A0A5K4ERF3_SCHMA Loading...

DUF4065 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4ERF3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 256 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.1	Very low	31.8	Very low	242 Å²	242	159 Å²	159	100%	1.192	83%	0.829	S	S	*	*				0	68.5	0	-71.9	174	102.6	0	0	110.3
2	I	33.4	Very low	31.9	Very low	149 Å²	149	150.2 Å²	150.2	76%	0.764	79%	0.789	S	S	*	*			trans	-144.3	108.6	136.5	-63.4	-177.2	0	0	0	98.7	N4	I2-N4 PolarHBondContact O-N 3.4Å
3	E	36.3	Very low	32.4	Very low	173 Å²	173	146 Å²	146	81%	0.808	77%	0.773	S	S	*	*			trans	-62.2	107.2	176.4	-76.8	-178.7	167.8	0	0	106.1	L5	E3-L5 PolarHBondContact O-N 3.12Å
4	N	33.5	Very low	32.4	Very low	146 Å²	146	145.6 Å²	145.6	78%	0.781	76%	0.756	S	S	*	*			trans	-60.7	88.2	171.7	-84.3	-29	0	0	0	106.7	I2 N6	I2-N4 PolarHBondContact O-N 3.4Å; N4-N6 PolarHBondContact O-N 3.27Å
5	L	33.7	Very low	32.5	Very low	158 Å²	158	143.5 Å²	143.5	83%	0.827	75%	0.745	S	S	*	*			trans	-65.5	75.4	164.8	-82.2	151.6	0	0	0	106.4	E3 P7	E3-L5 PolarHBondContact O-N 3.12Å; L5-P7 WeakPolarHBondContact O-CD 3.4Å
6	N	29	Very low	32.7	Very low	137 Å²	137	136 Å²	136	73%	0.733	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-54	118.5	167.5	-92.7	-20.9	0	0	0	106	N4 K8	N4-N6 PolarHBondContact O-N 3.27Å; N6-K8 PolarHBondContact O-N 3.49Å; N6-K8 VanDerWaalsContact O-N 3.08Å
7	P	27.3	Very low	32.9	Very low	115 Å²	115	135.9 Å²	135.9	75%	0.747	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-56.3	123.1	-179.4	21.7	-30.7	0	0	0	107.3	L5	L5-P7 WeakPolarHBondContact O-CD 3.4Å
8	K	32.5	Very low	32.9	Very low	198 Å²	198	132.6 Å²	132.6	86%	0.861	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-53.6	129.4	175.9	-77.8	178.6	177.3	177	0	107.5	N6 L10	N6-K8 PolarHBondContact O-N 3.49Å; N6-K8 VanDerWaalsContact O-N 3.08Å; K8-L10 PolarHBondContact O-N 3.38Å
9	P	30.8	Very low	33.1	Very low	120 Å²	120	130.3 Å²	130.3	78%	0.779	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-54.9	134.7	-176	19.6	-30.3	0	0	0	109.4	L11	P9-L11 PolarHBondContact O-N 3.4Å
10	L	28.6	Very low	33.3	Very low	170 Å²	170	127.9 Å²	127.9	89%	0.89	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-50.3	125.6	175.7	-79.8	156.8	0	0	0	108.1	K8	K8-L10 PolarHBondContact O-N 3.38Å
11	L	33	Very low	33.3	Very low	141 Å²	141	125.6 Å²	125.6	74%	0.738	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-54.4	130.4	175.6	-76	161.6	0	0	0	108.1	P9 T13	P9-L11 PolarHBondContact O-N 3.4Å; L11-T13 PolarHBondContact O-N 3.13Å
12	P	32.3	Very low	33.5	Very low	53 Å²	53	119.6 Å²	119.6	34%	0.344	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-53.7	130.1	-174.6	16	-27.7	0	0	0	109.4	A16 R17	P12-A16 HydrophobicContact CB-CB 3.62Å; P12-R17 HydrophobicContact CB-CG 4.13Å; P12-R17 HydrophobicContact CG-CG 4.07Å; P12-R17 PolarHBondContact O-NE 2.85Å; P12-R17 VanDerWaalsContact O-NE 3.07Å; P12-R17 PolarHBondContact O-NH2 2.9Å
13	T	39.1	Very low	33.8	Very low	96 Å²	96	116.9 Å²	116.9	59%	0.589	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-57.2	162	176.9	48	0	0	0	0	109.4	L11 I15 A16 R17	L11-T13 PolarHBondContact O-N 3.13Å; T13-I15 PolarHBondContact O-N 2.91Å; T13-A16 PolarHBondContact O-N 3.23Å; T13-R17 PolarHBondContact O-N 3.49Å
14	R	31.5	Very low	33.7	Very low	140 Å²	140	111.2 Å²	111.2	53%	0.528	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-52.2	-28	-179.6	-160.2	174.7	178.7	-172.6	-2.4	112.5	Y38 S42	R14-Y38 HydrophobicContact CG-CE2 3.97Å; R14-Y38 WeakPolarHBondContact CG-OH 3.3Å; R14-Y38 VanDerWaalsContact CZ-CE2 3.42Å; R14-Y38 VanDerWaalsContact CZ-CZ 3.48Å; R14-Y38 PolarHBondContact NE-OH 2.97Å; R14-Y38 PolarHBondContact NH2-OH 3.22Å; R14-S42 PolarHBondContact NH2-OG 3.46Å
15	I	34.5	Very low	34	Very low	115 Å²	115	110.8 Å²	110.8	59%	0.59	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-51.4	176.8	-62.4	168.5	0	0	0	110.8	T13 R17 L18 E19	T13-I15 PolarHBondContact O-N 2.91Å; I15-R17 VanDerWaalsContact C-N 3.25Å; I15-R17 PolarHBondContact O-N 3.34Å; I15-L18 CarbonylContact O-C 3.57Å; I15-L18 WeakPolarHBondContact O-CA 3.5Å; I15-L18 VanDerWaalsContact O-CB 3.3Å; I15-L18 WeakPolarHBondContact O-CB 3.3Å; I15-L18 PolarHBondContact O-N 3.44Å; I15-E19 PolarHBondContact O-N 2.97Å
16	A	35.8	Very low	34	Very low	23 Å²	23	109.7 Å²	109.7	19%	0.19	58%	0.58	C	S	.	*	H	α-helix	trans	-59	-33.4	179.3	0	0	0	0	0	113.7	P12 T13 L18 E19 E20	P12-A16 HydrophobicContact CB-CB 3.62Å; T13-A16 PolarHBondContact O-N 3.23Å; A16-L18 VanDerWaalsContact C-N 3.32Å; A16-E19 WeakPolarHBondContact CA-OE2 3.46Å; A16-E20 WeakPolarHBondContact O-CG 3.26Å; A16-E20 PolarHBondContact O-N 2.92Å
17	R	36	Very low	34.3	Very low	135 Å²	135	107.7 Å²	107.7	51%	0.509	57%	0.573	S	S	.	*	H	α-helix	trans	-71.9	-28.5	174.2	-64.6	-174.9	-149.3	177.8	2.2	113.2	P12 T13 I15 L21	P12-R17 HydrophobicContact CB-CG 4.13Å; P12-R17 HydrophobicContact CG-CG 4.07Å; P12-R17 PolarHBondContact O-NE 2.85Å; P12-R17 VanDerWaalsContact O-NE 3.07Å; P12-R17 PolarHBondContact O-NH2 2.9Å; T13-R17 PolarHBondContact O-N 3.49Å; I15-R17 VanDerWaalsContact C-N 3.25Å; I15-R17 PolarHBondContact O-N 3.34Å; R17-L21 WeakPolarHBondContact O-CB 3.3Å; R17-L21 WeakPolarHBondContact O-CD1 3.41Å; R17-L21 PolarHBondContact O-N 2.8Å
18	L	33.7	Very low	34.6	Very low	75 Å²	75	111.3 Å²	111.3	39%	0.393	57%	0.573	S	S	.	*	H	α-helix	trans	-77.2	-40	177.1	-111.3	151.5	0	0	0	110.3	I15 A16 L21 L22	I15-L18 CarbonylContact O-C 3.57Å; I15-L18 WeakPolarHBondContact O-CA 3.5Å; I15-L18 VanDerWaalsContact O-CB 3.3Å; I15-L18 WeakPolarHBondContact O-CB 3.3Å; I15-L18 PolarHBondContact O-N 3.44Å; A16-L18 VanDerWaalsContact C-N 3.32Å; L18-L21 WeakPolarHBondContact O-CB 3.39Å; L18-L21 PolarHBondContact O-N 2.87Å; L18-L22 WeakPolarHBondContact O-CG 3.34Å; L18-L22 PolarHBondContact O-N 3.35Å
19	E	35.5	Very low	34.7	Very low	89 Å²	89	106.5 Å²	106.5	42%	0.416	57%	0.565	S	S	.	*	H	α-helix	trans	-57	-49.4	169.6	-78.8	169.6	171.8	0	0	111.5	I15 A16 L21 L22 L23	I15-E19 PolarHBondContact O-N 2.97Å; A16-E19 WeakPolarHBondContact CA-OE2 3.46Å; E19-L21 PolarHBondContact O-N 3.48Å; E19-L22 PolarHBondContact O-N 2.75Å; E19-L23 VanDerWaalsContact O-CB 3.28Å; E19-L23 WeakPolarHBondContact O-CB 3.45Å; E19-L23 VanDerWaalsContact O-CG 3.24Å; E19-L23 WeakPolarHBondContact O-CG 3.33Å; E19-L23 PolarHBondContact O-N 2.88Å
20	E	37.1	Very low	35	Very low	83 Å²	83	104.6 Å²	104.6	39%	0.388	55%	0.547	S	S	.	.	H	α-helix	trans	-62.3	-32.5	177.9	-75.6	179.3	167.5	0	0	112.8	A16 K25	A16-E20 WeakPolarHBondContact O-CG 3.26Å; A16-E20 PolarHBondContact O-N 2.92Å; E20-K25 PolarHBondContact O-N 3.46Å; E20-K25 VanDerWaalsContact O-N 3.07Å
21	L	33.4	Very low	35.6	Very low	79 Å²	79	100.9 Å²	100.9	41%	0.414	53%	0.525	S	S	.	.	H	α-helix	trans	-72.1	-40.5	177.2	-97.7	160.7	0	0	0	113	R17 L18 E19 L30	R17-L21 WeakPolarHBondContact O-CB 3.3Å; R17-L21 WeakPolarHBondContact O-CD1 3.41Å; R17-L21 PolarHBondContact O-N 2.8Å; L18-L21 WeakPolarHBondContact O-CB 3.39Å; L18-L21 PolarHBondContact O-N 2.87Å; E19-L21 PolarHBondContact O-N 3.48Å; L21-L30 HydrophobicContact CD1-CD1 3.32Å; L21-L30 HydrophobicContact CD2-CB 4.01Å; L21-L30 HydrophobicContact CD2-CD1 3.39Å; L21-L30 HydrophobicContact CD2-CG 4.18Å; L21-L30 HydrophobicContact CG-CD1 3.98Å
22	L	35.9	Very low	36.1	Very low	116 Å²	116	97.4 Å²	97.4	61%	0.607	51%	0.511	S	S	*	.	H	α-helix	trans	-75.7	-35.5	178.6	-71.3	171.2	0	0	0	111.9	L18 E19 G24	L18-L22 WeakPolarHBondContact O-CG 3.34Å; L18-L22 PolarHBondContact O-N 3.35Å; E19-L22 PolarHBondContact O-N 2.75Å; L22-G24 PolarHBondContact O-N 3.26Å; L22-G24 VanDerWaalsContact O-N 3.11Å
23	L	40.7	Very low	36.8	Very low	92 Å²	92	101.1 Å²	101.1	48%	0.482	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	7.2	176	-67.1	171.7	0	0	0	113.5	E19 K25	E19-L23 VanDerWaalsContact O-CB 3.28Å; E19-L23 WeakPolarHBondContact O-CB 3.45Å; E19-L23 VanDerWaalsContact O-CG 3.24Å; E19-L23 WeakPolarHBondContact O-CG 3.33Å; E19-L23 PolarHBondContact O-N 2.88Å; L23-K25 HydrophobicContact CB-CD 4.48Å; L23-K25 HydrophobicContact CB-CG 4.26Å; L23-K25 PolarHBondContact O-N 2.87Å
24	G	34.2	Very low	37	Very low	54 Å²	54	103.4 Å²	103.4	56%	0.557	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	19.7	178.7	0	0	0	0	0	113.4	L22 T26	L22-G24 PolarHBondContact O-N 3.26Å; L22-G24 VanDerWaalsContact O-N 3.11Å; G24-T26 PolarHBondContact O-N 2.82Å
25	K	38.9	Very low	37.5	Very low	137 Å²	137	100.2 Å²	100.2	60%	0.596	52%	0.519	S	S	*	.			trans	-74.7	84.8	177.9	-73.2	-178.8	-179.8	171.4	0	107.6	E20 L23 T27	E20-K25 PolarHBondContact O-N 3.46Å; E20-K25 VanDerWaalsContact O-N 3.07Å; L23-K25 HydrophobicContact CB-CD 4.48Å; L23-K25 HydrophobicContact CB-CG 4.26Å; L23-K25 PolarHBondContact O-N 2.87Å; K25-T27 PolarHBondContact O-N 3.5Å
26	T	34.1	Very low	38	Very low	135 Å²	135	96.1 Å²	96.1	83%	0.828	50%	0.499	S	S	*	.			trans	-54.9	91.3	-175.5	53	0	0	0	0	112.3	G24	G24-T26 PolarHBondContact O-N 2.82Å
27	T	35.3	Very low	38.5	Very low	95 Å²	95	96.9 Å²	96.9	58%	0.583	50%	0.5	S	S	*	.	S	Bend	trans	-124.8	-18.7	160.8	47.8	0	0	0	0	114.1	K25	K25-T27 PolarHBondContact O-N 3.5Å
28	Y	33.6	Very low	39	Very low	191 Å²	191	94.5 Å²	94.5	75%	0.749	49%	0.492	S	S	*	.	S	Bend	trans	-136.1	112.9	174	-68.6	-82	0	0	0	110.2	L30	Y28-L30 PolarHBondContact O-N 2.94Å
29	S	35.4	Very low	39.5	Very low	98 Å²	98	94 Å²	94	69%	0.685	49%	0.492	S	S	*	.			trans	-54.5	114.2	166.7	80.7	0	0	0	0	106.7	Q31	S29-Q31 VanDerWaalsContact C-N 3.33Å; S29-Q31 PolarHBondContact O-N 2.74Å
30	L	36.7	Very low	39.8	Very low	80 Å²	80	91.1 Å²	91.1	42%	0.419	48%	0.479	S	S	.	.			trans	-67	96.9	-178.9	-161.2	88	0	0	0	107.8	L21 Y28 P32 L35	L21-L30 HydrophobicContact CD1-CD1 3.32Å; L21-L30 HydrophobicContact CD2-CB 4.01Å; L21-L30 HydrophobicContact CD2-CD1 3.39Å; L21-L30 HydrophobicContact CD2-CG 4.18Å; L21-L30 HydrophobicContact CG-CD1 3.98Å; Y28-L30 PolarHBondContact O-N 2.94Å; L30-P32 VanDerWaalsContact O-CD 3.3Å; L30-P32 WeakPolarHBondContact O-CD 3.47Å; L30-L35 HydrophobicContact CD2-CB 3.99Å; L30-L35 HydrophobicContact CD2-CD1 4.29Å; L30-L35 HydrophobicContact CD2-CD2 4.02Å; L30-L35 HydrophobicContact CD2-CG 4.32Å
31	Q	41.9	Very low	40.2	Very low	92 Å²	92	90.7 Å²	90.7	43%	0.43	48%	0.479	S	S	.	.			trans	-64.3	118.3	174.2	-67.3	-86.9	-42.5	0	0	106.5	S29 E33 K34	S29-Q31 VanDerWaalsContact C-N 3.33Å; S29-Q31 PolarHBondContact O-N 2.74Å; Q31-E33 PolarHBondContact O-N 2.74Å; Q31-K34 WeakPolarHBondContact O-CB 3.45Å; Q31-K34 PolarHBondContact O-N 2.67Å
32	P	42.9	Very low	40.6	Very low	67 Å²	67	88.5 Å²	88.5	44%	0.435	47%	0.47	S	S	.	.	H	α-helix	trans	-50.4	-34.4	-173.3	-29.5	34.8	0	0	0	113.2	L30 K34 L35 V36 W57	L30-P32 VanDerWaalsContact O-CD 3.3Å; L30-P32 WeakPolarHBondContact O-CD 3.47Å; P32-K34 VanDerWaalsContact C-N 3.32Å; P32-K34 PolarHBondContact O-N 3.18Å; P32-L35 PolarHBondContact O-N 2.94Å; P32-V36 WeakPolarHBondContact O-CG2 3.2Å; P32-V36 PolarHBondContact O-N 3.47Å; P32-W57 HydrophobicContact CB-CZ2 4.33Å
33	E	45.8	Very low	40.9	Very low	131 Å²	131	87.9 Å²	87.9	61%	0.612	46%	0.46	S	S	*	.	H	α-helix	trans	-55.5	-41.4	175.2	-63.1	153.7	-168.1	0	0	112.8	Q31 V36 N37	Q31-E33 PolarHBondContact O-N 2.74Å; E33-V36 PolarHBondContact O-N 3.21Å; E33-N37 WeakPolarHBondContact O-CB 3.21Å; E33-N37 VanDerWaalsContact O-CG 3.32Å; E33-N37 PolarHBondContact O-N 2.91Å; E33-N37 PolarHBondContact O-ND2 3.26Å
34	K	44.3	Very low	40.7	Very low	145 Å²	145	86 Å²	86	63%	0.63	46%	0.464	S	S	*	.	H	α-helix	trans	-70.1	-38.5	-179.6	-74	-175.1	178.7	174.8	0	111.7	Q31 P32 N37 Y38	Q31-K34 WeakPolarHBondContact O-CB 3.45Å; Q31-K34 PolarHBondContact O-N 2.67Å; P32-K34 VanDerWaalsContact C-N 3.32Å; P32-K34 PolarHBondContact O-N 3.18Å; K34-N37 PolarHBondContact O-N 3.27Å; K34-Y38 VanDerWaalsContact O-CB 3.31Å; K34-Y38 WeakPolarHBondContact O-CB 3.41Å; K34-Y38 PolarHBondContact O-N 2.76Å
35	L	42.8	Very low	40.9	Very low	72 Å²	72	86.3 Å²	86.3	38%	0.377	45%	0.45	S	S	.	.	H	α-helix	trans	-64.5	-47	175.1	-177.6	68.2	0	0	0	110.3	L30 P32 N37 Y38 V39	L30-L35 HydrophobicContact CD2-CB 3.99Å; L30-L35 HydrophobicContact CD2-CD1 4.29Å; L30-L35 HydrophobicContact CD2-CD2 4.02Å; L30-L35 HydrophobicContact CD2-CG 4.32Å; P32-L35 PolarHBondContact O-N 2.94Å; L35-N37 PolarHBondContact O-N 2.93Å; L35-Y38 WeakPolarHBondContact O-CA 3.46Å; L35-Y38 WeakPolarHBondContact O-CB 3.46Å; L35-Y38 PolarHBondContact O-N 3.39Å; L35-V39 WeakPolarHBondContact O-CG2 3.38Å; L35-V39 PolarHBondContact O-N 2.65Å
36	V	44.7	Very low	40.7	Very low	29 Å²	29	89.2 Å²	89.2	18%	0.176	46%	0.458	C	S	.	.	H	α-helix	trans	-57.8	-48.7	176	167.9	0	0	0	0	110.9	P32 E33 Y38 V39 L40 I56	P32-V36 WeakPolarHBondContact O-CG2 3.2Å; P32-V36 PolarHBondContact O-N 3.47Å; E33-V36 PolarHBondContact O-N 3.21Å; V36-Y38 PolarHBondContact O-N 2.82Å; V36-V39 PolarHBondContact O-N 3.26Å; V36-L40 HydrophobicContact CG1-CD1 3.69Å; V36-L40 HydrophobicContact CG1-CG 4.22Å; V36-L40 VanDerWaalsContact O-CB 3.28Å; V36-L40 WeakPolarHBondContact O-CB 3.37Å; V36-L40 WeakPolarHBondContact O-CG 3.3Å; V36-L40 PolarHBondContact O-N 3.36Å; V36-I56 HydrophobicContact CG1-CD1 3.4Å; V36-I56 HydrophobicContact CG2-CG2 4.39Å
37	N	46.6	Very low	40.9	Very low	39 Å²	39	91.3 Å²	91.3	21%	0.209	46%	0.456	C	S	.	.	H	α-helix	trans	-59.4	-37.8	175.2	-77.3	-63	0	0	0	112	E33 K34 L35 N41 Q49	E33-N37 WeakPolarHBondContact O-CB 3.21Å; E33-N37 VanDerWaalsContact O-CG 3.32Å; E33-N37 PolarHBondContact O-N 2.91Å; E33-N37 PolarHBondContact O-ND2 3.26Å; K34-N37 PolarHBondContact O-N 3.27Å; L35-N37 PolarHBondContact O-N 2.93Å; N37-N41 WeakPolarHBondContact O-CB 3.28Å; N37-N41 PolarHBondContact O-N 2.92Å; N37-N41 PolarHBondContact O-ND2 3.08Å; N37-N41 VanDerWaalsContact O-ND2 3.12Å; N37-Q49 VanDerWaalsContact CG-NE2 3.26Å; N37-Q49 PolarHBondContact ND2-NE2 2.8Å; N37-Q49 PolarHBondContact OD1-NE2 2.69Å
38	Y	45.2	Very low	41.2	Very low	86 Å²	86	96 Å²	96	34%	0.337	47%	0.468	S	S	.	.	H	α-helix	trans	-66.9	-45.2	178.4	-179	-85.4	0	0	0	112.4	R14 K34 L35 V36 S42	R14-Y38 HydrophobicContact CG-CE2 3.97Å; R14-Y38 WeakPolarHBondContact CG-OH 3.3Å; R14-Y38 VanDerWaalsContact CZ-CE2 3.42Å; R14-Y38 VanDerWaalsContact CZ-CZ 3.48Å; R14-Y38 PolarHBondContact NE-OH 2.97Å; R14-Y38 PolarHBondContact NH2-OH 3.22Å; K34-Y38 VanDerWaalsContact O-CB 3.31Å; K34-Y38 WeakPolarHBondContact O-CB 3.41Å; K34-Y38 PolarHBondContact O-N 2.76Å; L35-Y38 WeakPolarHBondContact O-CA 3.46Å; L35-Y38 WeakPolarHBondContact O-CB 3.46Å; L35-Y38 PolarHBondContact O-N 3.39Å; V36-Y38 PolarHBondContact O-N 2.82Å; Y38-S42 WeakPolarHBondContact O-CB 3.33Å; Y38-S42 PolarHBondContact O-N 2.85Å; Y38-S42 PolarHBondContact O-OG 2.62Å
