A0A3Q0KH16_SCHMA Loading...

Rho GTPase-activating protein 7

AlphaFold DB , UniProt , Accession A0A3Q0KH16, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 374 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	29.8	Very low	28.2	Very low	223 Å²	223	148.1 Å²	148.1	100%	1.099	68%	0.678	S	S	*	*				0	-63.3	0	-68.1	-175	-178.3	0	0	114.3	R3 A4	M1-R3 PolarHBondContact O-N 2.94Å; M1-R3 VanDerWaalsContact O-N 3.15Å; M1-A4 PolarHBondContact O-N 3.15Å
2	A	20.7	Very low	28.4	Very low	77 Å²	77	151.8 Å²	151.8	64%	0.636	69%	0.691	S	S	*	*	H	α-helix	trans	-51.4	-42.7	-167.4	0	0	0	0	0	116.5	A4 R5 I6	A2-A4 VanDerWaalsContact C-N 3.29Å; A2-A4 PolarHBondContact O-N 3.33Å; A2-R5 PolarHBondContact O-N 3.46Å; A2-I6 PolarHBondContact O-N 3.27Å
3	R	24.3	Very low	28.6	Very low	195 Å²	195	144.8 Å²	144.8	74%	0.736	67%	0.671	S	S	*	*	H	α-helix	trans	-54.4	-39.5	177.5	-80.4	-176.6	168.1	-161.4	-3.4	113.2	M1 I6 W7 D330	M1-R3 PolarHBondContact O-N 2.94Å; M1-R3 VanDerWaalsContact O-N 3.15Å; R3-I6 PolarHBondContact O-N 3.14Å; R3-W7 PolarHBondContact O-N 2.95Å; R3-D330 IonicContact NH1-OD2 2.68Å; R3-D330 PolarHBondContact NH1-OD2 3Å
4	A	25.3	Very low	29	Very low	60 Å²	60	141.7 Å²	141.7	50%	0.496	66%	0.662	S	S	.	*	H	α-helix	trans	-67.1	-39.8	-178.2	0	0	0	0	0	112.7	M1 A2 I6 W7 Q8	M1-A4 PolarHBondContact O-N 3.15Å; A2-A4 VanDerWaalsContact C-N 3.29Å; A2-A4 PolarHBondContact O-N 3.33Å; A4-I6 VanDerWaalsContact C-N 3.29Å; A4-I6 PolarHBondContact O-N 3.27Å; A4-W7 WeakPolarHBondContact O-CB 3.49Å; A4-W7 PolarHBondContact O-N 3.08Å; A4-Q8 PolarHBondContact O-N 2.73Å
5	R	25.2	Very low	29.1	Very low	190 Å²	190	146 Å²	146	72%	0.717	67%	0.67	S	S	*	*	H	α-helix	trans	-60.4	-37.7	174.5	-85.1	-173.4	172.3	179.3	-1.9	112.1	A2 W7 Q8 L9	A2-R5 PolarHBondContact O-N 3.46Å; R5-W7 VanDerWaalsContact C-N 3.34Å; R5-Q8 PolarHBondContact O-N 3.11Å; R5-L9 WeakPolarHBondContact O-CB 3.1Å; R5-L9 WeakPolarHBondContact O-CD1 3.46Å; R5-L9 VanDerWaalsContact O-CG 3.23Å; R5-L9 WeakPolarHBondContact O-CG 3.46Å; R5-L9 PolarHBondContact O-N 2.88Å
6	I	28.5	Very low	29.8	Very low	104 Å²	104	141.1 Å²	141.1	53%	0.533	66%	0.658	S	S	.	*	H	α-helix	trans	-67	-37.6	178.4	-62.7	169.3	0	0	0	110.9	A2 R3 A4 R10	A2-I6 PolarHBondContact O-N 3.27Å; R3-I6 PolarHBondContact O-N 3.14Å; A4-I6 VanDerWaalsContact C-N 3.29Å; A4-I6 PolarHBondContact O-N 3.27Å; I6-R10 PolarHBondContact O-N 3.05Å
7	W	29.7	Very low	30.2	Very low	169 Å²	169	136.5 Å²	136.5	64%	0.64	64%	0.635	S	S	*	*	H	α-helix	trans	-66.1	-46.6	173.4	-117.7	78.4	0	0	0	112.1	R3 A4 R5 L9 R10	R3-W7 PolarHBondContact O-N 2.95Å; A4-W7 WeakPolarHBondContact O-CB 3.49Å; A4-W7 PolarHBondContact O-N 3.08Å; R5-W7 VanDerWaalsContact C-N 3.34Å; W7-L9 PolarHBondContact O-N 3.06Å; W7-R10 PolarHBondContact O-N 2.7Å
8	Q	28.7	Very low	30.6	Very low	137 Å²	137	136.1 Å²	136.1	64%	0.64	64%	0.638	S	S	*	*	H	α-helix	trans	-62.1	-39.1	175.8	-72	175	-37.4	0	0	112.5	A4 R5 R10 R11	A4-Q8 PolarHBondContact O-N 2.73Å; R5-Q8 PolarHBondContact O-N 3.11Å; Q8-R10 PolarHBondContact O-N 3.15Å; Q8-R11 PolarHBondContact O-N 2.95Å; Q8-R11 VanDerWaalsContact O-N 3.13Å
9	L	29.6	Very low	31	Very low	119 Å²	119	136.6 Å²	136.6	62%	0.623	63%	0.634	S	S	*	*	H	α-helix	trans	-63.1	-27.5	176.4	-78.5	165.3	0	0	0	113	R5 W7	R5-L9 WeakPolarHBondContact O-CB 3.1Å; R5-L9 WeakPolarHBondContact O-CD1 3.46Å; R5-L9 VanDerWaalsContact O-CG 3.23Å; R5-L9 WeakPolarHBondContact O-CG 3.46Å; R5-L9 PolarHBondContact O-N 2.88Å; W7-L9 PolarHBondContact O-N 3.06Å
10	R	31	Very low	31.3	Very low	202 Å²	202	132.2 Å²	132.2	76%	0.762	62%	0.615	S	S	*	*	H	α-helix	trans	-75.7	-17.9	175	-77.1	-176.3	171.8	-176.3	-2.4	114.2	I6 W7 Q8 K12	I6-R10 PolarHBondContact O-N 3.05Å; W7-R10 PolarHBondContact O-N 2.7Å; Q8-R10 PolarHBondContact O-N 3.15Å; R10-K12 VanDerWaalsContact C-N 3.28Å; R10-K12 PolarHBondContact O-N 2.84Å
11	R	36.8	Very low	31.7	Very low	153 Å²	153	128.2 Å²	128.2	58%	0.577	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	3.8	179.2	-77.9	-158.7	178.1	-173.6	-1.9	115.4	Q8 S13 D14	Q8-R11 PolarHBondContact O-N 2.95Å; Q8-R11 VanDerWaalsContact O-N 3.13Å; R11-S13 PolarHBondContact O-N 2.95Å; R11-D14 WeakPolarHBondContact CB-OD1 3.32Å; R11-D14 PolarHBondContact O-N 3.41Å; R11-D14 VanDerWaalsContact O-OD1 3.08Å
12	K	30.9	Very low	32.1	Very low	192 Å²	192	120.5 Å²	120.5	84%	0.835	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	15	172.2	-70.2	-164.8	172.2	-170	0	114.8	R10	R10-K12 VanDerWaalsContact C-N 3.28Å; R10-K12 PolarHBondContact O-N 2.84Å
13	S	31.6	Very low	32.9	Very low	62 Å²	62	120.1 Å²	120.1	43%	0.434	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-131.9	32.1	172.7	73.5	0	0	0	0	113.3	R11 W15 S16	R11-S13 PolarHBondContact O-N 2.95Å; S13-W15 PolarHBondContact O-N 3.26Å; S13-S16 PolarHBondContact O-OG 3.45Å
14	D	34.3	Very low	33.3	Very low	101 Å²	101	112.9 Å²	112.9	54%	0.54	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	8.7	-177.8	-72.9	-11.8	0	0	0	115.2	R11 S16	R11-D14 WeakPolarHBondContact CB-OD1 3.32Å; R11-D14 PolarHBondContact O-N 3.41Å; R11-D14 VanDerWaalsContact O-OD1 3.08Å; D14-S16 PolarHBondContact O-N 3.18Å
15	W	30.2	Very low	33.9	Very low	206 Å²	206	112 Å²	112	78%	0.78	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	4.2	176.7	-127.3	65.8	0	0	0	114.6	S13	S13-W15 PolarHBondContact O-N 3.26Å
16	S	40.6	Very low	34.2	Very low	68 Å²	68	108.5 Å²	108.5	48%	0.476	52%	0.524	S	S	.	.	S	Bend	trans	-111.6	-27.2	-172.1	57.9	0	0	0	0	115.7	S13 D14 L20	S13-S16 PolarHBondContact O-OG 3.45Å; D14-S16 PolarHBondContact O-N 3.18Å; S16-L20 WeakPolarHBondContact O-CB 3.16Å; S16-L20 PolarHBondContact O-N 3.27Å; S16-L20 VanDerWaalsContact O-N 3.13Å
17	F	36.6	Very low	34.6	Very low	62 Å²	62	107 Å²	107	27%	0.272	52%	0.523	S	S	.	.	H	α-helix	trans	-79.7	-54.7	-170.6	-172.7	-91.9	0	0	0	113.4	R19 L20 V21 F34 I37	F17-R19 PolarHBondContact O-N 3.35Å; F17-R19 VanDerWaalsContact O-N 3.14Å; F17-L20 WeakPolarHBondContact O-CA 3.43Å; F17-L20 WeakPolarHBondContact O-CB 3.49Å; F17-L20 PolarHBondContact O-N 2.87Å; F17-V21 HydrophobicContact CD1-CG2 4.19Å; F17-V21 HydrophobicContact CE1-CG2 3.7Å; F17-V21 HydrophobicContact CZ-CG2 4.03Å; F17-V21 PolarHBondContact O-N 3.2Å; F17-F34 HydrophobicContact CD1-CE1 4.45Å; F17-F34 HydrophobicContact CD1-CZ 4.32Å; F17-F34 AromaticContact CE1-CE1 3.59Å; F17-F34 HydrophobicContact CE1-CE1 3.59Å; F17-F34 HydrophobicContact CE1-CE2 4.25Å; F17-F34 AromaticContact CE1-CZ 3.4Å; F17-F34 HydrophobicContact CE1-CZ 3.4Å; F17-F34 HydrophobicContact CE2-CD1 4.37Å; F17-F34 AromaticContact CE2-CE1 3.87Å; F17-F34 HydrophobicContact CE2-CE1 3.87Å; F17-F34 AromaticContact CZ-CD1 3.85Å; F17-F34 HydrophobicContact CZ-CD1 3.85Å; F17-F34 AromaticContact CZ-CE1 3.24Å; F17-F34 HydrophobicContact CZ-CE1 3.24Å; F17-F34 HydrophobicContact CZ-CE2 4.32Å; F17-F34 AromaticContact CZ-CZ 3.52Å; F17-F34 HydrophobicContact CZ-CZ 3.52Å; F17-I37 HydrophobicContact CE2-CD1 3.73Å; F17-I37 HydrophobicContact CZ-CD1 3.79Å
18	D	37.2	Very low	34.7	Very low	129 Å²	129	104.8 Å²	104.8	69%	0.69	53%	0.534	S	S	*	.	H	α-helix	trans	-58.8	-33	-179.3	-59.3	-8.3	0	0	0	111.8	A22	D18-A22 WeakPolarHBondContact O-CB 3.16Å; D18-A22 PolarHBondContact O-N 2.85Å
19	R	38.7	Very low	34.8	Very low	146 Å²	146	105.9 Å²	105.9	55%	0.551	54%	0.538	S	S	*	.	H	α-helix	trans	-77.8	-24.8	175	-156.7	174	-171.8	174.3	2.4	113.2	F17 D23	F17-R19 PolarHBondContact O-N 3.35Å; F17-R19 VanDerWaalsContact O-N 3.14Å; R19-D23 WeakPolarHBondContact O-CB 3.27Å; R19-D23 PolarHBondContact O-N 2.8Å; R19-D23 VanDerWaalsContact O-N 3.13Å
20	L	37	Very low	34.9	Very low	49 Å²	49	104.4 Å²	104.4	26%	0.257	54%	0.537	S	S	.	.	H	α-helix	trans	-63	-51.9	167.5	-146.6	78.8	0	0	0	109.4	S16 F17 D23 L24 W65	S16-L20 WeakPolarHBondContact O-CB 3.16Å; S16-L20 PolarHBondContact O-N 3.27Å; S16-L20 VanDerWaalsContact O-N 3.13Å; F17-L20 WeakPolarHBondContact O-CA 3.43Å; F17-L20 WeakPolarHBondContact O-CB 3.49Å; F17-L20 PolarHBondContact O-N 2.87Å; L20-D23 PolarHBondContact O-N 2.76Å; L20-L24 HydrophobicContact CB-CD1 4.46Å; L20-L24 HydrophobicContact CD2-CD1 4.19Å; L20-L24 HydrophobicContact CG-CD1 3.94Å; L20-L24 WeakPolarHBondContact O-CB 3.14Å; L20-L24 WeakPolarHBondContact O-CD1 3.47Å; L20-L24 WeakPolarHBondContact O-CG 3.47Å; L20-L24 PolarHBondContact O-N 3.16Å; L20-W65 HydrophobicContact CD1-CH2 3.65Å; L20-W65 HydrophobicContact CD1-CZ3 3.56Å; L20-W65 HydrophobicContact CD2-CZ3 4.34Å; L20-W65 HydrophobicContact CG-CH2 3.73Å; L20-W65 HydrophobicContact CG-CZ3 3.67Å
21	V	38.8	Very low	35.1	Very low	49 Å²	49	102.7 Å²	102.7	30%	0.297	54%	0.538	S	S	.	.	H	α-helix	trans	-61.4	-47.4	-178.9	179.8	0	0	0	0	110.7	F17 D23 L24 T25	F17-V21 HydrophobicContact CD1-CG2 4.19Å; F17-V21 HydrophobicContact CE1-CG2 3.7Å; F17-V21 HydrophobicContact CZ-CG2 4.03Å; F17-V21 PolarHBondContact O-N 3.2Å; V21-D23 VanDerWaalsContact C-N 3.33Å; V21-D23 PolarHBondContact O-N 2.82Å; V21-L24 PolarHBondContact O-N 2.97Å; V21-L24 VanDerWaalsContact O-N 3.08Å; V21-T25 PolarHBondContact O-N 3.49Å; V21-T25 PolarHBondContact O-OG1 3.45Å
22	A	37.5	Very low	35.2	Very low	60 Å²	60	97.3 Å²	97.3	50%	0.496	52%	0.521	S	S	.	.	H	α-helix	trans	-60.8	-37.1	177.2	0	0	0	0	0	113.8	D18	D18-A22 WeakPolarHBondContact O-CB 3.16Å; D18-A22 PolarHBondContact O-N 2.85Å
23	D	37.6	Very low	35.8	Very low	69 Å²	69	90.5 Å²	90.5	37%	0.369	50%	0.495	S	S	.	.	H	α-helix	trans	-77.6	-20.9	175.2	-76.4	4.5	0	0	0	113	R19 L20 V21 W65 R69	R19-D23 WeakPolarHBondContact O-CB 3.27Å; R19-D23 PolarHBondContact O-N 2.8Å; R19-D23 VanDerWaalsContact O-N 3.13Å; L20-D23 PolarHBondContact O-N 2.76Å; V21-D23 VanDerWaalsContact C-N 3.33Å; V21-D23 PolarHBondContact O-N 2.82Å; D23-W65 HydrophobicContact CB-CH2 4.4Å; D23-W65 HydrophobicContact CB-CZ2 3.91Å; D23-R69 IonicContact OD2-CZ 2.63Å; D23-R69 IonicContact OD2-NH1 3.21Å; D23-R69 PolarHBondContact OD2-NH1 3.41Å; D23-R69 IonicContact OD2-NH2 3.88Å; D23-R69 PolarHBondContact OD2-NH2 2.88Å
24	L	33.1	Very low	36.3	Very low	43 Å²	43	93.6 Å²	93.6	23%	0.225	50%	0.501	C	S	.	.	H	α-helix	trans	-84	-25.2	178	-77.7	162	0	0	0	112.8	L20 V21 P26 L32 W65	L20-L24 HydrophobicContact CB-CD1 4.46Å; L20-L24 HydrophobicContact CD2-CD1 4.19Å; L20-L24 HydrophobicContact CG-CD1 3.94Å; L20-L24 WeakPolarHBondContact O-CB 3.14Å; L20-L24 WeakPolarHBondContact O-CD1 3.47Å; L20-L24 WeakPolarHBondContact O-CG 3.47Å; L20-L24 PolarHBondContact O-N 3.16Å; V21-L24 PolarHBondContact O-N 2.97Å; V21-L24 VanDerWaalsContact O-N 3.08Å; L24-P26 WeakPolarHBondContact O-CD 3.43Å; L24-L32 HydrophobicContact CB-CD1 3.95Å; L24-L32 HydrophobicContact CD1-CD1 4.17Å; L24-L32 HydrophobicContact CD2-CD1 4.06Å; L24-L32 HydrophobicContact CG-CD1 4.28Å; L24-W65 HydrophobicContact CD1-CH2 4.05Å; L24-W65 HydrophobicContact CD1-CZ3 3.99Å; L24-W65 HydrophobicContact CD2-CD2 3.85Å; L24-W65 HydrophobicContact CD2-CE3 3.81Å; L24-W65 HydrophobicContact CD2-CG 4.49Å; L24-W65 HydrophobicContact CD2-CH2 3.91Å; L24-W65 HydrophobicContact CD2-CZ2 3.95Å; L24-W65 HydrophobicContact CD2-CZ3 3.84Å; L24-W65 HydrophobicContact CG-CE3 4.39Å; L24-W65 HydrophobicContact CG-CH2 3.62Å; L24-W65 HydrophobicContact CG-CZ2 3.89Å; L24-W65 HydrophobicContact CG-CZ3 3.9Å
25	T	37.5	Very low	36.7	Very low	42 Å²	42	93.5 Å²	93.5	26%	0.258	50%	0.497	S	S	.	.			trans	-119.6	60.3	177.5	66	0	0	0	0	113	V21 S27 C30	V21-T25 PolarHBondContact O-N 3.49Å; V21-T25 PolarHBondContact O-OG1 3.45Å; T25-S27 CarbonylContact C-O 3.46Å; T25-S27 PolarHBondContact O-N 3.38Å; T25-C30 WeakPolarHBondContact CG2-O 3.18Å
26	P	32.8	Very low	37.4	Very low	117 Å²	117	85.9 Å²	85.9	76%	0.76	47%	0.471	S	S	*	.	S	Bend	trans	-66.8	-21.5	174	30.5	-35.7	0	0	0	112.1	L24	L24-P26 WeakPolarHBondContact O-CD 3.43Å
27	S	35.8	Very low	37.7	Very low	73 Å²	73	84.2 Å²	84.2	51%	0.51	46%	0.456	S	S	.	.	S	Bend	trans	-110.3	138.8	157.1	53.5	0	0	0	0	109.4	T25 Q29	T25-S27 CarbonylContact C-O 3.46Å; T25-S27 PolarHBondContact O-N 3.38Å; S27-Q29 PolarHBondContact O-N 3.12Å
28	S	31.8	Very low	38.3	Very low	122 Å²	122	86 Å²	86	85%	0.853	47%	0.465	S	S	*	.	S	Bend	trans	-80.7	59.3	-172.8	58.4	0	0	0	0	112.7
29	Q	31.9	Very low	38.8	Very low	159 Å²	159	81.5 Å²	81.5	74%	0.743	44%	0.441	S	S	*	.			trans	-136.5	3.7	-168.7	-71.2	-173.2	-27.3	0	0	116.1	S27	S27-Q29 PolarHBondContact O-N 3.12Å
30	C	31.9	Very low	39.2	Very low	89 Å²	89	74.8 Å²	74.8	60%	0.601	42%	0.416	S	S	*	.			trans	-144.3	103.7	173.5	-84.7	0	0	0	0	110.9	T25 L32	T25-C30 WeakPolarHBondContact CG2-O 3.18Å; C30-L32 PolarHBondContact O-N 3.2Å
31	E	34.5	Very low	39.6	Very low	165 Å²	165	74.3 Å²	74.3	77%	0.771	42%	0.417	S	S	*	.			trans	-71.5	99.1	167.9	-67.7	-170.1	146.1	0	0	109.7	T33	E31-T33 PolarHBondContact O-N 3.25Å
32	L	39.7	Very low	39.9	Very low	41 Å²	41	73.8 Å²	73.8	22%	0.215	41%	0.41	C	S	.	.			trans	-72.9	92	170.8	-105.1	145	0	0	0	108.9	L24 C30 M36 I37	L24-L32 HydrophobicContact CB-CD1 3.95Å; L24-L32 HydrophobicContact CD1-CD1 4.17Å; L24-L32 HydrophobicContact CD2-CD1 4.06Å; L24-L32 HydrophobicContact CG-CD1 4.28Å; C30-L32 PolarHBondContact O-N 3.2Å; L32-M36 HydrophobicContact CD2-CB 4.04Å; L32-M36 HydrophobicContact CD2-CE 3.91Å; L32-M36 HydrophobicContact CD2-SD 4.43Å; L32-M36 HydrophobicContact CG-CE 4.21Å; L32-I37 HydrophobicContact CD2-CG1 4.27Å
33	T	41.9	Very low	40.1	Very low	49 Å²	49	71.4 Å²	71.4	30%	0.301	39%	0.389	S	S	.	.			trans	-63.5	157.1	-177.5	80.1	0	0	0	0	111.4	E31 E35 M36 I37	E31-T33 PolarHBondContact O-N 3.25Å; T33-E35 WeakPolarHBondContact CB-OE2 3.39Å; T33-E35 PolarHBondContact O-N 3.26Å; T33-E35 WeakPolarHBondContact OG1-CB 3.49Å; T33-E35 PolarHBondContact OG1-N 3.27Å; T33-E35 PolarHBondContact OG1-OE2 3.42Å; T33-M36 WeakPolarHBondContact O-CB 3.47Å; T33-M36 PolarHBondContact O-N 3.37Å; T33-M36 PolarHBondContact OG1-N 3.23Å; T33-I37 PolarHBondContact O-N 3.02Å; T33-I37 VanDerWaalsContact O-N 3.16Å
34	F	42.5	Very low	40.6	Very low	126 Å²	126	71.2 Å²	71.2	55%	0.553	39%	0.386	S	S	*	.	H	α-helix	trans	-56	-32.1	171.5	-81.8	-84.7	0	0	0	111.7	F17 I37 H38	F17-F34 HydrophobicContact CD1-CE1 4.45Å; F17-F34 HydrophobicContact CD1-CZ 4.32Å; F17-F34 AromaticContact CE1-CE1 3.59Å; F17-F34 HydrophobicContact CE1-CE1 3.59Å; F17-F34 HydrophobicContact CE1-CE2 4.25Å; F17-F34 AromaticContact CE1-CZ 3.4Å; F17-F34 HydrophobicContact CE1-CZ 3.4Å; F17-F34 HydrophobicContact CE2-CD1 4.37Å; F17-F34 AromaticContact CE2-CE1 3.87Å; F17-F34 HydrophobicContact CE2-CE1 3.87Å; F17-F34 AromaticContact CZ-CD1 3.85Å; F17-F34 HydrophobicContact CZ-CD1 3.85Å; F17-F34 AromaticContact CZ-CE1 3.24Å; F17-F34 HydrophobicContact CZ-CE1 3.24Å; F17-F34 HydrophobicContact CZ-CE2 4.32Å; F17-F34 AromaticContact CZ-CZ 3.52Å; F17-F34 HydrophobicContact CZ-CZ 3.52Å; F34-I37 PolarHBondContact O-N 3.14Å; F34-H38 VanDerWaalsContact O-CB 3.32Å; F34-H38 WeakPolarHBondContact O-CB 3.14Å; F34-H38 PolarHBondContact O-CD2 3.28Å; F34-H38 VanDerWaalsContact O-CD2 3.29Å; F34-H38 PolarHBondContact O-N 3.06Å
