A0A077ZKQ6_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZKQ6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 456 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	37	Very low	30.3	Very low	248 Å²	248	166.3 Å²	166.3	100%	1.222	83%	0.826	S	S	*	*				0	107.2	0	-71.2	-179.5	176.5	0	0	108.5
2	R	33.6	Very low	30.1	Very low	256 Å²	256	170.4 Å²	170.4	97%	0.966	83%	0.825	S	S	*	*			trans	-126.3	104.7	171.8	-74.6	-176.6	-172.8	169.1	2.4	107.1
3	R	27	Very low	29.9	Very low	243 Å²	243	168.3 Å²	168.3	92%	0.917	81%	0.809	S	S	*	*			trans	-96	158.6	165.4	-79.5	-176.3	178.5	177.2	-0.6	107.9
4	V	26.6	Very low	29.6	Very low	135 Å²	135	159.2 Å²	159.2	82%	0.818	78%	0.776	S	S	*	*			trans	90.8	92.3	162	-161.2	0	0	0	0	116.1
5	R	29.1	Very low	29.3	Very low	248 Å²	248	150.8 Å²	150.8	94%	0.936	75%	0.747	S	S	*	*			trans	-171.8	81.7	137.9	-103.5	-179.1	-178.2	179.2	0.8	107.4
6	Q	28.9	Very low	29.1	Very low	181 Å²	181	148.2 Å²	148.2	85%	0.846	74%	0.736	S	S	*	*			trans	-140.1	8.2	178.1	-123.5	177.6	3.3	0	0	115.3
7	E	29.2	Very low	29	Very low	186 Å²	186	140.9 Å²	140.9	87%	0.869	70%	0.701	S	S	*	*	S	Bend	trans	-110.1	1	-167.7	-74	176.7	163.9	0	0	116.9
8	A	30.2	Very low	28.8	Very low	82 Å²	82	143.2 Å²	143.2	68%	0.678	70%	0.7	S	S	*	*	S	Bend	trans	-100.8	-13.4	-177.7	0	0	0	0	0	115.7
9	T	31.7	Very low	28.6	Very low	105 Å²	105	139.4 Å²	139.4	64%	0.644	69%	0.689	S	S	*	*	H	α-helix	trans	-91.5	-17.3	-175.3	47.4	0	0	0	0	114.1
10	G	28.8	Very low	28.5	Very low	52 Å²	52	135.9 Å²	135.9	54%	0.536	67%	0.673	S	S	.	*	H	α-helix	trans	-75	-36.3	179.9	0	0	0	0	0	113.8	A14	G10-A14 WeakPolarHBondContact O-CB 3.47Å; G10-A14 PolarHBondContact O-N 2.97Å
11	S	31.4	Very low	28.4	Very low	93 Å²	93	131 Å²	131	65%	0.65	65%	0.654	S	S	*	*	H	α-helix	trans	-71.8	-43.5	-177.7	168.1	0	0	0	0	112.9	A14 G15	S11-A14 PolarHBondContact O-N 3.15Å; S11-G15 PolarHBondContact O-N 2.84Å
12	R	27.4	Very low	27.9	Very low	216 Å²	216	123.2 Å²	123.2	82%	0.815	62%	0.621	S	S	*	*	H	α-helix	trans	-67.4	-37.9	178.8	-72.7	-175	-175	178	0.2	113	G15 L16	R12-G15 PolarHBondContact O-N 3.02Å; R12-L16 WeakPolarHBondContact O-CB 3.43Å; R12-L16 PolarHBondContact O-N 3.4Å
13	K	27.5	Very low	27.7	Very low	143 Å²	143	114.8 Å²	114.8	62%	0.622	60%	0.597	S	S	*	*	H	α-helix	trans	-65.4	-38.9	173.3	-78.9	-172.5	174.7	-172.8	0	111.8	L16 V17	K13-L16 PolarHBondContact O-N 3.32Å; K13-V17 WeakPolarHBondContact O-CB 3.37Å; K13-V17 WeakPolarHBondContact O-CG2 3.37Å; K13-V17 PolarHBondContact O-N 3.06Å