39	V	43.7	Very low	41.4	Very low	65 Å²	65	93.4 Å²	93.4	39%	0.394	46%	0.463	S	S	.	.	H	α-helix	trans	-57.9	-58	173.4	170.4	0	0	0	0	107.8	L35 V36 N41 S42 Y43	L35-V39 WeakPolarHBondContact O-CG2 3.38Å; L35-V39 PolarHBondContact O-N 2.65Å; V36-V39 PolarHBondContact O-N 3.26Å; V39-N41 VanDerWaalsContact C-N 3.34Å; V39-N41 PolarHBondContact O-N 2.87Å; V39-S42 WeakPolarHBondContact O-CA 3.3Å; V39-S42 WeakPolarHBondContact O-CB 3.28Å; V39-S42 PolarHBondContact O-N 2.77Å; V39-Y43 HydrophobicContact CG1-CD2 3.91Å; V39-Y43 HydrophobicContact CG1-CE2 3.69Å; V39-Y43 WeakPolarHBondContact O-CD2 3.39Å; V39-Y43 PolarHBondContact O-N 2.68Å; V39-Y43 VanDerWaalsContact O-N 3.11Å
40	L	43.5	Very low	41.5	Very low	28 Å²	28	97 Å²	97	15%	0.147	47%	0.469	C	S	.	.	H	α-helix	trans	-55.9	-43.3	-179.8	-70.3	178.1	0	0	0	113.1	V36 S42 Y43 G44 F45 F52 I56	V36-L40 HydrophobicContact CG1-CD1 3.69Å; V36-L40 HydrophobicContact CG1-CG 4.22Å; V36-L40 VanDerWaalsContact O-CB 3.28Å; V36-L40 WeakPolarHBondContact O-CB 3.37Å; V36-L40 WeakPolarHBondContact O-CG 3.3Å; V36-L40 PolarHBondContact O-N 3.36Å; L40-S42 PolarHBondContact O-N 3.42Å; L40-Y43 CarbonylContact O-C 3.52Å; L40-Y43 PolarHBondContact O-N 2.82Å; L40-Y43 VanDerWaalsContact O-N 3.13Å; L40-G44 PolarHBondContact O-N 3.26Å; L40-F45 HydrophobicContact CB-CB 4.07Å; L40-F45 HydrophobicContact CD2-CB 4.16Å; L40-F45 HydrophobicContact CD2-CD2 3.87Å; L40-F45 HydrophobicContact CD2-CG 4.18Å; L40-F45 PolarHBondContact O-N 2.85Å; L40-F52 HydrophobicContact CD1-CE2 4.43Å; L40-F52 HydrophobicContact CD1-CZ 4.41Å; L40-I56 HydrophobicContact CD1-CD1 4.2Å
41	N	44.6	Very low	41.9	Very low	73 Å²	73	99.4 Å²	99.4	39%	0.39	49%	0.487	S	S	.	.	H	α-helix	trans	-63.6	-40.3	175.2	-77.9	-24.4	0	0	0	112.2	N37 V39 Y43 G44 Y46	N37-N41 WeakPolarHBondContact O-CB 3.28Å; N37-N41 PolarHBondContact O-N 2.92Å; N37-N41 PolarHBondContact O-ND2 3.08Å; N37-N41 VanDerWaalsContact O-ND2 3.12Å; V39-N41 VanDerWaalsContact C-N 3.34Å; V39-N41 PolarHBondContact O-N 2.87Å; N41-Y43 PolarHBondContact O-N 3.07Å; N41-G44 PolarHBondContact O-N 3.36Å; N41-G44 VanDerWaalsContact O-N 3.08Å; N41-Y46 WeakPolarHBondContact OD1-CD2 3.4Å
42	S	42.8	Very low	41.8	Very low	33 Å²	33	99.2 Å²	99.2	23%	0.231	49%	0.485	C	S	.	.	H	α-helix	trans	-66.2	-18.6	176.9	-56.6	0	0	0	0	112.1	R14 Y38 V39 L40 R75	R14-S42 PolarHBondContact NH2-OG 3.46Å; Y38-S42 WeakPolarHBondContact O-CB 3.33Å; Y38-S42 PolarHBondContact O-N 2.85Å; Y38-S42 PolarHBondContact O-OG 2.62Å; V39-S42 WeakPolarHBondContact O-CA 3.3Å; V39-S42 WeakPolarHBondContact O-CB 3.28Å; V39-S42 PolarHBondContact O-N 2.77Å; L40-S42 PolarHBondContact O-N 3.42Å; S42-R75 PolarHBondContact O-NH2 3.36Å
43	Y	40.7	Very low	41.7	Very low	103 Å²	103	102 Å²	102	40%	0.404	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	5.1	173.3	-61.1	-72.6	0	0	0	114.1	V39 L40 N41 Y68	V39-Y43 HydrophobicContact CG1-CD2 3.91Å; V39-Y43 HydrophobicContact CG1-CE2 3.69Å; V39-Y43 WeakPolarHBondContact O-CD2 3.39Å; V39-Y43 PolarHBondContact O-N 2.68Å; V39-Y43 VanDerWaalsContact O-N 3.11Å; L40-Y43 CarbonylContact O-C 3.52Å; L40-Y43 PolarHBondContact O-N 2.82Å; L40-Y43 VanDerWaalsContact O-N 3.13Å; N41-Y43 PolarHBondContact O-N 3.07Å; Y43-Y68 HydrophobicContact CE1-CD2 4.48Å
44	G	37.5	Very low	41.3	Very low	53 Å²	53	100.4 Å²	100.4	55%	0.546	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	12.1	173.1	0	0	0	0	0	115.6	L40 N41 Y46	L40-G44 PolarHBondContact O-N 3.26Å; N41-G44 PolarHBondContact O-N 3.36Å; N41-G44 VanDerWaalsContact O-N 3.08Å; G44-Y46 PolarHBondContact O-N 3.41Å
45	F	37.4	Very low	41.1	Very low	61 Å²	61	98 Å²	98	27%	0.268	49%	0.488	S	S	.	.			trans	-79.5	62.2	176.3	-61.5	-78.4	0	0	0	111.2	L40 K47 L67	L40-F45 HydrophobicContact CB-CB 4.07Å; L40-F45 HydrophobicContact CD2-CB 4.16Å; L40-F45 HydrophobicContact CD2-CD2 3.87Å; L40-F45 HydrophobicContact CD2-CG 4.18Å; L40-F45 PolarHBondContact O-N 2.85Å; F45-K47 PolarHBondContact O-N 3.47Å; F45-L67 HydrophobicContact CE1-CD2 4.19Å; F45-L67 HydrophobicContact CZ-CB 4.4Å; F45-L67 HydrophobicContact CZ-CD2 4.32Å
46	Y	36	Very low	40.8	Very low	197 Å²	197	97 Å²	97	77%	0.773	48%	0.483	S	S	*	.			trans	-82.6	94.6	171.1	-131.7	-86.8	0	0	0	108.8	N41 G44	N41-Y46 WeakPolarHBondContact OD1-CD2 3.4Å; G44-Y46 PolarHBondContact O-N 3.41Å
47	K	37.9	Very low	40.3	Very low	179 Å²	179	104.3 Å²	104.3	78%	0.778	51%	0.508	S	S	*	.			trans	-129.9	127.7	152.6	-143.5	178.4	-177.8	-172.4	0	107.4	F45 Q49	F45-K47 PolarHBondContact O-N 3.47Å; K47-Q49 PolarHBondContact O-N 3.38Å
48	K	41.8	Very low	39.8	Very low	194 Å²	194	106.4 Å²	106.4	84%	0.843	53%	0.525	S	S	*	.			trans	-40.2	131.9	176.3	-93.8	178.7	170.3	-179.7	0	109.1	E50	K48-E50 PolarHBondContact O-N 2.88Å
49	Q	37	Very low	39.2	Very low	137 Å²	137	104 Å²	104	64%	0.64	52%	0.518	S	S	*	.			trans	-58.1	66.9	-178.3	-67.9	171.9	-9.3	0	0	113.2	N37 K47 T51	N37-Q49 VanDerWaalsContact CG-NE2 3.26Å; N37-Q49 PolarHBondContact ND2-NE2 2.8Å; N37-Q49 PolarHBondContact OD1-NE2 2.69Å; K47-Q49 PolarHBondContact O-N 3.38Å; Q49-T51 PolarHBondContact O-N 3.03Å
50	E	38.6	Very low	39.1	Very low	172 Å²	172	105.7 Å²	105.7	80%	0.804	52%	0.524	S	S	*	.	S	Bend	trans	-76.9	106	149.1	-75.9	179.1	178.5	0	0	105.1	K48 F52	K48-E50 PolarHBondContact O-N 2.88Å; E50-F52 PolarHBondContact O-N 2.71Å; E50-F52 VanDerWaalsContact O-N 3.13Å
51	T	43.6	Very low	39	Very low	132 Å²	132	109.5 Å²	109.5	81%	0.81	55%	0.545	S	S	*	.			trans	0.9	99.1	166.5	44.8	0	0	0	0	113.2	Q49	Q49-T51 PolarHBondContact O-N 3.03Å
52	F	40.5	Very low	38.6	Very low	88 Å²	88	113.2 Å²	113.2	39%	0.386	56%	0.56	S	S	.	*			trans	-57.9	127.3	173.7	-73.9	-80.6	0	0	0	108.1	L40 E50 F54	L40-F52 HydrophobicContact CD1-CE2 4.43Å; L40-F52 HydrophobicContact CD1-CZ 4.41Å; E50-F52 PolarHBondContact O-N 2.71Å; E50-F52 VanDerWaalsContact O-N 3.13Å; F52-F54 HydrophobicContact CB-CD2 4.48Å; F52-F54 HydrophobicContact CB-CE2 4.37Å; F52-F54 HydrophobicContact CD1-CE2 4.26Å; F52-F54 HydrophobicContact CD1-CZ 4.04Å; F52-F54 PolarHBondContact O-N 2.92Å
53	P	41.6	Very low	38.1	Very low	124 Å²	124	113.7 Å²	113.7	81%	0.805	57%	0.566	S	S	*	*	S	Bend	trans	-72.6	8.3	-173.9	28.2	-33.7	0	0	0	113.3
54	F	36.2	Very low	37.9	Very low	98 Å²	98	112 Å²	112	43%	0.43	57%	0.566	S	S	.	*	S	Bend	trans	-139.6	140	-175.2	45.7	-106.3	0	0	0	110.8	F52 I56 I59	F52-F54 HydrophobicContact CB-CD2 4.48Å; F52-F54 HydrophobicContact CB-CE2 4.37Å; F52-F54 HydrophobicContact CD1-CE2 4.26Å; F52-F54 HydrophobicContact CD1-CZ 4.04Å; F52-F54 PolarHBondContact O-N 2.92Å; F54-I56 HydrophobicContact CD2-CG1 4.27Å; F54-I56 HydrophobicContact CE2-CG1 4.26Å; F54-I56 PolarHBondContact O-N 3.28Å; F54-I59 HydrophobicContact CB-CD1 4.38Å; F54-I59 HydrophobicContact CB-CG1 4.46Å; F54-I59 HydrophobicContact CD2-CD1 3.18Å; F54-I59 HydrophobicContact CD2-CG1 4.12Å; F54-I59 HydrophobicContact CE2-CD1 3.51Å; F54-I59 HydrophobicContact CG-CD1 3.97Å
55	N	40.9	Very low	37.9	Very low	95 Å²	95	112.3 Å²	112.3	51%	0.508	55%	0.554	S	S	.	*			trans	-79.2	113.8	173.3	176.1	5	0	0	0	108.2	W57 S58 I59	N55-W57 PolarHBondContact O-N 2.65Å; N55-W57 VanDerWaalsContact O-N 3.15Å; N55-W57 WeakPolarHBondContact OD1-CB 3.36Å; N55-W57 PolarHBondContact OD1-N 3.34Å; N55-W57 VanDerWaalsContact OD1-N 3.12Å; N55-S58 WeakPolarHBondContact CB-OG 3.46Å; N55-S58 WeakPolarHBondContact O-CA 3.2Å; N55-S58 PolarHBondContact O-N 3.43Å; N55-S58 PolarHBondContact O-OG 2.99Å; N55-I59 PolarHBondContact O-N 2.94Å
56	I	36.3	Very low	37.9	Very low	52 Å²	52	114.8 Å²	114.8	27%	0.267	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-58.9	-27.6	-177.7	-80.9	163.9	0	0	0	112.9	V36 L40 F54 S58 I59	V36-I56 HydrophobicContact CG1-CD1 3.4Å; V36-I56 HydrophobicContact CG2-CG2 4.39Å; L40-I56 HydrophobicContact CD1-CD1 4.2Å; F54-I56 HydrophobicContact CD2-CG1 4.27Å; F54-I56 HydrophobicContact CE2-CG1 4.26Å; F54-I56 PolarHBondContact O-N 3.28Å; I56-S58 PolarHBondContact O-N 3.39Å; I56-I59 HydrophobicContact CB-CD1 4.36Å; I56-I59 HydrophobicContact CG1-CD1 3.74Å; I56-I59 PolarHBondContact O-N 2.98Å
57	W	34.5	Very low	37.9	Very low	182 Å²	182	109 Å²	109	69%	0.689	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-73	-15.1	174.4	-57.2	108.7	0	0	0	113.6	P32 N55	P32-W57 HydrophobicContact CB-CZ2 4.33Å; N55-W57 PolarHBondContact O-N 2.65Å; N55-W57 VanDerWaalsContact O-N 3.15Å; N55-W57 WeakPolarHBondContact OD1-CB 3.36Å; N55-W57 PolarHBondContact OD1-N 3.34Å; N55-W57 VanDerWaalsContact OD1-N 3.12Å
58	S	35.4	Very low	37.9	Very low	82 Å²	82	104.2 Å²	104.2	57%	0.573	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-101.7	0.9	173.9	67.1	0	0	0	0	113.5	N55 I56 D60	N55-S58 WeakPolarHBondContact CB-OG 3.46Å; N55-S58 WeakPolarHBondContact O-CA 3.2Å; N55-S58 PolarHBondContact O-N 3.43Å; N55-S58 PolarHBondContact O-OG 2.99Å; I56-S58 PolarHBondContact O-N 3.39Å; S58-D60 PolarHBondContact O-N 2.85Å
59	I	33	Very low	37.7	Very low	36 Å²	36	102.6 Å²	102.6	19%	0.185	52%	0.515	C	S	.	.	S	Bend	trans	-83.5	115.9	178.7	-62.9	174.6	0	0	0	108.7	F54 N55 I56 A63 V64	F54-I59 HydrophobicContact CB-CD1 4.38Å; F54-I59 HydrophobicContact CB-CG1 4.46Å; F54-I59 HydrophobicContact CD2-CD1 3.18Å; F54-I59 HydrophobicContact CD2-CG1 4.12Å; F54-I59 HydrophobicContact CE2-CD1 3.51Å; F54-I59 HydrophobicContact CG-CD1 3.97Å; N55-I59 PolarHBondContact O-N 2.94Å; I56-I59 HydrophobicContact CB-CD1 4.36Å; I56-I59 HydrophobicContact CG1-CD1 3.74Å; I56-I59 PolarHBondContact O-N 2.98Å; I59-A63 HydrophobicContact CG2-CB 3.36Å; I59-V64 HydrophobicContact CG2-CG2 4.27Å
60	D	40.9	Very low	37.7	Very low	100 Å²	100	98.7 Å²	98.7	54%	0.535	51%	0.505	S	S	.	.			trans	-50.4	142.3	174.5	-77.5	-38	0	0	0	112.9	S58 Q62 A63 V64	S58-D60 PolarHBondContact O-N 2.85Å; D60-Q62 PolarHBondContact O-N 3.25Å; D60-A63 PolarHBondContact O-N 3.49Å; D60-V64 PolarHBondContact O-N 2.85Å
61	N	42.4	Very low	37.4	Very low	109 Å²	109	90.8 Å²	90.8	58%	0.583	47%	0.47	S	S	*	.	H	α-helix	trans	-51	-31	-176	-87.8	-19.6	0	0	0	113.9	A63 V64 M65	N61-A63 PolarHBondContact O-N 2.9Å; N61-V64 PolarHBondContact O-N 3.38Å; N61-M65 WeakPolarHBondContact O-CB 3.43Å; N61-M65 VanDerWaalsContact O-CG 3.28Å; N61-M65 WeakPolarHBondContact O-CG 3.43Å; N61-M65 PolarHBondContact O-N 3.06Å
62	Q	36.3	Very low	37.1	Very low	151 Å²	151	86.7 Å²	86.7	71%	0.706	44%	0.443	S	S	*	.	H	α-helix	trans	-64.4	-38.5	175.8	-80.5	-172.8	-4.6	0	0	112.5	D60 M65 H66	D60-Q62 PolarHBondContact O-N 3.25Å; Q62-M65 CarbonylContact O-C 3.59Å; Q62-M65 PolarHBondContact O-N 2.75Å; Q62-H66 WeakPolarHBondContact O-CB 3.27Å; Q62-H66 PolarHBondContact O-CD2 3.05Å; Q62-H66 PolarHBondContact O-N 3.3Å
63	A	30.9	Very low	37	Very low	42 Å²	42	90.4 Å²	90.4	35%	0.347	46%	0.459	S	S	.	.	H	α-helix	trans	-72.2	-35.3	177.5	0	0	0	0	0	111.5	I59 D60 N61 M65 H66 L67	I59-A63 HydrophobicContact CG2-CB 3.36Å; D60-A63 PolarHBondContact O-N 3.49Å; N61-A63 PolarHBondContact O-N 2.9Å; A63-M65 VanDerWaalsContact C-N 3.34Å; A63-H66 PolarHBondContact O-N 3.41Å; A63-L67 WeakPolarHBondContact O-CB 3.28Å; A63-L67 VanDerWaalsContact O-CG 3.28Å; A63-L67 WeakPolarHBondContact O-CG 3.34Å; A63-L67 PolarHBondContact O-N 2.63Å
64	V	36.7	Very low	36.7	Very low	69 Å²	69	90 Å²	90	42%	0.418	45%	0.447	S	S	.	.	H	α-helix	trans	-61.3	-43.8	168.7	179.2	0	0	0	0	110.6	I59 D60 N61 L67 Y68	I59-V64 HydrophobicContact CG2-CG2 4.27Å; D60-V64 PolarHBondContact O-N 2.85Å; N61-V64 PolarHBondContact O-N 3.38Å; V64-L67 PolarHBondContact O-N 2.97Å; V64-Y68 VanDerWaalsContact O-CB 3.3Å; V64-Y68 WeakPolarHBondContact O-CB 3.18Å; V64-Y68 PolarHBondContact O-N 3.44Å
65	M	37.8	Very low	36.7	Very low	59 Å²	59	92.5 Å²	92.5	29%	0.291	45%	0.453	S	S	.	.	H	α-helix	trans	-66.7	-36.1	176	-77	-65	-74.4	0	0	112.8	N61 Q62 A63 Y68 R69 F229	N61-M65 WeakPolarHBondContact O-CB 3.43Å; N61-M65 VanDerWaalsContact O-CG 3.28Å; N61-M65 WeakPolarHBondContact O-CG 3.43Å; N61-M65 PolarHBondContact O-N 3.06Å; Q62-M65 CarbonylContact O-C 3.59Å; Q62-M65 PolarHBondContact O-N 2.75Å; A63-M65 VanDerWaalsContact C-N 3.34Å; M65-Y68 WeakPolarHBondContact O-CB 3.35Å; M65-Y68 PolarHBondContact O-N 3.21Å; M65-Y68 HydrophobicContact SD-CD1 4.49Å; M65-R69 WeakPolarHBondContact O-CB 3.45Å; M65-R69 VanDerWaalsContact O-CG 3.24Å; M65-R69 WeakPolarHBondContact O-CG 3.48Å; M65-R69 PolarHBondContact O-N 3.06Å; M65-F229 HydrophobicContact CE-CD1 4.21Å; M65-F229 HydrophobicContact CE-CE1 3.6Å; M65-F229 HydrophobicContact CE-CE2 4.01Å; M65-F229 HydrophobicContact CE-CZ 3.48Å; M65-F229 VanDerWaalsContact CE-CZ 3.48Å; M65-F229 HydrophobicContact SD-CE1 4.41Å; M65-F229 HydrophobicContact SD-CZ 3.92Å
66	H	38.1	Very low	36.4	Very low	112 Å²	112	95.8 Å²	95.8	52%	0.519	46%	0.458	S	S	.	.	H	α-helix	trans	-69.2	-40.2	173.8	-83.9	-68.7	0	0	0	111.6	Q62 A63 Y68 R69 A70	Q62-H66 WeakPolarHBondContact O-CB 3.27Å; Q62-H66 PolarHBondContact O-CD2 3.05Å; Q62-H66 PolarHBondContact O-N 3.3Å; A63-H66 PolarHBondContact O-N 3.41Å; H66-Y68 VanDerWaalsContact C-N 3.34Å; H66-R69 PolarHBondContact O-N 3.37Å; H66-A70 VanDerWaalsContact O-CB 3.29Å; H66-A70 WeakPolarHBondContact O-CB 3.36Å; H66-A70 PolarHBondContact O-N 2.8Å
67	L	36.4	Very low	36.5	Very low	75 Å²	75	98.6 Å²	98.6	39%	0.393	47%	0.47	S	S	.	.	H	α-helix	trans	-62.4	-42.3	171.7	-75.4	167	0	0	0	111	F45 A63 V64 A70 G71	F45-L67 HydrophobicContact CE1-CD2 4.19Å; F45-L67 HydrophobicContact CZ-CB 4.4Å; F45-L67 HydrophobicContact CZ-CD2 4.32Å; A63-L67 WeakPolarHBondContact O-CB 3.28Å; A63-L67 VanDerWaalsContact O-CG 3.28Å; A63-L67 WeakPolarHBondContact O-CG 3.34Å; A63-L67 PolarHBondContact O-N 2.63Å; V64-L67 PolarHBondContact O-N 2.97Å; L67-A70 PolarHBondContact O-N 2.84Å; L67-G71 PolarHBondContact O-N 2.85Å
68	Y	37.6	Very low	36.6	Very low	80 Å²	80	95 Å²	95	31%	0.314	46%	0.463	S	S	.	.	H	α-helix	trans	-61.3	-48.7	173.4	175.6	-96.8	0	0	0	112	Y43 V64 M65 H66 A70 G71 I72 F229	Y43-Y68 HydrophobicContact CE1-CD2 4.48Å; V64-Y68 VanDerWaalsContact O-CB 3.3Å; V64-Y68 WeakPolarHBondContact O-CB 3.18Å; V64-Y68 PolarHBondContact O-N 3.44Å; M65-Y68 WeakPolarHBondContact O-CB 3.35Å; M65-Y68 PolarHBondContact O-N 3.21Å; M65-Y68 HydrophobicContact SD-CD1 4.49Å; H66-Y68 VanDerWaalsContact C-N 3.34Å; Y68-A70 VanDerWaalsContact C-N 3.32Å; Y68-A70 PolarHBondContact O-N 3.42Å; Y68-G71 PolarHBondContact O-N 3.46Å; Y68-I72 HydrophobicContact CD1-CD1 4Å; Y68-I72 HydrophobicContact CD2-CD1 4.38Å; Y68-I72 HydrophobicContact CE1-CD1 3.32Å; Y68-I72 HydrophobicContact CE1-CG1 4.38Å; Y68-I72 HydrophobicContact CE2-CD1 3.79Å; Y68-I72 HydrophobicContact CE2-CG1 4.43Å; Y68-I72 HydrophobicContact CG-CD1 4.48Å; Y68-I72 WeakPolarHBondContact O-CG1 3.27Å; Y68-I72 PolarHBondContact O-N 2.88Å; Y68-I72 WeakPolarHBondContact OH-CD1 3.41Å; Y68-F229 HydrophobicContact CD1-CE2 4.38Å; Y68-F229 HydrophobicContact CE1-CD2 4.2Å; Y68-F229 AromaticContact CE1-CE2 3.55Å; Y68-F229 HydrophobicContact CE1-CE2 3.55Å; Y68-F229 HydrophobicContact CE1-CZ 4.49Å; Y68-F229 AromaticContact CZ-CE2 3.97Å