35	E	43.9	Very low	41.1	Very low	99 Å²	99	76 Å²	76	46%	0.463	41%	0.405	S	S	.	.	H	α-helix	trans	-65.4	-43.4	175.2	-46.2	149.8	106.5	0	0	111.2	T33 I37 H38 M39	T33-E35 WeakPolarHBondContact CB-OE2 3.39Å; T33-E35 PolarHBondContact O-N 3.26Å; T33-E35 WeakPolarHBondContact OG1-CB 3.49Å; T33-E35 PolarHBondContact OG1-N 3.27Å; T33-E35 PolarHBondContact OG1-OE2 3.42Å; E35-I37 VanDerWaalsContact C-N 3.32Å; E35-I37 PolarHBondContact O-N 3.06Å; E35-H38 CarbonylContact O-C 3.55Å; E35-H38 PolarHBondContact O-N 3.15Å; E35-M39 VanDerWaalsContact O-CB 3.28Å; E35-M39 WeakPolarHBondContact O-CB 3.21Å; E35-M39 VanDerWaalsContact O-CG 3.25Å; E35-M39 WeakPolarHBondContact O-CG 3.41Å; E35-M39 PolarHBondContact O-N 3.4Å
36	M	45	Very low	41	Very low	47 Å²	47	77.5 Å²	77.5	23%	0.232	41%	0.413	C	S	.	.	H	α-helix	trans	-60.7	-42.4	176.2	-68.8	178.9	66.2	0	0	111.5	L32 T33 M39 V40 F59	L32-M36 HydrophobicContact CD2-CB 4.04Å; L32-M36 HydrophobicContact CD2-CE 3.91Å; L32-M36 HydrophobicContact CD2-SD 4.43Å; L32-M36 HydrophobicContact CG-CE 4.21Å; T33-M36 WeakPolarHBondContact O-CB 3.47Å; T33-M36 PolarHBondContact O-N 3.37Å; T33-M36 PolarHBondContact OG1-N 3.23Å; M36-M39 PolarHBondContact O-N 3.26Å; M36-V40 WeakPolarHBondContact O-CG2 3.35Å; M36-V40 PolarHBondContact O-N 3.25Å; M36-F59 HydrophobicContact CB-CE1 4.41Å; M36-F59 HydrophobicContact CE-CE1 4.27Å; M36-F59 HydrophobicContact CE-CZ 4.36Å; M36-F59 HydrophobicContact CG-CE1 4.38Å
37	I	46.9	Very low	41.1	Very low	32 Å²	32	73.1 Å²	73.1	16%	0.164	39%	0.387	C	S	.	.	H	α-helix	trans	-68	-41.4	177.8	-62.1	173.1	0	0	0	110.6	F17 L32 T33 F34 E35 S41	F17-I37 HydrophobicContact CE2-CD1 3.73Å; F17-I37 HydrophobicContact CZ-CD1 3.79Å; L32-I37 HydrophobicContact CD2-CG1 4.27Å; T33-I37 PolarHBondContact O-N 3.02Å; T33-I37 VanDerWaalsContact O-N 3.16Å; F34-I37 PolarHBondContact O-N 3.14Å; E35-I37 VanDerWaalsContact C-N 3.32Å; E35-I37 PolarHBondContact O-N 3.06Å; I37-S41 WeakPolarHBondContact O-CB 3.44Å; I37-S41 PolarHBondContact O-N 2.93Å
38	H	49	Very low	41.1	Very low	100 Å²	100	73.7 Å²	73.7	46%	0.463	39%	0.389	S	S	.	.	H	α-helix	trans	-65.3	-37.6	173.3	-89	-121.9	0	0	0	112.4	F34 E35 S41 Y42	F34-H38 VanDerWaalsContact O-CB 3.32Å; F34-H38 WeakPolarHBondContact O-CB 3.14Å; F34-H38 PolarHBondContact O-CD2 3.28Å; F34-H38 VanDerWaalsContact O-CD2 3.29Å; F34-H38 PolarHBondContact O-N 3.06Å; E35-H38 CarbonylContact O-C 3.55Å; E35-H38 PolarHBondContact O-N 3.15Å; H38-S41 CarbonylContact O-C 3.53Å; H38-S41 PolarHBondContact O-N 2.99Å; H38-Y42 WeakPolarHBondContact O-CB 3.14Å; H38-Y42 PolarHBondContact O-N 2.97Å
39	M	47.7	Very low	41.6	Very low	35 Å²	35	74.7 Å²	74.7	17%	0.172	39%	0.393	C	S	.	.	H	α-helix	trans	-64.7	-49.1	176.1	-81.7	172.6	51.9	0	0	111.3	E35 M36 S41 Y42 V43 F59 V357 I361	E35-M39 VanDerWaalsContact O-CB 3.28Å; E35-M39 WeakPolarHBondContact O-CB 3.21Å; E35-M39 VanDerWaalsContact O-CG 3.25Å; E35-M39 WeakPolarHBondContact O-CG 3.41Å; E35-M39 PolarHBondContact O-N 3.4Å; M36-M39 PolarHBondContact O-N 3.26Å; M39-S41 VanDerWaalsContact C-N 3.32Å; M39-S41 PolarHBondContact O-N 3.03Å; M39-Y42 WeakPolarHBondContact O-CB 3.25Å; M39-Y42 PolarHBondContact O-N 3.47Å; M39-Y42 VanDerWaalsContact O-N 3.11Å; M39-V43 VanDerWaalsContact O-CG2 3.29Å; M39-V43 WeakPolarHBondContact O-CG2 3.34Å; M39-V43 PolarHBondContact O-N 3.41Å; M39-F59 HydrophobicContact CE-CE1 3.85Å; M39-F59 HydrophobicContact CE-CZ 3.72Å; M39-V357 HydrophobicContact CE-CG1 3.82Å; M39-I361 HydrophobicContact CE-CD1 3.85Å; M39-I361 HydrophobicContact CE-CG1 3.95Å
40	V	46.4	Very low	42	Very low	4 Å²	4	69 Å²	69	2%	0.024	38%	0.377	C	S	.	.	H	α-helix	trans	-60.4	-46	176.5	177.3	0	0	0	0	110.1	M36 Y42 V43 E44 F59 A62 I66	M36-V40 WeakPolarHBondContact O-CG2 3.35Å; M36-V40 PolarHBondContact O-N 3.25Å; V40-Y42 VanDerWaalsContact C-N 3.25Å; V40-Y42 PolarHBondContact O-N 3.27Å; V40-V43 PolarHBondContact O-N 2.85Å; V40-E44 VanDerWaalsContact O-CB 3.23Å; V40-E44 WeakPolarHBondContact O-CB 3.2Å; V40-E44 PolarHBondContact O-N 2.76Å; V40-F59 HydrophobicContact CG2-CD1 3.81Å; V40-A62 HydrophobicContact CG2-CB 4.06Å; V40-I66 HydrophobicContact CG1-CD1 3.82Å
41	S	45.7	Very low	42.3	Very low	40 Å²	40	67.8 Å²	67.8	28%	0.28	36%	0.363	S	S	.	.	H	α-helix	trans	-71.9	-14.8	177.8	-151.7	0	0	0	0	114	I37 H38 M39 K45	I37-S41 WeakPolarHBondContact O-CB 3.44Å; I37-S41 PolarHBondContact O-N 2.93Å; H38-S41 CarbonylContact O-C 3.53Å; H38-S41 PolarHBondContact O-N 2.99Å; M39-S41 VanDerWaalsContact C-N 3.32Å; M39-S41 PolarHBondContact O-N 3.03Å; S41-K45 VanDerWaalsContact O-CG 3.32Å; S41-K45 WeakPolarHBondContact O-CG 3.49Å; S41-K45 PolarHBondContact O-NZ 3.38Å; S41-K45 PolarHBondContact OG-NZ 3.25Å
42	Y	44.4	Very low	42.6	Very low	38 Å²	38	60.4 Å²	60.4	15%	0.149	33%	0.329	C	S	.	.	H	α-helix	trans	-80.2	-54.5	170.6	172.3	-99.7	0	0	0	109.7	H38 M39 V40 E44 K45 V46 L329 L333	H38-Y42 WeakPolarHBondContact O-CB 3.14Å; H38-Y42 PolarHBondContact O-N 2.97Å; M39-Y42 WeakPolarHBondContact O-CB 3.25Å; M39-Y42 PolarHBondContact O-N 3.47Å; M39-Y42 VanDerWaalsContact O-N 3.11Å; V40-Y42 VanDerWaalsContact C-N 3.25Å; V40-Y42 PolarHBondContact O-N 3.27Å; Y42-E44 VanDerWaalsContact C-N 3.29Å; Y42-E44 PolarHBondContact O-N 2.84Å; Y42-K45 WeakPolarHBondContact O-CA 3.22Å; Y42-K45 PolarHBondContact O-N 3.36Å; Y42-V46 HydrophobicContact CD1-CG2 3.83Å; Y42-V46 HydrophobicContact CD2-CG1 4.42Å; Y42-V46 HydrophobicContact CD2-CG2 4.15Å; Y42-V46 HydrophobicContact CE1-CG2 3.53Å; Y42-V46 HydrophobicContact CE2-CG1 4.17Å; Y42-V46 HydrophobicContact CE2-CG2 3.87Å; Y42-V46 HydrophobicContact CG-CG2 4.14Å; Y42-V46 WeakPolarHBondContact O-CG2 3.34Å; Y42-V46 PolarHBondContact O-N 2.77Å; Y42-L329 HydrophobicContact CD2-CD2 3.78Å; Y42-L329 HydrophobicContact CE2-CD2 3.93Å; Y42-L329 HydrophobicContact CG-CD2 4.5Å; Y42-L333 HydrophobicContact CD2-CD2 4.38Å; Y42-L333 HydrophobicContact CE2-CD2 4.48Å
43	V	42.8	Very low	42.6	Very low	10 Å²	10	61.5 Å²	61.5	6%	0.061	34%	0.34	C	S	.	.	H	α-helix	trans	-60.1	-39.8	-179.8	-178.1	0	0	0	0	110.8	M39 V40 K45 A47 L52 F55	M39-V43 VanDerWaalsContact O-CG2 3.29Å; M39-V43 WeakPolarHBondContact O-CG2 3.34Å; M39-V43 PolarHBondContact O-N 3.41Å; V40-V43 PolarHBondContact O-N 2.85Å; V43-K45 PolarHBondContact O-N 3.49Å; V43-A47 HydrophobicContact CB-CB 4.46Å; V43-A47 HydrophobicContact CG1-CB 3.55Å; V43-A47 WeakPolarHBondContact O-CB 3.23Å; V43-A47 PolarHBondContact O-N 3.09Å; V43-L52 HydrophobicContact CB-CD2 3.92Å; V43-L52 HydrophobicContact CB-CG 4.36Å; V43-L52 HydrophobicContact CG1-CD1 4.36Å; V43-L52 HydrophobicContact CG1-CD2 3.56Å; V43-L52 HydrophobicContact CG1-CG 3.61Å; V43-F55 HydrophobicContact CB-CZ 4.5Å; V43-F55 HydrophobicContact CG1-CE2 3.81Å; V43-F55 HydrophobicContact CG1-CZ 4.1Å; V43-F55 HydrophobicContact CG2-CE1 4.28Å; V43-F55 HydrophobicContact CG2-CE2 4.19Å; V43-F55 HydrophobicContact CG2-CZ 3.61Å
44	E	46.5	Very low	42.4	Very low	65 Å²	65	64.9 Å²	64.9	30%	0.304	36%	0.36	S	S	.	.	H	α-helix	trans	-59.7	-24.6	173.2	-174.2	179	-135.4	0	0	113.9	V40 Y42 L52	V40-E44 VanDerWaalsContact O-CB 3.23Å; V40-E44 WeakPolarHBondContact O-CB 3.2Å; V40-E44 PolarHBondContact O-N 2.76Å; Y42-E44 VanDerWaalsContact C-N 3.29Å; Y42-E44 PolarHBondContact O-N 2.84Å; E44-L52 HydrophobicContact CB-CD1 4.42Å
45	K	45	Very low	42.1	Very low	143 Å²	143	60.1 Å²	60.1	62%	0.622	34%	0.34	S	S	*	.	H	α-helix	trans	-98.2	-33.9	179.5	-69.2	-173.9	-161.5	78.6	0	114.9	S41 Y42 V43	S41-K45 VanDerWaalsContact O-CG 3.32Å; S41-K45 WeakPolarHBondContact O-CG 3.49Å; S41-K45 PolarHBondContact O-NZ 3.38Å; S41-K45 PolarHBondContact OG-NZ 3.25Å; Y42-K45 WeakPolarHBondContact O-CA 3.22Å; Y42-K45 PolarHBondContact O-N 3.36Å; V43-K45 PolarHBondContact O-N 3.49Å
46	V	35.4	Very low	41.8	Very low	73 Å²	73	58.1 Å²	58.1	44%	0.442	34%	0.335	S	S	.	.	H	α-helix	trans	-111.4	-15.6	-172.7	-57.3	0	0	0	0	114.8	Y42 L333	Y42-V46 HydrophobicContact CD1-CG2 3.83Å; Y42-V46 HydrophobicContact CD2-CG1 4.42Å; Y42-V46 HydrophobicContact CD2-CG2 4.15Å; Y42-V46 HydrophobicContact CE1-CG2 3.53Å; Y42-V46 HydrophobicContact CE2-CG1 4.17Å; Y42-V46 HydrophobicContact CE2-CG2 3.87Å; Y42-V46 HydrophobicContact CG-CG2 4.14Å; Y42-V46 WeakPolarHBondContact O-CG2 3.34Å; Y42-V46 PolarHBondContact O-N 2.77Å; V46-L333 HydrophobicContact CG1-CD2 4.44Å
47	A	34.7	Very low	41.3	Very low	25 Å²	25	60 Å²	60	21%	0.207	35%	0.353	C	S	.	.	S	Bend	trans	-88.7	148.3	-176	0	0	0	0	0	112.3	V43 M51	V43-A47 HydrophobicContact CB-CB 4.46Å; V43-A47 HydrophobicContact CG1-CB 3.55Å; V43-A47 WeakPolarHBondContact O-CB 3.23Å; V43-A47 PolarHBondContact O-N 3.09Å; A47-M51 HydrophobicContact CB-CB 3.63Å; A47-M51 HydrophobicContact CB-CE 3.84Å; A47-M51 HydrophobicContact CB-CG 4.27Å; A47-M51 HydrophobicContact CB-SD 3.81Å
48	P	36.3	Very low	40.7	Very low	86 Å²	86	61.8 Å²	61.8	56%	0.558	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-58.6	148.6	172.1	-23.9	35.5	0	0	0	111.8	G50 M51	P48-G50 PolarHBondContact O-N 3.46Å; P48-G50 VanDerWaalsContact O-N 3.14Å; P48-M51 PolarHBondContact O-N 2.8Å
49	P	40.4	Very low	40.1	Very low	142 Å²	142	57.9 Å²	57.9	92%	0.922	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	122.2	176.4	-29.1	35.9	0	0	0	112
50	G	40.4	Very low	39.6	Very low	41 Å²	41	60 Å²	60	42%	0.423	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.3	-8.4	-178.5	0	0	0	0	0	116	P48 L52 S53	P48-G50 PolarHBondContact O-N 3.46Å; P48-G50 VanDerWaalsContact O-N 3.14Å; G50-L52 PolarHBondContact O-N 3.08Å; G50-S53 WeakPolarHBondContact O-CB 3.5Å; G50-S53 PolarHBondContact O-N 3.18Å; G50-S53 PolarHBondContact O-OG 3.34Å
51	M	39.7	Very low	38.9	Very low	62 Å²	62	63.2 Å²	63.2	31%	0.305	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-61	-32.4	179.8	-152.4	-152.8	-87.7	0	0	112.6	A47 P48 S53 V54 F55	A47-M51 HydrophobicContact CB-CB 3.63Å; A47-M51 HydrophobicContact CB-CE 3.84Å; A47-M51 HydrophobicContact CB-CG 4.27Å; A47-M51 HydrophobicContact CB-SD 3.81Å; P48-M51 PolarHBondContact O-N 2.8Å; M51-S53 PolarHBondContact O-N 2.86Å; M51-V54 WeakPolarHBondContact O-CB 3.49Å; M51-V54 WeakPolarHBondContact O-CG2 3.46Å; M51-V54 PolarHBondContact O-N 3.19Å; M51-F55 WeakPolarHBondContact O-CD2 3.47Å; M51-F55 HydrophobicContact SD-CE2 4.41Å
52	L	40.2	Very low	38.6	Very low	11 Å²	11	61.9 Å²	61.9	6%	0.058	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-60.6	-28.4	174.3	-74.9	159.8	0	0	0	113.2	V43 E44 G50 V54 F55 E63	V43-L52 HydrophobicContact CB-CD2 3.92Å; V43-L52 HydrophobicContact CB-CG 4.36Å; V43-L52 HydrophobicContact CG1-CD1 4.36Å; V43-L52 HydrophobicContact CG1-CD2 3.56Å; V43-L52 HydrophobicContact CG1-CG 3.61Å; E44-L52 HydrophobicContact CB-CD1 4.42Å; G50-L52 PolarHBondContact O-N 3.08Å; L52-V54 PolarHBondContact O-N 3.3Å; L52-V54 VanDerWaalsContact O-N 3.12Å; L52-F55 HydrophobicContact CD2-CD2 4.44Å; L52-F55 WeakPolarHBondContact O-CB 3.47Å; L52-F55 PolarHBondContact O-N 3.45Å; L52-E63 VanDerWaalsContact CB-CD 3.4Å; L52-E63 HydrophobicContact CB-CG 4.4Å; L52-E63 WeakPolarHBondContact CB-OE2 3.48Å; L52-E63 HydrophobicContact CD1-CB 4.39Å; L52-E63 VanDerWaalsContact CD1-CD 3.48Å; L52-E63 HydrophobicContact CD1-CG 3.85Å; L52-E63 VanDerWaalsContact CD1-OE1 3.28Å; L52-E63 WeakPolarHBondContact CD1-OE1 3.09Å
53	S	38.8	Very low	38.2	Very low	64 Å²	64	61.3 Å²	61.3	45%	0.448	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-69.7	-4.8	174.6	75.6	0	0	0	0	114.4	G50 M51 Q60	G50-S53 WeakPolarHBondContact O-CB 3.5Å; G50-S53 PolarHBondContact O-N 3.18Å; G50-S53 PolarHBondContact O-OG 3.34Å; M51-S53 PolarHBondContact O-N 2.86Å; S53-Q60 PolarHBondContact O-NE2 3.14Å
54	V	37.8	Very low	37.8	Very low	119 Å²	119	63.7 Å²	63.7	72%	0.721	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-96.7	-16.2	173.6	-165.3	0	0	0	0	111.7	M51 L52	M51-V54 WeakPolarHBondContact O-CB 3.49Å; M51-V54 WeakPolarHBondContact O-CG2 3.46Å; M51-V54 PolarHBondContact O-N 3.19Å; L52-V54 PolarHBondContact O-N 3.3Å; L52-V54 VanDerWaalsContact O-N 3.12Å
55	F	36.6	Very low	37.5	Very low	27 Å²	27	63.4 Å²	63.4	12%	0.118	38%	0.384	C	S	.	.	S	Bend	trans	-72.9	155.3	-179.9	-80.9	-110.8	0	0	0	112.1	V43 M51 L52 F59 Q60 V357 I361	V43-F55 HydrophobicContact CB-CZ 4.5Å; V43-F55 HydrophobicContact CG1-CE2 3.81Å; V43-F55 HydrophobicContact CG1-CZ 4.1Å; V43-F55 HydrophobicContact CG2-CE1 4.28Å; V43-F55 HydrophobicContact CG2-CE2 4.19Å; V43-F55 HydrophobicContact CG2-CZ 3.61Å; M51-F55 WeakPolarHBondContact O-CD2 3.47Å; M51-F55 HydrophobicContact SD-CE2 4.41Å; L52-F55 HydrophobicContact CD2-CD2 4.44Å; L52-F55 WeakPolarHBondContact O-CB 3.47Å; L52-F55 PolarHBondContact O-N 3.45Å; F55-F59 HydrophobicContact CB-CB 3.77Å; F55-F59 HydrophobicContact CB-CG 4.44Å; F55-F59 HydrophobicContact CD1-CB 4.14Å; F55-F59 HydrophobicContact CD1-CD2 4.08Å; F55-F59 HydrophobicContact CD1-CG 4.03Å; F55-F59 HydrophobicContact CG-CB 4.3Å; F55-Q60 WeakPolarHBondContact O-CG 3.38Å; F55-Q60 PolarHBondContact O-NE2 3.04Å; F55-V357 HydrophobicContact CE1-CG1 4.47Å; F55-I361 HydrophobicContact CE1-CD1 4.44Å
56	P	38.3	Very low	37.2	Very low	56 Å²	56	58.6 Å²	58.6	36%	0.364	37%	0.365	S	S	.	.			trans	-54.4	150.9	171.7	-26.1	35.2	0	0	0	113.2	P58 F59 Q60	P56-P58 HydrophobicContact CB-CG 4.4Å; P56-P58 WeakPolarHBondContact O-CD 3.47Å; P56-P58 VanDerWaalsContact O-N 3.1Å; P56-F59 PolarHBondContact O-N 3.36Å; P56-Q60 PolarHBondContact O-N 3.12Å
57	S	34	Very low	37.3	Very low	87 Å²	87	60.8 Å²	60.8	61%	0.608	37%	0.365	S	S	*	.	H	α-helix	trans	-48.3	-36.3	-174.5	57.6	0	0	0	0	117.4	F59 Q60 S61	S57-F59 VanDerWaalsContact C-N 3.27Å; S57-F59 PolarHBondContact O-N 2.7Å; S57-Q60 PolarHBondContact O-N 2.96Å; S57-S61 WeakPolarHBondContact O-CB 3.23Å; S57-S61 PolarHBondContact O-N 2.95Å; S57-S61 PolarHBondContact O-OG 3.42Å
58	P	34.6	Very low	37.4	Very low	70 Å²	70	64.4 Å²	64.4	46%	0.455	38%	0.381	S	S	.	.	H	α-helix	trans	-59.7	-34	174.3	21.3	-34.3	0	0	0	113.7	P56 A62	P56-P58 HydrophobicContact CB-CG 4.4Å; P56-P58 WeakPolarHBondContact O-CD 3.47Å; P56-P58 VanDerWaalsContact O-N 3.1Å; P58-A62 PolarHBondContact O-N 3.1Å
59	F	37.5	Very low	37.3	Very low	17 Å²	17	65.4 Å²	65.4	8%	0.075	37%	0.373	C	S	.	.	H	α-helix	trans	-77.9	-32	177.1	-68.4	-75.9	0	0	0	112.4	M36 M39 V40 F55 P56 S57 A62 E63 I361	M36-F59 HydrophobicContact CB-CE1 4.41Å; M36-F59 HydrophobicContact CE-CE1 4.27Å; M36-F59 HydrophobicContact CE-CZ 4.36Å; M36-F59 HydrophobicContact CG-CE1 4.38Å; M39-F59 HydrophobicContact CE-CE1 3.85Å; M39-F59 HydrophobicContact CE-CZ 3.72Å; V40-F59 HydrophobicContact CG2-CD1 3.81Å; F55-F59 HydrophobicContact CB-CB 3.77Å; F55-F59 HydrophobicContact CB-CG 4.44Å; F55-F59 HydrophobicContact CD1-CB 4.14Å; F55-F59 HydrophobicContact CD1-CD2 4.08Å; F55-F59 HydrophobicContact CD1-CG 4.03Å; F55-F59 HydrophobicContact CG-CB 4.3Å; P56-F59 PolarHBondContact O-N 3.36Å; S57-F59 VanDerWaalsContact C-N 3.27Å; S57-F59 PolarHBondContact O-N 2.7Å; F59-A62 PolarHBondContact O-N 2.88Å; F59-E63 PolarHBondContact O-N 2.88Å; F59-I361 HydrophobicContact CE2-CD1 4.29Å
