O-N 3.33Å; E205-I208 PolarHBondContact O-N 3.06Å; I208-L210 VanDerWaalsContact C-N 3.27Å; I208-L210 PolarHBondContact O-N 3.03Å; I208-L211 PolarHBondContact O-N 3.25Å; I208-K212 PolarHBondContact O-N 3.02Å
209	S	54.3	Low	48.6	Very low	74 Å²	74	110.6 Å²	110.6	52%	0.517	56%	0.556	S	S	.	*	H	α-helix	trans	-65.1	-27.8	178.1	79.7	0	0	0	0	113.7	E205 K206 L207 L211	E205-S209 WeakPolarHBondContact O-CB 3.44Å; E205-S209 PolarHBondContact O-N 2.96Å; K206-S209 PolarHBondContact O-N 3.15Å; K206-S209 PolarHBondContact O-OG 3.2Å; L207-S209 VanDerWaalsContact C-N 3.31Å; L207-S209 PolarHBondContact O-N 2.76Å; S209-L211 VanDerWaalsContact C-N 3.31Å
210	L	45.6	Very low	48.7	Very low	97 Å²	97	114.1 Å²	114.1	51%	0.508	57%	0.573	S	S	.	*	H	α-helix	trans	-78.4	-15.2	177.1	-70.7	166.2	0	0	0	113.1	K206 L207 I208	K206-L210 WeakPolarHBondContact O-CG 3.2Å; K206-L210 PolarHBondContact O-N 3.01Å; L207-L210 PolarHBondContact O-N 3.24Å; I208-L210 VanDerWaalsContact C-N 3.27Å; I208-L210 PolarHBondContact O-N 3.03Å
211	L	47.4	Very low	49.2	Very low	119 Å²	119	117.8 Å²	117.8	62%	0.623	58%	0.583	S	S	*	*	H	α-helix	trans	-95.5	-18.1	-178.3	-71.8	168.8	0	0	0	113.6	R55 I208 S209	R55-L211 PolarHBondContact NH2-O 2.73Å; I208-L211 PolarHBondContact O-N 3.25Å; S209-L211 VanDerWaalsContact C-N 3.31Å
212	K	41.4	Very low	48.9	Very low	229 Å²	229	120.1 Å²	120.1	100%	0.996	58%	0.577	S	S	*	*			trans	-80	0	171.5	-74.1	-176.4	177.9	176.8	0	110.8	I208	I208-K212 PolarHBondContact O-N 3.02Å

Retrieved 212 of 212 residues in 180.7 ms (Link to these results)

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