69	R	37.5	Very low	36.5	Very low	160 Å²	160	96.8 Å²	96.8	60%	0.604	46%	0.463	S	S	*	.	H	α-helix	trans	-59.3	-41.9	175.3	-76.5	173.5	178.6	-177.7	0.1	111.5	M65 H66 K73	M65-R69 WeakPolarHBondContact O-CB 3.45Å; M65-R69 VanDerWaalsContact O-CG 3.24Å; M65-R69 WeakPolarHBondContact O-CG 3.48Å; M65-R69 PolarHBondContact O-N 3.06Å; H66-R69 PolarHBondContact O-N 3.37Å; R69-K73 WeakPolarHBondContact O-CB 3.39Å; R69-K73 PolarHBondContact O-N 3.01Å
70	A	36.2	Very low	36.5	Very low	54 Å²	54	99.6 Å²	99.6	45%	0.446	48%	0.477	S	S	.	.	H	α-helix	trans	-66.8	-44	177	0	0	0	0	0	111.9	H66 L67 Y68 K73 Q74	H66-A70 VanDerWaalsContact O-CB 3.29Å; H66-A70 WeakPolarHBondContact O-CB 3.36Å; H66-A70 PolarHBondContact O-N 2.8Å; L67-A70 PolarHBondContact O-N 2.84Å; Y68-A70 VanDerWaalsContact C-N 3.32Å; Y68-A70 PolarHBondContact O-N 3.42Å; A70-K73 PolarHBondContact O-N 3.27Å; A70-Q74 PolarHBondContact O-N 3.12Å
71	G	33.1	Very low	36	Very low	7 Å²	7	98.9 Å²	98.9	7%	0.072	47%	0.47	C	S	.	.	H	α-helix	trans	-63.7	-41.6	177.4	0	0	0	0	0	112.8	L67 Y68 Q74 R75	L67-G71 PolarHBondContact O-N 2.85Å; Y68-G71 PolarHBondContact O-N 3.46Å; G71-Q74 PolarHBondContact O-N 3.43Å; G71-R75 WeakPolarHBondContact O-CB 3.11Å; G71-R75 PolarHBondContact O-N 2.82Å
72	I	36.6	Very low	35.4	Very low	45 Å²	45	96.2 Å²	96.2	23%	0.231	46%	0.461	C	S	.	.	H	α-helix	trans	-65.1	-43.5	173.3	-72.2	-174.7	0	0	0	111.1	Y68 Q74 R75 R76	Y68-I72 HydrophobicContact CD1-CD1 4Å; Y68-I72 HydrophobicContact CD2-CD1 4.38Å; Y68-I72 HydrophobicContact CE1-CD1 3.32Å; Y68-I72 HydrophobicContact CE1-CG1 4.38Å; Y68-I72 HydrophobicContact CE2-CD1 3.79Å; Y68-I72 HydrophobicContact CE2-CG1 4.43Å; Y68-I72 HydrophobicContact CG-CD1 4.48Å; Y68-I72 WeakPolarHBondContact O-CG1 3.27Å; Y68-I72 PolarHBondContact O-N 2.88Å; Y68-I72 WeakPolarHBondContact OH-CD1 3.41Å; I72-Q74 VanDerWaalsContact C-N 3.28Å; I72-Q74 PolarHBondContact O-N 2.96Å; I72-R75 PolarHBondContact O-N 2.99Å; I72-R76 HydrophobicContact CG2-CG 4.07Å; I72-R76 VanDerWaalsContact O-CB 3.26Å; I72-R76 WeakPolarHBondContact O-CB 3.3Å; I72-R76 VanDerWaalsContact O-CG 3.3Å; I72-R76 WeakPolarHBondContact O-CG 3.45Å; I72-R76 PolarHBondContact O-N 3.31Å
73	K	38.2	Very low	35.2	Very low	166 Å²	166	91.8 Å²	91.8	72%	0.722	44%	0.443	S	S	*	.	H	α-helix	trans	-60	-41.7	177.4	-168.7	176.4	-178.9	179.4	0	111	R69 A70 H77	R69-K73 WeakPolarHBondContact O-CB 3.39Å; R69-K73 PolarHBondContact O-N 3.01Å; A70-K73 PolarHBondContact O-N 3.27Å; K73-H77 WeakPolarHBondContact O-CB 3.32Å; K73-H77 PolarHBondContact O-N 3.18Å
74	Q	35.3	Very low	35.5	Very low	117 Å²	117	96.9 Å²	96.9	55%	0.547	46%	0.458	S	S	.	.	H	α-helix	trans	-70.1	-43.6	177.9	-163.2	174.7	10.7	0	0	112.3	A70 G71 I72 H77 L78	A70-Q74 PolarHBondContact O-N 3.12Å; G71-Q74 PolarHBondContact O-N 3.43Å; I72-Q74 VanDerWaalsContact C-N 3.28Å; I72-Q74 PolarHBondContact O-N 2.96Å; Q74-H77 PolarHBondContact O-N 3.03Å; Q74-L78 WeakPolarHBondContact O-CB 3.34Å; Q74-L78 WeakPolarHBondContact O-CG 3.28Å; Q74-L78 PolarHBondContact O-N 3.04Å
75	R	36.9	Very low	35.2	Very low	150 Å²	150	100.2 Å²	100.2	57%	0.566	47%	0.469	S	S	*	.	H	α-helix	trans	-63.8	-42	175.6	-174.4	-179.1	-95.5	171.4	-4.8	111.5	S42 G71 I72 H77 L78 H79	S42-R75 PolarHBondContact O-NH2 3.36Å; G71-R75 WeakPolarHBondContact O-CB 3.11Å; G71-R75 PolarHBondContact O-N 2.82Å; I72-R75 PolarHBondContact O-N 2.99Å; R75-H77 VanDerWaalsContact C-N 3.35Å; R75-L78 PolarHBondContact O-N 3.37Å; R75-H79 WeakPolarHBondContact O-CB 3.2Å; R75-H79 PolarHBondContact O-N 2.84Å
76	R	34.8	Very low	35	Very low	164 Å²	164	101.9 Å²	101.9	62%	0.619	48%	0.482	S	S	*	.	H	α-helix	trans	-62.7	-40.6	172.9	-74.6	-179	-178.2	176.8	2.5	111	I72 H79 I80	I72-R76 HydrophobicContact CG2-CG 4.07Å; I72-R76 VanDerWaalsContact O-CB 3.26Å; I72-R76 WeakPolarHBondContact O-CB 3.3Å; I72-R76 VanDerWaalsContact O-CG 3.3Å; I72-R76 WeakPolarHBondContact O-CG 3.45Å; I72-R76 PolarHBondContact O-N 3.31Å; R76-H79 PolarHBondContact O-N 3.15Å; R76-I80 WeakPolarHBondContact O-CB 3.29Å; R76-I80 WeakPolarHBondContact O-CG1 3.49Å; R76-I80 PolarHBondContact O-N 2.77Å
77	H	38.4	Very low	34.6	Very low	111 Å²	111	106.8 Å²	106.8	51%	0.514	50%	0.497	S	S	.	.	H	α-helix	trans	-65.1	-45.3	176.4	-163.9	81.4	0	0	0	112.3	K73 Q74 R75 H79 I80 Q81	K73-H77 WeakPolarHBondContact O-CB 3.32Å; K73-H77 PolarHBondContact O-N 3.18Å; Q74-H77 PolarHBondContact O-N 3.03Å; R75-H77 VanDerWaalsContact C-N 3.35Å; H77-H79 VanDerWaalsContact C-N 3.34Å; H77-I80 PolarHBondContact O-N 2.85Å; H77-Q81 PolarHBondContact NE2-NE2 3Å; H77-Q81 VanDerWaalsContact NE2-NE2 3.17Å; H77-Q81 WeakPolarHBondContact O-CG 3.42Å; H77-Q81 PolarHBondContact O-N 3.43Å
78	L	36.9	Very low	34.1	Very low	105 Å²	105	114 Å²	114	55%	0.55	52%	0.519	S	S	.	.	H	α-helix	trans	-63.5	-39.8	174.6	-74.5	170.4	0	0	0	111.7	Q74 R75 Q81 S82	Q74-L78 WeakPolarHBondContact O-CB 3.34Å; Q74-L78 WeakPolarHBondContact O-CG 3.28Å; Q74-L78 PolarHBondContact O-N 3.04Å; R75-L78 PolarHBondContact O-N 3.37Å; L78-Q81 PolarHBondContact O-N 2.81Å; L78-S82 WeakPolarHBondContact O-CB 3.25Å; L78-S82 PolarHBondContact O-N 3.43Å
79	H	33.3	Very low	33.7	Very low	121 Å²	121	120.2 Å²	120.2	56%	0.56	54%	0.541	S	S	*	.	H	α-helix	trans	-65.6	-46.6	176.6	-165.3	64.9	0	0	0	110.9	R75 R76 H77 Q81 S82 V83	R75-H79 WeakPolarHBondContact O-CB 3.2Å; R75-H79 PolarHBondContact O-N 2.84Å; R76-H79 PolarHBondContact O-N 3.15Å; H77-H79 VanDerWaalsContact C-N 3.34Å; H79-Q81 VanDerWaalsContact C-N 3.33Å; H79-Q81 PolarHBondContact O-N 3.34Å; H79-S82 WeakPolarHBondContact CA-OG 3.49Å; H79-S82 CarbonylContact O-C 3.55Å; H79-S82 PolarHBondContact O-N 2.84Å; H79-S82 VanDerWaalsContact O-N 3.08Å; H79-S82 PolarHBondContact O-OG 2.81Å; H79-V83 VanDerWaalsContact O-CG2 3.28Å; H79-V83 WeakPolarHBondContact O-CG2 3.37Å; H79-V83 PolarHBondContact O-N 2.8Å
80	I	32.4	Very low	33.4	Very low	94 Å²	94	118.3 Å²	118.3	48%	0.482	55%	0.55	S	S	.	*	H	α-helix	trans	-60.3	-41.2	174.9	-69.4	165.9	0	0	0	111.2	R76 H77 V83 K84	R76-I80 WeakPolarHBondContact O-CB 3.29Å; R76-I80 WeakPolarHBondContact O-CG1 3.49Å; R76-I80 PolarHBondContact O-N 2.77Å; H77-I80 PolarHBondContact O-N 2.85Å; I80-V83 PolarHBondContact O-N 3.4Å; I80-K84 HydrophobicContact CG2-CD 4.26Å; I80-K84 HydrophobicContact CG2-CG 4.47Å; I80-K84 WeakPolarHBondContact O-CB 3.3Å; I80-K84 WeakPolarHBondContact O-CG 3.3Å; I80-K84 PolarHBondContact O-N 3.38Å
81	Q	30.3	Very low	33.2	Very low	85 Å²	85	125.3 Å²	125.3	40%	0.397	57%	0.57	S	S	.	*	H	α-helix	trans	-62.5	-44.1	173.2	-77.2	-175.2	-7.9	0	0	111.4	H77 L78 H79 V83 K84 H85	H77-Q81 PolarHBondContact NE2-NE2 3Å; H77-Q81 VanDerWaalsContact NE2-NE2 3.17Å; H77-Q81 WeakPolarHBondContact O-CG 3.42Å; H77-Q81 PolarHBondContact O-N 3.43Å; L78-Q81 PolarHBondContact O-N 2.81Å; H79-Q81 VanDerWaalsContact C-N 3.33Å; H79-Q81 PolarHBondContact O-N 3.34Å; Q81-V83 VanDerWaalsContact C-N 3.33Å; Q81-V83 PolarHBondContact O-N 2.75Å; Q81-K84 PolarHBondContact O-N 2.84Å; Q81-H85 WeakPolarHBondContact O-CB 3.24Å; Q81-H85 PolarHBondContact O-CD2 3.45Å; Q81-H85 PolarHBondContact O-N 3.33Å
82	S	30.8	Very low	33.1	Very low	54 Å²	54	129.7 Å²	129.7	38%	0.378	60%	0.6	S	S	.	*	H	α-helix	trans	-64.9	-36	178.5	77.8	0	0	0	0	112.6	L78 H79 H85 T86	L78-S82 WeakPolarHBondContact O-CB 3.25Å; L78-S82 PolarHBondContact O-N 3.43Å; H79-S82 WeakPolarHBondContact CA-OG 3.49Å; H79-S82 CarbonylContact O-C 3.55Å; H79-S82 PolarHBondContact O-N 2.84Å; H79-S82 VanDerWaalsContact O-N 3.08Å; H79-S82 PolarHBondContact O-OG 2.81Å; S82-H85 PolarHBondContact O-N 2.79Å; S82-T86 WeakPolarHBondContact O-CB 3.34Å; S82-T86 WeakPolarHBondContact O-CG2 3.26Å; S82-T86 PolarHBondContact O-N 3.25Å; S82-T86 PolarHBondContact O-OG1 3.44Å
83	V	30.5	Very low	32.7	Very low	57 Å²	57	133.5 Å²	133.5	35%	0.345	63%	0.625	S	S	.	*	H	α-helix	trans	-72.7	-42.6	177.6	174.1	0	0	0	0	110.1	H79 I80 Q81 H85 T86 W87	H79-V83 VanDerWaalsContact O-CG2 3.28Å; H79-V83 WeakPolarHBondContact O-CG2 3.37Å; H79-V83 PolarHBondContact O-N 2.8Å; I80-V83 PolarHBondContact O-N 3.4Å; Q81-V83 VanDerWaalsContact C-N 3.33Å; Q81-V83 PolarHBondContact O-N 2.75Å; V83-H85 VanDerWaalsContact C-N 3.27Å; V83-H85 PolarHBondContact O-N 2.85Å; V83-T86 WeakPolarHBondContact CA-OG1 3.46Å; V83-T86 PolarHBondContact O-N 3.35Å; V83-T86 PolarHBondContact O-OG1 2.88Å; V83-W87 PolarHBondContact O-N 3.42Å
84	K	36.9	Very low	32.3	Very low	150 Å²	150	136 Å²	136	65%	0.652	63%	0.63	S	S	*	*	H	α-helix	trans	-63.5	-32.2	174.7	-76.3	-174.1	177.6	-173.8	0	112.5	I80 Q81	I80-K84 HydrophobicContact CG2-CD 4.26Å; I80-K84 HydrophobicContact CG2-CG 4.47Å; I80-K84 WeakPolarHBondContact O-CB 3.3Å; I80-K84 WeakPolarHBondContact O-CG 3.3Å; I80-K84 PolarHBondContact O-N 3.38Å; Q81-K84 PolarHBondContact O-N 2.84Å
85	H	32.1	Very low	31.9	Very low	138 Å²	138	139.9 Å²	139.9	64%	0.639	65%	0.645	S	S	*	*	H	α-helix	trans	-86.2	-18.3	177.9	-69.5	-51.1	0	0	0	114.6	Q81 S82 V83	Q81-H85 WeakPolarHBondContact O-CB 3.24Å; Q81-H85 PolarHBondContact O-CD2 3.45Å; Q81-H85 PolarHBondContact O-N 3.33Å; S82-H85 PolarHBondContact O-N 2.79Å; V83-H85 VanDerWaalsContact C-N 3.27Å; V83-H85 PolarHBondContact O-N 2.85Å
86	T	32.7	Very low	31.7	Very low	95 Å²	95	138.3 Å²	138.3	58%	0.583	66%	0.657	S	S	*	*	H	α-helix	trans	-84.5	-27.5	178.3	35.3	0	0	0	0	113	S82 V83 W88	S82-T86 WeakPolarHBondContact O-CB 3.34Å; S82-T86 WeakPolarHBondContact O-CG2 3.26Å; S82-T86 PolarHBondContact O-N 3.25Å; S82-T86 PolarHBondContact O-OG1 3.44Å; V83-T86 WeakPolarHBondContact CA-OG1 3.46Å; V83-T86 PolarHBondContact O-N 3.35Å; V83-T86 PolarHBondContact O-OG1 2.88Å; T86-W88 VanDerWaalsContact C-N 3.27Å; T86-W88 PolarHBondContact O-N 3.27Å
87	W	28.7	Very low	31.5	Very low	215 Å²	215	136.1 Å²	136.1	81%	0.814	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-15	180	-79.1	56.1	0	0	0	114.6	V83	V83-W87 PolarHBondContact O-N 3.42Å
88	W	27.4	Very low	31.2	Very low	226 Å²	226	134.1 Å²	134.1	86%	0.856	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	8.6	-178.5	-69.9	98.3	0	0	0	115.3	T86 P90	T86-W88 VanDerWaalsContact C-N 3.27Å; T86-W88 PolarHBondContact O-N 3.27Å; W88-P90 VanDerWaalsContact O-CD 3.29Å; W88-P90 WeakPolarHBondContact O-CD 3.39Å
89	R	28.4	Very low	30.8	Very low	210 Å²	210	140.4 Å²	140.4	79%	0.792	69%	0.692	S	S	*	*	S	Bend	trans	-102.8	102.3	169.6	-70.5	-154.2	-176.5	-152.5	3.3	109.6	K91	R89-K91 PolarHBondContact O-N 2.98Å; R89-K91 VanDerWaalsContact O-N 3.12Å
90	P	30.6	Very low	30.7	Very low	121 Å²	121	140.2 Å²	140.2	79%	0.786	70%	0.7	S	S	*	*			trans	-52.9	124.9	167	-16.2	27.7	0	0	0	107.1	W88 S92	W88-P90 VanDerWaalsContact O-CD 3.29Å; W88-P90 WeakPolarHBondContact O-CD 3.39Å; P90-S92 PolarHBondContact O-N 2.85Å
91	K	33.3	Very low	30.3	Very low	200 Å²	200	139.1 Å²	139.1	87%	0.87	71%	0.712	S	S	*	*			trans	-61.6	79.5	175.4	-69.7	177.1	178	175.1	0	108.9	R89 V93	R89-K91 PolarHBondContact O-N 2.98Å; R89-K91 VanDerWaalsContact O-N 3.12Å; K91-V93 VanDerWaalsContact C-N 3.28Å; K91-V93 PolarHBondContact O-N 3.37Å
92	S	30.1	Very low	30.1	Very low	100 Å²	100	146.1 Å²	146.1	70%	0.699	74%	0.736	S	S	*	*			trans	-72.9	94.2	162.4	174.9	0	0	0	0	106	P90 R94	P90-S92 PolarHBondContact O-N 2.85Å; S92-R94 PolarHBondContact O-N 2.89Å
93	V	29.7	Very low	29.8	Very low	124 Å²	124	150.4 Å²	150.4	75%	0.752	76%	0.76	S	S	*	*			trans	-67.1	79.3	173.5	-177.3	0	0	0	0	107.7	K91 K95	K91-V93 VanDerWaalsContact C-N 3.28Å; K91-V93 PolarHBondContact O-N 3.37Å; V93-K95 PolarHBondContact O-N 2.87Å
94	R	29	Very low	29.4	Very low	220 Å²	220	158.8 Å²	158.8	83%	0.83	79%	0.787	S	S	*	*			trans	-84.9	102.5	163	-104	-174.5	-180	-177.1	0.9	108.1	S92 S96	S92-R94 PolarHBondContact O-N 2.89Å; R94-S96 PolarHBondContact O-N 3.38Å
95	K	27.7	Very low	28.9	Very low	197 Å²	197	160.9 Å²	160.9	86%	0.857	80%	0.796	S	S	*	*			trans	-52.1	101.5	162.2	-68.9	179.5	176	179.8	0	108	V93	V93-K95 PolarHBondContact O-N 2.87Å
96	S	32	Very low	28.7	Very low	117 Å²	117	160.3 Å²	160.3	82%	0.818	81%	0.805	S	S	*	*			trans	-96.9	96.9	167.4	37.8	0	0	0	0	107.2	R94 G98	R94-S96 PolarHBondContact O-N 3.38Å; S96-G98 PolarHBondContact O-N 2.88Å
97	S	30.5	Very low	28.6	Very low	119 Å²	119	165.1 Å²	165.1	83%	0.832	82%	0.821	S	S	*	*			trans	-67.4	121.3	168.4	54.4	0	0	0	0	109.5
98	G	31.7	Very low	28.7	Very low	68 Å²	68	160.3 Å²	160.3	70%	0.701	82%	0.82	S	S	*	*			trans	99.7	128.1	151.1	0	0	0	0	0	116.8	S96	S96-G98 PolarHBondContact O-N 2.88Å
99	R	29.8	Very low	28.8	Very low	238 Å²	238	154 Å²	154	90%	0.898	82%	0.816	S	S	*	*			trans	70.8	140.6	155.9	-82.7	-179.9	150.8	176.6	-6.8	116.1
100	T	29.2	Very low	28.9	Very low	117 Å²	117	153.3 Å²	153.3	72%	0.718	82%	0.822	S	S	*	*			cis	-162.7	139	15.2	3.9	0	0	0	0	107
101	G	25.8	Very low	28.7	Very low	71 Å²	71	156.2 Å²	156.2	73%	0.732	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-67.4	151.4	177.5	0	0	0	0	0	113.9
102	Y	24.6	Very low	28.6	Very low	232 Å²	232	155.8 Å²	155.8	91%	0.91	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-76.4	120.3	177.8	-67.7	-91.4	0	0	0	110.5
103	T	24.2	Very low	28.3	Very low	144 Å²	144	157.3 Å²	157.3	88%	0.883	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-97.2	116.8	167.7	27	0	0	0	0	108.9
104	Y	23.5	Very low	28.4	Very low	232 Å²	232	158.1 Å²	158.1	91%	0.91	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-89.5	120.9	177	-135.3	-94.2	0	0	0	109
105	K	26.8	Very low	28.2	Very low	194 Å²	194	153.1 Å²	153.1	84%	0.843	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-82.6	126.1	172	-97	-175.9	174.5	-179.2	0	109.4	Q107	K105-Q107 PolarHBondContact O-N 3.43Å
106	P	27.8	Very low	28.4	Very low	126 Å²	126	149 Å²	149	82%	0.818	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-75.6	119.4	177.1	29.2	-30	0	0	0	109.6
107	Q	29.4	Very low	28.1	Very low	196 Å²	196	150.1 Å²	150.1	92%	0.916	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-81.2	125	174.8	-127.2	164.2	-27.1	0	0	109	K105	K105-Q107 PolarHBondContact O-N 3.43Å