60	Q	35.9	Very low	36.9	Very low	80 Å²	80	64.7 Å²	64.7	37%	0.374	35%	0.352	S	S	.	.	H	α-helix	trans	-68.7	-37.9	171.4	-60.8	-171.8	12.1	0	0	111.7	S53 F55 P56 S57 A62 E63 S64	S53-Q60 PolarHBondContact O-NE2 3.14Å; F55-Q60 WeakPolarHBondContact O-CG 3.38Å; F55-Q60 PolarHBondContact O-NE2 3.04Å; P56-Q60 PolarHBondContact O-N 3.12Å; S57-Q60 PolarHBondContact O-N 2.96Å; Q60-A62 VanDerWaalsContact C-N 3.34Å; Q60-E63 PolarHBondContact O-N 3.05Å; Q60-S64 WeakPolarHBondContact O-CB 3.32Å; Q60-S64 PolarHBondContact O-N 3.4Å; Q60-S64 PolarHBondContact O-OG 3Å
61	S	32.1	Very low	36.4	Very low	72 Å²	72	65.8 Å²	65.8	50%	0.503	35%	0.348	S	S	.	.	H	α-helix	trans	-60	-44.5	169.8	-61.5	0	0	0	0	111.2	S57 S64 W65	S57-S61 WeakPolarHBondContact O-CB 3.23Å; S57-S61 PolarHBondContact O-N 2.95Å; S57-S61 PolarHBondContact O-OG 3.42Å; S61-S64 PolarHBondContact O-OG 3.19Å; S61-W65 WeakPolarHBondContact O-CB 3.31Å; S61-W65 PolarHBondContact O-N 3.07Å
62	A	38.5	Very low	35.8	Very low	12 Å²	12	69.9 Å²	69.9	10%	0.099	36%	0.364	C	S	.	.	H	α-helix	trans	-63.9	-46.4	175.7	0	0	0	0	0	112.4	V40 P58 F59 Q60 I66	V40-A62 HydrophobicContact CG2-CB 4.06Å; P58-A62 PolarHBondContact O-N 3.1Å; F59-A62 PolarHBondContact O-N 2.88Å; Q60-A62 VanDerWaalsContact C-N 3.34Å; A62-I66 VanDerWaalsContact O-CB 3.28Å; A62-I66 WeakPolarHBondContact O-CB 3.11Å; A62-I66 WeakPolarHBondContact O-CD1 3.42Å; A62-I66 WeakPolarHBondContact O-CG1 3.42Å; A62-I66 PolarHBondContact O-N 3.24Å
63	E	36.6	Very low	35.3	Very low	26 Å²	26	77.7 Å²	77.7	12%	0.121	39%	0.393	C	S	.	.	H	α-helix	trans	-57.8	-55.1	175.7	178.1	-171	-158.1	0	0	111.4	L52 F59 Q60 W65 I66 R67	L52-E63 VanDerWaalsContact CB-CD 3.4Å; L52-E63 HydrophobicContact CB-CG 4.4Å; L52-E63 WeakPolarHBondContact CB-OE2 3.48Å; L52-E63 HydrophobicContact CD1-CB 4.39Å; L52-E63 VanDerWaalsContact CD1-CD 3.48Å; L52-E63 HydrophobicContact CD1-CG 3.85Å; L52-E63 VanDerWaalsContact CD1-OE1 3.28Å; L52-E63 WeakPolarHBondContact CD1-OE1 3.09Å; F59-E63 PolarHBondContact O-N 2.88Å; Q60-E63 PolarHBondContact O-N 3.05Å; E63-W65 VanDerWaalsContact C-N 3.32Å; E63-W65 PolarHBondContact O-N 3.28Å; E63-I66 PolarHBondContact O-N 3.44Å; E63-R67 HydrophobicContact CG-CG 4.27Å; E63-R67 WeakPolarHBondContact O-CB 3.49Å; E63-R67 WeakPolarHBondContact O-CG 3.34Å; E63-R67 PolarHBondContact O-N 3.4Å; E63-R67 IonicContact OE1-CZ 2.65Å; E63-R67 IonicContact OE1-NE 2.69Å; E63-R67 PolarHBondContact OE1-NE 3.32Å; E63-R67 IonicContact OE1-NH2 3.19Å; E63-R67 PolarHBondContact OE1-NH2 2.95Å
64	S	34.7	Very low	35	Very low	59 Å²	59	81.3 Å²	81.3	41%	0.413	40%	0.403	S	S	.	.	H	α-helix	trans	-60.3	-42.6	-176.1	50.9	0	0	0	0	111.9	Q60 S61 R67 D68	Q60-S64 WeakPolarHBondContact O-CB 3.32Å; Q60-S64 PolarHBondContact O-N 3.4Å; Q60-S64 PolarHBondContact O-OG 3Å; S61-S64 PolarHBondContact O-OG 3.19Å; S64-R67 PolarHBondContact O-N 3.29Å; S64-D68 WeakPolarHBondContact O-CB 3.15Å; S64-D68 PolarHBondContact O-N 2.97Å
65	W	39.3	Very low	34.7	Very low	60 Å²	60	81.5 Å²	81.5	23%	0.227	40%	0.4	C	S	.	.	H	α-helix	trans	-68.5	-36	177.9	-170.3	101.7	0	0	0	113	L20 D23 L24 S61 E63 R69	L20-W65 HydrophobicContact CD1-CH2 3.65Å; L20-W65 HydrophobicContact CD1-CZ3 3.56Å; L20-W65 HydrophobicContact CD2-CZ3 4.34Å; L20-W65 HydrophobicContact CG-CH2 3.73Å; L20-W65 HydrophobicContact CG-CZ3 3.67Å; D23-W65 HydrophobicContact CB-CH2 4.4Å; D23-W65 HydrophobicContact CB-CZ2 3.91Å; L24-W65 HydrophobicContact CD1-CH2 4.05Å; L24-W65 HydrophobicContact CD1-CZ3 3.99Å; L24-W65 HydrophobicContact CD2-CD2 3.85Å; L24-W65 HydrophobicContact CD2-CE3 3.81Å; L24-W65 HydrophobicContact CD2-CG 4.49Å; L24-W65 HydrophobicContact CD2-CH2 3.91Å; L24-W65 HydrophobicContact CD2-CZ2 3.95Å; L24-W65 HydrophobicContact CD2-CZ3 3.84Å; L24-W65 HydrophobicContact CG-CE3 4.39Å; L24-W65 HydrophobicContact CG-CH2 3.62Å; L24-W65 HydrophobicContact CG-CZ2 3.89Å; L24-W65 HydrophobicContact CG-CZ3 3.9Å; S61-W65 WeakPolarHBondContact O-CB 3.31Å; S61-W65 PolarHBondContact O-N 3.07Å; E63-W65 VanDerWaalsContact C-N 3.32Å; E63-W65 PolarHBondContact O-N 3.28Å; W65-R69 WeakPolarHBondContact O-CB 3.41Å; W65-R69 PolarHBondContact O-N 2.9Å; W65-R69 VanDerWaalsContact O-N 3.14Å
66	I	40.4	Very low	34.6	Very low	42 Å²	42	85 Å²	85	22%	0.215	42%	0.419	C	S	.	.	H	α-helix	trans	-66.1	-48.4	172.1	-74.8	166.4	0	0	0	110.5	V40 A62 E63 R69 W70	V40-I66 HydrophobicContact CG1-CD1 3.82Å; A62-I66 VanDerWaalsContact O-CB 3.28Å; A62-I66 WeakPolarHBondContact O-CB 3.11Å; A62-I66 WeakPolarHBondContact O-CD1 3.42Å; A62-I66 WeakPolarHBondContact O-CG1 3.42Å; A62-I66 PolarHBondContact O-N 3.24Å; E63-I66 PolarHBondContact O-N 3.44Å; I66-R69 PolarHBondContact O-N 3.33Å; I66-W70 HydrophobicContact CG2-CE3 4.09Å; I66-W70 WeakPolarHBondContact O-CB 3.38Å; I66-W70 PolarHBondContact O-N 2.76Å
67	R	37	Very low	34.3	Very low	118 Å²	118	87.3 Å²	87.3	45%	0.445	44%	0.437	S	S	.	.	H	α-helix	trans	-57	-52.2	177.1	-75.1	178	179.5	-102.9	6.5	111.5	E63 S64 R69 W70 I71	E63-R67 HydrophobicContact CG-CG 4.27Å; E63-R67 WeakPolarHBondContact O-CB 3.49Å; E63-R67 WeakPolarHBondContact O-CG 3.34Å; E63-R67 PolarHBondContact O-N 3.4Å; E63-R67 IonicContact OE1-CZ 2.65Å; E63-R67 IonicContact OE1-NE 2.69Å; E63-R67 PolarHBondContact OE1-NE 3.32Å; E63-R67 IonicContact OE1-NH2 3.19Å; E63-R67 PolarHBondContact OE1-NH2 2.95Å; S64-R67 PolarHBondContact O-N 3.29Å; R67-R69 VanDerWaalsContact C-N 3.32Å; R67-R69 PolarHBondContact O-N 2.92Å; R67-W70 PolarHBondContact O-N 2.68Å; R67-W70 VanDerWaalsContact O-N 3.17Å; R67-I71 VanDerWaalsContact O-CG1 3.3Å; R67-I71 WeakPolarHBondContact O-CG1 3.39Å; R67-I71 PolarHBondContact O-N 2.95Å
68	D	36.2	Very low	34.2	Very low	101 Å²	101	87.3 Å²	87.3	54%	0.54	44%	0.443	S	S	.	.	H	α-helix	trans	-57	-45.2	179.5	-78.5	-9.6	0	0	0	111.2	S64 I71 F72	S64-D68 WeakPolarHBondContact O-CB 3.15Å; S64-D68 PolarHBondContact O-N 2.97Å; D68-I71 PolarHBondContact O-N 2.97Å; D68-F72 WeakPolarHBondContact O-CD2 3.45Å; D68-F72 PolarHBondContact O-N 3.38Å
69	R	35.3	Very low	33.9	Very low	108 Å²	108	92.7 Å²	92.7	41%	0.408	46%	0.459	S	S	.	.	H	α-helix	trans	-76.1	-23.3	178.7	-71.9	-171.2	168.1	-150.8	-0.8	114.4	D23 W65 I66 R67 F72	D23-R69 IonicContact OD2-CZ 2.63Å; D23-R69 IonicContact OD2-NH1 3.21Å; D23-R69 PolarHBondContact OD2-NH1 3.41Å; D23-R69 IonicContact OD2-NH2 3.88Å; D23-R69 PolarHBondContact OD2-NH2 2.88Å; W65-R69 WeakPolarHBondContact O-CB 3.41Å; W65-R69 PolarHBondContact O-N 2.9Å; W65-R69 VanDerWaalsContact O-N 3.14Å; I66-R69 PolarHBondContact O-N 3.33Å; R67-R69 VanDerWaalsContact C-N 3.32Å; R67-R69 PolarHBondContact O-N 2.92Å; R69-F72 WeakPolarHBondContact O-CB 3.32Å
70	W	31.6	Very low	33.4	Very low	127 Å²	127	97 Å²	97	48%	0.481	49%	0.491	S	S	.	.	H	α-helix	trans	-72.4	-38.7	171.6	-155.4	-44.7	0	0	0	110.9	I66 R67 F72 R73 E74	I66-W70 HydrophobicContact CG2-CE3 4.09Å; I66-W70 WeakPolarHBondContact O-CB 3.38Å; I66-W70 PolarHBondContact O-N 2.76Å; R67-W70 PolarHBondContact O-N 2.68Å; R67-W70 VanDerWaalsContact O-N 3.17Å; W70-F72 VanDerWaalsContact C-N 3.25Å; W70-F72 PolarHBondContact O-N 3.47Å; W70-R73 WeakPolarHBondContact O-CA 3.28Å; W70-R73 WeakPolarHBondContact O-CB 3.17Å; W70-R73 PolarHBondContact O-N 2.78Å; W70-E74 PolarHBondContact O-N 3.13Å
71	I	28.5	Very low	33	Very low	63 Å²	63	102.6 Å²	102.6	32%	0.323	52%	0.519	S	S	.	.	H	α-helix	trans	-62.1	-33.3	174.2	-68.2	164.7	0	0	0	111.5	R67 D68 R73 N75	R67-I71 VanDerWaalsContact O-CG1 3.3Å; R67-I71 WeakPolarHBondContact O-CG1 3.39Å; R67-I71 PolarHBondContact O-N 2.95Å; D68-I71 PolarHBondContact O-N 2.97Å; I71-R73 PolarHBondContact O-N 2.78Å; I71-N75 WeakPolarHBondContact CG2-ND2 3.17Å; I71-N75 PolarHBondContact O-N 3.49Å; I71-N75 PolarHBondContact O-ND2 3.38Å
72	F	27.4	Very low	32.7	Very low	149 Å²	149	106.9 Å²	106.9	65%	0.654	53%	0.532	S	S	*	.	H	α-helix	trans	-63.4	-23.5	168.7	-95.2	-85.2	0	0	0	113.7	D68 R69 W70 N76	D68-F72 WeakPolarHBondContact O-CD2 3.45Å; D68-F72 PolarHBondContact O-N 3.38Å; R69-F72 WeakPolarHBondContact O-CB 3.32Å; W70-F72 VanDerWaalsContact C-N 3.25Å; W70-F72 PolarHBondContact O-N 3.47Å; F72-N76 WeakPolarHBondContact O-CB 3.38Å; F72-N76 PolarHBondContact O-ND2 2.81Å
73	R	30.5	Very low	32.1	Very low	174 Å²	174	115.7 Å²	115.7	66%	0.657	57%	0.57	S	S	*	*	H	α-helix	trans	-81.8	-38.9	-180	-151.3	-179.9	-159.7	-151.8	6.1	112.5	W70 I71 S77	W70-R73 WeakPolarHBondContact O-CA 3.28Å; W70-R73 WeakPolarHBondContact O-CB 3.17Å; W70-R73 PolarHBondContact O-N 2.78Å; I71-R73 PolarHBondContact O-N 2.78Å; R73-S77 WeakPolarHBondContact O-CB 3.27Å
74	E	32.2	Very low	31.5	Very low	141 Å²	141	120.6 Å²	120.6	66%	0.659	60%	0.602	S	S	*	*	H	α-helix	trans	-76.7	-44.7	-179.3	-62	-167.1	147.5	0	0	111.9	W70 N76 S77	W70-E74 PolarHBondContact O-N 3.13Å; E74-N76 VanDerWaalsContact C-N 3.32Å; E74-N76 PolarHBondContact O-N 3.34Å; E74-S77 PolarHBondContact O-N 3.42Å
75	N	32.3	Very low	31.1	Very low	123 Å²	123	125.2 Å²	125.2	66%	0.658	62%	0.621	S	S	*	*	H	α-helix	trans	-70.7	-21.4	-176.2	-73.9	-51	0	0	0	114.7	I71	I71-N75 WeakPolarHBondContact CG2-ND2 3.17Å; I71-N75 PolarHBondContact O-N 3.49Å; I71-N75 PolarHBondContact O-ND2 3.38Å
76	N	34	Very low	30.3	Very low	99 Å²	99	127.1 Å²	127.1	53%	0.529	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.9	0.2	-178.6	-63.3	-69.4	0	0	0	114.1	F72 E74 A78	F72-N76 WeakPolarHBondContact O-CB 3.38Å; F72-N76 PolarHBondContact O-ND2 2.81Å; E74-N76 VanDerWaalsContact C-N 3.32Å; E74-N76 PolarHBondContact O-N 3.34Å; N76-A78 VanDerWaalsContact C-N 3.32Å; N76-A78 PolarHBondContact O-N 3.33Å
77	S	32.4	Very low	29.6	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	67%	0.673	S	S	*	*	S	Bend	trans	-84.9	6.8	-173.3	-171.1	0	0	0	0	115.1	R73 E74	R73-S77 WeakPolarHBondContact O-CB 3.27Å; E74-S77 PolarHBondContact O-N 3.42Å
78	A	30.6	Very low	28.9	Very low	88 Å²	88	136.3 Å²	136.3	73%	0.727	69%	0.69	S	S	*	*	S	Bend	trans	-127.8	-39	-171.2	0	0	0	0	0	115.7	N76	N76-A78 VanDerWaalsContact C-N 3.32Å; N76-A78 PolarHBondContact O-N 3.33Å
79	K	28	Very low	28.4	Very low	183 Å²	183	141.4 Å²	141.4	80%	0.796	71%	0.708	S	S	*	*	S	Bend	trans	-151.7	162.9	-175.5	-61.5	-174.5	-177.2	176.9	0	109.9
80	S	28.4	Very low	27.8	Very low	107 Å²	107	139.8 Å²	139.8	75%	0.748	73%	0.725	S	S	*	*			trans	72.9	49.5	176.1	-162	0	0	0	0	116.7	E82	S80-E82 PolarHBondContact O-N 3.18Å
81	M	27.1	Very low	27.4	Very low	197 Å²	197	141.4 Å²	141.4	97%	0.97	74%	0.742	S	S	*	*			trans	-84.9	34	163.5	-165.2	171.6	157.6	0	0	112.3
82	E	25.2	Very low	27.3	Very low	163 Å²	163	150.2 Å²	150.2	76%	0.762	77%	0.771	S	S	*	*			trans	-135.6	94.9	174.6	-71.9	-168.9	134.2	0	0	109.7	S80	S80-E82 PolarHBondContact O-N 3.18Å
83	H	26.9	Very low	27.1	Very low	196 Å²	196	150.3 Å²	150.3	91%	0.907	78%	0.777	S	S	*	*			trans	-172.8	117	134.9	-104.1	-66.6	0	0	0	110.7
84	T	23.8	Very low	26.9	Very low	129 Å²	129	146.3 Å²	146.3	79%	0.791	78%	0.781	S	S	*	*			trans	-72.7	132.7	-172.1	-48.4	0	0	0	0	113.1
85	L	25	Very low	26.5	Very low	156 Å²	156	146 Å²	146	82%	0.817	78%	0.784	S	S	*	*			trans	-109.3	137.9	153.8	-78.7	173	0	0	0	110.1	L87	L85-L87 PolarHBondContact O-N 3.46Å; L85-L87 VanDerWaalsContact O-N 3.1Å
86	P	23.2	Very low	26.2	Very low	101 Å²	101	146 Å²	146	66%	0.656	79%	0.791	S	S	*	*			trans	-87.3	88.5	-157.3	33.6	-37.4	0	0	0	114.1	K88	P86-K88 PolarHBondContact O-N 3.48Å
87	L	25.5	Very low	25.9	Very low	168 Å²	168	147.7 Å²	147.7	88%	0.88	81%	0.805	S	S	*	*			trans	-68.8	77.5	161.8	-80.9	168.1	0	0	0	110.9	L85	L85-L87 PolarHBondContact O-N 3.46Å; L85-L87 VanDerWaalsContact O-N 3.1Å
88	K	23.5	Very low	25.6	Very low	184 Å²	184	147.3 Å²	147.3	80%	0.8	80%	0.802	S	S	*	*			trans	-74.4	124.9	177.4	-98.8	-179.9	174.8	174.1	0	111.5	P86	P86-K88 PolarHBondContact O-N 3.48Å
89	K	24.6	Very low	25.3	Very low	208 Å²	208	148.9 Å²	148.9	90%	0.904	81%	0.805	S	S	*	*	S	Bend	trans	73.3	124.1	173	-51.2	173.4	179	-179.9	0	114.2
90	G	23.4	Very low	25.2	Very low	75 Å²	75	145.1 Å²	145.1	77%	0.773	80%	0.801	S	S	*	*	S	Bend	trans	165.1	-108.7	179.2	0	0	0	0	0	111.8
91	L	23.7	Very low	25.1	Very low	160 Å²	160	147.4 Å²	147.4	84%	0.838	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-81.1	128.2	-176.6	-96	57.7	0	0	0	112.8
92	R	24.6	Very low	25.2	Very low	249 Å²	249	146.7 Å²	146.7	94%	0.94	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-78.8	116.6	151.3	-65.9	-174.4	-175.5	-173.6	2.2	107	A94	R92-A94 PolarHBondContact O-N 3.23Å
93	I	24.7	Very low	25.3	Very low	150 Å²	150	143.4 Å²	143.4	77%	0.769	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-68.2	127.8	167	-60.6	170.8	0	0	0	106.5
94	A	25.2	Very low	25.2	Very low	91 Å²	91	143.9 Å²	143.9	75%	0.752	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-91.7	129.6	168.1	0	0	0	0	0	108.1	R92	R92-A94 PolarHBondContact O-N 3.23Å
95	D	25.1	Very low	25.5	Very low	135 Å²	135	144.6 Å²	144.6	72%	0.722	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-66.8	146	-174.2	-64.4	-65.1	0	0	0	112.6	V97	D95-V97 PolarHBondContact O-N 3.44Å
96	P	25.7	Very low	25.7	Very low	121 Å²	121	143.6 Å²	143.6	79%	0.786	79%	0.794	S	S	*	*			trans	-72.6	94.9	177.3	30.1	-34.3	0	0	0	110.6	S98	P96-S98 PolarHBondContact O-N 3.09Å
97	V	26.8	Very low	26	Very low	136 Å²	136	145.6 Å²	145.6	82%	0.824	79%	0.794	S	S	*	*			trans	-66.3	114.6	174.3	-179.1	0	0	0	0	109.8	D95	D95-V97 PolarHBondContact O-N 3.44Å
98	S	25.6	Very low	26.1	Very low	96 Å²	96	144.3 Å²	144.3	67%	0.671	79%	0.788	S	S	*	*			trans	-63.2	146.2	176.6	-67.4	0	0	0	0	112.4	P96 S100	P96-S98 PolarHBondContact O-N 3.09Å; S98-S100 PolarHBondContact O-N 3.26Å; S98-S100 VanDerWaalsContact O-N 3.08Å
99	P	24.9	Very low	26.4	Very low	122 Å²	122	142.6 Å²	142.6	79%	0.792	78%	0.78	S	S	*	*			trans	-71.3	104.5	179.4	29.1	-34.3	0	0	0	111.2
100	S	26.6	Very low	26.7	Very low	103 Å²	103	139.6 Å²	139.6	72%	0.72	77%	0.774	S	S	*	*			trans	-87.2	119.1	172.5	50.7	0	0	0	0	111.1	S98 H102	S98-S100 PolarHBondContact O-N 3.26Å; S98-S100 VanDerWaalsContact O-N 3.08Å; S100-H102 PolarHBondContact O-N 3.03Å; S100-H102 VanDerWaalsContact O-N 3.09Å
101	N	26.2	Very low	27.1	Very low	156 Å²	156	147.5 Å²	147.5	83%	0.834	78%	0.781	S	S	*	*			trans	-73.9	95.9	176.9	-65	-47.3	0	0	0	110.9
102	H	29.2	Very low	27.5	Very low	181 Å²	181	149 Å²	149	84%	0.838	78%	0.78	S	S	*	*			trans	-138.5	140	162.3	-88.2	-71.7	0	0	0	112.1	S100	S100-H102 PolarHBondContact O-N 3.03Å; S100-H102 VanDerWaalsContact O-N 3.09Å
103	A	27.6	Very low	27.6	Very low	94 Å²	94	144.5 Å²	144.5	78%	0.777	77%	0.774	S	S	*	*			trans	-75.5	141.4	-171.9	0	0	0	0	0	112.6	N105	A103-N105 PolarHBondContact O-N 3.27Å
104	F	25.1	Very low	27.9	Very low	207 Å²	207	145.8 Å²	145.8	91%	0.908	78%	0.778	S	S	*	*			trans	-65.4	125.5	162.4	-95.4	-102	0	0	0	109.9
105	N	29.3	Very low	28	Very low	143 Å²	143	150.2 Å²	150.2	77%	0.765	78%	0.781	S	S	*	*			trans	-154.4	128	158.6	-103.5	-30.1	0	0	0	111.3	A103	A103-N105 PolarHBondContact O-N 3.27Å
106	N	29.6	Very low	28.3	Very low	135 Å²	135	150.2 Å²	150.2	72%	0.722	79%	0.785	S	S	*	*			trans	67.5	131.8	154.2	-67.2	-1.1	0	0	0	122.7
107	E	29.8	Very low	28.3	Very low	143 Å²	143	150.5 Å²	150.5	67%	0.668	78%	0.78	S	S	*	*			trans	63.4	110.4	143.4	-64.4	-167.9	103.2	0	0	119.9	K109	E107-K109 IonicContact OE1-NZ 3.74Å
108	L	27.2	Very low	28.6	Very low	141 Å²	141	153.2 Å²	153.2	74%	0.738	78%	0.784	S	S	*	*				80.7	142.2	72.8	-98.3	90.9	0	0	0	115.6