14	A	26	Very low	27.6	Very low	41 Å²	41	107 Å²	107	34%	0.339	57%	0.573	S	S	.	*	H	α-helix	trans	-69.7	-31	176.7	0	0	0	0	0	113.5	G10 S11 R18	G10-A14 WeakPolarHBondContact O-CB 3.47Å; G10-A14 PolarHBondContact O-N 2.97Å; S11-A14 PolarHBondContact O-N 3.15Å; A14-R18 WeakPolarHBondContact O-CB 3.39Å; A14-R18 PolarHBondContact O-N 3.27Å; A14-R18 VanDerWaalsContact O-N 3.15Å
15	G	25.4	Very low	27.7	Very low	33 Å²	33	101.7 Å²	101.7	34%	0.34	55%	0.545	S	S	.	.	H	α-helix	trans	-67.4	-49	171.2	0	0	0	0	0	111.8	S11 R12 V17 R18 S19	S11-G15 PolarHBondContact O-N 2.84Å; R12-G15 PolarHBondContact O-N 3.02Å; G15-V17 PolarHBondContact O-N 3.05Å; G15-R18 WeakPolarHBondContact O-CB 3.48Å; G15-R18 PolarHBondContact O-N 3.17Å; G15-S19 PolarHBondContact O-N 3.3Å; G15-S19 PolarHBondContact O-OG 2.93Å
16	L	25.7	Very low	27.5	Very low	109 Å²	109	94.2 Å²	94.2	57%	0.571	52%	0.518	S	S	*	.	H	α-helix	trans	-62.7	-41	178.1	-156.7	87.4	0	0	0	112.4	R12 K13 R18 S19 I20	R12-L16 WeakPolarHBondContact O-CB 3.43Å; R12-L16 PolarHBondContact O-N 3.4Å; K13-L16 PolarHBondContact O-N 3.32Å; L16-R18 VanDerWaalsContact C-N 3.34Å; L16-S19 PolarHBondContact O-N 3.5Å; L16-I20 HydrophobicContact CD2-CD1 4.05Å; L16-I20 HydrophobicContact CG-CD1 3.96Å; L16-I20 WeakPolarHBondContact O-CB 3.35Å; L16-I20 WeakPolarHBondContact O-CD1 3.48Å; L16-I20 WeakPolarHBondContact O-CG1 3.2Å; L16-I20 PolarHBondContact O-N 3.06Å
17	V	27.3	Very low	27.5	Very low	24 Å²	24	89.4 Å²	89.4	15%	0.145	50%	0.502	C	S	.	.	H	α-helix	trans	-67.8	-33.7	176.6	171.4	0	0	0	0	111.5	K13 G15 A21 L42	K13-V17 WeakPolarHBondContact O-CB 3.37Å; K13-V17 WeakPolarHBondContact O-CG2 3.37Å; K13-V17 PolarHBondContact O-N 3.06Å; G15-V17 PolarHBondContact O-N 3.05Å; V17-A21 WeakPolarHBondContact O-CB 3.15Å; V17-A21 PolarHBondContact O-N 2.94Å; V17-L42 HydrophobicContact CG1-CD1 4Å
18	R	25.8	Very low	27.4	Very low	182 Å²	182	87.4 Å²	87.4	69%	0.687	51%	0.505	S	S	*	.	H	α-helix	trans	-65.8	-48.8	170.4	-97.3	-177.1	-95.4	-169.1	-9.1	111.2	A14 G15 L16 I20 A21 T22	A14-R18 WeakPolarHBondContact O-CB 3.39Å; A14-R18 PolarHBondContact O-N 3.27Å; A14-R18 VanDerWaalsContact O-N 3.15Å; G15-R18 WeakPolarHBondContact O-CB 3.48Å; G15-R18 PolarHBondContact O-N 3.17Å; L16-R18 VanDerWaalsContact C-N 3.34Å; R18-I20 VanDerWaalsContact C-N 3.32Å; R18-I20 PolarHBondContact O-N 3.46Å; R18-A21 PolarHBondContact O-N 3.15Å; R18-T22 WeakPolarHBondContact O-CB 3.49Å; R18-T22 PolarHBondContact O-N 3.13Å; R18-T22 PolarHBondContact O-OG1 3.19Å
19	S	25.5	Very low	27.2	Very low	71 Å²	71	87.5 Å²	87.5	50%	0.497	51%	0.506	S	S	.	.	H	α-helix	trans	-58.7	-41.9	177.5	-50.3	0	0	0	0	112.5	G15 L16 T22 V23	G15-S19 PolarHBondContact O-N 3.3Å; G15-S19 PolarHBondContact O-OG 2.93Å; L16-S19 PolarHBondContact O-N 3.5Å; S19-T22 PolarHBondContact O-N 3.23Å; S19-V23 WeakPolarHBondContact O-CB 3.47Å; S19-V23 WeakPolarHBondContact O-CG2 3.39Å; S19-V23 PolarHBondContact O-N 3.47Å