108	S	30.8	Very low	28.1	Very low	114 Å²	114	154 Å²	154	80%	0.797	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-52.9	136.4	-175.7	40.9	0	0	0	0	114.4
109	A	30.1	Very low	27.9	Very low	94 Å²	94	155.5 Å²	155.5	78%	0.777	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-55	126.4	174.3	0	0	0	0	0	112.6
110	Q	30.2	Very low	27.6	Very low	196 Å²	196	152.9 Å²	152.9	92%	0.916	82%	0.823	S	S	*	*			trans	-108	99.4	151.9	-86.6	-175.7	-32.9	0	0	106.9	K112	Q110-K112 PolarHBondContact O-N 2.69Å
111	E	27.6	Very low	27.6	Very low	182 Å²	182	154.1 Å²	154.1	85%	0.85	82%	0.824	S	S	*	*			trans	-57.7	116.9	166.5	-77.4	171	136.4	0	0	109
112	K	29.9	Very low	27.7	Very low	190 Å²	190	155.6 Å²	155.6	83%	0.826	82%	0.819	S	S	*	*			trans	-112.2	95.6	162	-119.5	-179	179.6	-176.6	0	107.5	Q110 I114	Q110-K112 PolarHBondContact O-N 2.69Å; K112-I114 PolarHBondContact O-N 3.31Å
113	V	24.7	Very low	27.8	Very low	132 Å²	132	152.1 Å²	152.1	80%	0.8	82%	0.816	S	S	*	*			trans	-65	110.8	168.7	177	0	0	0	0	107.4
114	I	30.4	Very low	27.9	Very low	142 Å²	142	153 Å²	153	73%	0.728	81%	0.81	S	S	*	*			trans	-124	100.1	164.9	-56.9	177.7	0	0	0	106.1	K112 S116	K112-I114 PolarHBondContact O-N 3.31Å; I114-S116 PolarHBondContact O-N 2.84Å
115	S	26	Very low	28.1	Very low	114 Å²	114	148 Å²	148	80%	0.797	80%	0.804	S	S	*	*			trans	-61.5	114.2	166.5	49	0	0	0	0	109
116	S	30.7	Very low	28	Very low	110 Å²	110	148.1 Å²	148.1	77%	0.769	81%	0.807	S	S	*	*			trans	-115	115.7	168.3	-163.8	0	0	0	0	108.6	I114 K118	I114-S116 PolarHBondContact O-N 2.84Å; S116-K118 PolarHBondContact O-N 3.17Å
117	T	26.2	Very low	28.1	Very low	142 Å²	142	145.7 Å²	145.7	87%	0.871	79%	0.793	S	S	*	*			trans	-54	109.5	175.7	24.2	0	0	0	0	110.4	S119	T117-S119 PolarHBondContact O-N 3.44Å
118	K	30.7	Very low	28.3	Very low	200 Å²	200	141.6 Å²	141.6	87%	0.87	79%	0.786	S	S	*	*			trans	-70.9	107.1	178.2	-161.4	178.3	-174	-172.8	0	108.6	S116 E120	S116-K118 PolarHBondContact O-N 3.17Å; K118-E120 PolarHBondContact O-N 2.95Å
119	S	26.9	Very low	28.6	Very low	100 Å²	100	140.7 Å²	140.7	70%	0.699	78%	0.776	S	S	*	*			trans	-68.5	114.9	163.4	36.1	0	0	0	0	108.2	T117 I121	T117-S119 PolarHBondContact O-N 3.44Å; S119-I121 PolarHBondContact O-N 3.21Å
120	E	25	Very low	29.1	Very low	183 Å²	183	142 Å²	142	86%	0.855	77%	0.769	S	S	*	*			trans	-66.8	88.8	178.9	-171	169.7	-165.6	0	0	109.4	K118	K118-E120 PolarHBondContact O-N 2.95Å
121	I	28.4	Very low	30.2	Very low	143 Å²	143	136.4 Å²	136.4	73%	0.733	74%	0.742	S	S	*	*			trans	-87.8	109.7	165.4	-60.1	174.2	0	0	0	105.4	S119 D123	S119-I121 PolarHBondContact O-N 3.21Å; I121-D123 PolarHBondContact O-N 3.34Å
122	T	27.2	Very low	32.1	Very low	101 Å²	101	133.4 Å²	133.4	62%	0.62	73%	0.728	S	S	*	*			trans	-65.1	108.9	-178.6	-37.4	0	0	0	0	109.3	Q124	T122-Q124 VanDerWaalsContact C-N 3.33Å; T122-Q124 HydrophobicContact CG2-CG 4.27Å; T122-Q124 PolarHBondContact O-N 2.89Å
123	D	28.2	Very low	33.7	Very low	159 Å²	159	125 Å²	125	85%	0.85	69%	0.693	S	S	*	*			trans	-63.8	89.2	170.6	-73.9	-42.7	0	0	0	109.4	I121	I121-D123 PolarHBondContact O-N 3.34Å
124	Q	25.3	Very low	35.4	Very low	164 Å²	164	122.9 Å²	122.9	77%	0.766	68%	0.676	S	S	*	*			trans	-118.1	72.5	165.8	-72.8	-168.1	23.8	0	0	109	T122	T122-Q124 VanDerWaalsContact C-N 3.33Å; T122-Q124 HydrophobicContact CG2-CG 4.27Å; T122-Q124 PolarHBondContact O-N 2.89Å
125	T	28.6	Very low	37.3	Very low	126 Å²	126	121.2 Å²	121.2	77%	0.773	66%	0.664	S	S	*	*			trans	-152.8	71	151.3	-9.8	0	0	0	0	107.7	S127	T125-S127 PolarHBondContact O-N 3.35Å
126	E	25.1	Very low	39.4	Very low	197 Å²	197	119.8 Å²	119.8	92%	0.921	64%	0.641	S	S	*	*			trans	-64.3	66.3	150.8	-70.5	180	163.8	0	0	107.6	S128	E126-S128 VanDerWaalsContact C-N 3.31Å; E126-S128 PolarHBondContact O-N 3.17Å
127	S	28.4	Very low	41.1	Very low	75 Å²	75	115.2 Å²	115.2	52%	0.524	61%	0.608	S	S	.	*			trans	-70.8	100.6	163.3	60.3	0	0	0	0	104.9	T125 V129	T125-S127 PolarHBondContact O-N 3.35Å; S127-V129 VanDerWaalsContact O-CG2 3.25Å; S127-V129 WeakPolarHBondContact O-CG2 3.31Å; S127-V129 PolarHBondContact O-N 2.67Å
128	S	33.9	Very low	43	Very low	109 Å²	109	113.8 Å²	113.8	76%	0.762	59%	0.591	S	S	*	*			trans	-58.7	91.7	159.8	65.3	0	0	0	0	105.7	E126 D130	E126-S128 VanDerWaalsContact C-N 3.31Å; E126-S128 PolarHBondContact O-N 3.17Å; S128-D130 VanDerWaalsContact C-N 3.26Å; S128-D130 PolarHBondContact O-N 3.13Å
129	V	37	Very low	45.1	Very low	96 Å²	96	107.3 Å²	107.3	58%	0.582	57%	0.569	S	S	*	*			trans	-72.3	95.5	-178	-159	0	0	0	0	105.1	S127 F131	S127-V129 VanDerWaalsContact O-CG2 3.25Å; S127-V129 WeakPolarHBondContact O-CG2 3.31Å; S127-V129 PolarHBondContact O-N 2.67Å; V129-F131 HydrophobicContact CB-CD2 4.15Å; V129-F131 HydrophobicContact CG1-CD2 3.33Å; V129-F131 HydrophobicContact CG1-CE2 3.72Å; V129-F131 HydrophobicContact CG1-CG 4.48Å; V129-F131 PolarHBondContact O-N 2.83Å
130	D	40.7	Very low	47.3	Very low	120 Å²	120	102.9 Å²	102.9	64%	0.642	54%	0.537	S	S	*	.			trans	-71.9	73	178.8	-141	9.7	0	0	0	107.1	S128 E132 K135	S128-D130 VanDerWaalsContact C-N 3.26Å; S128-D130 PolarHBondContact O-N 3.13Å; D130-E132 PolarHBondContact O-N 2.78Å; D130-K135 WeakPolarHBondContact OD1-CE 3.47Å; D130-K135 IonicContact OD1-NZ 3.56Å; D130-K135 PolarHBondContact OD1-NZ 3.28Å; D130-K135 IonicContact OD2-NZ 3.48Å; D130-K135 PolarHBondContact OD2-NZ 3.37Å
131	F	52.7	Low	49.4	Very low	79 Å²	79	94.7 Å²	94.7	35%	0.346	50%	0.5	S	S	.	.			trans	-76.2	96.1	-174.4	-123.4	-88.9	0	0	0	108.3	V129 P133 I134 K135	V129-F131 HydrophobicContact CB-CD2 4.15Å; V129-F131 HydrophobicContact CG1-CD2 3.33Å; V129-F131 HydrophobicContact CG1-CE2 3.72Å; V129-F131 HydrophobicContact CG1-CG 4.48Å; V129-F131 PolarHBondContact O-N 2.83Å; F131-P133 VanDerWaalsContact C-N 3.25Å; F131-P133 HydrophobicContact CD1-CB 4.1Å; F131-P133 HydrophobicContact CD1-CG 3.74Å; F131-P133 HydrophobicContact CE1-CG 4.1Å; F131-I134 HydrophobicContact CB-CB 4.31Å; F131-I134 HydrophobicContact CB-CD1 3.64Å; F131-I134 HydrophobicContact CB-CG1 3.88Å; F131-I134 HydrophobicContact CG-CD1 4.22Å; F131-I134 HydrophobicContact CG-CG1 4.48Å; F131-I134 PolarHBondContact O-N 3.27Å; F131-K135 PolarHBondContact O-N 3.3Å
132	E	68.6	Low	51.5	Low	119 Å²	119	93.3 Å²	93.3	56%	0.556	49%	0.49	S	S	*	.	H	α-helix	trans	-46.9	-40.5	175	-151.4	-168.4	152.9	0	0	113.5	D130 I134 K135 R136	D130-E132 PolarHBondContact O-N 2.78Å; E132-I134 VanDerWaalsContact C-N 3.33Å; E132-I134 PolarHBondContact O-N 3.09Å; E132-K135 PolarHBondContact O-N 3.33Å; E132-R136 VanDerWaalsContact CD-NH2 3.3Å; E132-R136 WeakPolarHBondContact O-CG 3.28Å; E132-R136 PolarHBondContact O-N 3.42Å; E132-R136 VanDerWaalsContact O-N 3.09Å; E132-R136 IonicContact OE1-CZ 3.43Å; E132-R136 IonicContact OE1-NE 3.18Å; E132-R136 IonicContact OE1-NH2 3.68Å; E132-R136 PolarHBondContact OE1-NH2 3.36Å; E132-R136 IonicContact OE2-NH2 3.65Å
133	P	64.1	Low	53.7	Low	15 Å²	15	91.2 Å²	91.2	10%	0.097	48%	0.475	C	S	.	.	H	α-helix	trans	-56.1	-39.4	173.7	-29.5	36.5	0	0	0	114.8	F131 R136 I137 I161 M165	F131-P133 VanDerWaalsContact C-N 3.25Å; F131-P133 HydrophobicContact CD1-CB 4.1Å; F131-P133 HydrophobicContact CD1-CG 3.74Å; F131-P133 HydrophobicContact CE1-CG 4.1Å; P133-R136 PolarHBondContact O-N 2.97Å; P133-I137 WeakPolarHBondContact O-CG1 3.27Å; P133-I137 PolarHBondContact O-N 2.88Å; P133-I161 HydrophobicContact CB-CG2 4.02Å; P133-M165 HydrophobicContact CB-CG 3.77Å; P133-M165 HydrophobicContact CB-SD 4.22Å; P133-M165 HydrophobicContact CG-CG 4.1Å
134	I	60	Low	55.6	Low	86 Å²	86	85 Å²	85	44%	0.441	44%	0.443	S	S	.	.	H	α-helix	trans	-69.3	-42.1	-178.1	-63	174.7	0	0	0	110.2	F131 E132 R136 I137 Q138	F131-I134 HydrophobicContact CB-CB 4.31Å; F131-I134 HydrophobicContact CB-CD1 3.64Å; F131-I134 HydrophobicContact CB-CG1 3.88Å; F131-I134 HydrophobicContact CG-CD1 4.22Å; F131-I134 HydrophobicContact CG-CG1 4.48Å; F131-I134 PolarHBondContact O-N 3.27Å; E132-I134 VanDerWaalsContact C-N 3.33Å; E132-I134 PolarHBondContact O-N 3.09Å; I134-R136 VanDerWaalsContact C-N 3.29Å; I134-R136 PolarHBondContact O-N 3.39Å; I134-I137 PolarHBondContact O-N 2.95Å; I134-Q138 PolarHBondContact O-N 3.38Å
135	K	69.5	Low	57.5	Low	107 Å²	107	82.4 Å²	82.4	47%	0.465	43%	0.426	S	S	.	.	H	α-helix	trans	-60.9	-39.7	174.6	-69.7	-176.5	-175.8	169.3	0	111.3	D130 F131 E132 I137 Q138 T139	D130-K135 WeakPolarHBondContact OD1-CE 3.47Å; D130-K135 IonicContact OD1-NZ 3.56Å; D130-K135 PolarHBondContact OD1-NZ 3.28Å; D130-K135 IonicContact OD2-NZ 3.48Å; D130-K135 PolarHBondContact OD2-NZ 3.37Å; F131-K135 PolarHBondContact O-N 3.3Å; E132-K135 PolarHBondContact O-N 3.33Å; K135-I137 PolarHBondContact O-N 2.78Å; K135-Q138 WeakPolarHBondContact O-CB 3.38Å; K135-Q138 PolarHBondContact O-N 2.93Å; K135-T139 PolarHBondContact O-N 3.06Å; K135-T139 PolarHBondContact O-OG1 3.48Å
136	R	70.2	Confident	59.7	Low	84 Å²	84	82.4 Å²	82.4	32%	0.317	42%	0.421	S	S	.	.	H	α-helix	trans	-63.6	-39.1	176.2	-68.3	-178.2	-161.8	173.3	5.4	112.5	E132 P133 I134 T139 L140 I161 E164	E132-R136 VanDerWaalsContact CD-NH2 3.3Å; E132-R136 WeakPolarHBondContact O-CG 3.28Å; E132-R136 PolarHBondContact O-N 3.42Å; E132-R136 VanDerWaalsContact O-N 3.09Å; E132-R136 IonicContact OE1-CZ 3.43Å; E132-R136 IonicContact OE1-NE 3.18Å; E132-R136 IonicContact OE1-NH2 3.68Å; E132-R136 PolarHBondContact OE1-NH2 3.36Å; E132-R136 IonicContact OE2-NH2 3.65Å; P133-R136 PolarHBondContact O-N 2.97Å; I134-R136 VanDerWaalsContact C-N 3.29Å; I134-R136 PolarHBondContact O-N 3.39Å; R136-T139 VanDerWaalsContact CA-OG1 3.3Å; R136-T139 WeakPolarHBondContact CA-OG1 3.38Å; R136-T139 PolarHBondContact O-N 3.31Å; R136-T139 PolarHBondContact O-OG1 3.48Å; R136-L140 PolarHBondContact O-N 2.86Å; R136-I161 HydrophobicContact CB-CD1 4.06Å; R136-E164 IonicContact CZ-OE1 3.57Å; R136-E164 IonicContact CZ-OE2 3.94Å; R136-E164 IonicContact NH1-OE1 2.75Å; R136-E164 PolarHBondContact NH1-OE1 3.01Å; R136-E164 IonicContact NH1-OE2 3.74Å; R136-E164 PolarHBondContact NH1-OE2 2.91Å
137	I	65.6	Low	62	Low	15 Å²	15	81.7 Å²	81.7	8%	0.077	42%	0.418	C	S	.	.	H	α-helix	trans	-63	-42.7	174.2	-64.7	159.3	0	0	0	110.6	P133 I134 K135 T139 L140 V141 I161 L241 L245	P133-I137 WeakPolarHBondContact O-CG1 3.27Å; P133-I137 PolarHBondContact O-N 2.88Å; I134-I137 PolarHBondContact O-N 2.95Å; K135-I137 PolarHBondContact O-N 2.78Å; I137-T139 PolarHBondContact O-N 2.83Å; I137-L140 WeakPolarHBondContact O-CB 3.46Å; I137-L140 PolarHBondContact O-N 3.34Å; I137-L140 VanDerWaalsContact O-N 3.14Å; I137-V141 WeakPolarHBondContact O-CG2 3.2Å; I137-V141 PolarHBondContact O-N 3.4Å; I137-I161 HydrophobicContact CD1-CG2 3.97Å; I137-I161 HydrophobicContact CG1-CD1 3.99Å; I137-I161 HydrophobicContact CG1-CG2 4.03Å; I137-L241 HydrophobicContact CD1-CD1 4.17Å; I137-L241 HydrophobicContact CD1-CD2 3.59Å; I137-L241 HydrophobicContact CD1-CG 4.48Å; I137-L245 HydrophobicContact CG2-CD2 4.02Å
138	Q	67.1	Low	64.2	Low	112 Å²	112	81.6 Å²	81.6	52%	0.523	42%	0.417	S	S	.	.	H	α-helix	trans	-61	-44.6	176.3	-69.9	174	-21.2	0	0	111.9	I134 K135 L140 V141 E142	I134-Q138 PolarHBondContact O-N 3.38Å; K135-Q138 WeakPolarHBondContact O-CB 3.38Å; K135-Q138 PolarHBondContact O-N 2.93Å; Q138-L140 VanDerWaalsContact C-N 3.29Å; Q138-L140 PolarHBondContact O-N 2.7Å; Q138-V141 WeakPolarHBondContact O-CB 3.29Å; Q138-V141 PolarHBondContact O-N 3.26Å; Q138-E142 PolarHBondContact O-N 3.48Å; Q138-E142 VanDerWaalsContact O-N 3.17Å
139	T	75.8	Confident	66.1	Low	64 Å²	64	78.3 Å²	78.3	39%	0.393	39%	0.391	S	S	.	.	H	α-helix	trans	-65.3	-30.7	174.5	49.6	0	0	0	0	113.1	K135 R136 I137 E142 N143	K135-T139 PolarHBondContact O-N 3.06Å; K135-T139 PolarHBondContact O-OG1 3.48Å; R136-T139 VanDerWaalsContact CA-OG1 3.3Å; R136-T139 WeakPolarHBondContact CA-OG1 3.38Å; R136-T139 PolarHBondContact O-N 3.31Å; R136-T139 PolarHBondContact O-OG1 3.48Å; I137-T139 PolarHBondContact O-N 2.83Å; T139-E142 PolarHBondContact O-N 2.93Å; T139-N143 WeakPolarHBondContact O-CB 3.32Å; T139-N143 PolarHBondContact O-N 2.75Å; T139-N143 PolarHBondContact O-ND2 3.1Å
140	L	72.1	Confident	67.9	Low	7 Å²	7	76.4 Å²	76.4	4%	0.037	38%	0.381	C	S	.	.	H	α-helix	trans	-64.7	-42.4	173.3	-91.6	152.6	0	0	0	111.7	R136 I137 Q138 E142 N143 V144 V154 I157 I161	R136-L140 PolarHBondContact O-N 2.86Å; I137-L140 WeakPolarHBondContact O-CB 3.46Å; I137-L140 PolarHBondContact O-N 3.34Å; I137-L140 VanDerWaalsContact O-N 3.14Å; Q138-L140 VanDerWaalsContact C-N 3.29Å; Q138-L140 PolarHBondContact O-N 2.7Å; L140-E142 VanDerWaalsContact C-N 3.31Å; L140-E142 PolarHBondContact O-N 3.38Å; L140-N143 PolarHBondContact O-N 3.02Å; L140-V144 VanDerWaalsContact O-CG2 3.26Å; L140-V144 WeakPolarHBondContact O-CG2 3.46Å; L140-V144 PolarHBondContact O-N 3.3Å; L140-V154 HydrophobicContact CD2-CG1 4.25Å; L140-V154 HydrophobicContact CD2-CG2 4.28Å; L140-I157 HydrophobicContact CD1-CB 4.34Å; L140-I157 HydrophobicContact CD1-CG2 3.64Å; L140-I157 HydrophobicContact CD2-CB 4.19Å; L140-I157 HydrophobicContact CD2-CD1 3.88Å; L140-I157 HydrophobicContact CD2-CG2 4.07Å; L140-I157 HydrophobicContact CG-CG2 4.3Å; L140-I161 HydrophobicContact CD1-CD1 3.45Å; L140-I161 VanDerWaalsContact CD1-CD1 3.45Å
141	V	68.4	Low	69.3	Low	11 Å²	11	75.3 Å²	75.3	7%	0.067	38%	0.375	C	S	.	.	H	α-helix	trans	-57.9	-46.9	174.4	178	0	0	0	0	110.4	I137 Q138 V144 R145 L245 L248 L249	I137-V141 WeakPolarHBondContact O-CG2 3.2Å; I137-V141 PolarHBondContact O-N 3.4Å; Q138-V141 WeakPolarHBondContact O-CB 3.29Å; Q138-V141 PolarHBondContact O-N 3.26Å; V141-V144 PolarHBondContact O-N 2.87Å; V141-R145 WeakPolarHBondContact O-CB 3.36Å; V141-R145 VanDerWaalsContact O-CG 3.24Å; V141-R145 WeakPolarHBondContact O-CG 3.3Å; V141-R145 PolarHBondContact O-N 3.28Å; V141-L245 HydrophobicContact CB-CD2 4.39Å; V141-L245 HydrophobicContact CG2-CD2 3.19Å; V141-L248 HydrophobicContact CG1-CB 4.39Å; V141-L248 HydrophobicContact CG2-CB 4.27Å; V141-L248 HydrophobicContact CG2-CD1 3.85Å; V141-L249 HydrophobicContact CG1-CD2 4.39Å
142	E	73	Confident	70.1	Confident	113 Å²	113	76.9 Å²	76.9	53%	0.528	39%	0.387	S	S	.	.	H	α-helix	trans	-61.3	-45.7	178.4	-68.2	174.2	174.9	0	0	111.5	Q138 T139 L140 V144 R145 D146	Q138-E142 PolarHBondContact O-N 3.48Å; Q138-E142 VanDerWaalsContact O-N 3.17Å; T139-E142 PolarHBondContact O-N 2.93Å; L140-E142 VanDerWaalsContact C-N 3.31Å; L140-E142 PolarHBondContact O-N 3.38Å; E142-V144 PolarHBondContact O-N 3.05Å; E142-R145 WeakPolarHBondContact O-CB 3.38Å; E142-R145 PolarHBondContact O-N 3.39Å; E142-D146 PolarHBondContact O-N 2.85Å