109	K	29.6	Very low	28.6	Very low	149 Å²	149	156.1 Å²	156.1	65%	0.648	79%	0.792	S	S	*	*			trans	85.7	115.2	156.2	-67.6	147.6	-175.1	160.5	0	119.8	E107	E107-K109 IonicContact OE1-NZ 3.74Å
110	N	31.4	Very low	28.9	Very low	144 Å²	144	155.4 Å²	155.4	77%	0.77	79%	0.79	S	S	*	*			trans	81	96.7	132.2	-57.3	-13.4	0	0	0	121.7
111	R	32.6	Very low	28.9	Very low	241 Å²	241	157.4 Å²	157.4	91%	0.909	80%	0.798	S	S	*	*				167.6	119.6	114	-88.7	160.8	-179.6	-167.6	0	108.8
112	K	31.2	Very low	29	Very low	192 Å²	192	155.3 Å²	155.3	84%	0.835	79%	0.791	S	S	*	*				84.5	80.1	56.2	-165.1	177.5	-176.2	180	0	113.8
113	I	27.3	Very low	28.8	Very low	155 Å²	155	153.1 Å²	153.1	80%	0.795	79%	0.79	S	S	*	*			trans	28.6	120.8	143.1	-49.9	169	0	0	0	117.9
114	M	30.7	Very low	28.7	Very low	176 Å²	176	154.7 Å²	154.7	87%	0.867	79%	0.79	S	S	*	*			trans	-134.4	138.5	139.6	-74.7	-170.5	64.4	0	0	109.9
115	K	27.7	Very low	28.9	Very low	185 Å²	185	149.7 Å²	149.7	80%	0.804	78%	0.781	S	S	*	*			trans	-99.4	145.9	163.5	-77	-171.8	173.4	-169.1	0	108.8
116	V	30.1	Very low	28.7	Very low	134 Å²	134	145.3 Å²	145.3	81%	0.812	77%	0.769	S	S	*	*			trans	-140.7	119.8	157.5	179	0	0	0	0	107.7
117	D	26.2	Very low	28.4	Very low	128 Å²	128	144.6 Å²	144.6	68%	0.684	77%	0.772	S	S	*	*			trans	-82.4	144	165.9	-73.1	-66.4	0	0	0	109.9
118	Q	32.6	Very low	28.2	Very low	192 Å²	192	143.6 Å²	143.6	90%	0.897	78%	0.776	S	S	*	*			trans	-162.5	140.2	130.8	-112	168.2	48.1	0	0	113.1
119	N	25.9	Very low	28	Very low	157 Å²	157	142.5 Å²	142.5	84%	0.84	78%	0.775	S	S	*	*			trans	-74.1	134.8	-169.7	-57.9	-45.1	0	0	0	112.6
120	S	31.7	Very low	27.8	Very low	107 Å²	107	143.8 Å²	143.8	75%	0.748	78%	0.783	S	S	*	*			trans	-144.4	115.8	151.1	51.2	0	0	0	0	109.8	T122	S120-T122 PolarHBondContact O-N 2.65Å
121	T	26.1	Very low	27.5	Very low	145 Å²	145	145.2 Å²	145.2	89%	0.89	78%	0.782	S	S	*	*			trans	-77.1	88.2	-165.7	-47.6	0	0	0	0	111.8
122	T	27.9	Very low	27.1	Very low	113 Å²	113	136.9 Å²	136.9	69%	0.693	77%	0.765	S	S	*	*			trans	-110	124.8	166.5	-54.7	0	0	0	0	108.8	S120 V124	S120-T122 PolarHBondContact O-N 2.65Å; T122-V124 VanDerWaalsContact C-N 3.3Å; T122-V124 PolarHBondContact O-N 2.97Å
123	T	26.3	Very low	26.8	Very low	134 Å²	134	134.1 Å²	134.1	82%	0.822	76%	0.759	S	S	*	*			trans	-71	84.1	179.9	-47.5	0	0	0	0	110.5	S125	T123-S125 PolarHBondContact O-N 3.22Å
124	V	25.6	Very low	26.8	Very low	128 Å²	128	136.7 Å²	136.7	78%	0.776	76%	0.759	S	S	*	*			trans	-67.2	101.6	171.1	-177.9	0	0	0	0	107.7	T122 G126	T122-V124 VanDerWaalsContact C-N 3.3Å; T122-V124 PolarHBondContact O-N 2.97Å; V124-G126 PolarHBondContact O-N 2.65Å; V124-G126 VanDerWaalsContact O-N 3.12Å
125	S	27.6	Very low	26.5	Very low	102 Å²	102	133 Å²	133	71%	0.713	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-56.8	117	166	55.7	0	0	0	0	108.2	T123	T123-S125 PolarHBondContact O-N 3.22Å
126	G	25.7	Very low	26.5	Very low	51 Å²	51	129.1 Å²	129.1	53%	0.526	74%	0.738	S	S	.	*	P	Polyproline II helix	trans	-53.9	151.1	170.8	0	0	0	0	0	109.9	V124 T128	V124-G126 PolarHBondContact O-N 2.65Å; V124-G126 VanDerWaalsContact O-N 3.12Å; G126-T128 PolarHBondContact O-N 2.69Å
127	P	24	Very low	26.4	Very low	120 Å²	120	124.7 Å²	124.7	78%	0.779	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-56.9	119.7	-177.8	24.4	-33.6	0	0	0	109.2	V129	P127-V129 VanDerWaalsContact C-N 3.29Å; P127-V129 PolarHBondContact O-N 2.84Å
128	T	24.2	Very low	26.4	Very low	121 Å²	121	119.6 Å²	119.6	74%	0.742	69%	0.689	S	S	*	*			trans	-62.7	96	173	-51.7	0	0	0	0	107.5	G126 H130	G126-T128 PolarHBondContact O-N 2.69Å; T128-H130 PolarHBondContact O-N 2.9Å
129	V	24.1	Very low	26.2	Very low	118 Å²	118	115.7 Å²	115.7	72%	0.715	67%	0.67	S	S	*	*			trans	-63.2	103	175.9	179	0	0	0	0	106.2	P127 K131	P127-V129 VanDerWaalsContact C-N 3.29Å; P127-V129 PolarHBondContact O-N 2.84Å; V129-K131 PolarHBondContact O-N 3.43Å
130	H	25.1	Very low	26.3	Very low	176 Å²	176	115.2 Å²	115.2	82%	0.815	66%	0.662	S	S	*	*			trans	-64.5	83.6	164.6	-88.8	-85.5	0	0	0	107.3	T128 A132	T128-H130 PolarHBondContact O-N 2.9Å; H130-A132 PolarHBondContact O-N 3.01Å
131	K	24.1	Very low	26.1	Very low	174 Å²	174	113.7 Å²	113.7	76%	0.757	65%	0.649	S	S	*	*			trans	-65.3	91	171.3	-164.9	-176.9	-173.8	-171	0	105.6	V129 N133	V129-K131 PolarHBondContact O-N 3.43Å; K131-N133 PolarHBondContact O-N 3.47Å; K131-N133 PolarHBondContact O-OD1 3.44Å
132	A	24.7	Very low	26.3	Very low	66 Å²	66	111.2 Å²	111.2	55%	0.545	63%	0.629	S	S	.	*			trans	-59.9	115.5	177.4	0	0	0	0	0	107.2	H130 R134	H130-A132 PolarHBondContact O-N 3.01Å; A132-R134 HydrophobicContact CB-CG 4.04Å; A132-R134 PolarHBondContact O-N 3.11Å
133	N	24.9	Very low	26.2	Very low	134 Å²	134	110.6 Å²	110.6	72%	0.717	62%	0.621	S	S	*	*			trans	-72.1	69.9	178.6	-72.9	-14.3	0	0	0	109.3	K131 S135	K131-N133 PolarHBondContact O-N 3.47Å; K131-N133 PolarHBondContact O-OD1 3.44Å; N133-S135 PolarHBondContact O-N 3.3Å
134	R	27.2	Very low	26.3	Very low	210 Å²	210	110 Å²	110	79%	0.792	61%	0.609	S	S	*	*			trans	-77.4	2	179.5	-73.1	-176.8	167.9	-170.6	-4.8	113	A132 L136	A132-R134 HydrophobicContact CB-CG 4.04Å; A132-R134 PolarHBondContact O-N 3.11Å; R134-L136 PolarHBondContact O-N 3.31Å
135	S	24.5	Very low	26.4	Very low	97 Å²	97	108.3 Å²	108.3	68%	0.678	60%	0.602	S	S	*	*			trans	-74.8	69.5	162.4	54.5	0	0	0	0	109.9	N133 P137	N133-S135 PolarHBondContact O-N 3.3Å; S135-P137 WeakPolarHBondContact O-CD 3.47Å
136	L	28.2	Very low	26.4	Very low	105 Å²	105	106.8 Å²	106.8	55%	0.55	60%	0.602	S	S	.	*			trans	-73.1	120.7	157.7	-80.4	170.4	0	0	0	107.1	R134 F139	R134-L136 PolarHBondContact O-N 3.31Å; L136-F139 HydrophobicContact CB-CB 4.1Å; L136-F139 HydrophobicContact CB-CD2 3.81Å; L136-F139 HydrophobicContact CB-CG 4.28Å; L136-F139 HydrophobicContact CD1-CD2 3.71Å; L136-F139 HydrophobicContact CD1-CE2 3.75Å; L136-F139 HydrophobicContact CG-CD2 4.43Å; L136-F139 WeakPolarHBondContact O-CB 3.33Å; L136-F139 PolarHBondContact O-N 3.26Å; L136-F139 VanDerWaalsContact O-N 3.16Å
137	P	26.8	Very low	26.3	Very low	41 Å²	41	111.6 Å²	111.6	27%	0.266	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.8	142.2	172.6	-26.4	38.6	0	0	0	110.3	S135 F139 L309 D310 S313	S135-P137 WeakPolarHBondContact O-CD 3.47Å; P137-F139 VanDerWaalsContact C-N 3.29Å; P137-F139 PolarHBondContact O-N 2.83Å; P137-L309 HydrophobicContact CG-CB 3.81Å; P137-D310 WeakPolarHBondContact CG-OD1 3.29Å; P137-S313 VanDerWaalsContact CB-CB 3.45Å
138	G	27	Very low	26.5	Very low	21 Å²	21	111.6 Å²	111.6	22%	0.216	61%	0.606	C	S	.	*	T	Hydrogen-bonded Turn	trans	83.7	-22.3	-173	0	0	0	0	0	115.8	Q140 T141 I142 S313	G138-Q140 VanDerWaalsContact C-N 3.26Å; G138-Q140 PolarHBondContact O-N 3.34Å; G138-T141 WeakPolarHBondContact O-CA 3.2Å; G138-T141 VanDerWaalsContact O-CB 3.24Å; G138-T141 WeakPolarHBondContact O-CB 3.39Å; G138-T141 PolarHBondContact O-N 3.32Å; G138-I142 WeakPolarHBondContact O-CG1 3.33Å; G138-I142 PolarHBondContact O-N 2.63Å; G138-S313 PolarHBondContact N-OG 3.05Å
139	F	28.7	Very low	26.5	Very low	110 Å²	110	112.7 Å²	112.7	48%	0.482	61%	0.607	S	S	.	*	H	α-helix	trans	-63.4	-32.5	-179.6	-128.5	-94.6	0	0	0	112.9	L136 P137 L143	L136-F139 HydrophobicContact CB-CB 4.1Å; L136-F139 HydrophobicContact CB-CD2 3.81Å; L136-F139 HydrophobicContact CB-CG 4.28Å; L136-F139 HydrophobicContact CD1-CD2 3.71Å; L136-F139 HydrophobicContact CD1-CE2 3.75Å; L136-F139 HydrophobicContact CG-CD2 4.43Å; L136-F139 WeakPolarHBondContact O-CB 3.33Å; L136-F139 PolarHBondContact O-N 3.26Å; L136-F139 VanDerWaalsContact O-N 3.16Å; P137-F139 VanDerWaalsContact C-N 3.29Å; P137-F139 PolarHBondContact O-N 2.83Å; F139-L143 WeakPolarHBondContact O-CG 3.25Å; F139-L143 PolarHBondContact O-N 2.86Å
140	Q	27.4	Very low	26.6	Very low	146 Å²	146	113.6 Å²	113.6	68%	0.682	61%	0.612	S	S	*	*	H	α-helix	trans	-72.6	-34.2	173.7	-164.7	129.8	-19.8	0	0	111.9	G138 L143 Q144	G138-Q140 VanDerWaalsContact C-N 3.26Å; G138-Q140 PolarHBondContact O-N 3.34Å; Q140-L143 CarbonylContact O-C 3.56Å; Q140-L143 PolarHBondContact O-N 3.37Å; Q140-Q144 WeakPolarHBondContact O-CG 3.28Å; Q140-Q144 PolarHBondContact O-N 3.42Å
141	T	28.2	Very low	26.7	Very low	76 Å²	76	110.8 Å²	110.8	47%	0.466	60%	0.603	S	S	.	*	H	α-helix	trans	-64.1	-45.9	174.2	-41.3	0	0	0	0	110.9	G138 L143 Q144 C145	G138-T141 WeakPolarHBondContact O-CA 3.2Å; G138-T141 VanDerWaalsContact O-CB 3.24Å; G138-T141 WeakPolarHBondContact O-CB 3.39Å; G138-T141 PolarHBondContact O-N 3.32Å; T141-L143 PolarHBondContact O-N 2.71Å; T141-Q144 CarbonylContact O-C 3.52Å; T141-Q144 WeakPolarHBondContact O-CA 3.13Å; T141-Q144 PolarHBondContact O-N 3.48Å; T141-C145 PolarHBondContact O-N 3.28Å; T141-C145 PolarHBondContact O-SG 2.84Å; T141-C145 VanDerWaalsContact O-SG 3.42Å
142	I	29.2	Very low	26.7	Very low	92 Å²	92	110.1 Å²	110.1	47%	0.472	61%	0.608	S	S	.	*	H	α-helix	trans	-56.3	-40.6	174.1	-66.6	165.7	0	0	0	110.8	G138 Q144 G146	G138-I142 WeakPolarHBondContact O-CG1 3.33Å; G138-I142 PolarHBondContact O-N 2.63Å; I142-Q144 PolarHBondContact O-N 3.5Å; I142-G146 PolarHBondContact O-N 3.36Å
143	L	27.3	Very low	26.7	Very low	100 Å²	100	112.6 Å²	112.6	52%	0.524	62%	0.616	S	S	.	*	H	α-helix	trans	-76.2	-1.5	175.8	-68.7	170.9	0	0	0	115	F139 Q140 T141 K147	F139-L143 WeakPolarHBondContact O-CG 3.25Å; F139-L143 PolarHBondContact O-N 2.86Å; Q140-L143 CarbonylContact O-C 3.56Å; Q140-L143 PolarHBondContact O-N 3.37Å; T141-L143 PolarHBondContact O-N 2.71Å; L143-K147 VanDerWaalsContact O-CD 3.31Å; L143-K147 WeakPolarHBondContact O-CD 3.32Å; L143-K147 WeakPolarHBondContact O-CE 3.41Å; L143-K147 PolarHBondContact O-NZ 2.99Å
144	Q	28.1	Very low	26.7	Very low	123 Å²	123	114.1 Å²	114.1	58%	0.575	62%	0.624	S	S	*	*	H	α-helix	trans	-114.4	-35.1	175.5	-73.9	179.7	-57.8	0	0	112.8	Q140 T141 I142 G146 K147	Q140-Q144 WeakPolarHBondContact O-CG 3.28Å; Q140-Q144 PolarHBondContact O-N 3.42Å; T141-Q144 CarbonylContact O-C 3.52Å; T141-Q144 WeakPolarHBondContact O-CA 3.13Å; T141-Q144 PolarHBondContact O-N 3.48Å; I142-Q144 PolarHBondContact O-N 3.5Å; Q144-G146 VanDerWaalsContact C-N 3.25Å; Q144-G146 PolarHBondContact O-N 3.2Å; Q144-K147 WeakPolarHBondContact O-CA 3.41Å; Q144-K147 WeakPolarHBondContact O-CB 3.33Å; Q144-K147 PolarHBondContact O-N 2.96Å
145	C	27.6	Very low	26.5	Very low	92 Å²	92	113.1 Å²	113.1	62%	0.622	63%	0.633	S	S	*	*	H	α-helix	trans	-62.1	-33.8	172.4	-68	0	0	0	0	111.8	T141 K147	T141-C145 PolarHBondContact O-N 3.28Å; T141-C145 PolarHBondContact O-SG 2.84Å; T141-C145 VanDerWaalsContact O-SG 3.42Å; C145-K147 PolarHBondContact O-N 3.04Å; C145-K147 VanDerWaalsContact O-N 3.12Å
146	G	26.7	Very low	26.5	Very low	70 Å²	70	111.1 Å²	111.1	72%	0.722	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	13.9	169.2	0	0	0	0	0	115.7	I142 Q144	I142-G146 PolarHBondContact O-N 3.36Å; Q144-G146 VanDerWaalsContact C-N 3.25Å; Q144-G146 PolarHBondContact O-N 3.2Å
147	K	24.9	Very low	26.3	Very low	152 Å²	152	115.5 Å²	115.5	66%	0.661	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.2	33.9	-178.5	-61.8	-178.2	178.8	168	0	113.5	L143 Q144 C145	L143-K147 VanDerWaalsContact O-CD 3.31Å; L143-K147 WeakPolarHBondContact O-CD 3.32Å; L143-K147 WeakPolarHBondContact O-CE 3.41Å; L143-K147 PolarHBondContact O-NZ 2.99Å; Q144-K147 WeakPolarHBondContact O-CA 3.41Å; Q144-K147 WeakPolarHBondContact O-CB 3.33Å; Q144-K147 PolarHBondContact O-N 2.96Å; C145-K147 PolarHBondContact O-N 3.04Å; C145-K147 VanDerWaalsContact O-N 3.12Å
148	T	26.8	Very low	26.1	Very low	119 Å²	119	118.9 Å²	118.9	73%	0.73	66%	0.663	S	S	*	*	S	Bend	trans	-66.9	143.4	159.4	45.5	0	0	0	0	109.8	V150	T148-V150 PolarHBondContact O-N 3.28Å
149	L	25.5	Very low	25.8	Very low	145 Å²	145	125 Å²	125	76%	0.759	69%	0.691	S	S	*	*			trans	-63.6	122.9	-173.3	-83.4	68.4	0	0	0	110.9	D151	L149-D151 WeakPolarHBondContact CD2-OD2 3.42Å; L149-D151 PolarHBondContact O-N 2.95Å
150	V	25.9	Very low	25.7	Very low	136 Å²	136	126.1 Å²	126.1	82%	0.824	71%	0.706	S	S	*	*			trans	-83.6	78.1	154.6	-176	0	0	0	0	106.6	T148	T148-V150 PolarHBondContact O-N 3.28Å
151	D	25.8	Very low	25.4	Very low	118 Å²	118	127.3 Å²	127.3	63%	0.631	72%	0.718	S	S	*	*			trans	-72.7	129.6	163.3	-95.3	-40.9	0	0	0	108.6	L149 T153	L149-D151 WeakPolarHBondContact CD2-OD2 3.42Å; L149-D151 PolarHBondContact O-N 2.95Å; D151-T153 VanDerWaalsContact C-N 3.32Å; D151-T153 PolarHBondContact O-N 3.2Å
152	D	24.1	Very low	25.2	Very low	159 Å²	159	128.8 Å²	128.8	85%	0.85	73%	0.726	S	S	*	*	S	Bend	trans	-70.3	81.1	-178.3	-86.1	-50.6	0	0	0	111.3
153	T	25.5	Very low	24.8	Very low	118 Å²	118	130 Å²	130	72%	0.724	74%	0.743	S	S	*	*			trans	-154.7	172.8	167.8	4.2	0	0	0	0	112.4	D151 L155	D151-T153 VanDerWaalsContact C-N 3.32Å; D151-T153 PolarHBondContact O-N 3.2Å; T153-L155 PolarHBondContact O-N 3.29Å
154	L	25.6	Very low	24.7	Very low	166 Å²	166	134.6 Å²	134.6	87%	0.869	76%	0.755	S	S	*	*			trans	68.6	24.7	175.7	-49.7	-176	0	0	0	117.1	G156	L154-G156 PolarHBondContact O-N 3.05Å
155	L	23.2	Very low	24.4	Very low	190 Å²	190	137.7 Å²	137.7	100%	0.995	77%	0.769	S	S	*	*			trans	-69	78.7	149.5	-110.3	173.8	0	0	0	109.8	T153	T153-L155 PolarHBondContact O-N 3.29Å
156	G	23.2	Very low	24.3	Very low	55 Å²	55	143.1 Å²	143.1	57%	0.567	78%	0.778	S	S	*	*			trans	164.1	133.3	168.8	0	0	0	0	0	117.3	L154	L154-G156 PolarHBondContact O-N 3.05Å
157	K	25.2	Very low	24.1	Very low	196 Å²	196	145.2 Å²	145.2	85%	0.852	78%	0.779	S	S	*	*			trans	71.1	101.3	163.5	-56.3	176.8	-174.2	177.7	0	114.6
158	T	22	Very low	24	Very low	113 Å²	113	143.6 Å²	143.6	69%	0.693	79%	0.787	S	S	*	*				62.3	118.3	82.6	61.9	0	0	0	0	114.5
159	D	21.6	Very low	23.9	Very low	150 Å²	150	146 Å²	146	80%	0.802	79%	0.794	S	S	*	*			trans	60.5	96	149.4	-46.4	-25.3	0	0	0	118.1
160	T	25.3	Very low	23.7	Very low	133 Å²	133	143.9 Å²	143.9	82%	0.816	79%	0.792	S	S	*	*			trans	-160.9	138.9	149.3	-2.2	0	0	0	0	109.7	T162	T160-T162 PolarHBondContact O-N 2.8Å
161	D	21.6	Very low	23.5	Very low	171 Å²	171	144.5 Å²	144.5	91%	0.914	79%	0.79	S	S	*	*			trans	-67.1	119.9	176.1	-67.5	-72	0	0	0	111.2
162	T	24.6	Very low	23.3	Very low	106 Å²	106	145.5 Å²	145.5	65%	0.65	79%	0.794	S	S	*	*			trans	-114.4	104.4	169.9	44.6	0	0	0	0	110.4	T160 Y164	T160-T162 PolarHBondContact O-N 2.8Å; T162-Y164 PolarHBondContact O-N 3.32Å; T162-Y164 VanDerWaalsContact O-N 3.15Å
163	S	21.3	Very low	23.2	Very low	118 Å²	118	145.3 Å²	145.3	83%	0.825	79%	0.787	S	S	*	*			trans	-67	108.8	171	54.4	0	0	0	0	109.9	E165	S163-E165 PolarHBondContact O-N 2.89Å; S163-E165 VanDerWaalsContact O-N 3.12Å
164	Y	24.9	Very low	23.2	Very low	197 Å²	197	145.7 Å²	145.7	77%	0.773	79%	0.79	S	S	*	*			trans	-72.1	104.6	169.9	-83.4	-93.7	0	0	0	109.7	T162 Y166	T162-Y164 PolarHBondContact O-N 3.32Å; T162-Y164 VanDerWaalsContact O-N 3.15Å; Y164-Y166 PolarHBondContact O-N 2.84Å
165	E	22.1	Very low	23	Very low	188 Å²	188	142.5 Å²	142.5	88%	0.879	78%	0.781	S	S	*	*			trans	-67.3	108.2	174.4	-170.6	168	-143.2	0	0	109.2	S163	S163-E165 PolarHBondContact O-N 2.89Å; S163-E165 VanDerWaalsContact O-N 3.12Å
166	Y	24.3	Very low	23.2	Very low	205 Å²	205	141.3 Å²	141.3	80%	0.804	78%	0.776	S	S	*	*			trans	-68.9	136.1	-179.2	-91.5	-96.6	0	0	0	110.9	Y164 S168	Y164-Y166 PolarHBondContact O-N 2.84Å; Y166-S168 PolarHBondContact O-N 3.29Å; Y166-S168 VanDerWaalsContact O-N 3.09Å