20	I	26.8	Very low	26.9	Very low	69 Å²	69	92.2 Å²	92.2	35%	0.354	51%	0.514	S	S	.	.	H	α-helix	trans	-71.8	-38.5	178.7	-68.1	167.3	0	0	0	111.3	L16 R18 T22 V23 I24	L16-I20 HydrophobicContact CD2-CD1 4.05Å; L16-I20 HydrophobicContact CG-CD1 3.96Å; L16-I20 WeakPolarHBondContact O-CB 3.35Å; L16-I20 WeakPolarHBondContact O-CD1 3.48Å; L16-I20 WeakPolarHBondContact O-CG1 3.2Å; L16-I20 PolarHBondContact O-N 3.06Å; R18-I20 VanDerWaalsContact C-N 3.32Å; R18-I20 PolarHBondContact O-N 3.46Å; I20-T22 VanDerWaalsContact C-N 3.33Å; I20-T22 PolarHBondContact O-N 2.89Å; I20-V23 PolarHBondContact O-N 3.34Å; I20-I24 HydrophobicContact CG2-CD1 3.47Å; I20-I24 VanDerWaalsContact CG2-CD1 3.47Å; I20-I24 HydrophobicContact CG2-CG1 4.29Å; I20-I24 WeakPolarHBondContact O-CB 3.44Å; I20-I24 VanDerWaalsContact O-CG1 3.24Å; I20-I24 WeakPolarHBondContact O-CG1 3.23Å; I20-I24 PolarHBondContact O-N 3.2Å
21	A	25	Very low	26.8	Very low	35 Å²	35	93.4 Å²	93.4	29%	0.289	53%	0.526	S	S	.	.	H	α-helix	trans	-67.5	-32.5	174.9	0	0	0	0	0	112.8	V17 R18 G25	V17-A21 WeakPolarHBondContact O-CB 3.15Å; V17-A21 PolarHBondContact O-N 2.94Å; R18-A21 PolarHBondContact O-N 3.15Å; A21-G25 PolarHBondContact O-N 2.73Å
22	T	27.3	Very low	26.6	Very low	84 Å²	84	93.1 Å²	93.1	52%	0.515	54%	0.537	S	S	.	.	H	α-helix	trans	-73.8	-33.5	173.8	-49.7	0	0	0	0	112.2	R18 S19 I20	R18-T22 WeakPolarHBondContact O-CB 3.49Å; R18-T22 PolarHBondContact O-N 3.13Å; R18-T22 PolarHBondContact O-OG1 3.19Å; S19-T22 PolarHBondContact O-N 3.23Å; I20-T22 VanDerWaalsContact C-N 3.33Å; I20-T22 PolarHBondContact O-N 2.89Å
23	V	28.2	Very low	26.7	Very low	78 Å²	78	86.4 Å²	86.4	47%	0.473	53%	0.528	S	S	.	.	H	α-helix	trans	-81.7	-20.3	178.2	171.2	0	0	0	0	113.3	S19 I20 G241	S19-V23 WeakPolarHBondContact O-CB 3.47Å; S19-V23 WeakPolarHBondContact O-CG2 3.39Å; S19-V23 PolarHBondContact O-N 3.47Å; I20-V23 PolarHBondContact O-N 3.34Å; V23-G241 CarbonylContact C-O 3.57Å; V23-G241 CarbonylContact O-C 3.59Å; V23-G241 WeakPolarHBondContact O-CA 3.2Å
24	I	26.7	Very low	27.1	Very low	80 Å²	80	84 Å²	84	41%	0.41	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	3.2	-180	-59.7	175.9	0	0	0	112.2	I20 Y26	I20-I24 HydrophobicContact CG2-CD1 3.47Å; I20-I24 VanDerWaalsContact CG2-CD1 3.47Å; I20-I24 HydrophobicContact CG2-CG1 4.29Å; I20-I24 WeakPolarHBondContact O-CB 3.44Å; I20-I24 VanDerWaalsContact O-CG1 3.24Å; I20-I24 WeakPolarHBondContact O-CG1 3.23Å; I20-I24 PolarHBondContact O-N 3.2Å; I24-Y26 VanDerWaalsContact C-N 3.34Å; I24-Y26 HydrophobicContact CB-CD2 4.22Å; I24-Y26 HydrophobicContact CB-CE2 4.3Å; I24-Y26 HydrophobicContact CG2-CD2 3.9Å; I24-Y26 HydrophobicContact CG2-CE2 3.62Å; I24-Y26 PolarHBondContact O-N 3.35Å