143	N	73.9	Confident	70.4	Confident	57 Å²	57	76.2 Å²	76.2	31%	0.305	38%	0.384	S	S	.	.	H	α-helix	trans	-64.9	-38	179.8	-69.2	-19.5	0	0	0	113.5	T139 L140 R145 S148 I149	T139-N143 WeakPolarHBondContact O-CB 3.32Å; T139-N143 PolarHBondContact O-N 2.75Å; T139-N143 PolarHBondContact O-ND2 3.1Å; L140-N143 PolarHBondContact O-N 3.02Å; N143-R145 VanDerWaalsContact C-N 3.33Å; N143-S148 VanDerWaalsContact C-OG 3.32Å; N143-S148 VanDerWaalsContact CA-OG 3.28Å; N143-S148 WeakPolarHBondContact CA-OG 3.45Å; N143-S148 WeakPolarHBondContact CB-OG 3.37Å; N143-S148 PolarHBondContact O-N 3.41Å; N143-S148 PolarHBondContact O-OG 2.94Å; N143-I149 HydrophobicContact CB-CD1 3.7Å; N143-I149 HydrophobicContact CB-CG1 4.1Å
144	V	66.7	Low	70.8	Confident	29 Å²	29	75.9 Å²	75.9	18%	0.176	38%	0.382	C	S	.	.	H	α-helix	trans	-67.7	-37.6	175.2	173.7	0	0	0	0	110.6	L140 V141 E142 E147 V154 L249	L140-V144 VanDerWaalsContact O-CG2 3.26Å; L140-V144 WeakPolarHBondContact O-CG2 3.46Å; L140-V144 PolarHBondContact O-N 3.3Å; V141-V144 PolarHBondContact O-N 2.87Å; E142-V144 PolarHBondContact O-N 3.05Å; V144-E147 PolarHBondContact O-N 3.25Å; V144-V154 HydrophobicContact CG2-CG2 3.23Å; V144-L249 HydrophobicContact CG1-CD1 4.23Å; V144-L249 HydrophobicContact CG1-CD2 4.39Å
145	R	65.6	Low	71.3	Confident	109 Å²	109	77.6 Å²	77.6	41%	0.411	38%	0.383	S	S	.	.	H	α-helix	trans	-65.8	-40.6	175.6	-75.6	172.8	175.8	-164.7	-1.7	112.5	V141 E142 N143 E147 L248 L249 N252	V141-R145 WeakPolarHBondContact O-CB 3.36Å; V141-R145 VanDerWaalsContact O-CG 3.24Å; V141-R145 WeakPolarHBondContact O-CG 3.3Å; V141-R145 PolarHBondContact O-N 3.28Å; E142-R145 WeakPolarHBondContact O-CB 3.38Å; E142-R145 PolarHBondContact O-N 3.39Å; N143-R145 VanDerWaalsContact C-N 3.33Å; R145-E147 PolarHBondContact O-N 3.45Å; R145-E147 VanDerWaalsContact O-N 3.11Å; R145-L248 PolarHBondContact NH2-O 3.04Å; R145-L249 HydrophobicContact CG-CD2 3.78Å; R145-N252 PolarHBondContact NH1-ND2 2.73Å; R145-N252 PolarHBondContact NH2-ND2 3.08Å
146	D	75.2	Confident	71.6	Confident	127 Å²	127	76.4 Å²	76.4	68%	0.679	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	8.3	177.3	-70.9	-16.5	0	0	0	112.9	E142 S148	E142-D146 PolarHBondContact O-N 2.85Å; D146-S148 PolarHBondContact O-N 2.72Å
147	E	73.2	Confident	71.9	Confident	182 Å²	182	75.4 Å²	75.4	85%	0.85	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	20.2	-174.4	-60.8	-177.6	172.1	0	0	113.2	V144 R145 I149	V144-E147 PolarHBondContact O-N 3.25Å; R145-E147 PolarHBondContact O-N 3.45Å; R145-E147 VanDerWaalsContact O-N 3.11Å; E147-I149 VanDerWaalsContact C-N 3.31Å
148	S	75.4	Confident	72.1	Confident	72 Å²	72	74.8 Å²	74.8	50%	0.503	38%	0.383	S	S	.	.	S	Bend	trans	-77.7	-21.4	-176.8	68.8	0	0	0	0	112.5	N143 D146	N143-S148 VanDerWaalsContact C-OG 3.32Å; N143-S148 VanDerWaalsContact CA-OG 3.28Å; N143-S148 WeakPolarHBondContact CA-OG 3.45Å; N143-S148 WeakPolarHBondContact CB-OG 3.37Å; N143-S148 PolarHBondContact O-N 3.41Å; N143-S148 PolarHBondContact O-OG 2.94Å; D146-S148 PolarHBondContact O-N 2.72Å
149	I	73.6	Confident	72.3	Confident	40 Å²	40	74.5 Å²	74.5	21%	0.205	38%	0.377	C	S	.	.	S	Bend	trans	-137.1	137.4	-179.8	-57.9	179.1	0	0	0	108.6	N143 E147 E153 V154	N143-I149 HydrophobicContact CB-CD1 3.7Å; N143-I149 HydrophobicContact CB-CG1 4.1Å; E147-I149 VanDerWaalsContact C-N 3.31Å; I149-E153 HydrophobicContact CG2-CB 3.53Å; I149-V154 HydrophobicContact CG2-CG2 4.13Å
150	S	74.3	Confident	72.3	Confident	56 Å²	56	75.3 Å²	75.3	39%	0.392	38%	0.379	S	S	.	.			trans	-79.4	153.4	175.5	65.2	0	0	0	0	112.2	D152 E153 V154	S150-D152 PolarHBondContact O-N 2.86Å; S150-D152 VanDerWaalsContact O-N 3.16Å; S150-E153 PolarHBondContact N-OE2 3.3Å; S150-E153 WeakPolarHBondContact O-CA 3.26Å; S150-E153 WeakPolarHBondContact O-CB 3.36Å; S150-E153 PolarHBondContact O-N 2.89Å; S150-E153 VanDerWaalsContact OG-CG 3.27Å; S150-E153 WeakPolarHBondContact OG-CG 3.29Å; S150-E153 PolarHBondContact OG-OE2 3.29Å; S150-V154 WeakPolarHBondContact O-CG2 3.49Å; S150-V154 PolarHBondContact O-N 2.99Å
151	L	69.3	Low	72.2	Confident	97 Å²	97	75.1 Å²	75.1	51%	0.508	38%	0.378	S	S	.	.	H	α-helix	trans	-60.9	-28.2	-179.4	-152.3	125.9	0	0	0	112.9	E153 V154	L151-E153 VanDerWaalsContact C-N 3.35Å; L151-V154 PolarHBondContact O-N 2.83Å
152	D	69.9	Low	71.8	Confident	112 Å²	112	74.6 Å²	74.6	60%	0.599	38%	0.375	S	S	*	.	H	α-helix	trans	-72.4	-27.6	174.6	-71.5	-31	0	0	0	112.8	S150 R155 P156	S150-D152 PolarHBondContact O-N 2.86Å; S150-D152 VanDerWaalsContact O-N 3.16Å; D152-R155 IonicContact OD1-CZ 2.79Å; D152-R155 IonicContact OD1-NE 2.85Å; D152-R155 IonicContact OD1-NH2 2.67Å; D152-R155 PolarHBondContact OD1-NH2 3.34Å; D152-P156 WeakPolarHBondContact O-CD 3.43Å
153	E	75.3	Confident	71.4	Confident	106 Å²	106	73 Å²	73	50%	0.495	37%	0.367	S	S	.	.	H	α-helix	trans	-78.9	-21.7	172.8	-71.8	164.9	157.3	0	0	112.6	I149 S150 L151 P156 I157	I149-E153 HydrophobicContact CG2-CB 3.53Å; S150-E153 PolarHBondContact N-OE2 3.3Å; S150-E153 WeakPolarHBondContact O-CA 3.26Å; S150-E153 WeakPolarHBondContact O-CB 3.36Å; S150-E153 PolarHBondContact O-N 2.89Å; S150-E153 VanDerWaalsContact OG-CG 3.27Å; S150-E153 WeakPolarHBondContact OG-CG 3.29Å; S150-E153 PolarHBondContact OG-OE2 3.29Å; L151-E153 VanDerWaalsContact C-N 3.35Å; E153-P156 VanDerWaalsContact O-CD 3.31Å; E153-P156 WeakPolarHBondContact O-CD 3.37Å; E153-P156 VanDerWaalsContact O-CG 3.28Å; E153-P156 WeakPolarHBondContact O-CG 3.39Å; E153-I157 WeakPolarHBondContact O-CD1 3.4Å; E153-I157 WeakPolarHBondContact O-CG1 3.41Å
154	V	72.4	Confident	71.1	Confident	7 Å²	7	73.6 Å²	73.6	4%	0.042	37%	0.368	C	S	.	.	H	α-helix	trans	-70.3	-41.6	177.3	173	0	0	0	0	111.9	L140 V144 I149 S150 L151 I157 L158 L245	L140-V154 HydrophobicContact CD2-CG1 4.25Å; L140-V154 HydrophobicContact CD2-CG2 4.28Å; V144-V154 HydrophobicContact CG2-CG2 3.23Å; I149-V154 HydrophobicContact CG2-CG2 4.13Å; S150-V154 WeakPolarHBondContact O-CG2 3.49Å; S150-V154 PolarHBondContact O-N 2.99Å; L151-V154 PolarHBondContact O-N 2.83Å; V154-I157 WeakPolarHBondContact O-CA 3.36Å; V154-I157 WeakPolarHBondContact O-CB 3.44Å; V154-I157 PolarHBondContact O-N 2.72Å; V154-L158 HydrophobicContact CG1-CD1 3.87Å; V154-L158 HydrophobicContact CG1-CG 3.92Å; V154-L158 PolarHBondContact O-N 2.87Å; V154-L245 HydrophobicContact CG1-CD1 3.8Å
155	R	71.3	Confident	70.8	Confident	123 Å²	123	74.5 Å²	74.5	46%	0.464	37%	0.371	S	S	.	.	H	α-helix	trans	-53.5	-48.9	-177.2	-71.1	-165.4	-113.1	-164.7	-2.3	114.6	D152 I157 L158 R159 E242	D152-R155 IonicContact OD1-CZ 2.79Å; D152-R155 IonicContact OD1-NE 2.85Å; D152-R155 IonicContact OD1-NH2 2.67Å; D152-R155 PolarHBondContact OD1-NH2 3.34Å; R155-I157 VanDerWaalsContact C-N 3.25Å; R155-I157 PolarHBondContact O-N 3.03Å; R155-L158 PolarHBondContact O-N 2.97Å; R155-R159 PolarHBondContact O-N 2.9Å; R155-E242 WeakPolarHBondContact CG-OE1 3.31Å
156	P	76	Confident	70.3	Confident	81 Å²	81	69.9 Å²	69.9	53%	0.526	36%	0.355	S	S	.	.	H	α-helix	trans	-64.7	-30.4	175.8	24.5	-33.6	0	0	0	112.6	D152 E153 N160	D152-P156 WeakPolarHBondContact O-CD 3.43Å; E153-P156 VanDerWaalsContact O-CD 3.31Å; E153-P156 WeakPolarHBondContact O-CD 3.37Å; E153-P156 VanDerWaalsContact O-CG 3.28Å; E153-P156 WeakPolarHBondContact O-CG 3.39Å; P156-N160 PolarHBondContact O-N 3.44Å; P156-N160 VanDerWaalsContact O-N 3.08Å
157	I	76	Confident	69.5	Low	64 Å²	64	68 Å²	68	33%	0.328	34%	0.342	S	S	.	.	H	α-helix	trans	-71.7	-44.4	178.2	-54.3	168.8	0	0	0	110.5	L140 E153 V154 R155 R159 N160 I161	L140-I157 HydrophobicContact CD1-CB 4.34Å; L140-I157 HydrophobicContact CD1-CG2 3.64Å; L140-I157 HydrophobicContact CD2-CB 4.19Å; L140-I157 HydrophobicContact CD2-CD1 3.88Å; L140-I157 HydrophobicContact CD2-CG2 4.07Å; L140-I157 HydrophobicContact CG-CG2 4.3Å; E153-I157 WeakPolarHBondContact O-CD1 3.4Å; E153-I157 WeakPolarHBondContact O-CG1 3.41Å; V154-I157 WeakPolarHBondContact O-CA 3.36Å; V154-I157 WeakPolarHBondContact O-CB 3.44Å; V154-I157 PolarHBondContact O-N 2.72Å; R155-I157 VanDerWaalsContact C-N 3.25Å; R155-I157 PolarHBondContact O-N 3.03Å; I157-R159 VanDerWaalsContact C-N 3.29Å; I157-R159 PolarHBondContact O-N 2.7Å; I157-N160 WeakPolarHBondContact O-CB 3.46Å; I157-N160 PolarHBondContact O-N 3.32Å; I157-N160 VanDerWaalsContact O-N 3.1Å; I157-I161 HydrophobicContact CG2-CD1 4.23Å; I157-I161 WeakPolarHBondContact O-CG1 3.45Å; I157-I161 PolarHBondContact O-N 3.24Å
158	L	68.6	Low	68.7	Low	1 Å²	1	61.1 Å²	61.1	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-58.9	-41.4	173.3	-76.1	176.2	0	0	0	112.4	V154 R155 N160 I161 S162 L241 E242 L245	V154-L158 HydrophobicContact CG1-CD1 3.87Å; V154-L158 HydrophobicContact CG1-CG 3.92Å; V154-L158 PolarHBondContact O-N 2.87Å; R155-L158 PolarHBondContact O-N 2.97Å; L158-N160 VanDerWaalsContact C-N 3.29Å; L158-N160 PolarHBondContact O-N 3.31Å; L158-I161 PolarHBondContact O-N 3.3Å; L158-S162 WeakPolarHBondContact O-CB 3.45Å; L158-S162 PolarHBondContact O-N 3.49Å; L158-S162 PolarHBondContact O-OG 2.84Å; L158-L241 HydrophobicContact CD2-CB 3.86Å; L158-L241 HydrophobicContact CD2-CD1 4.28Å; L158-E242 HydrophobicContact CD1-CB 4.42Å; L158-E242 HydrophobicContact CD1-CG 3.47Å; L158-E242 VanDerWaalsContact CD1-CG 3.47Å; L158-L245 HydrophobicContact CD1-CD1 3.36Å; L158-L245 HydrophobicContact CD2-CD1 3.55Å; L158-L245 HydrophobicContact CD2-CG 4.42Å; L158-L245 HydrophobicContact CG-CD1 3.78Å
159	R	71.9	Confident	67.6	Low	107 Å²	107	62.5 Å²	62.5	40%	0.404	33%	0.325	S	S	.	.	H	α-helix	trans	-61.4	-39	175	-172	179.9	-176.3	129.2	16.5	111.7	R155 I157 S162 Q163 T234 D235	R155-R159 PolarHBondContact O-N 2.9Å; I157-R159 VanDerWaalsContact C-N 3.29Å; I157-R159 PolarHBondContact O-N 2.7Å; R159-S162 WeakPolarHBondContact CA-OG 3.27Å; R159-S162 PolarHBondContact O-OG 3.48Å; R159-Q163 VanDerWaalsContact O-CG 3.28Å; R159-Q163 WeakPolarHBondContact O-CG 3.28Å; R159-Q163 PolarHBondContact O-N 2.79Å; R159-T234 HydrophobicContact CG-CG2 4.42Å; R159-D235 IonicContact CZ-OD1 3.71Å; R159-D235 IonicContact NH1-OD1 2.86Å; R159-D235 IonicContact NH2-OD1 3.78Å; R159-D235 PolarHBondContact NH2-OD1 3.18Å
160	N	76.4	Confident	66.5	Low	80 Å²	80	62.7 Å²	62.7	43%	0.428	33%	0.326	S	S	.	.	H	α-helix	trans	-66.6	-42.6	175.7	-168.2	25.6	0	0	0	111.3	P156 I157 L158 S162 Q163 E164	P156-N160 PolarHBondContact O-N 3.44Å; P156-N160 VanDerWaalsContact O-N 3.08Å; I157-N160 WeakPolarHBondContact O-CB 3.46Å; I157-N160 PolarHBondContact O-N 3.32Å; I157-N160 VanDerWaalsContact O-N 3.1Å; L158-N160 VanDerWaalsContact C-N 3.29Å; L158-N160 PolarHBondContact O-N 3.31Å; N160-S162 PolarHBondContact O-N 3.26Å; N160-Q163 WeakPolarHBondContact O-CB 3.21Å; N160-Q163 PolarHBondContact O-N 3.5Å; N160-E164 PolarHBondContact O-N 2.93Å
161	I	69.1	Low	65.4	Low	3 Å²	3	65 Å²	65	2%	0.015	33%	0.331	C	S	.	.	H	α-helix	trans	-62.5	-43	176.2	-67.9	171.8	0	0	0	111.3	P133 R136 I137 L140 I157 L158 Q163 E164 M165 L241	P133-I161 HydrophobicContact CB-CG2 4.02Å; R136-I161 HydrophobicContact CB-CD1 4.06Å; I137-I161 HydrophobicContact CD1-CG2 3.97Å; I137-I161 HydrophobicContact CG1-CD1 3.99Å; I137-I161 HydrophobicContact CG1-CG2 4.03Å; L140-I161 HydrophobicContact CD1-CD1 3.45Å; L140-I161 VanDerWaalsContact CD1-CD1 3.45Å; I157-I161 HydrophobicContact CG2-CD1 4.23Å; I157-I161 WeakPolarHBondContact O-CG1 3.45Å; I157-I161 PolarHBondContact O-N 3.24Å; L158-I161 PolarHBondContact O-N 3.3Å; I161-Q163 VanDerWaalsContact C-N 3.33Å; I161-Q163 PolarHBondContact O-N 2.84Å; I161-E164 PolarHBondContact O-N 2.97Å; I161-M165 HydrophobicContact CG2-CG 4.42Å; I161-M165 HydrophobicContact CG2-SD 4.17Å; I161-M165 WeakPolarHBondContact O-CG 3.33Å; I161-M165 PolarHBondContact O-N 3.06Å; I161-L241 HydrophobicContact CG2-CD1 4.16Å
162	S	61.2	Low	64.4	Low	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65.6	-37.5	178.1	64.8	0	0	0	0	111.8	L158 R159 N160 M165 V166 T234 S238	L158-S162 WeakPolarHBondContact O-CB 3.45Å; L158-S162 PolarHBondContact O-N 3.49Å; L158-S162 PolarHBondContact O-OG 2.84Å; R159-S162 WeakPolarHBondContact CA-OG 3.27Å; R159-S162 PolarHBondContact O-OG 3.48Å; N160-S162 PolarHBondContact O-N 3.26Å; S162-M165 PolarHBondContact O-N 3.22Å; S162-V166 WeakPolarHBondContact O-CB 3.32Å; S162-V166 VanDerWaalsContact O-CG2 3.29Å; S162-V166 WeakPolarHBondContact O-CG2 3.5Å; S162-V166 PolarHBondContact O-N 2.79Å; S162-T234 VanDerWaalsContact OG-CG2 3.27Å; S162-T234 WeakPolarHBondContact OG-CG2 3.3Å; S162-T234 PolarHBondContact OG-O 3.34Å; S162-S238 WeakPolarHBondContact CB-OG 3.3Å; S162-S238 PolarHBondContact OG-OG 3.27Å
163	Q	65	Low	63.2	Low	81 Å²	81	58.2 Å²	58.2	38%	0.379	30%	0.304	S	S	.	.	H	α-helix	trans	-60.4	-47.7	171.4	-74.6	178.1	-26	0	0	111.7	R159 N160 I161 M165 V166 Q167 T234	R159-Q163 VanDerWaalsContact O-CG 3.28Å; R159-Q163 WeakPolarHBondContact O-CG 3.28Å; R159-Q163 PolarHBondContact O-N 2.79Å; N160-Q163 WeakPolarHBondContact O-CB 3.21Å; N160-Q163 PolarHBondContact O-N 3.5Å; I161-Q163 VanDerWaalsContact C-N 3.33Å; I161-Q163 PolarHBondContact O-N 2.84Å; Q163-M165 VanDerWaalsContact C-N 3.34Å; Q163-M165 PolarHBondContact O-N 3.42Å; Q163-V166 PolarHBondContact O-N 3.13Å; Q163-Q167 VanDerWaalsContact O-CB 3.27Å; Q163-Q167 WeakPolarHBondContact O-CB 3.47Å; Q163-Q167 PolarHBondContact O-N 3.02Å; Q163-T234 HydrophobicContact CB-CG2 4.43Å; Q163-T234 HydrophobicContact CG-CG2 3.4Å; Q163-T234 VanDerWaalsContact CG-CG2 3.4Å
164	E	66.2	Low	61.7	Low	69 Å²	69	58.6 Å²	58.6	32%	0.322	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-41.8	175.7	-72.7	-180	174.1	0	0	112	R136 N160 I161 Q167 G168	R136-E164 IonicContact CZ-OE1 3.57Å; R136-E164 IonicContact CZ-OE2 3.94Å; R136-E164 IonicContact NH1-OE1 2.75Å; R136-E164 PolarHBondContact NH1-OE1 3.01Å; R136-E164 IonicContact NH1-OE2 3.74Å; R136-E164 PolarHBondContact NH1-OE2 2.91Å; N160-E164 PolarHBondContact O-N 2.93Å; I161-E164 PolarHBondContact O-N 2.97Å; E164-Q167 PolarHBondContact O-N 3.11Å; E164-G168 PolarHBondContact O-N 3.22Å
165	M	60.4	Low	60.2	Low	48 Å²	48	63.4 Å²	63.4	24%	0.236	33%	0.327	C	S	.	.	H	α-helix	trans	-65.7	-44	177.9	-72.1	-178.3	75.7	0	0	112	P133 I161 S162 Q163 G168 V169 L241	P133-M165 HydrophobicContact CB-CG 3.77Å; P133-M165 HydrophobicContact CB-SD 4.22Å; P133-M165 HydrophobicContact CG-CG 4.1Å; I161-M165 HydrophobicContact CG2-CG 4.42Å; I161-M165 HydrophobicContact CG2-SD 4.17Å; I161-M165 WeakPolarHBondContact O-CG 3.33Å; I161-M165 PolarHBondContact O-N 3.06Å; S162-M165 PolarHBondContact O-N 3.22Å; Q163-M165 VanDerWaalsContact C-N 3.34Å; Q163-M165 PolarHBondContact O-N 3.42Å; M165-G168 PolarHBondContact O-N 3.17Å; M165-V169 VanDerWaalsContact O-CG2 3.3Å; M165-V169 WeakPolarHBondContact O-CG2 3.42Å; M165-V169 PolarHBondContact O-N 2.94Å; M165-L241 HydrophobicContact SD-CD1 4.46Å