167	P	23.5	Very low	23.2	Very low	115 Å²	115	144 Å²	144	75%	0.747	79%	0.786	S	S	*	*			trans	-57.3	116.4	171.2	-24.2	34.2	0	0	0	110.9	L169	P167-L169 PolarHBondContact O-N 3.28Å
168	S	21.6	Very low	23.3	Very low	117 Å²	117	144.1 Å²	144.1	82%	0.818	79%	0.789	S	S	*	*			trans	-74	92.1	-176.5	49.5	0	0	0	0	111.2	Y166 S170	Y166-S168 PolarHBondContact O-N 3.29Å; Y166-S168 VanDerWaalsContact O-N 3.09Å; S168-S170 PolarHBondContact O-N 3.3Å
169	L	24.9	Very low	23.3	Very low	170 Å²	170	147.8 Å²	147.8	89%	0.89	80%	0.799	S	S	*	*			trans	-63.5	101.9	168.5	-69.6	177.5	0	0	0	109.3	P167 L171	P167-L169 PolarHBondContact O-N 3.28Å; L169-L171 PolarHBondContact O-N 2.91Å
170	S	21.3	Very low	23.6	Very low	101 Å²	101	149.3 Å²	149.3	71%	0.706	80%	0.801	S	S	*	*			trans	-66.6	113	-176.8	42.2	0	0	0	0	111.1	S168 I172	S168-S170 PolarHBondContact O-N 3.3Å; S170-I172 PolarHBondContact O-N 2.94Å
171	L	21.7	Very low	23.5	Very low	149 Å²	149	149.2 Å²	149.2	78%	0.78	80%	0.8	S	S	*	*			trans	-73.7	89.6	-179	-168.4	77.8	0	0	0	110.5	L169 H173	L169-L171 PolarHBondContact O-N 2.91Å; L171-H173 PolarHBondContact O-N 3Å
172	I	22.7	Very low	23.7	Very low	139 Å²	139	147.8 Å²	147.8	71%	0.713	79%	0.792	S	S	*	*			trans	-69.8	98.7	176	-59.2	179.7	0	0	0	109.4	S170 T174	S170-I172 PolarHBondContact O-N 2.94Å; I172-T174 HydrophobicContact CG2-CG2 4.22Å; I172-T174 PolarHBondContact O-N 3.26Å
173	H	21.1	Very low	23.7	Very low	154 Å²	154	151 Å²	151	71%	0.713	80%	0.799	S	S	*	*			trans	-81.1	103.6	173.6	-117.8	-121.7	0	0	0	110.4	L171	L171-H173 PolarHBondContact O-N 3Å
174	T	26.3	Very low	23.9	Very low	127 Å²	127	155.5 Å²	155.5	78%	0.779	80%	0.8	S	S	*	*			trans	-113	79.5	168.3	40.8	0	0	0	0	110.6	I172 N176	I172-T174 HydrophobicContact CG2-CG2 4.22Å; I172-T174 PolarHBondContact O-N 3.26Å; T174-N176 PolarHBondContact O-N 3.2Å
175	S	21.1	Very low	23.9	Very low	98 Å²	98	151.8 Å²	151.8	69%	0.685	80%	0.8	S	S	*	*			trans	-70.1	118.6	169.8	54	0	0	0	0	110.9
176	N	26.8	Very low	24.1	Very low	166 Å²	166	148.2 Å²	148.2	89%	0.888	80%	0.796	S	S	*	*			trans	-158.8	131.7	141.2	-102.4	-24.8	0	0	0	111	T174	T174-N176 PolarHBondContact O-N 3.2Å
177	S	23.3	Very low	24	Very low	110 Å²	110	145.7 Å²	145.7	77%	0.769	80%	0.796	S	S	*	*			trans	-94	125	178.1	54.7	0	0	0	0	111.1
178	Q	26.9	Very low	24.1	Very low	200 Å²	200	145.3 Å²	145.3	94%	0.935	80%	0.796	S	S	*	*			trans	-155	160.4	150.6	-113.3	156.6	52.3	0	0	110.4
179	Q	23.4	Very low	24.2	Very low	189 Å²	189	145.1 Å²	145.1	88%	0.883	79%	0.792	S	S	*	*			trans	-90.1	129.6	-171.6	-62.8	161.9	-51.1	0	0	110.2
180	E	26.7	Very low	24.2	Very low	183 Å²	183	142.6 Å²	142.6	86%	0.855	79%	0.786	S	S	*	*			trans	-125.4	118.5	161.2	-77.5	-161.6	126.3	0	0	111.1	L182	E180-L182 PolarHBondContact O-N 2.88Å
181	T	22.9	Very low	24.4	Very low	130 Å²	130	148.7 Å²	148.7	80%	0.798	80%	0.795	S	S	*	*			trans	-86.4	99.1	175.6	-57.7	0	0	0	0	109	H183	T181-H183 PolarHBondContact O-N 2.95Å
182	L	26.7	Very low	24.5	Very low	141 Å²	141	149.3 Å²	149.3	74%	0.738	80%	0.796	S	S	*	*			trans	-82.3	114.3	176.4	-88.5	167.8	0	0	0	111.8	E180	E180-L182 PolarHBondContact O-N 2.88Å
183	H	24.5	Very low	24.6	Very low	175 Å²	175	150.9 Å²	150.9	81%	0.81	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-63.6	138.5	169.7	-85.4	-100.9	0	0	0	111.4	T181	T181-H183 PolarHBondContact O-N 2.95Å
184	Y	26.2	Very low	24.7	Very low	211 Å²	211	149 Å²	149	83%	0.827	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-86.8	132.3	165.7	-80.4	-94.4	0	0	0	110.3
185	P	24	Very low	24.6	Very low	120 Å²	120	146.4 Å²	146.4	78%	0.779	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-61.8	142.7	166.5	-21.3	33.8	0	0	0	111.1	D187	P185-D187 PolarHBondContact O-N 3.44Å
186	S	25.3	Very low	24.7	Very low	113 Å²	113	152.4 Å²	152.4	79%	0.79	81%	0.81	S	S	*	*	S	Bend	trans	-93.2	7.3	-164.4	-165.3	0	0	0	0	115.3
187	D	23.9	Very low	24.7	Very low	152 Å²	152	148.5 Å²	148.5	81%	0.813	80%	0.796	S	S	*	*			trans	-109.3	73.6	-168.7	-63.9	-64.2	0	0	0	112.2	P185	P185-D187 PolarHBondContact O-N 3.44Å
188	S	24.9	Very low	24.9	Very low	106 Å²	106	152.5 Å²	152.5	74%	0.741	79%	0.794	S	S	*	*			trans	-145.8	131.4	168.1	-73.6	0	0	0	0	110.5
189	P	24	Very low	25	Very low	114 Å²	114	149.2 Å²	149.2	74%	0.74	78%	0.779	S	S	*	*			trans	-66.5	144.3	-174.1	27.8	-34.7	0	0	0	111	Y191	P189-Y191 PolarHBondContact O-N 2.98Å
190	P	24.7	Very low	25.2	Very low	116 Å²	116	144.3 Å²	144.3	75%	0.753	77%	0.766	S	S	*	*			trans	-65.4	129.1	-175.8	26.5	-34.4	0	0	0	111	M192	P190-M192 PolarHBondContact O-N 3.08Å
191	Y	25.5	Very low	25.4	Very low	229 Å²	229	141.7 Å²	141.7	90%	0.898	76%	0.756	S	S	*	*			trans	-60.4	108.4	167.5	-99.4	-96.3	0	0	0	109.2	P189 L193	P189-Y191 PolarHBondContact O-N 2.98Å; Y191-L193 PolarHBondContact O-N 3.29Å
192	M	23.9	Very low	25.8	Very low	162 Å²	162	141.5 Å²	141.5	80%	0.798	75%	0.747	S	S	*	*			trans	-63.8	99.3	172.3	-77	-72	-70	0	0	109.2	P190 V194	P190-M192 PolarHBondContact O-N 3.08Å; M192-V194 VanDerWaalsContact C-N 3.31Å; M192-V194 PolarHBondContact O-N 2.99Å
193	L	24	Very low	26.1	Very low	172 Å²	172	141.4 Å²	141.4	90%	0.901	74%	0.74	S	S	*	*			trans	-64.9	91.2	170.1	-86.5	165.4	0	0	0	109.3	Y191 G195	Y191-L193 PolarHBondContact O-N 3.29Å; L193-G195 PolarHBondContact O-N 2.93Å
194	V	23.5	Very low	26.5	Very low	114 Å²	114	139 Å²	139	69%	0.691	73%	0.733	S	S	*	*			trans	-72.2	78.8	174.1	-179.1	0	0	0	0	108.9	M192 R196	M192-V194 VanDerWaalsContact C-N 3.31Å; M192-V194 PolarHBondContact O-N 2.99Å; V194-R196 VanDerWaalsContact C-N 3.3Å; V194-R196 HydrophobicContact CG1-CG 4.17Å; V194-R196 PolarHBondContact O-N 3.35Å
195	G	23.8	Very low	26.7	Very low	74 Å²	74	135.6 Å²	135.6	76%	0.763	72%	0.72	S	S	*	*			trans	-67.5	82.7	174.6	0	0	0	0	0	111.6	L193 S197	L193-G195 PolarHBondContact O-N 2.93Å; G195-S197 PolarHBondContact O-N 3.07Å
196	R	24.8	Very low	27.2	Very low	223 Å²	223	137 Å²	137	84%	0.842	72%	0.716	S	S	*	*			trans	-80.2	111.8	167.7	-82.2	-179.9	172.8	-167.4	-2.7	109.3	V194 R198	V194-R196 VanDerWaalsContact C-N 3.3Å; V194-R196 HydrophobicContact CG1-CG 4.17Å; V194-R196 PolarHBondContact O-N 3.35Å; R196-R198 PolarHBondContact O-N 3Å
197	S	25.7	Very low	27.5	Very low	84 Å²	84	136.1 Å²	136.1	59%	0.587	71%	0.71	S	S	*	*			trans	-56.1	132.9	-177.1	-59.9	0	0	0	0	113	G195 E199 S200	G195-S197 PolarHBondContact O-N 3.07Å; S197-E199 PolarHBondContact O-N 3.1Å; S197-E199 VanDerWaalsContact O-N 3.1Å; S197-S200 PolarHBondContact O-N 3.46Å
198	R	28.3	Very low	27.9	Very low	195 Å²	195	133.8 Å²	133.8	74%	0.736	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.7	-30.7	-174.3	-167.5	169.2	177.1	140.7	-0.6	114.1	R196 S200	R196-R198 PolarHBondContact O-N 3Å; R198-S200 PolarHBondContact O-N 3.41Å
199	E	27.6	Very low	28.2	Very low	130 Å²	130	133.9 Å²	133.9	61%	0.607	71%	0.706	S	S	*	*	H	α-helix	trans	-69.6	-10.1	-176.5	-56.7	179	96.8	0	0	115.6	S197	S197-E199 PolarHBondContact O-N 3.1Å; S197-E199 VanDerWaalsContact O-N 3.1Å
200	S	29.2	Very low	28.5	Very low	87 Å²	87	136.3 Å²	136.3	61%	0.608	71%	0.705	S	S	*	*	H	α-helix	trans	-85.7	-20.4	-173.9	-165.2	0	0	0	0	114.2	S197 R198	S197-S200 PolarHBondContact O-N 3.46Å; R198-S200 PolarHBondContact O-N 3.41Å
201	L	29.5	Very low	28.8	Very low	127 Å²	127	139 Å²	139	67%	0.665	71%	0.707	S	S	*	*	H	α-helix	trans	-94.7	-37.4	-177.8	-93.9	121.8	0	0	0	113.8	K203 N204	L201-K203 PolarHBondContact O-N 3.06Å; L201-N204 PolarHBondContact O-N 3.15Å
202	E	31.8	Very low	28.9	Very low	127 Å²	127	136.4 Å²	136.4	59%	0.593	71%	0.707	S	S	*	*	H	α-helix	trans	-65.9	-37.1	-174.9	-67.5	172	157.2	0	0	112.2	N204 Y205	E202-N204 PolarHBondContact O-N 3.12Å; E202-N204 VanDerWaalsContact O-N 3.12Å; E202-Y205 PolarHBondContact O-N 3.44Å; E202-Y205 VanDerWaalsContact O-N 3.15Å
203	K	32.2	Very low	29.1	Very low	139 Å²	139	134.2 Å²	134.2	60%	0.604	71%	0.708	S	S	*	*	H	α-helix	trans	-64.3	-17.6	-177.3	-70.6	172.9	-178	162	0	114.8	L201	L201-K203 PolarHBondContact O-N 3.06Å
204	N	32.9	Very low	29.3	Very low	124 Å²	124	132.8 Å²	132.8	66%	0.663	71%	0.707	S	S	*	*	H	α-helix	trans	-89.4	-19.7	177.6	-73.7	-25.7	0	0	0	113.8	L201 E202	L201-N204 PolarHBondContact O-N 3.15Å; E202-N204 PolarHBondContact O-N 3.12Å; E202-N204 VanDerWaalsContact O-N 3.12Å
205	Y	31.5	Very low	29.5	Very low	140 Å²	140	139 Å²	139	55%	0.549	72%	0.718	S	S	.	*	H	α-helix	trans	-80.8	-31.7	-179.9	-89.1	-91.2	0	0	0	113.1	E202 S207	E202-Y205 PolarHBondContact O-N 3.44Å; E202-Y205 VanDerWaalsContact O-N 3.15Å; Y205-S207 VanDerWaalsContact C-N 3.26Å; Y205-S207 PolarHBondContact O-N 2.81Å
206	E	34.5	Very low	29.6	Very low	149 Å²	149	139.4 Å²	139.4	70%	0.696	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-10	-172.1	-147.7	176	-164.6	0	0	114.7
207	S	31.8	Very low	29.7	Very low	94 Å²	94	134.9 Å²	134.9	66%	0.657	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-27.5	-179.1	-65.7	0	0	0	0	114.2	Y205	Y205-S207 VanDerWaalsContact C-N 3.26Å; Y205-S207 PolarHBondContact O-N 2.81Å
208	S	31.4	Very low	29.9	Very low	104 Å²	104	138.7 Å²	138.7	73%	0.727	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-9.9	-173.4	-61.9	0	0	0	0	114.7
209	S	31.6	Very low	30.2	Very low	107 Å²	107	138.3 Å²	138.3	75%	0.748	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	9.2	-176.5	-155.2	0	0	0	0	114.4
210	K	31.2	Very low	30.2	Very low	166 Å²	166	138.1 Å²	138.1	72%	0.722	75%	0.746	S	S	*	*	S	Bend	trans	-102	16.3	-174.9	-72.9	174.3	-179.4	158.8	0	114.7
211	Q	30	Very low	30.5	Very low	171 Å²	171	140.9 Å²	140.9	80%	0.799	75%	0.754	S	S	*	*	S	Bend	trans	-130.3	156.2	168.4	-61.2	-171.9	8.3	0	0	109.2
212	I	28.2	Very low	30.6	Very low	175 Å²	175	140.1 Å²	140.1	90%	0.897	76%	0.759	S	S	*	*	S	Bend	trans	71.4	57.3	-176.1	-39.4	164.8	0	0	0	114.3
213	S	28.4	Very low	30.6	Very low	116 Å²	116	137.5 Å²	137.5	81%	0.811	77%	0.767	S	S	*	*			trans	-156.5	79.7	153.2	-165.6	0	0	0	0	112.5
214	T	27.6	Very low	30.6	Very low	143 Å²	143	135.4 Å²	135.4	88%	0.877	77%	0.769	S	S	*	*			trans	-140.3	57.9	-179.9	39.5	0	0	0	0	113.3
215	R	27.4	Very low	30.8	Very low	245 Å²	245	137.6 Å²	137.6	93%	0.925	77%	0.773	S	S	*	*	S	Bend	trans	-150.6	107.1	152.4	-137.4	170.2	-175.2	165.4	1.2	115
216	A	26.7	Very low	30.8	Very low	81 Å²	81	141.6 Å²	141.6	67%	0.669	79%	0.787	S	S	*	*			trans	43.8	85.5	150.6	0	0	0	0	0	118.9
217	S	26.8	Very low	30.7	Very low	129 Å²	129	140.4 Å²	140.4	90%	0.902	79%	0.785	S	S	*	*			trans	-95.3	88.6	137.1	-74.2	0	0	0	0	108.4
218	L	30.4	Very low	30.7	Very low	164 Å²	164	142.3 Å²	142.3	86%	0.859	79%	0.788	S	S	*	*			trans	-81.1	116.7	170.8	-81.2	170.8	0	0	0	108.8
219	K	33.6	Very low	30.7	Very low	186 Å²	186	142.8 Å²	142.8	81%	0.809	79%	0.792	S	S	*	*			trans	-61.6	135.7	173.7	-68.7	178.8	175.5	-179	0	109.8	D221	K219-D221 PolarHBondContact O-N 3.12Å
220	S	28.8	Very low	30.7	Very low	126 Å²	126	141.8 Å²	141.8	88%	0.881	80%	0.798	S	S	*	*			trans	-65.1	112.9	155.6	53	0	0	0	0	108.4
221	D	34.7	Very low	30.6	Very low	146 Å²	146	141.4 Å²	141.4	78%	0.781	80%	0.799	S	S	*	*			trans	-128.5	160.8	168.7	-143.3	-37.1	0	0	0	110.2	K219	K219-D221 PolarHBondContact O-N 3.12Å
222	S	32.1	Very low	30.5	Very low	110 Å²	110	143.3 Å²	143.3	77%	0.769	81%	0.805	S	S	*	*			trans	-89.5	151.5	-160.2	64.4	0	0	0	0	113.9
223	G	32	Very low	30.5	Very low	73 Å²	73	141.1 Å²	141.1	75%	0.753	79%	0.794	S	S	*	*			trans	133.7	107.3	152.3	0	0	0	0	0	118.7
224	S	32	Very low	30.5	Very low	95 Å²	95	143.4 Å²	143.4	66%	0.664	79%	0.794	S	S	*	*			trans	69.5	99.4	130.8	-178.9	0	0	0	0	121.4
225	K	35.7	Very low	30.6	Very low	170 Å²	170	141.8 Å²	141.8	74%	0.739	78%	0.784	S	S	*	*				84.6	127.7	128.7	-68.8	173.7	-171.5	160.7	0	121
226	R	32.6	Very low	30.7	Very low	223 Å²	223	134.6 Å²	134.6	84%	0.842	77%	0.771	S	S	*	*			trans	73.7	148.2	148.5	-65.7	163.6	-180	172.9	-3.1	116.9
227	N	31.5	Very low	30.9	Very low	124 Å²	124	137.7 Å²	137.7	66%	0.663	77%	0.772	S	S	*	*			cis	-166.2	166.1	-22.6	58.1	-51.6	0	0	0	110
228	N	33.1	Very low	31.1	Very low	134 Å²	134	138.2 Å²	138.2	72%	0.717	76%	0.758	S	S	*	*			trans	63.1	104	167.4	-64.1	20.3	0	0	0	116.1
229	S	30	Very low	31.3	Very low	115 Å²	115	136 Å²	136	80%	0.804	76%	0.756	S	S	*	*				77.7	106.1	72.1	74.4	0	0	0	0	114.9
230	G	31.9	Very low	31.1	Very low	85 Å²	85	134.3 Å²	134.3	88%	0.876	75%	0.751	S	S	*	*			trans	-167.5	114	170.5	0	0	0	0	0	110.1
231	H	28.8	Very low	31.3	Very low	159 Å²	159	134.8 Å²	134.8	74%	0.736	74%	0.744	S	S	*	*			trans	-127.3	122.6	-169.5	171.4	-71.6	0	0	0	109.9
232	F	29.5	Very low	31	Very low	211 Å²	211	134 Å²	134	93%	0.925	74%	0.739	S	S	*	*			trans	-144.9	154.5	168.6	-115.2	-85.7	0	0	0	111.7
233	L	26.5	Very low	30.8	Very low	129 Å²	129	138.9 Å²	138.9	68%	0.675	74%	0.74	S	S	*	*			trans	-139.3	-178.3	-167.1	-117.9	172.5	0	0	0	110
234	M	29.5	Very low	30.6	Very low	163 Å²	163	142.6 Å²	142.6	80%	0.803	74%	0.743	S	S	*	*			trans	81.4	146.4	174.7	-49.1	-81.2	-178.4	0	0	115
235	T	29.6	Very low	30.5	Very low	110 Å²	110	142.2 Å²	142.2	68%	0.675	74%	0.74	S	S	*	*			cis	-170.2	153.4	-9.9	20.7	0	0	0	0	110.4
236	S	29.9	Very low	30.1	Very low	93 Å²	93	142.1 Å²	142.1	65%	0.65	74%	0.742	S	S	*	*			trans	59.5	163.3	144.4	-68.3	0	0	0	0	120.2
237	E	30.9	Very low	29.7	Very low	146 Å²	146	138.7 Å²	138.7	68%	0.682	74%	0.741	S	S	*	*			cis	-173.1	175.6	-13.4	-105.7	170.9	-101.3	0	0	108.2
238	K	31	Very low	29.5	Very low	141 Å²	141	140 Å²	140	61%	0.613	75%	0.753	S	S	*	*			cis	-164.7	122.6	-9.4	162.7	-164.6	-60.1	100.1	0	108.8	Q240	K238-Q240 HydrophobicContact CG-CG 4.23Å
239	S	34.1	Very low	29.1	Very low	116 Å²	116	140.5 Å²	140.5	81%	0.811	76%	0.756	S	S	*	*			trans	-170.5	100.4	161.8	38.9	0	0	0	0	110.3
240	Q	29.6	Very low	28.8	Very low	152 Å²	152	142.8 Å²	142.8	71%	0.71	76%	0.758	S	S	*	*				80.3	138.6	59.2	-73.6	-160.1	-33.2	0	0	116.7	K238	K238-Q240 HydrophobicContact CG-CG 4.23Å
241	N	32.7	Very low	28.4	Very low	136 Å²	136	142 Å²	142	73%	0.727	75%	0.75	S	S	*	*			trans	89.3	134.9	168.3	-54	-34.2	0	0	0	117.9
242	L	28.2	Very low	28.1	Very low	130 Å²	130	144.5 Å²	144.5	68%	0.681	76%	0.762	S	S	*	*			cis	-166.4	132.6	-12	-118.1	169.2	0	0	0	111.5
243	R	28.5	Very low	27.7	Very low	212 Å²	212	139.6 Å²	139.6	80%	0.8	75%	0.754	S	S	*	*			trans	55.8	131.3	152.8	-79.3	176.9	-170.1	-166.4	-0.1	120.3
244	N	27.2	Very low	27.5	Very low	150 Å²	150	145.5 Å²	145.5	80%	0.802	77%	0.767	S	S	*	*				72.3	140.1	69.5	-65	32	0	0	0	113.4
245	S	28.9	Very low	27.2	Very low	87 Å²	87	142.2 Å²	142.2	61%	0.608	76%	0.76	S	S	*	*			cis	-161.3	176.8	0.8	47.5	0	0	0	0	113.7
246	E	27.7	Very low	26.9	Very low	168 Å²	168	144.2 Å²	144.2	79%	0.785	77%	0.767	S	S	*	*			trans	66.6	111.9	145.3	-76.6	153.5	126.1	0	0	123.7
247	N	24.3	Very low	26.6	Very low	151 Å²	151	148.3 Å²	148.3	81%	0.807	78%	0.778	S	S	*	*			trans	-0.1	134.6	130.6	-50.5	-10.8	0	0	0	119.1
248	T	28.7	Very low	26.1	Very low	152 Å²	152	148.2 Å²	148.2	93%	0.933	78%	0.781	S	S	*	*				-152.4	163.7	120.9	-2.6	0	0	0	0	111.8
249	D	23.6	Very low	25.8	Very low	145 Å²	145	148.9 Å²	148.9	78%	0.775	79%	0.792	S	S	*	*			trans	-105.7	-175.9	-175.4	-175.2	19	0	0	0	110.6