25	G	27	Very low	27.4	Very low	23 Å²	23	85.8 Å²	85.8	24%	0.237	53%	0.53	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	41.1	171.5	0	0	0	0	0	114.6	A21 P27 S243	A21-G25 PolarHBondContact O-N 2.73Å; G25-P27 VanDerWaalsContact O-CD 3.29Å; G25-P27 WeakPolarHBondContact O-CD 3.43Å; G25-S243 VanDerWaalsContact CA-OG 3.29Å; G25-S243 WeakPolarHBondContact CA-OG 3.35Å
26	Y	26	Very low	27.7	Very low	92 Å²	92	88 Å²	88	36%	0.361	55%	0.546	S	S	.	.			trans	-67	120.2	174.9	-92	-84.7	0	0	0	110.7	I24 I45	I24-Y26 VanDerWaalsContact C-N 3.34Å; I24-Y26 HydrophobicContact CB-CD2 4.22Å; I24-Y26 HydrophobicContact CB-CE2 4.3Å; I24-Y26 HydrophobicContact CG2-CD2 3.9Å; I24-Y26 HydrophobicContact CG2-CE2 3.62Å; I24-Y26 PolarHBondContact O-N 3.35Å; Y26-I45 VanDerWaalsContact OH-CG2 3.25Å; Y26-I45 WeakPolarHBondContact OH-CG2 3.36Å
27	P	27.9	Very low	28.2	Very low	80 Å²	80	89.5 Å²	89.5	52%	0.519	55%	0.55	S	S	.	.			trans	-68	142.2	174.2	25.6	-31	0	0	0	110.5	G25 A29	G25-P27 VanDerWaalsContact O-CD 3.29Å; G25-P27 WeakPolarHBondContact O-CD 3.43Å; P27-A29 HydrophobicContact CB-CB 4.5Å; P27-A29 PolarHBondContact O-N 3.25Å
28	P	27	Very low	28.6	Very low	143 Å²	143	93.2 Å²	93.2	93%	0.929	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	14.9	176.1	-1.6	9.3	0	0	0	115.1
29	A	26.2	Very low	28.7	Very low	84 Å²	84	87.6 Å²	87.6	69%	0.694	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	0.9	-167	0	0	0	0	0	115.4	P27 G31	P27-A29 HydrophobicContact CB-CB 4.5Å; P27-A29 PolarHBondContact O-N 3.25Å; A29-G31 PolarHBondContact O-N 2.92Å
30	Y	26	Very low	29	Very low	205 Å²	205	86.3 Å²	86.3	80%	0.804	55%	0.554	S	S	*	*	S	Bend	trans	-92.7	104.6	172.2	-86.1	-86.4	0	0	0	110.7
31	G	26.3	Very low	29.4	Very low	77 Å²	77	85.4 Å²	85.4	79%	0.794	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.2	132.9	-170.1	0	0	0	0	0	115.8	A29 A33	A29-G31 PolarHBondContact O-N 2.92Å; G31-A33 PolarHBondContact O-N 2.77Å
32	G	27.8	Very low	29.7	Very low	86 Å²	86	85.4 Å²	85.4	89%	0.887	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	-4.7	147.7	0	0	0	0	0	118.1
33	A	28.6	Very low	30.1	Very low	76 Å²	76	85.1 Å²	85.1	63%	0.628	54%	0.543	S	S	*	.			trans	-104.6	100.7	176.8	0	0	0	0	0	110.5	G31 P35	G31-A33 PolarHBondContact O-N 2.77Å; A33-P35 WeakPolarHBondContact O-CD 3.2Å