166	V	55.3	Low	58.7	Low	12 Å²	12	64.9 Å²	64.9	7%	0.073	34%	0.337	C	S	.	.	H	α-helix	trans	-63.2	-44.7	175.8	170	0	0	0	0	110.2	S162 Q163 V169 I170 L230 L233 V237	S162-V166 WeakPolarHBondContact O-CB 3.32Å; S162-V166 VanDerWaalsContact O-CG2 3.29Å; S162-V166 WeakPolarHBondContact O-CG2 3.5Å; S162-V166 PolarHBondContact O-N 2.79Å; Q163-V166 PolarHBondContact O-N 3.13Å; V166-V169 PolarHBondContact O-N 3.39Å; V166-I170 HydrophobicContact CG1-CD1 3.9Å; V166-I170 VanDerWaalsContact O-CG1 3.3Å; V166-I170 WeakPolarHBondContact O-CG1 3.4Å; V166-I170 PolarHBondContact O-N 3.14Å; V166-L230 HydrophobicContact CG1-CD2 4.04Å; V166-L233 HydrophobicContact CG1-CD2 3.96Å; V166-L233 HydrophobicContact CG2-CD2 4.07Å; V166-L233 HydrophobicContact CG2-CG 4.02Å; V166-V237 HydrophobicContact CG2-CG2 4.33Å
167	Q	58	Low	56.7	Low	88 Å²	88	63.7 Å²	63.7	41%	0.411	33%	0.331	S	S	.	.	H	α-helix	trans	-62.5	-44.4	177.4	-175.2	62	19.3	0	0	111.6	Q163 E164 V169 I170 E171	Q163-Q167 VanDerWaalsContact O-CB 3.27Å; Q163-Q167 WeakPolarHBondContact O-CB 3.47Å; Q163-Q167 PolarHBondContact O-N 3.02Å; E164-Q167 PolarHBondContact O-N 3.11Å; Q167-V169 VanDerWaalsContact C-N 3.29Å; Q167-V169 PolarHBondContact O-N 3.42Å; Q167-I170 CarbonylContact O-C 3.51Å; Q167-I170 WeakPolarHBondContact O-CA 3.44Å; Q167-I170 WeakPolarHBondContact O-CB 2.93Å; Q167-I170 PolarHBondContact O-N 2.84Å; Q167-E171 HydrophobicContact CG-CG 4.39Å; Q167-E171 WeakPolarHBondContact CG-OE1 3.49Å; Q167-E171 PolarHBondContact NE2-OE1 2.76Å; Q167-E171 PolarHBondContact O-N 2.87Å
168	G	56.5	Low	55	Low	36 Å²	36	64 Å²	64	37%	0.371	34%	0.339	S	S	.	.	H	α-helix	trans	-62.9	-34	176	0	0	0	0	0	113	E164 M165 G172	E164-G168 PolarHBondContact O-N 3.22Å; M165-G168 PolarHBondContact O-N 3.17Å; G168-G172 PolarHBondContact O-N 3.28Å
169	V	52.8	Low	53.7	Low	102 Å²	102	69.1 Å²	69.1	62%	0.618	36%	0.361	S	S	*	.	H	α-helix	trans	-66.9	-39.6	171.3	170	0	0	0	0	111.2	M165 V166 Q167 S173	M165-V169 VanDerWaalsContact O-CG2 3.3Å; M165-V169 WeakPolarHBondContact O-CG2 3.42Å; M165-V169 PolarHBondContact O-N 2.94Å; V166-V169 PolarHBondContact O-N 3.39Å; Q167-V169 VanDerWaalsContact C-N 3.29Å; Q167-V169 PolarHBondContact O-N 3.42Å; V169-S173 VanDerWaalsContact O-CB 3.27Å; V169-S173 WeakPolarHBondContact O-CB 3.32Å; V169-S173 PolarHBondContact O-N 3Å
170	I	50	Low	51.7	Low	43 Å²	43	68.3 Å²	68.3	22%	0.221	36%	0.361	C	S	.	.	H	α-helix	trans	-66.9	-54.4	177.3	-66.3	163.6	0	0	0	110.4	V166 Q167 G172 S173 E174 L230	V166-I170 HydrophobicContact CG1-CD1 3.9Å; V166-I170 VanDerWaalsContact O-CG1 3.3Å; V166-I170 WeakPolarHBondContact O-CG1 3.4Å; V166-I170 PolarHBondContact O-N 3.14Å; Q167-I170 CarbonylContact O-C 3.51Å; Q167-I170 WeakPolarHBondContact O-CA 3.44Å; Q167-I170 WeakPolarHBondContact O-CB 2.93Å; Q167-I170 PolarHBondContact O-N 2.84Å; I170-G172 VanDerWaalsContact C-N 3.34Å; I170-G172 PolarHBondContact O-N 3.38Å; I170-S173 CarbonylContact O-C 3.58Å; I170-S173 WeakPolarHBondContact O-CA 3.22Å; I170-S173 WeakPolarHBondContact O-CB 3.44Å; I170-S173 PolarHBondContact O-N 3.48Å; I170-S173 PolarHBondContact O-OG 2.96Å; I170-E174 PolarHBondContact O-N 3.21Å; I170-L230 HydrophobicContact CD1-CD1 4.5Å; I170-L230 HydrophobicContact CD1-CD2 3.52Å
171	E	52	Low	50.1	Low	106 Å²	106	69.6 Å²	69.6	50%	0.495	37%	0.367	S	S	.	.	H	α-helix	trans	-59.7	-44.6	179.2	-72.3	176.6	-171.8	0	0	111.3	Q167 S173 E174 E175	Q167-E171 HydrophobicContact CG-CG 4.39Å; Q167-E171 WeakPolarHBondContact CG-OE1 3.49Å; Q167-E171 PolarHBondContact NE2-OE1 2.76Å; Q167-E171 PolarHBondContact O-N 2.87Å; E171-S173 PolarHBondContact O-N 3.24Å; E171-E174 PolarHBondContact O-N 3.23Å; E171-E175 PolarHBondContact O-N 3.5Å
172	G	48.2	Very low	49	Very low	26 Å²	26	74.7 Å²	74.7	27%	0.268	39%	0.391	S	S	.	.	H	α-helix	trans	-63.3	-26.4	174.2	0	0	0	0	0	113	G168 I170 K176	G168-G172 PolarHBondContact O-N 3.28Å; I170-G172 VanDerWaalsContact C-N 3.34Å; I170-G172 PolarHBondContact O-N 3.38Å; G172-K176 WeakPolarHBondContact O-CB 3.33Å; G172-K176 WeakPolarHBondContact O-CD 3.2Å; G172-K176 WeakPolarHBondContact O-CG 3.44Å; G172-K176 PolarHBondContact O-N 3.12Å
173	S	43.6	Very low	48.2	Very low	40 Å²	40	78.7 Å²	78.7	28%	0.28	41%	0.411	S	S	.	.	H	α-helix	trans	-78.2	-33.7	172	81.7	0	0	0	0	112.7	V169 I170 E171 S177	V169-S173 VanDerWaalsContact O-CB 3.27Å; V169-S173 WeakPolarHBondContact O-CB 3.32Å; V169-S173 PolarHBondContact O-N 3Å; I170-S173 CarbonylContact O-C 3.58Å; I170-S173 WeakPolarHBondContact O-CA 3.22Å; I170-S173 WeakPolarHBondContact O-CB 3.44Å; I170-S173 PolarHBondContact O-N 3.48Å; I170-S173 PolarHBondContact O-OG 2.96Å; E171-S173 PolarHBondContact O-N 3.24Å; S173-S177 VanDerWaalsContact O-CB 3.28Å; S173-S177 WeakPolarHBondContact O-CB 3.5Å; S173-S177 PolarHBondContact O-N 3.4Å; S173-S177 PolarHBondContact O-OG 3.49Å
174	E	44.4	Very low	46.9	Very low	113 Å²	113	77.6 Å²	77.6	53%	0.528	41%	0.407	S	S	.	.	H	α-helix	trans	-71.2	-38.5	175.1	-71.5	-175.5	174.5	0	0	111.9	I170 E171 S177 S178	I170-E174 PolarHBondContact O-N 3.21Å; E171-E174 PolarHBondContact O-N 3.23Å; E174-S177 WeakPolarHBondContact CA-OG 3.3Å; E174-S177 PolarHBondContact O-N 2.9Å; E174-S177 PolarHBondContact O-OG 2.9Å; E174-S178 VanDerWaalsContact O-CB 3.3Å; E174-S178 WeakPolarHBondContact O-CB 3.45Å; E174-S178 PolarHBondContact O-N 2.83Å; E174-S178 PolarHBondContact O-OG 2.97Å
175	E	40.8	Very low	46	Very low	108 Å²	108	80.1 Å²	80.1	51%	0.505	42%	0.419	S	S	.	.	H	α-helix	trans	-65.2	-43.2	173.5	-164.8	-164.8	160.6	0	0	110.6	E171 S178 K179	E171-E175 PolarHBondContact O-N 3.5Å; E175-S178 PolarHBondContact O-N 3.39Å; E175-K179 WeakPolarHBondContact O-CG 3.45Å; E175-K179 PolarHBondContact O-N 2.88Å; E175-K179 VanDerWaalsContact OE1-CE 3.3Å; E175-K179 WeakPolarHBondContact OE1-CE 3.42Å; E175-K179 IonicContact OE1-NZ 2.68Å; E175-K179 PolarHBondContact OE1-NZ 3.04Å
176	K	39.2	Very low	45.4	Very low	155 Å²	155	83 Å²	83	67%	0.674	43%	0.432	S	S	*	.	H	α-helix	trans	-66.5	-38.8	176	-75.2	175.4	-175.9	179.1	0	112.1	G172 F180	G172-K176 WeakPolarHBondContact O-CB 3.33Å; G172-K176 WeakPolarHBondContact O-CD 3.2Å; G172-K176 WeakPolarHBondContact O-CG 3.44Å; G172-K176 PolarHBondContact O-N 3.12Å; K176-F180 VanDerWaalsContact O-CB 3.28Å; K176-F180 WeakPolarHBondContact O-CB 3.39Å; K176-F180 PolarHBondContact O-N 3.43Å
177	S	35.6	Very low	45	Very low	56 Å²	56	86.9 Å²	86.9	39%	0.392	45%	0.452	S	S	.	.	H	α-helix	trans	-68.5	-37.3	176.3	73.8	0	0	0	0	111.4	S173 E174 F180 L181	S173-S177 VanDerWaalsContact O-CB 3.28Å; S173-S177 WeakPolarHBondContact O-CB 3.5Å; S173-S177 PolarHBondContact O-N 3.4Å; S173-S177 PolarHBondContact O-OG 3.49Å; E174-S177 WeakPolarHBondContact CA-OG 3.3Å; E174-S177 PolarHBondContact O-N 2.9Å; E174-S177 PolarHBondContact O-OG 2.9Å; S177-F180 PolarHBondContact O-N 3.18Å; S177-L181 WeakPolarHBondContact O-CB 3.37Å; S177-L181 WeakPolarHBondContact O-CG 3.43Å; S177-L181 PolarHBondContact O-N 3.29Å
178	S	39.9	Very low	44.2	Very low	70 Å²	70	88.2 Å²	88.2	49%	0.49	46%	0.458	S	S	.	.	H	α-helix	trans	-65.6	-46.6	175.3	-59.4	0	0	0	0	111.3	E174 E175 F180 L181 E182	E174-S178 VanDerWaalsContact O-CB 3.3Å; E174-S178 WeakPolarHBondContact O-CB 3.45Å; E174-S178 PolarHBondContact O-N 2.83Å; E174-S178 PolarHBondContact O-OG 2.97Å; E175-S178 PolarHBondContact O-N 3.39Å; S178-F180 VanDerWaalsContact C-N 3.26Å; S178-F180 PolarHBondContact O-N 3.37Å; S178-L181 PolarHBondContact O-N 3.25Å; S178-E182 WeakPolarHBondContact O-CB 3.35Å; S178-E182 PolarHBondContact O-N 2.96Å
179	K	41.6	Very low	43.5	Very low	108 Å²	108	92.9 Å²	92.9	47%	0.47	47%	0.471	S	S	.	.	H	α-helix	trans	-59.9	-37.3	172.4	-75.6	177.4	-173.9	165.1	0	111.9	E175 E182 I183	E175-K179 WeakPolarHBondContact O-CG 3.45Å; E175-K179 PolarHBondContact O-N 2.88Å; E175-K179 VanDerWaalsContact OE1-CE 3.3Å; E175-K179 WeakPolarHBondContact OE1-CE 3.42Å; E175-K179 IonicContact OE1-NZ 2.68Å; E175-K179 PolarHBondContact OE1-NZ 3.04Å; K179-E182 PolarHBondContact O-N 2.83Å; K179-I183 WeakPolarHBondContact O-CD1 3.28Å; K179-I183 WeakPolarHBondContact O-CG1 3.31Å; K179-I183 PolarHBondContact O-N 3.11Å
180	F	30.4	Very low	42.8	Very low	91 Å²	91	92.7 Å²	92.7	40%	0.399	47%	0.469	S	S	.	.	H	α-helix	trans	-70.2	-40.9	177.2	-177.4	-110.5	0	0	0	112.6	K176 S177 S178 E182 I183 I184	K176-F180 VanDerWaalsContact O-CB 3.28Å; K176-F180 WeakPolarHBondContact O-CB 3.39Å; K176-F180 PolarHBondContact O-N 3.43Å; S177-F180 PolarHBondContact O-N 3.18Å; S178-F180 VanDerWaalsContact C-N 3.26Å; S178-F180 PolarHBondContact O-N 3.37Å; F180-E182 VanDerWaalsContact C-N 3.3Å; F180-E182 PolarHBondContact O-N 2.91Å; F180-I183 PolarHBondContact O-N 2.7Å; F180-I184 HydrophobicContact CD1-CD1 3.69Å; F180-I184 HydrophobicContact CD1-CG1 4.39Å; F180-I184 HydrophobicContact CE1-CD1 3.22Å; F180-I184 HydrophobicContact CE1-CG1 4.1Å; F180-I184 HydrophobicContact CE2-CD1 4.38Å; F180-I184 HydrophobicContact CE2-CG1 4.46Å; F180-I184 HydrophobicContact CG-CD1 4.47Å; F180-I184 HydrophobicContact CZ-CD1 3.61Å; F180-I184 HydrophobicContact CZ-CG1 4.13Å; F180-I184 WeakPolarHBondContact O-CG1 3.31Å; F180-I184 PolarHBondContact O-N 2.91Å
181	L	41.1	Very low	42.3	Very low	106 Å²	106	94.3 Å²	94.3	56%	0.555	48%	0.482	S	S	*	.	H	α-helix	trans	-62.7	-39.5	172.6	-76	172	0	0	0	111	S177 S178 I184 E185	S177-L181 WeakPolarHBondContact O-CB 3.37Å; S177-L181 WeakPolarHBondContact O-CG 3.43Å; S177-L181 PolarHBondContact O-N 3.29Å; S178-L181 PolarHBondContact O-N 3.25Å; L181-I184 PolarHBondContact O-N 3.38Å; L181-E185 WeakPolarHBondContact O-CB 3.32Å; L181-E185 PolarHBondContact O-N 2.94Å
182	E	47.5	Very low	41.4	Very low	111 Å²	111	94 Å²	94	52%	0.519	48%	0.482	S	S	.	.	H	α-helix	trans	-61.4	-43	172.7	-169.8	-178.7	-175.9	0	0	111.3	S178 K179 F180 E185 Q186	S178-E182 WeakPolarHBondContact O-CB 3.35Å; S178-E182 PolarHBondContact O-N 2.96Å; K179-E182 PolarHBondContact O-N 2.83Å; F180-E182 VanDerWaalsContact C-N 3.3Å; F180-E182 PolarHBondContact O-N 2.91Å; E182-E185 PolarHBondContact O-N 3.04Å; E182-Q186 WeakPolarHBondContact O-CB 3.32Å; E182-Q186 VanDerWaalsContact O-CG 3.3Å; E182-Q186 WeakPolarHBondContact O-CG 3.11Å; E182-Q186 PolarHBondContact O-N 3.12Å
183	I	43.9	Very low	40.9	Very low	84 Å²	84	97.7 Å²	97.7	43%	0.431	51%	0.505	S	S	.	.	H	α-helix	trans	-64.3	-41.1	174.7	-69.4	162.8	0	0	0	111.4	K179 F180 N187	K179-I183 WeakPolarHBondContact O-CD1 3.28Å; K179-I183 WeakPolarHBondContact O-CG1 3.31Å; K179-I183 PolarHBondContact O-N 3.11Å; F180-I183 PolarHBondContact O-N 2.7Å; I183-N187 WeakPolarHBondContact CG2-ND2 3.47Å; I183-N187 VanDerWaalsContact O-CB 3.26Å; I183-N187 WeakPolarHBondContact O-CB 3.35Å; I183-N187 PolarHBondContact O-N 3.05Å; I183-N187 PolarHBondContact O-ND2 3.46Å
184	I	36.3	Very low	40.8	Very low	57 Å²	57	104 Å²	104	29%	0.292	53%	0.529	S	S	.	.	H	α-helix	trans	-64.8	-43.3	175.9	-72.1	174.9	0	0	0	110.3	F180 L181 N187 Q188	F180-I184 HydrophobicContact CD1-CD1 3.69Å; F180-I184 HydrophobicContact CD1-CG1 4.39Å; F180-I184 HydrophobicContact CE1-CD1 3.22Å; F180-I184 HydrophobicContact CE1-CG1 4.1Å; F180-I184 HydrophobicContact CE2-CD1 4.38Å; F180-I184 HydrophobicContact CE2-CG1 4.46Å; F180-I184 HydrophobicContact CG-CD1 4.47Å; F180-I184 HydrophobicContact CZ-CD1 3.61Å; F180-I184 HydrophobicContact CZ-CG1 4.13Å; F180-I184 WeakPolarHBondContact O-CG1 3.31Å; F180-I184 PolarHBondContact O-N 2.91Å; L181-I184 PolarHBondContact O-N 3.38Å; I184-N187 CarbonylContact O-C 3.41Å; I184-N187 PolarHBondContact O-N 3.45Å; I184-Q188 HydrophobicContact CG2-CG 4.23Å; I184-Q188 WeakPolarHBondContact O-CB 3.44Å; I184-Q188 WeakPolarHBondContact O-CG 3.21Å; I184-Q188 PolarHBondContact O-N 3.38Å
185	E	48.6	Very low	40.5	Very low	123 Å²	123	105.7 Å²	105.7	58%	0.575	54%	0.538	S	S	*	.	H	α-helix	trans	-68.2	-39.6	-178.6	-165	169.9	-158.2	0	0	111.2	L181 E182 Q188 Q189	L181-E185 WeakPolarHBondContact O-CB 3.32Å; L181-E185 PolarHBondContact O-N 2.94Å; E182-E185 PolarHBondContact O-N 3.04Å; E185-Q188 PolarHBondContact O-N 3.23Å; E185-Q189 WeakPolarHBondContact O-CG 3.42Å; E185-Q189 PolarHBondContact O-N 3.22Å
186	Q	48.5	Very low	40.1	Very low	107 Å²	107	108 Å²	108	50%	0.5	55%	0.548	S	S	.	.	H	α-helix	trans	-61.8	-45.9	169.7	-74.7	179.4	8.7	0	0	111.4	E182 Q188 Q189 V190	E182-Q186 WeakPolarHBondContact O-CB 3.32Å; E182-Q186 VanDerWaalsContact O-CG 3.3Å; E182-Q186 WeakPolarHBondContact O-CG 3.11Å; E182-Q186 PolarHBondContact O-N 3.12Å; Q186-Q188 PolarHBondContact O-N 3.08Å; Q186-Q189 PolarHBondContact O-N 2.66Å; Q186-V190 VanDerWaalsContact O-CG2 3.3Å; Q186-V190 WeakPolarHBondContact O-CG2 3.36Å; Q186-V190 PolarHBondContact O-N 3.04Å
187	N	45.1	Very low	39.8	Very low	94 Å²	94	109 Å²	109	50%	0.503	56%	0.558	S	S	.	*	H	α-helix	trans	-68.2	-34.9	179.2	-74.1	-26.1	0	0	0	112.5	I183 I184 V190 T191	I183-N187 WeakPolarHBondContact CG2-ND2 3.47Å; I183-N187 VanDerWaalsContact O-CB 3.26Å; I183-N187 WeakPolarHBondContact O-CB 3.35Å; I183-N187 PolarHBondContact O-N 3.05Å; I183-N187 PolarHBondContact O-ND2 3.46Å; I184-N187 CarbonylContact O-C 3.41Å; I184-N187 PolarHBondContact O-N 3.45Å; N187-V190 CarbonylContact O-C 3.58Å; N187-V190 WeakPolarHBondContact O-CB 3.34Å; N187-V190 PolarHBondContact O-N 2.93Å; N187-T191 PolarHBondContact O-N 3.39Å; N187-T191 PolarHBondContact O-OG1 3.17Å
188	Q	41.7	Very low	39.5	Very low	116 Å²	116	115.5 Å²	115.5	54%	0.542	58%	0.579	S	S	.	*	H	α-helix	trans	-70.7	-35.7	174.3	-80	-176.4	-5.7	0	0	111.9	I184 E185 Q186 V190 T191 L192	I184-Q188 HydrophobicContact CG2-CG 4.23Å; I184-Q188 WeakPolarHBondContact O-CB 3.44Å; I184-Q188 WeakPolarHBondContact O-CG 3.21Å; I184-Q188 PolarHBondContact O-N 3.38Å; E185-Q188 PolarHBondContact O-N 3.23Å; Q186-Q188 PolarHBondContact O-N 3.08Å; Q188-V190 VanDerWaalsContact C-N 3.26Å; Q188-V190 PolarHBondContact O-N 3.16Å; Q188-T191 PolarHBondContact O-N 3.4Å; Q188-L192 WeakPolarHBondContact O-CB 3.47Å; Q188-L192 VanDerWaalsContact O-CG 3.3Å; Q188-L192 WeakPolarHBondContact O-CG 3.46Å; Q188-L192 PolarHBondContact O-N 2.95Å
189	Q	41.1	Very low	39.2	Very low	134 Å²	134	117.7 Å²	117.7	63%	0.626	59%	0.594	S	S	*	*	H	α-helix	trans	-64.6	-33.3	169	-78.7	-179.9	8.1	0	0	111.9	E185 Q186 S193	E185-Q189 WeakPolarHBondContact O-CG 3.42Å; E185-Q189 PolarHBondContact O-N 3.22Å; Q186-Q189 PolarHBondContact O-N 2.66Å; Q189-S193 PolarHBondContact O-N 3.28Å