250	I	24	Very low	25.3	Very low	162 Å²	162	149 Å²	149	83%	0.831	78%	0.782	S	S	*	*			trans	80.3	127.4	167.7	-49.2	158.2	0	0	0	114.9
251	G	23.1	Very low	25	Very low	70 Å²	70	151.1 Å²	151.1	72%	0.722	79%	0.789	S	S	*	*			trans	166.6	57.3	170.7	0	0	0	0	0	117.1	S253	G251-S253 PolarHBondContact O-N 3.06Å; G251-S253 VanDerWaalsContact O-N 3.14Å
252	Q	21.9	Very low	24.6	Very low	210 Å²	210	154.2 Å²	154.2	98%	0.981	79%	0.792	S	S	*	*			trans	-64.8	113	163.9	-74	-174	-3.2	0	0	109.6
253	S	22.7	Very low	24.6	Very low	108 Å²	108	151.3 Å²	151.3	76%	0.755	78%	0.777	S	S	*	*			trans	-139	118.5	170	-164.8	0	0	0	0	110.7	G251 S255	G251-S253 PolarHBondContact O-N 3.06Å; G251-S253 VanDerWaalsContact O-N 3.14Å; S253-S255 PolarHBondContact O-N 3.23Å
254	R	21.4	Very low	24.5	Very low	253 Å²	253	147 Å²	147	96%	0.955	78%	0.776	S	S	*	*			trans	-80	99	176.8	-71.2	175.2	171.6	170.9	-4.6	109
255	S	24.3	Very low	24.5	Very low	94 Å²	94	145.6 Å²	145.6	66%	0.657	77%	0.768	S	S	*	*			trans	-107.1	132.5	168.3	54.4	0	0	0	0	110.8	S253 M257	S253-S255 PolarHBondContact O-N 3.23Å; S255-M257 PolarHBondContact O-N 3.43Å
256	N	22.4	Very low	24.3	Very low	152 Å²	152	144.7 Å²	144.7	81%	0.813	77%	0.773	S	S	*	*			trans	-72.7	89.8	-177.4	-64.8	-22.1	0	0	0	110.6	L258	N256-L258 PolarHBondContact O-N 2.92Å; N256-L258 VanDerWaalsContact O-N 3.14Å
257	M	22.9	Very low	24.2	Very low	180 Å²	180	142.7 Å²	142.7	89%	0.887	77%	0.767	S	S	*	*			trans	-73.5	99	164	-75.9	-95.8	-76.5	0	0	108.2	S255	S255-M257 PolarHBondContact O-N 3.43Å
258	L	21.9	Very low	24.3	Very low	143 Å²	143	144.3 Å²	144.3	75%	0.749	77%	0.77	S	S	*	*			trans	-60.2	162.1	-179.4	-72.6	103.8	0	0	0	112.7	N256 I260	N256-L258 PolarHBondContact O-N 2.92Å; N256-L258 VanDerWaalsContact O-N 3.14Å; L258-I260 PolarHBondContact O-N 3.39Å
259	N	23.1	Very low	24.1	Very low	156 Å²	156	142.9 Å²	142.9	83%	0.834	76%	0.761	S	S	*	*			trans	-53.9	107.3	164.4	-64.4	-27	0	0	0	110.3
260	I	23.8	Very low	24.1	Very low	118 Å²	118	141.8 Å²	141.8	61%	0.605	76%	0.759	S	S	*	*			trans	-118.9	86.2	167	-49.7	178.7	0	0	0	108.2	L258 Y262	L258-I260 PolarHBondContact O-N 3.39Å; I260-Y262 HydrophobicContact CB-CD2 4.34Å; I260-Y262 HydrophobicContact CB-CE2 4.25Å; I260-Y262 HydrophobicContact CG2-CD2 3.59Å; I260-Y262 HydrophobicContact CG2-CE2 3.45Å; I260-Y262 VanDerWaalsContact CG2-CE2 3.45Å; I260-Y262 HydrophobicContact CG2-CG 4.34Å; I260-Y262 PolarHBondContact O-N 2.91Å
261	F	23.7	Very low	24.1	Very low	197 Å²	197	140.3 Å²	140.3	86%	0.864	75%	0.753	S	S	*	*			trans	-64.1	101.6	162.1	-80.2	-93.6	0	0	0	107.9	D263	F261-D263 PolarHBondContact O-N 3.19Å
262	Y	24.4	Very low	24.2	Very low	200 Å²	200	143.1 Å²	143.1	78%	0.784	76%	0.761	S	S	*	*			trans	-74.8	108.2	176.8	-98.6	-81.2	0	0	0	110.6	I260 P264	I260-Y262 HydrophobicContact CB-CD2 4.34Å; I260-Y262 HydrophobicContact CB-CE2 4.25Å; I260-Y262 HydrophobicContact CG2-CD2 3.59Å; I260-Y262 HydrophobicContact CG2-CE2 3.45Å; I260-Y262 VanDerWaalsContact CG2-CE2 3.45Å; I260-Y262 HydrophobicContact CG2-CG 4.34Å; I260-Y262 PolarHBondContact O-N 2.91Å; Y262-P264 WeakPolarHBondContact O-CD 3.45Å
263	D	27.3	Very low	24.3	Very low	69 Å²	69	139 Å²	139	37%	0.369	75%	0.745	S	S	.	*			trans	-60.1	122.4	168.3	171.2	37.4	0	0	0	110.4	F261 L265 G266 L267	F261-D263 PolarHBondContact O-N 3.19Å; D263-L265 VanDerWaalsContact C-N 3.28Å; D263-L265 PolarHBondContact O-N 3.01Å; D263-L265 WeakPolarHBondContact OD1-CB 3.46Å; D263-L265 PolarHBondContact OD1-N 3.46Å; D263-L265 PolarHBondContact OD2-N 3.29Å; D263-G266 PolarHBondContact OD2-N 2.88Å; D263-L267 PolarHBondContact OD2-N 3.41Å
264	P	28	Very low	24.4	Very low	121 Å²	121	141.1 Å²	141.1	79%	0.786	75%	0.748	S	S	*	*	S	Bend	trans	-79.5	-4.6	175.8	33.4	-36	0	0	0	113.9	Y262	Y262-P264 WeakPolarHBondContact O-CD 3.45Å
265	L	26.7	Very low	24.5	Very low	121 Å²	121	132.9 Å²	132.9	63%	0.634	74%	0.742	S	S	*	*	S	Bend	trans	-98.3	-14.6	-174.4	-61.2	178.8	0	0	0	114.7	D263	D263-L265 VanDerWaalsContact C-N 3.28Å; D263-L265 PolarHBondContact O-N 3.01Å; D263-L265 WeakPolarHBondContact OD1-CB 3.46Å; D263-L265 PolarHBondContact OD1-N 3.46Å; D263-L265 PolarHBondContact OD2-N 3.29Å
266	G	24.5	Very low	24.4	Very low	68 Å²	68	138.9 Å²	138.9	70%	0.701	75%	0.752	S	S	*	*			trans	70.4	32.3	177.4	0	0	0	0	0	113.2	D263	D263-G266 PolarHBondContact OD2-N 2.88Å
267	L	26.6	Very low	24.6	Very low	127 Å²	127	137.5 Å²	137.5	67%	0.665	75%	0.751	S	S	*	*			trans	-77.9	135.8	167.8	-68	171.7	0	0	0	108.8	D263 T269	D263-L267 PolarHBondContact OD2-N 3.41Å; L267-T269 PolarHBondContact O-N 3.42Å
268	E	25.2	Very low	24.7	Very low	185 Å²	185	134.3 Å²	134.3	86%	0.864	74%	0.741	S	S	*	*			trans	-60.4	128.2	-178.2	-65.7	-174.3	142.1	0	0	110.7	T270	E268-T270 PolarHBondContact O-N 3.23Å
269	T	23.6	Very low	24.8	Very low	121 Å²	121	133.9 Å²	133.9	74%	0.742	74%	0.744	S	S	*	*			trans	-69.3	94.4	175.7	51.2	0	0	0	0	109.6	L267 N271	L267-T269 PolarHBondContact O-N 3.42Å; T269-N271 PolarHBondContact O-N 2.86Å; T269-N271 PolarHBondContact O-OD1 3.34Å
270	T	25.3	Very low	24.8	Very low	122 Å²	122	132.6 Å²	132.6	75%	0.748	74%	0.737	S	S	*	*			trans	-67.4	103.1	168	34.2	0	0	0	0	109.2	E268 C272	E268-T270 PolarHBondContact O-N 3.23Å; T270-C272 PolarHBondContact O-N 3.38Å
271	N	24	Very low	24.9	Very low	131 Å²	131	131.1 Å²	131.1	70%	0.701	74%	0.737	S	S	*	*			trans	-54.1	107.8	-176.6	-67.1	-10	0	0	0	112.1	T269 D273	T269-N271 PolarHBondContact O-N 2.86Å; T269-N271 PolarHBondContact O-OD1 3.34Å; N271-D273 PolarHBondContact O-N 2.92Å; N271-D273 VanDerWaalsContact O-N 3.1Å
272	C	24.1	Very low	25.2	Very low	130 Å²	130	128.7 Å²	128.7	88%	0.878	73%	0.734	S	S	*	*			trans	-84.4	57.9	168.3	-64.3	0	0	0	0	110.9	T270 N274	T270-C272 PolarHBondContact O-N 3.38Å; C272-N274 PolarHBondContact O-N 2.83Å
273	D	23.7	Very low	25.4	Very low	123 Å²	123	128.1 Å²	128.1	66%	0.658	74%	0.735	S	S	*	*			trans	-79.1	115.4	177.9	-114.5	-47.9	0	0	0	111.3	N271	N271-D273 PolarHBondContact O-N 2.92Å; N271-D273 VanDerWaalsContact O-N 3.1Å
274	N	25.1	Very low	25.4	Very low	152 Å²	152	133.7 Å²	133.7	81%	0.813	76%	0.756	S	S	*	*	S	Bend	trans	36.9	92.8	150.7	-65.7	-65	0	0	0	118.8	C272	C272-N274 PolarHBondContact O-N 2.83Å
275	G	24.5	Very low	25.4	Very low	80 Å²	80	134.1 Å²	134.1	83%	0.825	76%	0.756	S	S	*	*			trans	-178.2	90.4	166.9	0	0	0	0	0	117.2
276	Y	22.2	Very low	25.5	Very low	221 Å²	221	133.4 Å²	133.4	87%	0.867	76%	0.762	S	S	*	*			trans	-69.2	155.3	154.1	-82.9	-84.4	0	0	0	109.5
277	P	26.6	Very low	25.7	Very low	122 Å²	122	138.1 Å²	138.1	79%	0.792	77%	0.77	S	S	*	*			cis	-143.8	171.2	36.6	42.4	-23.3	0	0	0	119.5
278	V	23.6	Very low	26.2	Very low	113 Å²	113	137.6 Å²	137.6	69%	0.685	78%	0.775	S	S	*	*			trans	-23.4	142.4	150.2	-178	0	0	0	0	116.6
279	V	25.1	Very low	26.4	Very low	135 Å²	135	133.5 Å²	133.5	82%	0.818	77%	0.767	S	S	*	*				-173.8	144.3	126.3	145.3	0	0	0	0	114
280	D	23.7	Very low	26.6	Very low	128 Å²	128	136.7 Å²	136.7	68%	0.684	77%	0.773	S	S	*	*			trans	-16.2	132.6	-178.9	-79.5	-76.9	0	0	0	127.3
281	S	25.4	Very low	26.8	Very low	87 Å²	87	135.4 Å²	135.4	61%	0.608	77%	0.769	S	S	*	*				43.9	124.4	104.6	-43.1	0	0	0	0	123
282	N	30.5	Very low	27	Very low	146 Å²	146	136.3 Å²	136.3	78%	0.781	77%	0.773	S	S	*	*				178.3	124.8	127.9	-92.2	-52.6	0	0	0	110
283	K	27.7	Very low	27.1	Very low	188 Å²	188	138 Å²	138	82%	0.817	77%	0.767	S	S	*	*				49.5	127.1	85.7	-75.9	175.3	-179.5	167.9	0	113.2
284	K	27.8	Very low	27.3	Very low	186 Å²	186	138.3 Å²	138.3	81%	0.809	77%	0.774	S	S	*	*			cis	-157.5	151.3	28.5	-112.6	175.2	176.8	-177.8	0	109.8
285	V	27.5	Very low	27.5	Very low	131 Å²	131	136.2 Å²	136.2	79%	0.794	77%	0.771	S	S	*	*				54.7	129.4	95.9	-178.3	0	0	0	0	113.8
286	S	29.6	Very low	27.5	Very low	106 Å²	106	140.1 Å²	140.1	74%	0.741	77%	0.773	S	S	*	*			cis	-163.7	152	20.4	38	0	0	0	0	115.9
287	N	27.7	Very low	27.7	Very low	166 Å²	166	132.9 Å²	132.9	89%	0.888	77%	0.766	S	S	*	*			trans	27	160.5	146.3	-89.3	25.1	0	0	0	126.6
288	P	36.5	Very low	27.5	Very low	116 Å²	116	138.5 Å²	138.5	75%	0.753	77%	0.771	S	S	*	*			trans	-116.7	171.2	-163.1	43.8	-34	0	0	0	117
289	S	29.6	Very low	27.7	Very low	100 Å²	100	141.5 Å²	141.5	70%	0.699	78%	0.778	S	S	*	*			trans	-170.1	132.6	164.9	57.6	0	0	0	0	114.7
290	H	29.4	Very low	27.7	Very low	187 Å²	187	143.4 Å²	143.4	87%	0.866	78%	0.783	S	S	*	*			trans	52.1	154.1	148.4	-59.5	-54.5	0	0	0	121.5
291	S	28	Very low	27.7	Very low	95 Å²	95	144.4 Å²	144.4	66%	0.664	79%	0.787	S	S	*	*			cis	-171.4	167.3	-16.4	53.8	0	0	0	0	112.5
292	L	28	Very low	27.6	Very low	151 Å²	151	148.1 Å²	148.1	79%	0.791	80%	0.8	S	S	*	*			trans	72.8	109.1	155.7	-97.5	81	0	0	0	123.6
293	H	27.9	Very low	27.3	Very low	165 Å²	165	148.7 Å²	148.7	76%	0.764	80%	0.798	S	S	*	*				80.3	152.5	117.3	-107.9	-92.6	0	0	0	125.6
294	T	27.6	Very low	27.2	Very low	130 Å²	130	144.3 Å²	144.3	80%	0.798	79%	0.791	S	S	*	*			trans	72.8	141.4	173.8	66.7	0	0	0	0	116.9
295	S	28.4	Very low	27.2	Very low	108 Å²	108	143.4 Å²	143.4	76%	0.755	79%	0.787	S	S	*	*			cis	-155.3	166.4	-9.1	50	0	0	0	0	111.6
296	D	25.5	Very low	27.1	Very low	161 Å²	161	144.4 Å²	144.4	86%	0.861	79%	0.788	S	S	*	*			trans	-3.2	121.3	171.6	-70.9	-81.8	0	0	0	120.6
297	G	25.3	Very low	26.8	Very low	69 Å²	69	145.7 Å²	145.7	71%	0.711	79%	0.786	S	S	*	*			trans	-156.2	94.9	165.8	0	0	0	0	0	112.1	H299	G297-H299 PolarHBondContact O-N 3.17Å; G297-H299 VanDerWaalsContact O-N 3.08Å
298	R	23.8	Very low	26.8	Very low	240 Å²	240	140.5 Å²	140.5	91%	0.906	77%	0.766	S	S	*	*			trans	-74.8	94.9	-178.4	-67	-174.2	-173.8	-178.3	2.2	112.2
299	H	26.9	Very low	26.3	Very low	177 Å²	177	140 Å²	140	82%	0.819	76%	0.757	S	S	*	*			trans	-134.6	135.4	161.3	-84.4	-85.4	0	0	0	111.1	G297 L301	G297-H299 PolarHBondContact O-N 3.17Å; G297-H299 VanDerWaalsContact O-N 3.08Å; H299-L301 VanDerWaalsContact C-N 3.31Å; H299-L301 PolarHBondContact O-N 2.81Å
300	N	24.1	Very low	26.2	Very low	174 Å²	174	140.3 Å²	140.3	93%	0.93	75%	0.75	S	S	*	*			trans	-74.3	82.9	176.3	-68.3	-10.2	0	0	0	109.9	L302	N300-L302 PolarHBondContact O-N 3.36Å
301	L	24.7	Very low	26.1	Very low	149 Å²	149	135.1 Å²	135.1	78%	0.78	73%	0.729	S	S	*	*			trans	-83.7	101.4	165.9	-167.8	70.7	0	0	0	108.2	H299 E303	H299-L301 VanDerWaalsContact C-N 3.31Å; H299-L301 PolarHBondContact O-N 2.81Å; L301-E303 PolarHBondContact O-N 3.32Å
302	L	24.2	Very low	26.1	Very low	166 Å²	166	133.5 Å²	133.5	87%	0.869	71%	0.712	S	S	*	*			trans	-67.5	102	161.8	-94.4	165	0	0	0	107.2	N300 S304	N300-L302 PolarHBondContact O-N 3.36Å; L302-S304 PolarHBondContact O-N 3.14Å
303	E	23.4	Very low	26.1	Very low	158 Å²	158	128.3 Å²	128.3	74%	0.738	69%	0.689	S	S	*	*			trans	-58.2	109.7	169	-66.9	-177	134.3	0	0	108.6	L301 K305	L301-E303 PolarHBondContact O-N 3.32Å; E303-K305 VanDerWaalsContact C-N 3.28Å; E303-K305 PolarHBondContact O-N 2.98Å
304	S	26	Very low	26.1	Very low	95 Å²	95	125.7 Å²	125.7	66%	0.664	69%	0.685	S	S	*	*			trans	-65.5	94.7	162.9	51.8	0	0	0	0	107.4	L302 D306	L302-S304 PolarHBondContact O-N 3.14Å; S304-D306 PolarHBondContact O-N 3.35Å
305	K	26.2	Very low	26.2	Very low	167 Å²	167	126.3 Å²	126.3	73%	0.726	68%	0.676	S	S	*	*			trans	-60.5	109.5	164.6	-74.6	-173.7	176.2	-178.7	0	107.1	E303 N307	E303-K305 VanDerWaalsContact C-N 3.28Å; E303-K305 PolarHBondContact O-N 2.98Å; K305-N307 PolarHBondContact O-N 3.3Å
306	D	25.5	Very low	26.2	Very low	153 Å²	153	126.9 Å²	126.9	82%	0.818	67%	0.669	S	S	*	*			trans	-68.2	71.5	173.7	-69	-49.4	0	0	0	109.6	S304 A308	S304-D306 PolarHBondContact O-N 3.35Å; D306-A308 PolarHBondContact O-N 3.47Å; D306-A308 VanDerWaalsContact O-N 3.12Å
307	N	25	Very low	26.3	Very low	133 Å²	133	125.6 Å²	125.6	71%	0.711	66%	0.662	S	S	*	*			trans	-64.5	111	172.6	-73.2	-7	0	0	0	107.4	K305 L309	K305-N307 PolarHBondContact O-N 3.3Å; N307-L309 PolarHBondContact O-N 3.39Å
308	A	26.1	Very low	26.5	Very low	57 Å²	57	127.8 Å²	127.8	47%	0.471	66%	0.661	S	S	.	*			trans	-61	108.3	-168.6	0	0	0	0	0	112.4	D306 D310 D311	D306-A308 PolarHBondContact O-N 3.47Å; D306-A308 VanDerWaalsContact O-N 3.12Å; A308-D310 PolarHBondContact O-N 2.8Å; A308-D310 VanDerWaalsContact O-N 3.14Å; A308-D311 WeakPolarHBondContact O-CB 3.47Å; A308-D311 PolarHBondContact O-N 3.04Å
309	L	26.7	Very low	26.7	Very low	105 Å²	105	121.8 Å²	121.8	55%	0.55	65%	0.654	S	S	.	*	H	α-helix	trans	-57.5	-24.8	171.7	-69.6	158.9	0	0	0	111.9	P137 N307 D311 I312 S313	P137-L309 HydrophobicContact CG-CB 3.81Å; N307-L309 PolarHBondContact O-N 3.39Å; L309-D311 VanDerWaalsContact C-N 3.28Å; L309-D311 PolarHBondContact O-N 3.12Å; L309-I312 HydrophobicContact CD2-CD1 4.35Å; L309-I312 WeakPolarHBondContact O-CB 3.24Å; L309-I312 PolarHBondContact O-N 3.2Å; L309-I312 VanDerWaalsContact O-N 3.12Å; L309-S313 PolarHBondContact O-N 3.18Å
310	D	27	Very low	26.9	Very low	106 Å²	106	117.2 Å²	117.2	57%	0.567	63%	0.634	S	S	*	*	H	α-helix	trans	-59.6	-34.7	172.7	-62.9	-44.9	0	0	0	112.9	P137 A308 I312 T314	P137-D310 WeakPolarHBondContact CG-OD1 3.29Å; A308-D310 PolarHBondContact O-N 2.8Å; A308-D310 VanDerWaalsContact O-N 3.14Å; D310-I312 VanDerWaalsContact C-N 3.3Å; D310-I312 PolarHBondContact O-N 3.38Å; D310-T314 VanDerWaalsContact O-CB 3.29Å; D310-T314 WeakPolarHBondContact O-CB 3.43Å; D310-T314 PolarHBondContact O-N 3.16Å; D310-T314 PolarHBondContact O-OG1 2.98Å
311	D	28.3	Very low	27.4	Very low	79 Å²	79	112.6 Å²	112.6	42%	0.422	61%	0.61	S	S	.	*	H	α-helix	trans	-70.3	-29.4	176.4	-172.4	50.7	0	0	0	111.5	A308 L309 K315	A308-D311 WeakPolarHBondContact O-CB 3.47Å; A308-D311 PolarHBondContact O-N 3.04Å; L309-D311 VanDerWaalsContact C-N 3.28Å; L309-D311 PolarHBondContact O-N 3.12Å; D311-K315 VanDerWaalsContact O-CB 3.26Å; D311-K315 WeakPolarHBondContact O-CB 3.41Å; D311-K315 WeakPolarHBondContact O-CD 3.4Å; D311-K315 VanDerWaalsContact O-CG 3.28Å; D311-K315 WeakPolarHBondContact O-CG 3.42Å; D311-K315 PolarHBondContact O-N 3.41Å; D311-K315 WeakPolarHBondContact OD1-CE 3.48Å; D311-K315 IonicContact OD1-NZ 2.72Å; D311-K315 PolarHBondContact OD1-NZ 3.27Å; D311-K315 IonicContact OD2-NZ 2.76Å; D311-K315 PolarHBondContact OD2-NZ 2.75Å
312	I	27.2	Very low	28	Very low	60 Å²	60	109.9 Å²	109.9	31%	0.308	60%	0.596	S	S	.	*	H	α-helix	trans	-72.2	-50.5	177.1	-62.6	177.7	0	0	0	110.4	L309 D310 T314 K315 M316	L309-I312 HydrophobicContact CD2-CD1 4.35Å; L309-I312 WeakPolarHBondContact O-CB 3.24Å; L309-I312 PolarHBondContact O-N 3.2Å; L309-I312 VanDerWaalsContact O-N 3.12Å; D310-I312 VanDerWaalsContact C-N 3.3Å; D310-I312 PolarHBondContact O-N 3.38Å; I312-T314 VanDerWaalsContact C-N 3.3Å; I312-T314 PolarHBondContact O-N 2.94Å; I312-K315 CarbonylContact O-C 3.59Å; I312-K315 PolarHBondContact O-N 3.26Å; I312-M316 HydrophobicContact CG2-CE 3.84Å; I312-M316 HydrophobicContact CG2-CG 4.39Å; I312-M316 HydrophobicContact CG2-SD 4.05Å; I312-M316 WeakPolarHBondContact O-CB 3.49Å; I312-M316 VanDerWaalsContact O-CG 3.31Å; I312-M316 WeakPolarHBondContact O-CG 3.39Å; I312-M316 PolarHBondContact O-N 3.03Å