34	N	36.2	Very low	30.6	Very low	91 Å²	91	88 Å²	88	49%	0.487	55%	0.549	S	S	.	.			trans	-60.1	121.9	171.5	-159.8	-12.9	0	0	0	108	A36 E37	N34-A36 PolarHBondContact O-N 3.46Å; N34-E37 HydrophobicContact CB-CB 4.34Å; N34-E37 HydrophobicContact CB-CG 3.95Å; N34-E37 PolarHBondContact O-N 3.35Å
35	P	32.2	Very low	31.1	Very low	80 Å²	80	87.6 Å²	87.6	52%	0.519	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-13.5	-178.6	20.1	-31.2	0	0	0	113.3	A33 L42	A33-P35 WeakPolarHBondContact O-CD 3.2Å; P35-L42 HydrophobicContact CB-CD1 3.71Å
36	A	31.9	Very low	31.5	Very low	80 Å²	80	88 Å²	88	66%	0.661	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-24.8	170	0	0	0	0	0	114.8	N34	N34-A36 PolarHBondContact O-N 3.46Å
37	E	36	Very low	32	Very low	140 Å²	140	89.1 Å²	89.1	65%	0.654	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-18.2	-169.9	-74.1	175.8	-175.5	0	0	113.9	N34	N34-E37 HydrophobicContact CB-CB 4.34Å; N34-E37 HydrophobicContact CB-CG 3.95Å; N34-E37 PolarHBondContact O-N 3.35Å
38	N	36.8	Very low	32.6	Very low	102 Å²	102	91.5 Å²	91.5	55%	0.545	56%	0.559	S	S	.	*			trans	-149.5	64.7	-177.9	-128.1	-26.4	0	0	0	113.9	G40 S41	N38-G40 PolarHBondContact O-N 2.88Å; N38-S41 PolarHBondContact O-N 3.26Å; N38-S41 PolarHBondContact O-OG 2.96Å; N38-S41 VanDerWaalsContact O-OG 3.05Å
39	P	28.2	Very low	33	Very low	63 Å²	63	87.5 Å²	87.5	41%	0.409	53%	0.534	S	S	.	.	H	α-helix	trans	-59.1	-24	-179.3	23.8	-34	0	0	0	113.4	I43	P39-I43 WeakPolarHBondContact O-CG1 3.34Å; P39-I43 PolarHBondContact O-N 2.93Å
40	G	30.9	Very low	33.5	Very low	44 Å²	44	89 Å²	89	45%	0.454	53%	0.53	S	S	.	.	H	α-helix	trans	-71.5	-26.6	176.9	0	0	0	0	0	114.7	N38 K44	N38-G40 PolarHBondContact O-N 2.88Å; G40-K44 PolarHBondContact O-N 3.38Å
41	S	34.6	Very low	33.9	Very low	51 Å²	51	82.3 Å²	82.3	36%	0.357	51%	0.513	S	S	.	.	H	α-helix	trans	-78.1	-39.2	175.7	71.4	0	0	0	0	111.3	N38 I43 K44 I45	N38-S41 PolarHBondContact O-N 3.26Å; N38-S41 PolarHBondContact O-OG 2.96Å; N38-S41 VanDerWaalsContact O-OG 3.05Å; S41-I43 PolarHBondContact O-N 2.91Å; S41-K44 PolarHBondContact O-N 3.35Å; S41-I45 WeakPolarHBondContact O-CD1 3.27Å; S41-I45 WeakPolarHBondContact O-CG1 3.06Å; S41-I45 PolarHBondContact O-N 2.98Å
42	L	32.3	Very low	34.4	Very low	35 Å²	35	80.9 Å²	80.9	18%	0.183	49%	0.494	C	S	.	.	H	α-helix	trans	-61.3	-42.5	176.7	-86.1	158.3	0	0	0	112.5	V17 P35 I45 C46	V17-L42 HydrophobicContact CG1-CD1 4Å; P35-L42 HydrophobicContact CB-CD1 3.71Å; L42-I45 PolarHBondContact O-N 3.49Å; L42-C46 WeakPolarHBondContact O-CB 3.24Å; L42-C46 PolarHBondContact O-N 3.47Å; L42-C46 PolarHBondContact O-SG 3.14Å