190	V	39.8	Very low	38.7	Very low	98 Å²	98	119.9 Å²	119.9	59%	0.594	61%	0.611	S	S	*	*	H	α-helix	trans	-69	-35.9	172.9	174.2	0	0	0	0	111.4	Q186 N187 Q188	Q186-V190 VanDerWaalsContact O-CG2 3.3Å; Q186-V190 WeakPolarHBondContact O-CG2 3.36Å; Q186-V190 PolarHBondContact O-N 3.04Å; N187-V190 CarbonylContact O-C 3.58Å; N187-V190 WeakPolarHBondContact O-CB 3.34Å; N187-V190 PolarHBondContact O-N 2.93Å; Q188-V190 VanDerWaalsContact C-N 3.26Å; Q188-V190 PolarHBondContact O-N 3.16Å
191	T	37.8	Very low	38.7	Very low	78 Å²	78	122.9 Å²	122.9	48%	0.479	63%	0.63	S	S	.	*	H	α-helix	trans	-78.7	-36	178.2	-25.9	0	0	0	0	113.4	N187 Q188 S193 E194 E195	N187-T191 PolarHBondContact O-N 3.39Å; N187-T191 PolarHBondContact O-OG1 3.17Å; Q188-T191 PolarHBondContact O-N 3.4Å; T191-S193 VanDerWaalsContact C-N 3.28Å; T191-S193 PolarHBondContact O-N 2.87Å; T191-E194 PolarHBondContact O-N 3.46Å; T191-E195 PolarHBondContact O-N 3.37Å
192	L	33.3	Very low	38.3	Very low	98 Å²	98	125 Å²	125	51%	0.513	64%	0.641	S	S	.	*	H	α-helix	trans	-71.1	-22.7	-179.4	-70.4	173.6	0	0	0	113	Q188 E194 E196	Q188-L192 WeakPolarHBondContact O-CB 3.47Å; Q188-L192 VanDerWaalsContact O-CG 3.3Å; Q188-L192 WeakPolarHBondContact O-CG 3.46Å; Q188-L192 PolarHBondContact O-N 2.95Å; L192-E194 VanDerWaalsContact C-N 3.32Å; L192-E194 PolarHBondContact O-N 3.11Å; L192-E196 HydrophobicContact CD2-CG 4.11Å
193	S	39.2	Very low	37.5	Very low	105 Å²	105	129.2 Å²	129.2	73%	0.734	66%	0.66	S	S	*	*	H	α-helix	trans	-73.3	-20.4	174.5	-173.9	0	0	0	0	113.8	Q189 T191	Q189-S193 PolarHBondContact O-N 3.28Å; T191-S193 VanDerWaalsContact C-N 3.28Å; T191-S193 PolarHBondContact O-N 2.87Å
194	E	40.4	Very low	36.9	Very low	171 Å²	171	129.6 Å²	129.6	80%	0.799	67%	0.67	S	S	*	*	H	α-helix	trans	-105.1	-24.3	-175.7	-75.5	-169	155.5	0	0	114.4	T191 L192	T191-E194 PolarHBondContact O-N 3.46Å; L192-E194 VanDerWaalsContact C-N 3.32Å; L192-E194 PolarHBondContact O-N 3.11Å
195	E	38.3	Very low	36.5	Very low	150 Å²	150	131.6 Å²	131.6	70%	0.701	69%	0.69	S	S	*	*	H	α-helix	trans	-114.2	-6.2	-170.8	-70.9	-172.1	152.9	0	0	116.9	T191 M197	T191-E195 PolarHBondContact O-N 3.37Å; E195-M197 PolarHBondContact O-N 2.81Å; E195-M197 VanDerWaalsContact O-N 3.12Å
196	E	33.7	Very low	35.6	Very low	155 Å²	155	132.8 Å²	132.8	72%	0.724	70%	0.7	S	S	*	*	S	Bend	trans	-77.1	6.8	179	-77.3	-162.4	156.4	0	0	115.6	L192	L192-E196 HydrophobicContact CD2-CG 4.11Å
197	M	31.2	Very low	34.7	Very low	177 Å²	177	133.7 Å²	133.7	87%	0.872	71%	0.713	S	S	*	*	S	Bend	trans	-106.1	63.1	164	-70.8	-154.7	-173.1	0	0	111.7	E195	E195-M197 PolarHBondContact O-N 2.81Å; E195-M197 VanDerWaalsContact O-N 3.12Å
198	K	31.1	Very low	33.9	Very low	192 Å²	192	136.6 Å²	136.6	84%	0.835	72%	0.724	S	S	*	*	S	Bend	trans	161.7	96.8	143.8	-86.7	150.2	-166.8	174.9	0	110.9
199	S	32.2	Very low	33.3	Very low	117 Å²	117	139.8 Å²	139.8	82%	0.818	74%	0.738	S	S	*	*				165.4	75.6	127.5	48.9	0	0	0	0	110.3
200	N	31	Very low	32.8	Very low	154 Å²	154	139.1 Å²	139.1	82%	0.824	74%	0.739	S	S	*	*			trans	-57.9	141.2	146.1	-78.1	-33	0	0	0	108
201	I	31.8	Very low	32.3	Very low	153 Å²	153	140.1 Å²	140.1	79%	0.785	75%	0.746	S	S	*	*			trans	92.8	90.1	170.9	-47.5	154.3	0	0	0	113.9
202	L	31.2	Very low	32	Very low	151 Å²	151	147 Å²	147	79%	0.791	76%	0.763	S	S	*	*				-164.1	105.6	101.6	-148.6	77.2	0	0	0	110.2	S204	L202-S204 PolarHBondContact O-N 3.43Å; L202-S204 VanDerWaalsContact O-N 3.13Å
203	E	31.5	Very low	31.9	Very low	199 Å²	199	150.7 Å²	150.7	93%	0.93	78%	0.777	S	S	*	*			trans	-60.7	106.3	160.9	-73.3	171.5	137.8	0	0	108.9
204	S	31.4	Very low	31.5	Very low	92 Å²	92	152.4 Å²	152.4	64%	0.643	78%	0.779	S	S	*	*			trans	-100.4	98.6	159.4	60.9	0	0	0	0	108.4	L202 N206	L202-S204 PolarHBondContact O-N 3.43Å; L202-S204 VanDerWaalsContact O-N 3.13Å; S204-N206 PolarHBondContact O-N 2.72Å
205	S	27.6	Very low	31.3	Very low	100 Å²	100	148.6 Å²	148.6	70%	0.699	77%	0.771	S	S	*	*			trans	-53.9	92.7	169	52.8	0	0	0	0	111.8	T207	S205-T207 PolarHBondContact O-N 3.42Å
206	N	29.5	Very low	31.3	Very low	147 Å²	147	146.2 Å²	146.2	79%	0.786	77%	0.766	S	S	*	*			trans	-95.1	78	158.4	-75.8	-18.6	0	0	0	108.1	S204 E208	S204-N206 PolarHBondContact O-N 2.72Å; N206-E208 PolarHBondContact O-N 3.08Å
207	T	29.7	Very low	31.4	Very low	126 Å²	126	144.1 Å²	144.1	77%	0.773	76%	0.759	S	S	*	*			trans	-68.9	69.9	158.9	42.4	0	0	0	0	109.1	S205	S205-T207 PolarHBondContact O-N 3.42Å
208	E	29	Very low	31.8	Very low	156 Å²	156	140.1 Å²	140.1	73%	0.729	74%	0.742	S	S	*	*			trans	-91.5	94.6	152.6	-82.4	-170.6	165.9	0	0	106.7	N206 N210	N206-E208 PolarHBondContact O-N 3.08Å; E208-N210 PolarHBondContact O-N 3.39Å
209	Q	29.3	Very low	32.1	Very low	182 Å²	182	139.4 Å²	139.4	85%	0.85	74%	0.741	S	S	*	*			trans	-60.6	63.9	153.7	-71.6	179.4	-30.7	0	0	108.7	T211	Q209-T211 PolarHBondContact O-N 3.4Å
210	N	30.9	Very low	32.2	Very low	121 Å²	121	139.4 Å²	139.4	65%	0.647	73%	0.732	S	S	*	*			trans	-69.3	90.3	149.4	-95.8	-39.8	0	0	0	104	E208 R212	E208-N210 PolarHBondContact O-N 3.39Å; N210-R212 PolarHBondContact O-N 2.84Å
211	T	28.6	Very low	33.1	Very low	119 Å²	119	134 Å²	134	73%	0.73	71%	0.705	S	S	*	*			trans	-32.4	89.4	142.4	23.5	0	0	0	0	106.8	Q209 Q213	Q209-T211 PolarHBondContact O-N 3.4Å; T211-Q213 PolarHBondContact O-N 2.96Å
212	R	32	Very low	33.4	Very low	221 Å²	221	129.1 Å²	129.1	83%	0.834	69%	0.688	S	S	*	*			trans	-57.5	86.6	158.6	-78.4	179.8	174.8	172.1	-1.8	102	N210 N214	N210-R212 PolarHBondContact O-N 2.84Å; R212-N214 PolarHBondContact O-N 3.02Å; R212-N214 PolarHBondContact O-OD1 2.89Å
213	Q	30.9	Very low	33.9	Very low	176 Å²	176	129.5 Å²	129.5	82%	0.822	68%	0.684	S	S	*	*			trans	-47.1	101.7	154.6	-72.6	-177.2	-20.3	0	0	101.3	T211 S215	T211-Q213 PolarHBondContact O-N 2.96Å; Q213-S215 PolarHBondContact O-N 3.02Å
214	N	31.1	Very low	34.5	Very low	142 Å²	142	125.3 Å²	125.3	76%	0.759	66%	0.664	S	S	*	*			trans	-52.5	91.2	170.7	-70.1	-34.2	0	0	0	102.5	R212 V216	R212-N214 PolarHBondContact O-N 3.02Å; R212-N214 PolarHBondContact O-OD1 2.89Å; N214-V216 WeakPolarHBondContact O-CG2 3.45Å; N214-V216 PolarHBondContact O-N 3.37Å
215	S	36	Very low	35	Very low	91 Å²	91	125.8 Å²	125.8	64%	0.636	66%	0.659	S	S	*	*			trans	-69.4	95.8	-178.7	133	0	0	0	0	100.4	Q213 L217	Q213-S215 PolarHBondContact O-N 3.02Å; S215-L217 PolarHBondContact O-N 2.69Å
216	V	37.2	Very low	35.8	Very low	100 Å²	100	123.3 Å²	123.3	61%	0.606	64%	0.644	S	S	*	*			trans	-63.7	57.5	172.3	-169.3	0	0	0	0	107.7	N214 N218	N214-V216 WeakPolarHBondContact O-CG2 3.45Å; N214-V216 PolarHBondContact O-N 3.37Å; V216-N218 HydrophobicContact CG1-CB 3.83Å; V216-N218 WeakPolarHBondContact CG1-OD1 3.39Å; V216-N218 PolarHBondContact O-N 3.32Å
217	L	35.7	Very low	36.6	Very low	110 Å²	110	121.6 Å²	121.6	58%	0.576	63%	0.632	S	S	*	*				-65.5	75.8	128.4	-70.9	169.5	0	0	0	103.5	S215 E219 L225	S215-L217 PolarHBondContact O-N 2.69Å; L217-E219 PolarHBondContact O-N 3.43Å; L217-L225 HydrophobicContact CD2-CD1 4.43Å
218	N	40.3	Very low	37.5	Very low	94 Å²	94	120.4 Å²	120.4	50%	0.503	62%	0.62	S	S	.	*			trans	-43.6	139	167.3	-108.7	-14	0	0	0	105.5	V216 L220 S221 A222	V216-N218 HydrophobicContact CG1-CB 3.83Å; V216-N218 WeakPolarHBondContact CG1-OD1 3.39Å; V216-N218 PolarHBondContact O-N 3.32Å; N218-L220 HydrophobicContact CB-CB 4.38Å; N218-L220 CarbonylContact O-C 3.6Å; N218-L220 PolarHBondContact O-N 2.93Å; N218-S221 WeakPolarHBondContact O-CA 3.46Å; N218-S221 WeakPolarHBondContact O-CB 3.28Å; N218-S221 PolarHBondContact O-N 2.97Å; N218-A222 PolarHBondContact O-N 3.37Å
219	E	37.1	Very low	38.4	Very low	176 Å²	176	115.7 Å²	115.7	82%	0.822	60%	0.597	S	S	*	*	H	α-helix	trans	-49.4	-28.7	179.3	-75.6	174.4	139.8	0	0	112.5	L217 S221 A222 K223	L217-E219 PolarHBondContact O-N 3.43Å; E219-S221 PolarHBondContact O-N 2.92Å; E219-A222 PolarHBondContact O-N 3.19Å; E219-K223 PolarHBondContact O-N 3.16Å; E219-K223 VanDerWaalsContact O-N 3.08Å
220	L	34.2	Very low	39.3	Very low	118 Å²	118	109.9 Å²	109.9	62%	0.618	57%	0.572	S	S	*	*	H	α-helix	trans	-53.3	-46.4	168.2	-79	153.4	0	0	0	113.5	N218 E224	N218-L220 HydrophobicContact CB-CB 4.38Å; N218-L220 CarbonylContact O-C 3.6Å; N218-L220 PolarHBondContact O-N 2.93Å; L220-E224 WeakPolarHBondContact O-CB 3.46Å; L220-E224 WeakPolarHBondContact O-CG 3.38Å; L220-E224 PolarHBondContact O-N 2.85Å
221	S	49.3	Very low	40.5	Very low	39 Å²	39	106.8 Å²	106.8	27%	0.273	56%	0.555	S	S	.	*	H	α-helix	trans	-69.7	-37	179.7	-45.6	0	0	0	0	112.9	N218 E219 L225	N218-S221 WeakPolarHBondContact O-CA 3.46Å; N218-S221 WeakPolarHBondContact O-CB 3.28Å; N218-S221 PolarHBondContact O-N 2.97Å; E219-S221 PolarHBondContact O-N 2.92Å; S221-L225 WeakPolarHBondContact O-CB 3.34Å; S221-L225 WeakPolarHBondContact O-CD1 3.28Å; S221-L225 WeakPolarHBondContact O-CG 3.43Å; S221-L225 PolarHBondContact O-N 2.84Å
222	A	38.7	Very low	41.6	Very low	52 Å²	52	105.5 Å²	105.5	43%	0.43	54%	0.544	S	S	.	.	H	α-helix	trans	-71.2	-41.6	-179.1	0	0	0	0	0	111.2	N218 E219 L225 A226	N218-A222 PolarHBondContact O-N 3.37Å; E219-A222 PolarHBondContact O-N 3.19Å; A222-L225 PolarHBondContact O-N 2.93Å; A222-A226 WeakPolarHBondContact O-CB 3.26Å; A222-A226 PolarHBondContact O-N 3.07Å
223	K	41.1	Very low	42.4	Very low	159 Å²	159	98 Å²	98	69%	0.691	52%	0.52	S	S	*	.	H	α-helix	trans	-66.3	-46.9	176.9	-169.5	177.4	178.8	-178.9	0	111.7	E219 L225 A226 E227	E219-K223 PolarHBondContact O-N 3.16Å; E219-K223 VanDerWaalsContact O-N 3.08Å; K223-L225 VanDerWaalsContact C-N 3.32Å; K223-L225 PolarHBondContact O-N 2.93Å; K223-A226 PolarHBondContact O-N 3Å; K223-E227 WeakPolarHBondContact O-CB 3.49Å; K223-E227 PolarHBondContact O-N 2.87Å
224	E	45.2	Very low	43.4	Very low	110 Å²	110	89.9 Å²	89.9	51%	0.514	48%	0.483	S	S	.	.	H	α-helix	trans	-60.2	-41.5	175.3	-74.4	170.2	-178.7	0	0	111.9	L220 E227 L228	L220-E224 WeakPolarHBondContact O-CB 3.46Å; L220-E224 WeakPolarHBondContact O-CG 3.38Å; L220-E224 PolarHBondContact O-N 2.85Å; E224-E227 PolarHBondContact O-N 3.26Å; E224-L228 WeakPolarHBondContact O-CB 3.34Å; E224-L228 VanDerWaalsContact O-CG 3.29Å; E224-L228 WeakPolarHBondContact O-CG 3.38Å; E224-L228 PolarHBondContact O-N 3.22Å
225	L	42.4	Very low	44.5	Very low	102 Å²	102	86.2 Å²	86.2	53%	0.534	46%	0.463	S	S	.	.	H	α-helix	trans	-67.7	-37.6	176.5	-77.6	169.6	0	0	0	112.6	L217 S221 A222 K223 F229	L217-L225 HydrophobicContact CD2-CD1 4.43Å; S221-L225 WeakPolarHBondContact O-CB 3.34Å; S221-L225 WeakPolarHBondContact O-CD1 3.28Å; S221-L225 WeakPolarHBondContact O-CG 3.43Å; S221-L225 PolarHBondContact O-N 2.84Å; A222-L225 PolarHBondContact O-N 2.93Å; K223-L225 VanDerWaalsContact C-N 3.32Å; K223-L225 PolarHBondContact O-N 2.93Å; L225-F229 VanDerWaalsContact O-CB 3.31Å; L225-F229 WeakPolarHBondContact O-CB 3.41Å; L225-F229 PolarHBondContact O-N 3.29Å
226	A	43.8	Very low	45.4	Very low	48 Å²	48	87 Å²	87	40%	0.397	46%	0.46	S	S	.	.	H	α-helix	trans	-65.6	-45.1	175	0	0	0	0	0	110.5	A222 K223 F229 L230	A222-A226 WeakPolarHBondContact O-CB 3.26Å; A222-A226 PolarHBondContact O-N 3.07Å; K223-A226 PolarHBondContact O-N 3Å; A226-F229 PolarHBondContact O-N 3.06Å; A226-L230 WeakPolarHBondContact O-CB 3.27Å; A226-L230 VanDerWaalsContact O-CG 3.26Å; A226-L230 WeakPolarHBondContact O-CG 3.24Å; A226-L230 PolarHBondContact O-N 2.8Å
227	E	47.2	Very low	46	Very low	112 Å²	112	84 Å²	84	52%	0.523	44%	0.442	S	S	.	.	H	α-helix	trans	-61.7	-45.7	177	-172.1	173.6	-179	0	0	111.7	K223 E224 F229 L230 N231	K223-E227 WeakPolarHBondContact O-CB 3.49Å; K223-E227 PolarHBondContact O-N 2.87Å; E224-E227 PolarHBondContact O-N 3.26Å; E227-F229 VanDerWaalsContact C-N 3.34Å; E227-F229 PolarHBondContact O-N 2.92Å; E227-L230 PolarHBondContact O-N 2.8Å; E227-N231 WeakPolarHBondContact O-CB 3.49Å; E227-N231 VanDerWaalsContact O-CG 3.23Å; E227-N231 PolarHBondContact O-N 2.91Å; E227-N231 PolarHBondContact O-ND2 3.26Å
228	L	47.8	Very low	46.7	Very low	101 Å²	101	79.2 Å²	79.2	53%	0.529	42%	0.417	S	S	.	.	H	α-helix	trans	-59.8	-42.8	173.1	-76.1	169.3	0	0	0	112.2	E224 N231 D232	E224-L228 WeakPolarHBondContact O-CB 3.34Å; E224-L228 VanDerWaalsContact O-CG 3.29Å; E224-L228 WeakPolarHBondContact O-CG 3.38Å; E224-L228 PolarHBondContact O-N 3.22Å; L228-N231 PolarHBondContact O-N 3.23Å; L228-D232 WeakPolarHBondContact O-CB 3.42Å; L228-D232 PolarHBondContact O-N 3.39Å
229	F	47.4	Very low	47.4	Very low	56 Å²	56	78.2 Å²	78.2	25%	0.246	42%	0.415	C	S	.	.	H	α-helix	trans	-64.4	-42.6	177.2	171.8	-98.8	0	0	0	112.3	M65 Y68 L225 A226 E227 N231 D232 L233	M65-F229 HydrophobicContact CE-CD1 4.21Å; M65-F229 HydrophobicContact CE-CE1 3.6Å; M65-F229 HydrophobicContact CE-CE2 4.01Å; M65-F229 HydrophobicContact CE-CZ 3.48Å; M65-F229 VanDerWaalsContact CE-CZ 3.48Å; M65-F229 HydrophobicContact SD-CE1 4.41Å; M65-F229 HydrophobicContact SD-CZ 3.92Å; Y68-F229 HydrophobicContact CD1-CE2 4.38Å; Y68-F229 HydrophobicContact CE1-CD2 4.2Å; Y68-F229 AromaticContact CE1-CE2 3.55Å; Y68-F229 HydrophobicContact CE1-CE2 3.55Å; Y68-F229 HydrophobicContact CE1-CZ 4.49Å; Y68-F229 AromaticContact CZ-CE2 3.97Å; L225-F229 VanDerWaalsContact O-CB 3.31Å; L225-F229 WeakPolarHBondContact O-CB 3.41Å; L225-F229 PolarHBondContact O-N 3.29Å; A226-F229 PolarHBondContact O-N 3.06Å; E227-F229 VanDerWaalsContact C-N 3.34Å; E227-F229 PolarHBondContact O-N 2.92Å; F229-N231 VanDerWaalsContact C-N 3.34Å; F229-D232 PolarHBondContact O-N 2.88Å; F229-L233 HydrophobicContact CE1-CD2 4.4Å; F229-L233 WeakPolarHBondContact O-CB 3.49Å; F229-L233 PolarHBondContact O-N 2.88Å
230	L	49.6	Very low	48.3	Very low	60 Å²	60	75.6 Å²	75.6	31%	0.314	40%	0.398	S	S	.	.	H	α-helix	trans	-65.7	-39.8	177.8	-70.9	174.6	0	0	0	111.2	V166 I170 A226 E227 L233 T234	V166-L230 HydrophobicContact CG1-CD2 4.04Å; I170-L230 HydrophobicContact CD1-CD1 4.5Å; I170-L230 HydrophobicContact CD1-CD2 3.52Å; A226-L230 WeakPolarHBondContact O-CB 3.27Å; A226-L230 VanDerWaalsContact O-CG 3.26Å; A226-L230 WeakPolarHBondContact O-CG 3.24Å; A226-L230 PolarHBondContact O-N 2.8Å; E227-L230 PolarHBondContact O-N 2.8Å; L230-L233 PolarHBondContact O-N 2.91Å; L230-T234 VanDerWaalsContact O-CB 3.27Å; L230-T234 WeakPolarHBondContact O-CB 3.43Å; L230-T234 PolarHBondContact O-N 2.89Å; L230-T234 PolarHBondContact O-OG1 3.23Å