313	S	28.2	Very low	28.6	Very low	43 Å²	43	106.2 Å²	106.2	30%	0.301	58%	0.581	S	S	.	*	H	α-helix	trans	-63.4	-36.2	176.5	172.3	0	0	0	0	112.4	P137 G138 L309 K315 M316	P137-S313 VanDerWaalsContact CB-CB 3.45Å; G138-S313 PolarHBondContact N-OG 3.05Å; L309-S313 PolarHBondContact O-N 3.18Å; S313-K315 VanDerWaalsContact C-N 3.35Å; S313-M316 PolarHBondContact O-N 3.4Å
314	T	28.4	Very low	29.2	Very low	110 Å²	110	104.5 Å²	104.5	68%	0.675	57%	0.571	S	S	*	*	H	α-helix	trans	-70.1	-30.2	177.1	-52.9	0	0	0	0	112.4	D310 I312	D310-T314 VanDerWaalsContact O-CB 3.29Å; D310-T314 WeakPolarHBondContact O-CB 3.43Å; D310-T314 PolarHBondContact O-N 3.16Å; D310-T314 PolarHBondContact O-OG1 2.98Å; I312-T314 VanDerWaalsContact C-N 3.3Å; I312-T314 PolarHBondContact O-N 2.94Å
315	K	29.4	Very low	29.9	Very low	142 Å²	142	102 Å²	102	62%	0.617	55%	0.55	S	S	*	.	H	α-helix	trans	-88.3	-17.2	175.4	-73	170.2	177.9	160.7	0	114.1	D311 I312 S313 N317	D311-K315 VanDerWaalsContact O-CB 3.26Å; D311-K315 WeakPolarHBondContact O-CB 3.41Å; D311-K315 WeakPolarHBondContact O-CD 3.4Å; D311-K315 VanDerWaalsContact O-CG 3.28Å; D311-K315 WeakPolarHBondContact O-CG 3.42Å; D311-K315 PolarHBondContact O-N 3.41Å; D311-K315 WeakPolarHBondContact OD1-CE 3.48Å; D311-K315 IonicContact OD1-NZ 2.72Å; D311-K315 PolarHBondContact OD1-NZ 3.27Å; D311-K315 IonicContact OD2-NZ 2.76Å; D311-K315 PolarHBondContact OD2-NZ 2.75Å; I312-K315 CarbonylContact O-C 3.59Å; I312-K315 PolarHBondContact O-N 3.26Å; S313-K315 VanDerWaalsContact C-N 3.35Å; K315-N317 PolarHBondContact O-N 3.13Å
316	M	27.9	Very low	30.7	Very low	121 Å²	121	99.1 Å²	99.1	60%	0.596	54%	0.542	S	S	*	.			trans	-72.7	46.6	167.1	-75.9	-179.7	168.6	0	0	111.8	I312 S313 V318	I312-M316 HydrophobicContact CG2-CE 3.84Å; I312-M316 HydrophobicContact CG2-CG 4.39Å; I312-M316 HydrophobicContact CG2-SD 4.05Å; I312-M316 WeakPolarHBondContact O-CB 3.49Å; I312-M316 VanDerWaalsContact O-CG 3.31Å; I312-M316 WeakPolarHBondContact O-CG 3.39Å; I312-M316 PolarHBondContact O-N 3.03Å; S313-M316 PolarHBondContact O-N 3.4Å; M316-V318 PolarHBondContact O-N 2.86Å
317	N	27.3	Very low	31.4	Very low	134 Å²	134	95.3 Å²	95.3	72%	0.717	52%	0.519	S	S	*	.			trans	-74.8	43.2	175.4	-167.6	21.8	0	0	0	112.1	K315 C319	K315-N317 PolarHBondContact O-N 3.13Å; N317-C319 PolarHBondContact O-N 2.84Å
318	V	29.2	Very low	32.1	Very low	114 Å²	114	90.3 Å²	90.3	69%	0.691	49%	0.491	S	S	*	.			trans	-77.8	76.6	160.8	-176.5	0	0	0	0	105.8	M316 M320	M316-V318 PolarHBondContact O-N 2.86Å; V318-M320 PolarHBondContact O-N 3.44Å
319	C	28.3	Very low	32.9	Very low	114 Å²	114	89 Å²	89	77%	0.77	48%	0.476	S	S	*	.			trans	-73.6	63.8	178	-164.6	0	0	0	0	110.7	N317	N317-C319 PolarHBondContact O-N 2.84Å
320	M	32.7	Very low	33.5	Very low	81 Å²	81	88.1 Å²	88.1	40%	0.399	47%	0.472	S	S	.	.			trans	-81.9	114.5	146.1	-69.5	-167.3	-174.8	0	0	106	V318 D322 F356	V318-M320 PolarHBondContact O-N 3.44Å; M320-D322 PolarHBondContact O-N 3.14Å; M320-F356 HydrophobicContact CE-CE2 3.94Å; M320-F356 HydrophobicContact CE-CZ 4.01Å; M320-F356 HydrophobicContact SD-CZ 4.23Å
321	D	32.9	Very low	34	Very low	78 Å²	78	88.5 Å²	88.5	42%	0.417	47%	0.465	S	S	.	.			trans	-51.1	130.5	164.4	175.4	0.9	0	0	0	108.8	T323 F324 L325	D321-T323 VanDerWaalsContact CG-CB 3.44Å; D321-T323 PolarHBondContact O-N 3.45Å; D321-T323 VanDerWaalsContact O-N 3.08Å; D321-T323 WeakPolarHBondContact OD1-CB 3.43Å; D321-T323 PolarHBondContact OD1-N 3.34Å; D321-T323 PolarHBondContact OD1-OG1 3.16Å; D321-T323 WeakPolarHBondContact OD2-CB 3.48Å; D321-T323 PolarHBondContact OD2-OG1 3.32Å; D321-F324 HydrophobicContact CB-CB 4.41Å; D321-F324 HydrophobicContact CB-CD2 4.12Å; D321-F324 WeakPolarHBondContact O-CA 3.36Å; D321-F324 WeakPolarHBondContact O-CB 3.3Å; D321-F324 PolarHBondContact O-N 3.1Å; D321-L325 PolarHBondContact O-N 3.2Å
322	D	38.3	Very low	34.4	Very low	92 Å²	92	86.4 Å²	86.4	49%	0.492	45%	0.454	S	S	.	.	H	α-helix	trans	-53.3	-30.8	175.2	-79.5	-46.7	0	0	0	110.7	M320 F324 L325 L326	M320-D322 PolarHBondContact O-N 3.14Å; D322-F324 VanDerWaalsContact C-N 3.33Å; D322-F324 PolarHBondContact O-N 3.45Å; D322-L325 PolarHBondContact O-N 3.25Å; D322-L326 VanDerWaalsContact O-CB 3.22Å; D322-L326 WeakPolarHBondContact O-CB 3.27Å; D322-L326 WeakPolarHBondContact O-CG 3.3Å; D322-L326 PolarHBondContact O-N 3.31Å
323	T	36.4	Very low	34.7	Very low	88 Å²	88	87.9 Å²	87.9	54%	0.54	46%	0.462	S	S	.	.	H	α-helix	trans	-60.8	-38.4	172.8	-41.8	0	0	0	0	112.1	D321 E327	D321-T323 VanDerWaalsContact CG-CB 3.44Å; D321-T323 PolarHBondContact O-N 3.45Å; D321-T323 VanDerWaalsContact O-N 3.08Å; D321-T323 WeakPolarHBondContact OD1-CB 3.43Å; D321-T323 PolarHBondContact OD1-N 3.34Å; D321-T323 PolarHBondContact OD1-OG1 3.16Å; D321-T323 WeakPolarHBondContact OD2-CB 3.48Å; D321-T323 PolarHBondContact OD2-OG1 3.32Å; T323-E327 WeakPolarHBondContact O-CB 3.44Å; T323-E327 PolarHBondContact O-N 3.03Å
324	F	35.6	Very low	34.7	Very low	122 Å²	122	88 Å²	88	54%	0.535	47%	0.466	S	S	.	.	H	α-helix	trans	-70.6	-40.7	176.2	-100	-98.8	0	0	0	112.2	D321 D322 E327 F328	D321-F324 HydrophobicContact CB-CB 4.41Å; D321-F324 HydrophobicContact CB-CD2 4.12Å; D321-F324 WeakPolarHBondContact O-CA 3.36Å; D321-F324 WeakPolarHBondContact O-CB 3.3Å; D321-F324 PolarHBondContact O-N 3.1Å; D322-F324 VanDerWaalsContact C-N 3.33Å; D322-F324 PolarHBondContact O-N 3.45Å; F324-E327 PolarHBondContact O-N 2.88Å; F324-F328 WeakPolarHBondContact O-CB 3.2Å; F324-F328 PolarHBondContact O-N 3.16Å
325	L	41.4	Very low	34.8	Very low	43 Å²	43	86.4 Å²	86.4	23%	0.225	47%	0.471	C	S	.	.	H	α-helix	trans	-68	-40.7	175.8	-176.3	61.1	0	0	0	110.9	D321 D322 L329	D321-L325 PolarHBondContact O-N 3.2Å; D322-L325 PolarHBondContact O-N 3.25Å; L325-L329 HydrophobicContact CG-CD1 4.41Å; L325-L329 WeakPolarHBondContact O-CB 3.33Å; L325-L329 VanDerWaalsContact O-CG 3.25Å; L325-L329 WeakPolarHBondContact O-CG 3.42Å; L325-L329 PolarHBondContact O-N 3.38Å
326	L	42.3	Very low	34.8	Very low	106 Å²	106	83.1 Å²	83.1	56%	0.555	46%	0.463	S	S	*	.	H	α-helix	trans	-68.8	-37.2	174.7	-71.3	168.6	0	0	0	112.5	D322 L329 D330	D322-L326 VanDerWaalsContact O-CB 3.22Å; D322-L326 WeakPolarHBondContact O-CB 3.27Å; D322-L326 WeakPolarHBondContact O-CG 3.3Å; D322-L326 PolarHBondContact O-N 3.31Å; L326-L329 PolarHBondContact O-N 3.02Å; L326-D330 WeakPolarHBondContact O-CB 3.44Å; L326-D330 PolarHBondContact O-N 3.31Å
327	E	41.3	Very low	35	Very low	74 Å²	74	84.2 Å²	84.2	35%	0.346	47%	0.472	S	S	.	.	H	α-helix	trans	-73.2	-37.3	176	-166.5	-170.2	-152.1	0	0	111.5	T323 F324 L329 D330 R331	T323-E327 WeakPolarHBondContact O-CB 3.44Å; T323-E327 PolarHBondContact O-N 3.03Å; F324-E327 PolarHBondContact O-N 2.88Å; E327-L329 VanDerWaalsContact C-N 3.31Å; E327-L329 PolarHBondContact O-N 2.93Å; E327-D330 PolarHBondContact O-N 3.44Å; E327-R331 VanDerWaalsContact CD-CZ 3.44Å; E327-R331 HydrophobicContact CG-CG 4.41Å; E327-R331 VanDerWaalsContact O-CB 3.27Å; E327-R331 WeakPolarHBondContact O-CB 3.48Å; E327-R331 WeakPolarHBondContact O-CG 3.44Å; E327-R331 PolarHBondContact O-N 2.79Å; E327-R331 IonicContact OE1-CZ 3.05Å; E327-R331 IonicContact OE1-NH1 2.97Å; E327-R331 PolarHBondContact OE1-NH1 3.37Å; E327-R331 IonicContact OE1-NH2 2.7Å; E327-R331 PolarHBondContact OE1-NH2 3.03Å; E327-R331 IonicContact OE2-CZ 3.71Å; E327-R331 IonicContact OE2-NH1 2.82Å; E327-R331 PolarHBondContact OE2-NH1 3.47Å; E327-R331 IonicContact OE2-NH2 3.94Å
328	F	40.1	Very low	35.2	Very low	27 Å²	27	83.5 Å²	83.5	12%	0.118	48%	0.477	C	S	.	.	H	α-helix	trans	-58.2	-45.1	169.2	172.2	-95.9	0	0	0	110.8	F324 N332 F356	F324-F328 WeakPolarHBondContact O-CB 3.2Å; F324-F328 PolarHBondContact O-N 3.16Å; F328-N332 WeakPolarHBondContact O-CB 3.5Å; F328-N332 PolarHBondContact O-N 2.97Å; F328-N332 PolarHBondContact O-ND2 2.72Å; F328-F356 HydrophobicContact CD1-CE1 4.3Å; F328-F356 HydrophobicContact CE1-CD1 4.06Å; F328-F356 AromaticContact CE1-CE1 3.94Å; F328-F356 HydrophobicContact CE1-CE1 3.94Å; F328-F356 HydrophobicContact CE2-CD1 4.35Å; F328-F356 HydrophobicContact CE2-CE1 4.46Å; F328-F356 AromaticContact CZ-CD1 3.78Å; F328-F356 HydrophobicContact CZ-CD1 3.78Å; F328-F356 HydrophobicContact CZ-CE1 4.02Å
329	L	41.2	Very low	35.5	Very low	29 Å²	29	87.5 Å²	87.5	15%	0.152	49%	0.485	C	S	.	.	H	α-helix	trans	-65.9	-52.6	175	-72.2	169.7	0	0	0	111.5	Y42 L325 L326 E327 R331 N332 L333	Y42-L329 HydrophobicContact CD2-CD2 3.78Å; Y42-L329 HydrophobicContact CE2-CD2 3.93Å; Y42-L329 HydrophobicContact CG-CD2 4.5Å; L325-L329 HydrophobicContact CG-CD1 4.41Å; L325-L329 WeakPolarHBondContact O-CB 3.33Å; L325-L329 VanDerWaalsContact O-CG 3.25Å; L325-L329 WeakPolarHBondContact O-CG 3.42Å; L325-L329 PolarHBondContact O-N 3.38Å; L326-L329 PolarHBondContact O-N 3.02Å; E327-L329 VanDerWaalsContact C-N 3.31Å; E327-L329 PolarHBondContact O-N 2.93Å; L329-R331 PolarHBondContact O-N 3.06Å; L329-N332 CarbonylContact O-C 3.53Å; L329-N332 PolarHBondContact O-N 2.76Å; L329-N332 VanDerWaalsContact O-N 3.16Å; L329-L333 HydrophobicContact CB-CD1 4.06Å; L329-L333 WeakPolarHBondContact O-CB 3.49Å; L329-L333 WeakPolarHBondContact O-CD1 3.43Å; L329-L333 WeakPolarHBondContact O-CG 3.28Å; L329-L333 PolarHBondContact O-N 3.34Å
330	D	39.9	Very low	36	Very low	87 Å²	87	86.4 Å²	86.4	47%	0.465	48%	0.475	S	S	.	.	H	α-helix	trans	-65.5	-34.5	-176.3	-130.6	41.5	0	0	0	111.9	R3 L326 E327 A334	R3-D330 IonicContact NH1-OD2 2.68Å; R3-D330 PolarHBondContact NH1-OD2 3Å; L326-D330 WeakPolarHBondContact O-CB 3.44Å; L326-D330 PolarHBondContact O-N 3.31Å; E327-D330 PolarHBondContact O-N 3.44Å; D330-A334 WeakPolarHBondContact O-CB 3.37Å; D330-A334 PolarHBondContact O-N 3.05Å
331	R	38.6	Very low	36.1	Very low	114 Å²	114	86.3 Å²	86.3	43%	0.43	48%	0.476	S	S	.	.	H	α-helix	trans	-66	-38.4	171.9	-81.8	-167.6	173.1	108.6	17	113.3	E327 L329	E327-R331 VanDerWaalsContact CD-CZ 3.44Å; E327-R331 HydrophobicContact CG-CG 4.41Å; E327-R331 VanDerWaalsContact O-CB 3.27Å; E327-R331 WeakPolarHBondContact O-CB 3.48Å; E327-R331 WeakPolarHBondContact O-CG 3.44Å; E327-R331 PolarHBondContact O-N 2.79Å; E327-R331 IonicContact OE1-CZ 3.05Å; E327-R331 IonicContact OE1-NH1 2.97Å; E327-R331 PolarHBondContact OE1-NH1 3.37Å; E327-R331 IonicContact OE1-NH2 2.7Å; E327-R331 PolarHBondContact OE1-NH2 3.03Å; E327-R331 IonicContact OE2-CZ 3.71Å; E327-R331 IonicContact OE2-NH1 2.82Å; E327-R331 PolarHBondContact OE2-NH1 3.47Å; E327-R331 IonicContact OE2-NH2 3.94Å; L329-R331 PolarHBondContact O-N 3.06Å
332	N	35.2	Very low	36.2	Very low	35 Å²	35	86 Å²	86	19%	0.187	49%	0.485	C	S	.	.	H	α-helix	trans	-87.2	-18.5	179.8	-72.2	-80.7	0	0	0	113.3	F328 L329	F328-N332 WeakPolarHBondContact O-CB 3.5Å; F328-N332 PolarHBondContact O-N 2.97Å; F328-N332 PolarHBondContact O-ND2 2.72Å; L329-N332 CarbonylContact O-C 3.53Å; L329-N332 PolarHBondContact O-N 2.76Å; L329-N332 VanDerWaalsContact O-N 3.16Å
333	L	34.1	Very low	36.4	Very low	91 Å²	91	85.7 Å²	85.7	48%	0.476	48%	0.483	S	S	.	.	H	α-helix	trans	-89.1	-32.9	174.9	-71.3	168.4	0	0	0	112.4	Y42 V46 L329 G335	Y42-L333 HydrophobicContact CD2-CD2 4.38Å; Y42-L333 HydrophobicContact CE2-CD2 4.48Å; V46-L333 HydrophobicContact CG1-CD2 4.44Å; L329-L333 HydrophobicContact CB-CD1 4.06Å; L329-L333 WeakPolarHBondContact O-CB 3.49Å; L329-L333 WeakPolarHBondContact O-CD1 3.43Å; L329-L333 WeakPolarHBondContact O-CG 3.28Å; L329-L333 PolarHBondContact O-N 3.34Å; L333-G335 PolarHBondContact O-N 3.02Å
334	A	29	Very low	36.5	Very low	46 Å²	46	84 Å²	84	38%	0.38	47%	0.468	S	S	.	.	S	Bend	trans	-72.3	95.3	166.6	0	0	0	0	0	108.8	D330 T336	D330-A334 WeakPolarHBondContact O-CB 3.37Å; D330-A334 PolarHBondContact O-N 3.05Å; A334-T336 VanDerWaalsContact C-N 3.28Å; A334-T336 HydrophobicContact CB-CG2 4.4Å; A334-T336 WeakPolarHBondContact O-CB 3.07Å; A334-T336 PolarHBondContact O-N 3.08Å; A334-T336 PolarHBondContact O-OG1 3.37Å
335	G	28.7	Very low	36.5	Very low	76 Å²	76	79 Å²	79	78%	0.784	45%	0.449	S	S	*	.			trans	-58.9	85.1	179	0	0	0	0	0	112.3	L333	L333-G335 PolarHBondContact O-N 3.02Å
336	T	30.6	Very low	36.5	Very low	73 Å²	73	83.6 Å²	83.6	45%	0.448	47%	0.47	S	S	.	.			trans	-108.5	86	-171.7	38.1	0	0	0	0	109.9	A334 S338	A334-T336 VanDerWaalsContact C-N 3.28Å; A334-T336 HydrophobicContact CB-CG2 4.4Å; A334-T336 WeakPolarHBondContact O-CB 3.07Å; A334-T336 PolarHBondContact O-N 3.08Å; A334-T336 PolarHBondContact O-OG1 3.37Å; T336-S338 PolarHBondContact O-N 3.25Å; T336-S338 VanDerWaalsContact O-N 3.15Å
337	D	31.5	Very low	36.6	Very low	145 Å²	145	87.1 Å²	87.1	78%	0.775	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	32.7	69.4	150.9	-58.1	-20.2	0	0	0	117.2	K339	D337-K339 PolarHBondContact O-N 3.04Å
338	S	31.4	Very low	36.6	Very low	118 Å²	118	86.7 Å²	86.7	83%	0.825	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.5	49.8	140.6	61.6	0	0	0	0	118.3	T336	T336-S338 PolarHBondContact O-N 3.25Å; T336-S338 VanDerWaalsContact O-N 3.15Å
339	K	36	Very low	36.9	Very low	199 Å²	199	88.5 Å²	88.5	87%	0.865	51%	0.507	S	S	*	.	S	Bend	trans	-159.6	-26.9	159.3	-111.5	149.1	-172.8	175.9	0	116.6	D337	D337-K339 PolarHBondContact O-N 3.04Å
340	T	38.5	Very low	37.2	Very low	91 Å²	91	88.9 Å²	88.9	56%	0.558	51%	0.509	S	S	*	.	S	Bend	trans	-88.5	-29.1	-170.8	38.2	0	0	0	0	115	A342 N343	T340-A342 PolarHBondContact O-N 3.04Å; T340-N343 WeakPolarHBondContact O-CB 3.41Å; T340-N343 PolarHBondContact O-N 3.27Å; T340-N343 VanDerWaalsContact O-N 3.08Å
341	N	35.7	Very low	37.5	Very low	79 Å²	79	92.9 Å²	92.9	42%	0.422	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-13.7	-171.1	-77.9	2	0	0	0	116	N343	N341-N343 VanDerWaalsContact C-N 3.33Å
342	A	34.9	Very low	37.6	Very low	72 Å²	72	89.3 Å²	89.3	60%	0.595	52%	0.522	S	S	*	.	H	α-helix	trans	-65.6	-36.9	171.9	0	0	0	0	0	112.3	T340 F344 E346	T340-A342 PolarHBondContact O-N 3.04Å; A342-F344 VanDerWaalsContact C-N 3.29Å; A342-F344 PolarHBondContact O-N 2.92Å; A342-E346 WeakPolarHBondContact O-CB 3.44Å; A342-E346 PolarHBondContact O-N 3.2Å
343	N	42.9	Very low	37.9	Very low	85 Å²	85	90 Å²	90	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-69.6	-20.9	-163.7	-151.8	-84.9	0	0	0	113.8	T340 N341 R347	T340-N343 WeakPolarHBondContact O-CB 3.41Å; T340-N343 PolarHBondContact O-N 3.27Å; T340-N343 VanDerWaalsContact O-N 3.08Å; N341-N343 VanDerWaalsContact C-N 3.33Å; N343-R347 WeakPolarHBondContact O-CD 3.5Å; N343-R347 WeakPolarHBondContact O-CG 3.34Å; N343-R347 PolarHBondContact O-N 3.18Å; N343-R347 PolarHBondContact OD1-NE 3.12Å; N343-R347 VanDerWaalsContact OD1-NE 3.11Å
344	F	38.5	Very low	38.2	Very low	51 Å²	51	88.9 Å²	88.9	22%	0.224	53%	0.526	C	S	.	.	H	α-helix	trans	-92.5	-34.7	-174.4	-133	-82.1	0	0	0	113.9	A342 E346 R347 C348	A342-F344 VanDerWaalsContact C-N 3.29Å; A342-F344 PolarHBondContact O-N 2.92Å; F344-E346 VanDerWaalsContact C-N 3.34Å; F344-R347 PolarHBondContact O-N 3.5Å; F344-C348 PolarHBondContact O-N 2.85Å
345	A	33.9	Very low	39	Very low	18 Å²	18	88 Å²	88	15%	0.149	52%	0.518	C	S	.	.	H	α-helix	trans	-68	-40.8	172.1	0	0	0	0	0	110.2	R347 C348 G349 L350	A345-R347 PolarHBondContact O-N 3.13Å; A345-C348 CarbonylContact O-C 3.12Å; A345-C348 WeakPolarHBondContact O-CA 3.31Å; A345-C348 PolarHBondContact O-N 3.39Å; A345-G349 PolarHBondContact O-N 3.39Å; A345-L350 CarbonylContact C-O 3.59Å; A345-L350 WeakPolarHBondContact CB-O 3.46Å; A345-L350 PolarHBondContact O-N 2.98Å