43	I	34.7	Very low	34.7	Very low	78 Å²	78	79.9 Å²	79.9	40%	0.4	47%	0.473	S	S	.	.	H	α-helix	trans	-62.2	-47.5	176.3	-67.7	167.7	0	0	0	110.8	P39 S41 I45 C46 E47	P39-I43 WeakPolarHBondContact O-CG1 3.34Å; P39-I43 PolarHBondContact O-N 2.93Å; S41-I43 PolarHBondContact O-N 2.91Å; I43-I45 VanDerWaalsContact C-N 3.31Å; I43-I45 PolarHBondContact O-N 2.8Å; I43-C46 PolarHBondContact O-N 3.42Å; I43-E47 HydrophobicContact CG2-CG 4.41Å; I43-E47 WeakPolarHBondContact O-CB 3.12Å; I43-E47 WeakPolarHBondContact O-CG 3.35Å; I43-E47 PolarHBondContact O-N 3.33Å
44	K	39.5	Very low	34.9	Very low	138 Å²	138	79.7 Å²	79.7	60%	0.6	46%	0.461	S	S	*	.	H	α-helix	trans	-60.7	-39.3	177.3	-87.2	-173.2	174.3	-176.6	0	112.8	G40 S41 Q48	G40-K44 PolarHBondContact O-N 3.38Å; S41-K44 PolarHBondContact O-N 3.35Å; K44-Q48 WeakPolarHBondContact O-CB 3.28Å; K44-Q48 WeakPolarHBondContact O-CG 3.31Å; K44-Q48 PolarHBondContact O-N 3.39Å
45	I	37.6	Very low	34.8	Very low	71 Å²	71	83 Å²	83	36%	0.364	47%	0.474	S	S	.	.	H	α-helix	trans	-69.8	-41	179	-66.1	164	0	0	0	110.3	Y26 S41 L42 I43 Q48 S49	Y26-I45 VanDerWaalsContact OH-CG2 3.25Å; Y26-I45 WeakPolarHBondContact OH-CG2 3.36Å; S41-I45 WeakPolarHBondContact O-CD1 3.27Å; S41-I45 WeakPolarHBondContact O-CG1 3.06Å; S41-I45 PolarHBondContact O-N 2.98Å; L42-I45 PolarHBondContact O-N 3.49Å; I43-I45 VanDerWaalsContact C-N 3.31Å; I43-I45 PolarHBondContact O-N 2.8Å; I45-Q48 PolarHBondContact O-N 2.84Å; I45-S49 WeakPolarHBondContact O-CB 3.2Å; I45-S49 PolarHBondContact O-N 2.9Å; I45-S49 PolarHBondContact O-OG 2.78Å
46	C	34.6	Very low	34.9	Very low	32 Å²	32	88.3 Å²	88.3	22%	0.216	49%	0.489	C	S	.	.	H	α-helix	trans	-63.5	-44.3	174.7	-67	0	0	0	0	111.6	L42 I43 Q48 S49 L50	L42-C46 WeakPolarHBondContact O-CB 3.24Å; L42-C46 PolarHBondContact O-N 3.47Å; L42-C46 PolarHBondContact O-SG 3.14Å; I43-C46 PolarHBondContact O-N 3.42Å; C46-Q48 VanDerWaalsContact C-N 3.33Å; C46-Q48 PolarHBondContact O-N 3.44Å; C46-S49 PolarHBondContact O-N 3.11Å; C46-L50 VanDerWaalsContact O-CB 3.28Å; C46-L50 WeakPolarHBondContact O-CB 3.26Å; C46-L50 PolarHBondContact O-N 2.66Å
47	E	37.5	Very low	34.7	Very low	115 Å²	115	89.1 Å²	89.1	54%	0.537	48%	0.48	S	S	.	.	H	α-helix	trans	-62	-38.8	175.5	-74.9	174.6	167.6	0	0	112.3	I43 S51	I43-E47 HydrophobicContact CG2-CG 4.41Å; I43-E47 WeakPolarHBondContact O-CB 3.12Å; I43-E47 WeakPolarHBondContact O-CG 3.35Å; I43-E47 PolarHBondContact O-N 3.33Å; E47-S51 VanDerWaalsContact O-CB 3.23Å; E47-S51 WeakPolarHBondContact O-CB 3.28Å; E47-S51 PolarHBondContact O-N 3.42Å; E47-S51 PolarHBondContact O-OG 2.98Å