231	N	54.8	Low	49	Very low	56 Å²	56	70.4 Å²	70.4	30%	0.299	37%	0.371	S	S	.	.	H	α-helix	trans	-62.7	-47.9	173.2	-72.8	-30.2	0	0	0	111.3	E227 L228 F229 L233 T234 D235	E227-N231 WeakPolarHBondContact O-CB 3.49Å; E227-N231 VanDerWaalsContact O-CG 3.23Å; E227-N231 PolarHBondContact O-N 2.91Å; E227-N231 PolarHBondContact O-ND2 3.26Å; L228-N231 PolarHBondContact O-N 3.23Å; F229-N231 VanDerWaalsContact C-N 3.34Å; N231-L233 VanDerWaalsContact C-N 3.32Å; N231-L233 PolarHBondContact O-N 3.36Å; N231-T234 WeakPolarHBondContact O-CB 3.43Å; N231-T234 PolarHBondContact O-N 3.47Å; N231-D235 WeakPolarHBondContact O-CB 3.28Å; N231-D235 VanDerWaalsContact O-CG 3.3Å; N231-D235 PolarHBondContact O-N 3.11Å
232	D	53.1	Low	49.2	Very low	92 Å²	92	71.5 Å²	71.5	49%	0.492	37%	0.372	S	S	.	.	H	α-helix	trans	-58.9	-42.7	175.9	-80.7	-3.2	0	0	0	111.5	L228 F229 N236	L228-D232 WeakPolarHBondContact O-CB 3.42Å; L228-D232 PolarHBondContact O-N 3.39Å; F229-D232 PolarHBondContact O-N 2.88Å; D232-N236 VanDerWaalsContact O-CG 3.31Å; D232-N236 PolarHBondContact O-N 3.03Å; D232-N236 PolarHBondContact O-ND2 3.46Å
233	L	48.2	Very low	49.9	Very low	65 Å²	65	73.5 Å²	73.5	34%	0.34	38%	0.375	S	S	.	.	H	α-helix	trans	-65.2	-45.5	177.9	-178.6	63.2	0	0	0	111.3	V166 F229 L230 N231 D235 N236 V237	V166-L233 HydrophobicContact CG1-CD2 3.96Å; V166-L233 HydrophobicContact CG2-CD2 4.07Å; V166-L233 HydrophobicContact CG2-CG 4.02Å; F229-L233 HydrophobicContact CE1-CD2 4.4Å; F229-L233 WeakPolarHBondContact O-CB 3.49Å; F229-L233 PolarHBondContact O-N 2.88Å; L230-L233 PolarHBondContact O-N 2.91Å; N231-L233 VanDerWaalsContact C-N 3.32Å; N231-L233 PolarHBondContact O-N 3.36Å; L233-D235 VanDerWaalsContact C-N 3.34Å; L233-D235 PolarHBondContact O-N 3.41Å; L233-N236 PolarHBondContact O-N 2.99Å; L233-V237 WeakPolarHBondContact O-CG2 3.49Å; L233-V237 PolarHBondContact O-N 3.41Å
234	T	50.5	Low	50.4	Low	5 Å²	5	68.2 Å²	68.2	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-58.4	-45.9	176.5	-60.2	0	0	0	0	111.1	R159 S162 Q163 L230 N231 V237 S238	R159-T234 HydrophobicContact CG-CG2 4.42Å; S162-T234 VanDerWaalsContact OG-CG2 3.27Å; S162-T234 WeakPolarHBondContact OG-CG2 3.3Å; S162-T234 PolarHBondContact OG-O 3.34Å; Q163-T234 HydrophobicContact CB-CG2 4.43Å; Q163-T234 HydrophobicContact CG-CG2 3.4Å; Q163-T234 VanDerWaalsContact CG-CG2 3.4Å; L230-T234 VanDerWaalsContact O-CB 3.27Å; L230-T234 WeakPolarHBondContact O-CB 3.43Å; L230-T234 PolarHBondContact O-N 2.89Å; L230-T234 PolarHBondContact O-OG1 3.23Å; N231-T234 WeakPolarHBondContact O-CB 3.43Å; N231-T234 PolarHBondContact O-N 3.47Å; T234-V237 PolarHBondContact O-N 2.99Å; T234-S238 WeakPolarHBondContact O-CB 3.4Å; T234-S238 PolarHBondContact O-N 2.66Å; T234-S238 PolarHBondContact O-OG 2.92Å
235	D	56.1	Low	50.8	Low	64 Å²	64	63.6 Å²	63.6	34%	0.342	33%	0.333	S	S	.	.	H	α-helix	trans	-64.7	-41.8	179.1	-71.9	-11.2	0	0	0	110.7	R159 N231 L233 V237 S238 V239	R159-D235 IonicContact CZ-OD1 3.71Å; R159-D235 IonicContact NH1-OD1 2.86Å; R159-D235 IonicContact NH2-OD1 3.78Å; R159-D235 PolarHBondContact NH2-OD1 3.18Å; N231-D235 WeakPolarHBondContact O-CB 3.28Å; N231-D235 VanDerWaalsContact O-CG 3.3Å; N231-D235 PolarHBondContact O-N 3.11Å; L233-D235 VanDerWaalsContact C-N 3.34Å; L233-D235 PolarHBondContact O-N 3.41Å; D235-V237 PolarHBondContact O-N 3.18Å; D235-S238 WeakPolarHBondContact O-CB 3.25Å; D235-S238 PolarHBondContact O-N 3.3Å; D235-V239 WeakPolarHBondContact O-CG2 3.38Å; D235-V239 PolarHBondContact O-N 2.95Å
236	N	54.1	Low	51.6	Low	108 Å²	108	62.3 Å²	62.3	58%	0.578	33%	0.326	S	S	*	.	H	α-helix	trans	-62.9	-42.6	175.3	-74.9	-56.7	0	0	0	112.7	D232 L233 S238 Y240	D232-N236 VanDerWaalsContact O-CG 3.31Å; D232-N236 PolarHBondContact O-N 3.03Å; D232-N236 PolarHBondContact O-ND2 3.46Å; L233-N236 PolarHBondContact O-N 2.99Å; N236-S238 VanDerWaalsContact C-N 3.3Å; N236-Y240 PolarHBondContact O-N 3.26Å; N236-Y240 VanDerWaalsContact O-N 3.12Å
237	V	49	Very low	52.3	Low	37 Å²	37	63.3 Å²	63.3	22%	0.224	32%	0.323	C	S	.	.	H	α-helix	trans	-64	-39.7	175	173.7	0	0	0	0	109.9	V166 L233 T234 D235 Y240 L241	V166-V237 HydrophobicContact CG2-CG2 4.33Å; L233-V237 WeakPolarHBondContact O-CG2 3.49Å; L233-V237 PolarHBondContact O-N 3.41Å; T234-V237 PolarHBondContact O-N 2.99Å; D235-V237 PolarHBondContact O-N 3.18Å; V237-Y240 WeakPolarHBondContact O-CB 3.24Å; V237-Y240 PolarHBondContact O-N 3.32Å; V237-L241 HydrophobicContact CG1-CD1 4.24Å; V237-L241 HydrophobicContact CG1-CG 4.33Å; V237-L241 WeakPolarHBondContact O-CG 3.46Å; V237-L241 PolarHBondContact O-N 3.35Å
238	S	51.4	Low	52.6	Low	9 Å²	9	61.1 Å²	61.1	6%	0.063	31%	0.314	C	S	.	.	H	α-helix	trans	-61.9	-47	178.1	-53	0	0	0	0	112	S162 T234 D235 N236 Y240 L241 E242	S162-S238 WeakPolarHBondContact CB-OG 3.3Å; S162-S238 PolarHBondContact OG-OG 3.27Å; T234-S238 WeakPolarHBondContact O-CB 3.4Å; T234-S238 PolarHBondContact O-N 2.66Å; T234-S238 PolarHBondContact O-OG 2.92Å; D235-S238 WeakPolarHBondContact O-CB 3.25Å; D235-S238 PolarHBondContact O-N 3.3Å; N236-S238 VanDerWaalsContact C-N 3.3Å; S238-Y240 VanDerWaalsContact C-N 3.27Å; S238-Y240 PolarHBondContact O-N 2.86Å; S238-L241 PolarHBondContact O-N 3.32Å; S238-L241 VanDerWaalsContact O-N 3.11Å; S238-E242 WeakPolarHBondContact O-CG 3.43Å; S238-E242 PolarHBondContact O-N 3.17Å
239	V	55.3	Low	53	Low	74 Å²	74	58.5 Å²	58.5	45%	0.448	30%	0.301	S	S	.	.	H	α-helix	trans	-58.9	-41.3	175.3	173	0	0	0	0	110.9	D235 L241 E242 D243	D235-V239 WeakPolarHBondContact O-CG2 3.38Å; D235-V239 PolarHBondContact O-N 2.95Å; V239-L241 VanDerWaalsContact C-N 3.33Å; V239-L241 PolarHBondContact O-N 3.18Å; V239-E242 WeakPolarHBondContact O-CB 3.46Å; V239-E242 PolarHBondContact O-N 2.99Å; V239-D243 PolarHBondContact O-N 3.02Å
240	Y	55.9	Low	53.6	Low	120 Å²	120	61.9 Å²	61.9	47%	0.471	32%	0.317	S	S	.	.	H	α-helix	trans	-65.6	-36.3	176.9	-172.6	-109.8	0	0	0	112.8	N236 V237 S238 D243 I244	N236-Y240 PolarHBondContact O-N 3.26Å; N236-Y240 VanDerWaalsContact O-N 3.12Å; V237-Y240 WeakPolarHBondContact O-CB 3.24Å; V237-Y240 PolarHBondContact O-N 3.32Å; S238-Y240 VanDerWaalsContact C-N 3.27Å; S238-Y240 PolarHBondContact O-N 2.86Å; Y240-D243 PolarHBondContact O-N 3.41Å; Y240-I244 HydrophobicContact CD1-CD1 3.73Å; Y240-I244 HydrophobicContact CE1-CD1 3.42Å; Y240-I244 VanDerWaalsContact CE1-CD1 3.42Å; Y240-I244 HydrophobicContact CE1-CG1 4.31Å; Y240-I244 WeakPolarHBondContact O-CG1 3.46Å; Y240-I244 PolarHBondContact O-N 3.07Å
241	L	48.7	Very low	53.8	Low	9 Å²	9	62.8 Å²	62.8	5%	0.047	32%	0.322	C	S	.	.	H	α-helix	trans	-69.8	-36.5	174.1	-68.3	180	0	0	0	112.1	I137 L158 I161 M165 V237 S238 V239 I244 L245	I137-L241 HydrophobicContact CD1-CD1 4.17Å; I137-L241 HydrophobicContact CD1-CD2 3.59Å; I137-L241 HydrophobicContact CD1-CG 4.48Å; L158-L241 HydrophobicContact CD2-CB 3.86Å; L158-L241 HydrophobicContact CD2-CD1 4.28Å; I161-L241 HydrophobicContact CG2-CD1 4.16Å; M165-L241 HydrophobicContact SD-CD1 4.46Å; V237-L241 HydrophobicContact CG1-CD1 4.24Å; V237-L241 HydrophobicContact CG1-CG 4.33Å; V237-L241 WeakPolarHBondContact O-CG 3.46Å; V237-L241 PolarHBondContact O-N 3.35Å; S238-L241 PolarHBondContact O-N 3.32Å; S238-L241 VanDerWaalsContact O-N 3.11Å; V239-L241 VanDerWaalsContact C-N 3.33Å; V239-L241 PolarHBondContact O-N 3.18Å; L241-I244 HydrophobicContact CD2-CD1 4.35Å; L241-I244 PolarHBondContact O-N 3.28Å; L241-L245 WeakPolarHBondContact O-CG 3.41Å; L241-L245 PolarHBondContact O-N 2.94Å
242	E	54	Low	53.6	Low	62 Å²	62	64.6 Å²	64.6	29%	0.29	33%	0.332	S	S	.	.	H	α-helix	trans	-60	-46.7	171	-71.9	177.2	-178.9	0	0	110.6	R155 L158 S238 V239 I244 L245 D246	R155-E242 WeakPolarHBondContact CG-OE1 3.31Å; L158-E242 HydrophobicContact CD1-CB 4.42Å; L158-E242 HydrophobicContact CD1-CG 3.47Å; L158-E242 VanDerWaalsContact CD1-CG 3.47Å; S238-E242 WeakPolarHBondContact O-CG 3.43Å; S238-E242 PolarHBondContact O-N 3.17Å; V239-E242 WeakPolarHBondContact O-CB 3.46Å; V239-E242 PolarHBondContact O-N 2.99Å; E242-I244 VanDerWaalsContact C-N 3.34Å; E242-I244 PolarHBondContact O-N 2.97Å; E242-L245 WeakPolarHBondContact O-CB 3.42Å; E242-L245 PolarHBondContact O-N 2.97Å; E242-L245 VanDerWaalsContact O-N 3.16Å; E242-D246 PolarHBondContact O-N 3.37Å
243	D	52.3	Low	53.4	Low	94 Å²	94	66.3 Å²	66.3	50%	0.503	34%	0.341	S	S	.	.	H	α-helix	trans	-59.2	-43.5	176.4	-70.8	-23	0	0	0	111.7	V239 Y240 D246 E247	V239-D243 PolarHBondContact O-N 3.02Å; Y240-D243 PolarHBondContact O-N 3.41Å; D243-D246 PolarHBondContact O-N 2.97Å; D243-E247 WeakPolarHBondContact O-CB 3.44Å; D243-E247 PolarHBondContact O-N 3.12Å
244	I	52.1	Low	53.2	Low	49 Å²	49	69.9 Å²	69.9	25%	0.251	36%	0.361	S	S	.	.	H	α-helix	trans	-63.1	-42.4	176.1	-71.2	166.1	0	0	0	111.1	Y240 L241 E242 E247 L248	Y240-I244 HydrophobicContact CD1-CD1 3.73Å; Y240-I244 HydrophobicContact CE1-CD1 3.42Å; Y240-I244 VanDerWaalsContact CE1-CD1 3.42Å; Y240-I244 HydrophobicContact CE1-CG1 4.31Å; Y240-I244 WeakPolarHBondContact O-CG1 3.46Å; Y240-I244 PolarHBondContact O-N 3.07Å; L241-I244 HydrophobicContact CD2-CD1 4.35Å; L241-I244 PolarHBondContact O-N 3.28Å; E242-I244 VanDerWaalsContact C-N 3.34Å; E242-I244 PolarHBondContact O-N 2.97Å; I244-E247 PolarHBondContact O-N 3.33Å; I244-L248 HydrophobicContact CG2-CD1 3.83Å; I244-L248 HydrophobicContact CG2-CG 4.27Å; I244-L248 WeakPolarHBondContact O-CB 3.47Å; I244-L248 VanDerWaalsContact O-CG 3.25Å; I244-L248 WeakPolarHBondContact O-CG 3.44Å; I244-L248 PolarHBondContact O-N 2.69Å
245	L	54	Low	52.7	Low	12 Å²	12	76.3 Å²	76.3	6%	0.063	40%	0.395	C	S	.	.	H	α-helix	trans	-63.2	-45.8	177.4	-78.5	174.4	0	0	0	111.5	I137 V141 V154 L158 L241 E242 E247 L248 L249	I137-L245 HydrophobicContact CG2-CD2 4.02Å; V141-L245 HydrophobicContact CB-CD2 4.39Å; V141-L245 HydrophobicContact CG2-CD2 3.19Å; V154-L245 HydrophobicContact CG1-CD1 3.8Å; L158-L245 HydrophobicContact CD1-CD1 3.36Å; L158-L245 HydrophobicContact CD2-CD1 3.55Å; L158-L245 HydrophobicContact CD2-CG 4.42Å; L158-L245 HydrophobicContact CG-CD1 3.78Å; L241-L245 WeakPolarHBondContact O-CG 3.41Å; L241-L245 PolarHBondContact O-N 2.94Å; E242-L245 WeakPolarHBondContact O-CB 3.42Å; E242-L245 PolarHBondContact O-N 2.97Å; E242-L245 VanDerWaalsContact O-N 3.16Å; L245-E247 VanDerWaalsContact C-N 3.28Å; L245-E247 PolarHBondContact O-N 3.18Å; L245-L248 PolarHBondContact O-N 2.82Å; L245-L249 VanDerWaalsContact O-CG 3.31Å; L245-L249 WeakPolarHBondContact O-CG 3.28Å; L245-L249 PolarHBondContact O-N 3.32Å
246	D	58.9	Low	51.7	Low	75 Å²	75	85.2 Å²	85.2	40%	0.401	43%	0.434	S	S	.	.	H	α-helix	trans	-59.3	-41.8	176.9	-83	-11.3	0	0	0	111.1	E242 D243 L249 Q250	E242-D246 PolarHBondContact O-N 3.37Å; D243-D246 PolarHBondContact O-N 2.97Å; D246-L249 PolarHBondContact O-N 3.08Å; D246-Q250 WeakPolarHBondContact O-CB 3.47Å; D246-Q250 VanDerWaalsContact O-CG 3.28Å; D246-Q250 WeakPolarHBondContact O-CG 3.29Å; D246-Q250 PolarHBondContact O-N 3.47Å
247	E	57.5	Low	51.6	Low	70 Å²	70	84.1 Å²	84.1	33%	0.327	43%	0.427	S	S	.	.	H	α-helix	trans	-64.3	-44.6	175.7	-164.5	-174.1	158.1	0	0	112	D243 I244 L245 L249 Q250 N251	D243-E247 WeakPolarHBondContact O-CB 3.44Å; D243-E247 PolarHBondContact O-N 3.12Å; I244-E247 PolarHBondContact O-N 3.33Å; L245-E247 VanDerWaalsContact C-N 3.28Å; L245-E247 PolarHBondContact O-N 3.18Å; E247-L249 VanDerWaalsContact C-N 3.27Å; E247-L249 PolarHBondContact O-N 3.21Å; E247-Q250 PolarHBondContact O-N 3.23Å; E247-N251 WeakPolarHBondContact O-CB 3.36Å; E247-N251 VanDerWaalsContact O-CG 3.28Å; E247-N251 PolarHBondContact O-N 3.41Å; E247-N251 PolarHBondContact O-ND2 2.78Å
248	L	54.7	Low	51.7	Low	66 Å²	66	86.6 Å²	86.6	35%	0.346	44%	0.437	S	S	.	.	H	α-helix	trans	-65.6	-28.9	177.3	-72.5	173.8	0	0	0	112.9	V141 R145 I244 L245	V141-L248 HydrophobicContact CG1-CB 4.39Å; V141-L248 HydrophobicContact CG2-CB 4.27Å; V141-L248 HydrophobicContact CG2-CD1 3.85Å; R145-L248 PolarHBondContact NH2-O 3.04Å; I244-L248 HydrophobicContact CG2-CD1 3.83Å; I244-L248 HydrophobicContact CG2-CG 4.27Å; I244-L248 WeakPolarHBondContact O-CB 3.47Å; I244-L248 VanDerWaalsContact O-CG 3.25Å; I244-L248 WeakPolarHBondContact O-CG 3.44Å; I244-L248 PolarHBondContact O-N 2.69Å; L245-L248 PolarHBondContact O-N 2.82Å
249	L	56	Low	51.7	Low	45 Å²	45	90.9 Å²	90.9	24%	0.236	46%	0.458	C	S	.	.	H	α-helix	trans	-76.1	-36.6	172.8	-70.3	171.4	0	0	0	111.7	V141 V144 R145 L245 D246 E247	V141-L249 HydrophobicContact CG1-CD2 4.39Å; V144-L249 HydrophobicContact CG1-CD1 4.23Å; V144-L249 HydrophobicContact CG1-CD2 4.39Å; R145-L249 HydrophobicContact CG-CD2 3.78Å; L245-L249 VanDerWaalsContact O-CG 3.31Å; L245-L249 WeakPolarHBondContact O-CG 3.28Å; L245-L249 PolarHBondContact O-N 3.32Å; D246-L249 PolarHBondContact O-N 3.08Å; E247-L249 VanDerWaalsContact C-N 3.27Å; E247-L249 PolarHBondContact O-N 3.21Å
250	Q	59.3	Low	51.5	Low	127 Å²	127	91.9 Å²	91.9	59%	0.593	46%	0.459	S	S	*	.	H	α-helix	trans	-74.5	-39	-179.7	-74.4	174.7	26.8	0	0	113.5	D246 E247 N252 N253	D246-Q250 WeakPolarHBondContact O-CB 3.47Å; D246-Q250 VanDerWaalsContact O-CG 3.28Å; D246-Q250 WeakPolarHBondContact O-CG 3.29Å; D246-Q250 PolarHBondContact O-N 3.47Å; E247-Q250 PolarHBondContact O-N 3.23Å; Q250-N252 PolarHBondContact O-N 2.91Å; Q250-N253 PolarHBondContact O-N 2.95Å
251	N	54.5	Low	51.2	Low	79 Å²	79	90.1 Å²	90.1	42%	0.422	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-15.4	-172.7	-80.3	-25.3	0	0	0	115.3	E247	E247-N251 WeakPolarHBondContact O-CB 3.36Å; E247-N251 VanDerWaalsContact O-CG 3.28Å; E247-N251 PolarHBondContact O-N 3.41Å; E247-N251 PolarHBondContact O-ND2 2.78Å
252	N	49.6	Very low	51.4	Low	94 Å²	94	95.5 Å²	95.5	50%	0.503	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-7.4	175.8	-79.4	4.7	0	0	0	114.3	R145 Q250 D254	R145-N252 PolarHBondContact NH1-ND2 2.73Å; R145-N252 PolarHBondContact NH2-ND2 3.08Å; Q250-N252 PolarHBondContact O-N 2.91Å; N252-D254 VanDerWaalsContact C-N 3.29Å
253	N	48.5	Very low	51.2	Low	128 Å²	128	97.9 Å²	97.9	68%	0.684	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-80.1	-13.7	175.3	-74.1	-25.9	0	0	0	112.7	Q250 D255	Q250-N253 PolarHBondContact O-N 2.95Å; N253-D255 VanDerWaalsContact C-N 3.34Å
254	D	44.3	Very low	51.1	Low	140 Å²	140	98.2 Å²	98.2	75%	0.749	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-85.9	1.7	-179.8	-78.1	-20	0	0	0	114.1	N252	N252-D254 VanDerWaalsContact C-N 3.29Å
255	D	39.4	Very low	51.1	Low	140 Å²	140	102.3 Å²	102.3	75%	0.749	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-100.1	22.5	178.6	-91.6	-15	0	0	0	114.5	N253	N253-D255 VanDerWaalsContact C-N 3.34Å
256	H	36	Very low	50.8	Low	252 Å²	252	110.5 Å²	110.5	100%	1.167	56%	0.561	S	S	*	*			trans	-126.8	0	170.1	-83.5	-14.4	0	0	0	112.8

Retrieved 256 of 256 residues in 378.2 ms (Link to these results)

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