346	E	42.1	Very low	39.8	Very low	140 Å²	140	85.4 Å²	85.4	65%	0.654	49%	0.485	S	S	*	.	H	α-helix	trans	-58.1	-42.9	172.4	-169.7	169.4	-140.2	0	0	112.6	A342 F344 C348 G349	A342-E346 WeakPolarHBondContact O-CB 3.44Å; A342-E346 PolarHBondContact O-N 3.2Å; F344-E346 VanDerWaalsContact C-N 3.34Å; E346-C348 PolarHBondContact O-N 3.02Å; E346-G349 PolarHBondContact O-N 3.04Å
347	R	44.7	Very low	40.6	Very low	179 Å²	179	83 Å²	83	68%	0.675	47%	0.47	S	S	*	.	H	α-helix	trans	-60.5	-26	171.9	-81.4	167.5	-178.3	-129.3	-5.9	114.4	N343 F344 A345	N343-R347 WeakPolarHBondContact O-CD 3.5Å; N343-R347 WeakPolarHBondContact O-CG 3.34Å; N343-R347 PolarHBondContact O-N 3.18Å; N343-R347 PolarHBondContact OD1-NE 3.12Å; N343-R347 VanDerWaalsContact OD1-NE 3.11Å; F344-R347 PolarHBondContact O-N 3.5Å; A345-R347 PolarHBondContact O-N 3.13Å
348	C	41.5	Very low	41.4	Very low	66 Å²	66	80.5 Å²	80.5	45%	0.446	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	5	174	-62.6	0	0	0	0	113.1	F344 A345 E346 L350	F344-C348 PolarHBondContact O-N 2.85Å; A345-C348 CarbonylContact O-C 3.12Å; A345-C348 WeakPolarHBondContact O-CA 3.31Å; A345-C348 PolarHBondContact O-N 3.39Å; E346-C348 PolarHBondContact O-N 3.02Å; C348-L350 VanDerWaalsContact C-N 3.25Å; C348-L350 HydrophobicContact CB-CD1 4.04Å; C348-L350 WeakPolarHBondContact O-CG 3.42Å; C348-L350 PolarHBondContact O-N 2.68Å
349	G	46	Very low	42.3	Very low	65 Å²	65	77.2 Å²	77.2	67%	0.67	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	21.4	-176.8	0	0	0	0	0	114	A345 E346	A345-G349 PolarHBondContact O-N 3.39Å; E346-G349 PolarHBondContact O-N 3.04Å
350	L	46.6	Very low	43	Very low	37 Å²	37	69.9 Å²	69.9	19%	0.194	40%	0.397	C	S	.	.			trans	-124.3	124.8	-168.9	-73.4	161	0	0	0	110.7	A345 C348 S352 A355 F356	A345-L350 CarbonylContact C-O 3.59Å; A345-L350 WeakPolarHBondContact CB-O 3.46Å; A345-L350 PolarHBondContact O-N 2.98Å; C348-L350 VanDerWaalsContact C-N 3.25Å; C348-L350 HydrophobicContact CB-CD1 4.04Å; C348-L350 WeakPolarHBondContact O-CG 3.42Å; C348-L350 PolarHBondContact O-N 2.68Å; L350-S352 PolarHBondContact O-N 3.01Å; L350-A355 HydrophobicContact CB-CB 4.31Å; L350-A355 HydrophobicContact CD2-CB 3.94Å; L350-F356 HydrophobicContact CD1-CB 4.08Å; L350-F356 HydrophobicContact CD1-CD2 4.02Å
351	N	46.3	Very low	43.5	Very low	170 Å²	170	66.8 Å²	66.8	91%	0.909	38%	0.376	S	S	*	.	S	Bend	trans	-72.8	-3	-169.3	-61.3	-23.6	0	0	0	114.9
352	S	42.6	Very low	44.2	Very low	39 Å²	39	67.8 Å²	67.8	27%	0.273	38%	0.377	S	S	.	.	S	Bend	trans	-163.4	160.5	175.3	67.6	0	0	0	0	112.5	L350 T354 A355 F356	L350-S352 PolarHBondContact O-N 3.01Å; S352-T354 PolarHBondContact O-N 3.47Å; S352-T354 PolarHBondContact OG-N 2.74Å; S352-A355 WeakPolarHBondContact O-CB 3.31Å; S352-A355 PolarHBondContact O-N 3.32Å; S352-A355 VanDerWaalsContact O-N 3.1Å; S352-A355 PolarHBondContact OG-N 3.22Å; S352-F356 PolarHBondContact O-N 3.33Å
353	P	39.8	Very low	45.1	Very low	51 Å²	51	69.8 Å²	69.8	33%	0.331	37%	0.373	S	S	.	.	H	α-helix	trans	-57.2	-30.9	167	-25.4	35.6	0	0	0	113.2	F356 V357	P353-F356 WeakPolarHBondContact O-CB 3.18Å; P353-F356 PolarHBondContact O-N 3.09Å; P353-V357 PolarHBondContact O-N 2.81Å; P353-V357 VanDerWaalsContact O-N 3.07Å
354	T	41.5	Very low	45.1	Very low	66 Å²	66	68.3 Å²	68.3	41%	0.405	37%	0.372	S	S	.	.	H	α-helix	trans	-63.1	-42.8	173.8	-44.8	0	0	0	0	111.5	S352 F356 V357 E358	S352-T354 PolarHBondContact O-N 3.47Å; S352-T354 PolarHBondContact OG-N 2.74Å; T354-F356 VanDerWaalsContact C-N 3.29Å; T354-F356 PolarHBondContact O-N 2.87Å; T354-V357 PolarHBondContact O-N 3.46Å; T354-E358 WeakPolarHBondContact O-CB 3.15Å; T354-E358 PolarHBondContact O-N 2.78Å
355	A	46.1	Very low	45.3	Very low	27 Å²	27	70 Å²	70	22%	0.223	38%	0.38	C	S	.	.	H	α-helix	trans	-64.6	-33	177.5	0	0	0	0	0	112.4	L350 S352 D359	L350-A355 HydrophobicContact CB-CB 4.31Å; L350-A355 HydrophobicContact CD2-CB 3.94Å; S352-A355 WeakPolarHBondContact O-CB 3.31Å; S352-A355 PolarHBondContact O-N 3.32Å; S352-A355 VanDerWaalsContact O-N 3.1Å; S352-A355 PolarHBondContact OG-N 3.22Å; A355-D359 WeakPolarHBondContact O-CB 3.33Å; A355-D359 PolarHBondContact O-N 3.23Å
356	F	45.2	Very low	45.9	Very low	22 Å²	22	76.7 Å²	76.7	10%	0.096	41%	0.406	C	S	.	.	H	α-helix	trans	-65.8	-47.9	172.1	177.8	-98.8	0	0	0	112.4	M320 F328 L350 S352 P353 T354 E358 D359 M360	M320-F356 HydrophobicContact CE-CE2 3.94Å; M320-F356 HydrophobicContact CE-CZ 4.01Å; M320-F356 HydrophobicContact SD-CZ 4.23Å; F328-F356 HydrophobicContact CD1-CE1 4.3Å; F328-F356 HydrophobicContact CE1-CD1 4.06Å; F328-F356 AromaticContact CE1-CE1 3.94Å; F328-F356 HydrophobicContact CE1-CE1 3.94Å; F328-F356 HydrophobicContact CE2-CD1 4.35Å; F328-F356 HydrophobicContact CE2-CE1 4.46Å; F328-F356 AromaticContact CZ-CD1 3.78Å; F328-F356 HydrophobicContact CZ-CD1 3.78Å; F328-F356 HydrophobicContact CZ-CE1 4.02Å; L350-F356 HydrophobicContact CD1-CB 4.08Å; L350-F356 HydrophobicContact CD1-CD2 4.02Å; S352-F356 PolarHBondContact O-N 3.33Å; P353-F356 WeakPolarHBondContact O-CB 3.18Å; P353-F356 PolarHBondContact O-N 3.09Å; T354-F356 VanDerWaalsContact C-N 3.29Å; T354-F356 PolarHBondContact O-N 2.87Å; F356-E358 VanDerWaalsContact C-N 3.33Å; F356-E358 PolarHBondContact O-N 3.32Å; F356-D359 PolarHBondContact O-N 3.1Å; F356-M360 HydrophobicContact CD1-SD 4.05Å; F356-M360 HydrophobicContact CE1-CG 4.33Å; F356-M360 HydrophobicContact CE1-SD 3.42Å; F356-M360 WeakPolarHBondContact CE1-SD 3.33Å; F356-M360 HydrophobicContact CZ-CG 4.38Å; F356-M360 HydrophobicContact CZ-SD 3.73Å; F356-M360 WeakPolarHBondContact O-CG 3.32Å; F356-M360 PolarHBondContact O-N 2.68Å
357	V	47	Very low	45.8	Very low	22 Å²	22	73.6 Å²	73.6	13%	0.133	40%	0.397	C	S	.	.	H	α-helix	trans	-62.4	-40.5	175.3	175	0	0	0	0	111.4	M39 F55 P353 T354 M360 I361	M39-V357 HydrophobicContact CE-CG1 3.82Å; F55-V357 HydrophobicContact CE1-CG1 4.47Å; P353-V357 PolarHBondContact O-N 2.81Å; P353-V357 VanDerWaalsContact O-N 3.07Å; T354-V357 PolarHBondContact O-N 3.46Å; V357-M360 PolarHBondContact O-N 3.14Å; V357-I361 HydrophobicContact CG1-CD1 3.94Å; V357-I361 VanDerWaalsContact O-CG1 3.27Å; V357-I361 WeakPolarHBondContact O-CG1 3.36Å; V357-I361 PolarHBondContact O-N 3.02Å
358	E	48.2	Very low	45.5	Very low	94 Å²	94	69.5 Å²	69.5	44%	0.439	39%	0.388	S	S	.	.	H	α-helix	trans	-62	-42.2	173.9	-83.6	-170.6	-134.9	0	0	113.2	T354 F356 I361 K362	T354-E358 WeakPolarHBondContact O-CB 3.15Å; T354-E358 PolarHBondContact O-N 2.78Å; F356-E358 VanDerWaalsContact C-N 3.33Å; F356-E358 PolarHBondContact O-N 3.32Å; E358-I361 PolarHBondContact O-N 3.37Å; E358-K362 WeakPolarHBondContact O-CB 3.26Å; E358-K362 WeakPolarHBondContact O-CD 3.45Å; E358-K362 WeakPolarHBondContact O-CG 3.47Å; E358-K362 PolarHBondContact O-N 3.06Å; E358-K362 IonicContact OE2-NZ 3.38Å; E358-K362 PolarHBondContact OE2-NZ 3.24Å
359	D	50.4	Low	45.4	Very low	48 Å²	48	71.2 Å²	71.2	26%	0.257	39%	0.393	S	S	.	.	H	α-helix	trans	-67.9	-40.2	178.1	178.2	58	0	0	0	111.8	A355 F356 I361 K362 K363	A355-D359 WeakPolarHBondContact O-CB 3.33Å; A355-D359 PolarHBondContact O-N 3.23Å; F356-D359 PolarHBondContact O-N 3.1Å; D359-I361 PolarHBondContact O-N 2.74Å; D359-K362 PolarHBondContact O-N 2.88Å; D359-K363 WeakPolarHBondContact O-CB 3.02Å; D359-K363 WeakPolarHBondContact O-CG 3.27Å; D359-K363 PolarHBondContact O-N 2.84Å; D359-K363 WeakPolarHBondContact OD1-CE 3.49Å; D359-K363 IonicContact OD1-NZ 2.81Å; D359-K363 WeakPolarHBondContact OD2-CE 3.35Å; D359-K363 IonicContact OD2-NZ 2.84Å; D359-K363 PolarHBondContact OD2-NZ 3.04Å
360	M	51.1	Low	45.1	Very low	46 Å²	46	74.4 Å²	74.4	23%	0.227	39%	0.39	C	S	.	.	H	α-helix	trans	-57.7	-48.4	170.6	-72.1	-174.2	72.1	0	0	111.8	F356 V357 K362 K363 A364	F356-M360 HydrophobicContact CD1-SD 4.05Å; F356-M360 HydrophobicContact CE1-CG 4.33Å; F356-M360 HydrophobicContact CE1-SD 3.42Å; F356-M360 WeakPolarHBondContact CE1-SD 3.33Å; F356-M360 HydrophobicContact CZ-CG 4.38Å; F356-M360 HydrophobicContact CZ-SD 3.73Å; F356-M360 WeakPolarHBondContact O-CG 3.32Å; F356-M360 PolarHBondContact O-N 2.68Å; V357-M360 PolarHBondContact O-N 3.14Å; M360-K362 PolarHBondContact O-N 3.43Å; M360-K363 PolarHBondContact O-N 2.92Å; M360-A364 PolarHBondContact O-N 3Å
361	I	48.3	Very low	44.5	Very low	25 Å²	25	77.6 Å²	77.6	13%	0.128	40%	0.404	C	S	.	.	H	α-helix	trans	-60.7	-45.1	176.8	-67.5	165.2	0	0	0	110.7	M39 F55 F59 V357 E358 D359 K363 A364 Q365	M39-I361 HydrophobicContact CE-CD1 3.85Å; M39-I361 HydrophobicContact CE-CG1 3.95Å; F55-I361 HydrophobicContact CE1-CD1 4.44Å; F59-I361 HydrophobicContact CE2-CD1 4.29Å; V357-I361 HydrophobicContact CG1-CD1 3.94Å; V357-I361 VanDerWaalsContact O-CG1 3.27Å; V357-I361 WeakPolarHBondContact O-CG1 3.36Å; V357-I361 PolarHBondContact O-N 3.02Å; E358-I361 PolarHBondContact O-N 3.37Å; D359-I361 PolarHBondContact O-N 2.74Å; I361-K363 VanDerWaalsContact C-N 3.32Å; I361-K363 PolarHBondContact O-N 2.88Å; I361-A364 PolarHBondContact O-N 2.83Å; I361-Q365 HydrophobicContact CG2-CG 4.25Å; I361-Q365 VanDerWaalsContact O-CB 3.3Å; I361-Q365 WeakPolarHBondContact O-CB 3.28Å; I361-Q365 VanDerWaalsContact O-CG 3.27Å; I361-Q365 WeakPolarHBondContact O-CG 3.29Å; I361-Q365 PolarHBondContact O-N 2.93Å
362	K	51.7	Low	43.9	Very low	101 Å²	101	78.4 Å²	78.4	44%	0.439	40%	0.396	S	S	.	.	H	α-helix	trans	-63.8	-35.3	178.6	-72.7	161	-166.8	164.8	0	112.1	E358 D359 M360 K366	E358-K362 WeakPolarHBondContact O-CB 3.26Å; E358-K362 WeakPolarHBondContact O-CD 3.45Å; E358-K362 WeakPolarHBondContact O-CG 3.47Å; E358-K362 PolarHBondContact O-N 3.06Å; E358-K362 IonicContact OE2-NZ 3.38Å; E358-K362 PolarHBondContact OE2-NZ 3.24Å; D359-K362 PolarHBondContact O-N 2.88Å; M360-K362 PolarHBondContact O-N 3.43Å; K362-K366 WeakPolarHBondContact O-CB 3.38Å; K362-K366 WeakPolarHBondContact O-CG 3.5Å; K362-K366 PolarHBondContact O-N 3.49Å
363	K	52.5	Low	43.7	Very low	114 Å²	114	84.5 Å²	84.5	50%	0.496	42%	0.417	S	S	.	.	H	α-helix	trans	-68.2	-51.8	174.2	-76.6	166.9	175	169	0	111.4	D359 M360 I361 Q365 K366 T367	D359-K363 WeakPolarHBondContact O-CB 3.02Å; D359-K363 WeakPolarHBondContact O-CG 3.27Å; D359-K363 PolarHBondContact O-N 2.84Å; D359-K363 WeakPolarHBondContact OD1-CE 3.49Å; D359-K363 IonicContact OD1-NZ 2.81Å; D359-K363 WeakPolarHBondContact OD2-CE 3.35Å; D359-K363 IonicContact OD2-NZ 2.84Å; D359-K363 PolarHBondContact OD2-NZ 3.04Å; M360-K363 PolarHBondContact O-N 2.92Å; I361-K363 VanDerWaalsContact C-N 3.32Å; I361-K363 PolarHBondContact O-N 2.88Å; K363-Q365 VanDerWaalsContact C-N 3.33Å; K363-Q365 PolarHBondContact O-N 2.85Å; K363-K366 PolarHBondContact O-N 3.12Å; K363-K366 VanDerWaalsContact O-N 3.12Å; K363-T367 PolarHBondContact O-N 2.75Å; K363-T367 PolarHBondContact O-OG1 2.8Å
364	A	44.2	Very low	43.4	Very low	54 Å²	54	89.6 Å²	89.6	45%	0.446	45%	0.452	S	S	.	.	H	α-helix	trans	-57.3	-45	176.5	0	0	0	0	0	112.2	M360 I361 K366 T367 L368	M360-A364 PolarHBondContact O-N 3Å; I361-A364 PolarHBondContact O-N 2.83Å; A364-K366 PolarHBondContact O-N 3.44Å; A364-T367 PolarHBondContact O-N 3.12Å; A364-L368 PolarHBondContact O-N 3.03Å
365	Q	42.1	Very low	43.5	Very low	85 Å²	85	90.8 Å²	90.8	40%	0.397	46%	0.455	S	S	.	.	H	α-helix	trans	-64.8	-35.4	175.9	-73.9	178.4	-9.7	0	0	113	I361 K363 N369	I361-Q365 HydrophobicContact CG2-CG 4.25Å; I361-Q365 VanDerWaalsContact O-CB 3.3Å; I361-Q365 WeakPolarHBondContact O-CB 3.28Å; I361-Q365 VanDerWaalsContact O-CG 3.27Å; I361-Q365 WeakPolarHBondContact O-CG 3.29Å; I361-Q365 PolarHBondContact O-N 2.93Å; K363-Q365 VanDerWaalsContact C-N 3.33Å; K363-Q365 PolarHBondContact O-N 2.85Å; Q365-N369 VanDerWaalsContact O-CB 3.31Å; Q365-N369 WeakPolarHBondContact O-CB 3.08Å; Q365-N369 PolarHBondContact O-N 3.34Å; Q365-N369 PolarHBondContact O-ND2 2.83Å
366	K	46.9	Very low	43.4	Very low	159 Å²	159	94.2 Å²	94.2	69%	0.691	47%	0.467	S	S	*	.	H	α-helix	trans	-64.4	-45.3	173.2	-84.1	178.8	176.3	-176.9	0	111.5	K362 K363 A364 N369 H370	K362-K366 WeakPolarHBondContact O-CB 3.38Å; K362-K366 WeakPolarHBondContact O-CG 3.5Å; K362-K366 PolarHBondContact O-N 3.49Å; K363-K366 PolarHBondContact O-N 3.12Å; K363-K366 VanDerWaalsContact O-N 3.12Å; A364-K366 PolarHBondContact O-N 3.44Å; K366-N369 PolarHBondContact O-N 2.91Å; K366-H370 PolarHBondContact O-N 3.01Å
367	T	39.6	Very low	43.3	Very low	76 Å²	76	98.2 Å²	98.2	47%	0.466	49%	0.488	S	S	.	.	H	α-helix	trans	-59.8	-48.1	178.3	-54.4	0	0	0	0	111.4	K363 A364 H370 Q371	K363-T367 PolarHBondContact O-N 2.75Å; K363-T367 PolarHBondContact O-OG1 2.8Å; A364-T367 PolarHBondContact O-N 3.12Å; T367-H370 PolarHBondContact O-N 3.4Å; T367-Q371 PolarHBondContact O-N 3.49Å
368	L	37.3	Very low	43	Very low	92 Å²	92	102.6 Å²	102.6	48%	0.482	51%	0.508	S	S	.	.	H	α-helix	trans	-59.4	-50.7	175.2	-74.9	163.6	0	0	0	112.1	A364 H370 Q371 Y372	A364-L368 PolarHBondContact O-N 3.03Å; L368-H370 PolarHBondContact O-N 2.93Å; L368-Q371 PolarHBondContact O-N 3.06Å; L368-Q371 VanDerWaalsContact O-N 3.09Å; L368-Y372 VanDerWaalsContact O-CD2 3.27Å; L368-Y372 WeakPolarHBondContact O-CD2 3.35Å; L368-Y372 PolarHBondContact O-N 3.01Å
369	N	39.6	Very low	42.7	Very low	102 Å²	102	103.2 Å²	103.2	55%	0.545	51%	0.513	S	S	.	.	H	α-helix	trans	-66.5	-20.5	-178.7	-78.3	-64.2	0	0	0	113.8	Q365 K366	Q365-N369 VanDerWaalsContact O-CB 3.31Å; Q365-N369 WeakPolarHBondContact O-CB 3.08Å; Q365-N369 PolarHBondContact O-N 3.34Å; Q365-N369 PolarHBondContact O-ND2 2.83Å; K366-N369 PolarHBondContact O-N 2.91Å
370	H	40.1	Very low	42.2	Very low	133 Å²	133	106.9 Å²	106.9	62%	0.616	53%	0.53	S	S	*	.	H	α-helix	trans	-75.3	-36.2	172.5	-131.9	-37.2	0	0	0	111.8	K366 T367 L368 Y372 K373	K366-H370 PolarHBondContact O-N 3.01Å; T367-H370 PolarHBondContact O-N 3.4Å; L368-H370 PolarHBondContact O-N 2.93Å; H370-Y372 VanDerWaalsContact C-N 3.35Å; H370-K373 PolarHBondContact O-N 2.94Å
371	Q	34.7	Very low	41.6	Very low	104 Å²	104	111.2 Å²	111.2	49%	0.486	55%	0.551	S	S	.	*	H	α-helix	trans	-73.5	-21.1	176.8	-70.2	-174.8	-16.2	0	0	113.8	T367 L368 K373	T367-Q371 PolarHBondContact O-N 3.49Å; L368-Q371 PolarHBondContact O-N 3.06Å; L368-Q371 VanDerWaalsContact O-N 3.09Å; Q371-K373 VanDerWaalsContact C-N 3.26Å; Q371-K373 PolarHBondContact O-N 3.08Å
372	Y	33	Very low	41	Very low	187 Å²	187	117.8 Å²	117.8	73%	0.733	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	9.3	169.9	-72	-70.4	0	0	0	113.9	L368 H370	L368-Y372 VanDerWaalsContact O-CD2 3.27Å; L368-Y372 WeakPolarHBondContact O-CD2 3.35Å; L368-Y372 PolarHBondContact O-N 3.01Å; H370-Y372 VanDerWaalsContact C-N 3.35Å
373	K	38	Very low	40.1	Very low	167 Å²	167	119.3 Å²	119.3	73%	0.726	60%	0.596	S	S	*	*			trans	-132	9	-179.1	-75.7	-167.2	171.1	-168.1	0	114.5	H370 Q371	H370-K373 PolarHBondContact O-N 2.94Å; Q371-K373 VanDerWaalsContact C-N 3.26Å; Q371-K373 PolarHBondContact O-N 3.08Å
374	C	34	Very low	39	Very low	158 Å²	158	119.7 Å²	119.7	100%	1.068	61%	0.605	S	S	*	*			trans	-135.1	0	178.4	-64.3	0	0	0	0	110

Retrieved 374 of 374 residues in 270.8 ms (Link to these results)

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