48	Q	40.4	Very low	34.3	Very low	131 Å²	131	85.5 Å²	85.5	61%	0.612	48%	0.48	S	S	*	.	H	α-helix	trans	-68.2	-44.3	175.9	-77.2	174.9	-9	0	0	112.3	K44 I45 C46 S51 A52	K44-Q48 WeakPolarHBondContact O-CB 3.28Å; K44-Q48 WeakPolarHBondContact O-CG 3.31Å; K44-Q48 PolarHBondContact O-N 3.39Å; I45-Q48 PolarHBondContact O-N 2.84Å; C46-Q48 VanDerWaalsContact C-N 3.33Å; C46-Q48 PolarHBondContact O-N 3.44Å; Q48-S51 PolarHBondContact O-N 3.13Å; Q48-A52 VanDerWaalsContact O-CB 3.27Å; Q48-A52 WeakPolarHBondContact O-CB 3.48Å; Q48-A52 PolarHBondContact O-N 2.96Å
49	S	35.7	Very low	33.7	Very low	59 Å²	59	84.3 Å²	84.3	41%	0.413	48%	0.476	S	S	.	.	H	α-helix	trans	-66	-41.1	176.4	-70	0	0	0	0	112	I45 C46 A52 S53	I45-S49 WeakPolarHBondContact O-CB 3.2Å; I45-S49 PolarHBondContact O-N 2.9Å; I45-S49 PolarHBondContact O-OG 2.78Å; C46-S49 PolarHBondContact O-N 3.11Å; S49-A52 PolarHBondContact O-N 3.25Å; S49-S53 WeakPolarHBondContact O-CB 3.42Å; S49-S53 PolarHBondContact O-N 3.49Å; S49-S53 PolarHBondContact O-OG 2.98Å; S49-S53 VanDerWaalsContact O-OG 3.1Å
50	L	35.2	Very low	33.7	Very low	115 Å²	115	89.6 Å²	89.6	60%	0.602	50%	0.495	S	S	*	.	H	α-helix	trans	-65.3	-44.7	176.2	-156.9	90.5	0	0	0	111	C46 A52 S53 L54	C46-L50 VanDerWaalsContact O-CB 3.28Å; C46-L50 WeakPolarHBondContact O-CB 3.26Å; C46-L50 PolarHBondContact O-N 2.66Å; L50-A52 PolarHBondContact O-N 2.94Å; L50-S53 PolarHBondContact O-N 2.96Å; L50-L54 HydrophobicContact CD2-CD1 4.25Å; L50-L54 HydrophobicContact CG-CD1 4.28Å; L50-L54 WeakPolarHBondContact O-CB 3.38Å; L50-L54 VanDerWaalsContact O-CG 3.26Å; L50-L54 WeakPolarHBondContact O-CG 3.39Å; L50-L54 PolarHBondContact O-N 3.37Å
51	S	34.8	Very low	33.4	Very low	64 Å²	64	95.6 Å²	95.6	45%	0.448	52%	0.516	S	S	.	.	H	α-helix	trans	-63.7	-39.8	176.4	-62.2	0	0	0	0	112.2	E47 Q48 L54 Q55	E47-S51 VanDerWaalsContact O-CB 3.23Å; E47-S51 WeakPolarHBondContact O-CB 3.28Å; E47-S51 PolarHBondContact O-N 3.42Å; E47-S51 PolarHBondContact O-OG 2.98Å; Q48-S51 PolarHBondContact O-N 3.13Å; S51-L54 PolarHBondContact O-N 2.98Å; S51-Q55 WeakPolarHBondContact O-CB 3.41Å; S51-Q55 WeakPolarHBondContact O-CG 3.48Å; S51-Q55 PolarHBondContact O-N 2.93Å
52	A	36.5	Very low	33	Very low	48 Å²	48	97.1 Å²	97.1	40%	0.397	53%	0.532	S	S	.	.	H	α-helix	trans	-67.9	-37.6	176.5	0	0	0	0	0	112.3	Q48 S49 L50 K56	Q48-A52 VanDerWaalsContact O-CB 3.27Å; Q48-A52 WeakPolarHBondContact O-CB 3.48Å; Q48-A52 PolarHBondContact O-N 2.96Å; S49-A52 PolarHBondContact O-N 3.25Å; L50-A52 PolarHBondContact O-N 2.94Å; A52-K56 WeakPolarHBondContact O-CB 3.38Å; A52-K56 PolarHBondContact O-N 3.34Å
53	S	34.1	Very low	32.6	Very low	64 Å²	64	99.6 Å²	99.6	45%	0.448	56%	0.558	S	S	.	*	H	α-helix	trans	-67.7	-41.5	173.6	-68.6	0	0	0	0	112	S49 L50 K56 M57	S49-S53 WeakPolarHBondContact O-CB 3.42Å; S49-S53 PolarHBondContact O-N 3.49Å; S49-S53 PolarHBondContact O-OG 2.98Å; S49-S53 VanDerWaalsContact O-OG 3.1Å; L50-S53 PolarHBondContact O-N 2.96Å; S53-K56 PolarHBondContact O-N 3.15Å; S53-M57 WeakPolarHBondContact O-CB 3.27Å; S53-M57 WeakPolarHBondContact O-CE 3.41Å; S53-M57 VanDerWaalsContact O-CG 3.31Å; S53-M57 WeakPolarHBondContact O-CG 3.25Å; S53-M57 PolarHBondContact O-N 3.38Å
54	L	32.5	Very low	32	Very low	72 Å²	72	101.7 Å²	101.7	38%	0.377	58%	0.579	S	S	.	*	H	α-helix	trans	-66.3	-39.1	175.6	-71.4	166.9	0	0	0	112.2	L50 S51 M57 V59	L50-L54 HydrophobicContact CD2-CD1 4.25Å; L50-L54 HydrophobicContact CG-CD1 4.28Å; L50-L54 WeakPolarHBondContact O-CB 3.38Å; L50-L54 VanDerWaalsContact O-CG 3.26Å; L50-L54 WeakPolarHBondContact O-CG 3.39Å; L50-L54 PolarHBondContact O-N 3.37Å; S51-L54 PolarHBondContact O-N 2.98Å; L54-M57 HydrophobicContact CD2-CE 4.08Å; L54-M57 PolarHBondContact O-N 3.47Å; L54-V59 PolarHBondContact O-N 3.48Å
55	Q	34.1	Very low	31.2	Very low	160 Å²	160	98 Å²	98	75%	0.748	58%	0.58	S	S	*	*	H	α-helix	trans	-65.6	-40	172	-79.9	-179.9	-15.7	0	0	112.5	S51 M57 G58	S51-Q55 WeakPolarHBondContact O-CB 3.41Å; S51-Q55 WeakPolarHBondContact O-CG 3.48Å; S51-Q55 PolarHBondContact O-N 2.93Å; Q55-M57 VanDerWaalsContact C-N 3.31Å; Q55-M57 PolarHBondContact O-N 2.83Å; Q55-G58 PolarHBondContact O-N 2.94Å
56	K	34.8	Very low	30.7	Very low	193 Å²	193	102 Å²	102	84%	0.839	61%	0.608	S	S	*	*	H	α-helix	trans	-66.8	-29.3	174.6	-88.2	-175	174.5	-176.6	0	113.3	A52 S53 G58	A52-K56 WeakPolarHBondContact O-CB 3.38Å; A52-K56 PolarHBondContact O-N 3.34Å; S53-K56 PolarHBondContact O-N 3.15Å; K56-G58 VanDerWaalsContact C-N 3.26Å; K56-G58 PolarHBondContact O-N 3.15Å
57	M	28.7	Very low	30.1	Very low	97 Å²	97	104.4 Å²	104.4	48%	0.478	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	4.9	177.4	-71.5	-173	-67.3	0	0	113.7	S53 L54 Q55 V59	S53-M57 WeakPolarHBondContact O-CB 3.27Å; S53-M57 WeakPolarHBondContact O-CE 3.41Å; S53-M57 VanDerWaalsContact O-CG 3.31Å; S53-M57 WeakPolarHBondContact O-CG 3.25Å; S53-M57 PolarHBondContact O-N 3.38Å; L54-M57 HydrophobicContact CD2-CE 4.08Å; L54-M57 PolarHBondContact O-N 3.47Å; Q55-M57 VanDerWaalsContact C-N 3.31Å; Q55-M57 PolarHBondContact O-N 2.83Å; M57-V59 HydrophobicContact CB-CG2 4.06Å; M57-V59 PolarHBondContact O-N 3.32Å; M57-V59 VanDerWaalsContact O-N 3.15Å
58	G	26.5	Very low	29.5	Very low	63 Å²	63	102.6 Å²	102.6	65%	0.649	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.3	18.2	177	0	0	0	0	0	114.1	Q55 K56 E60	Q55-G58 PolarHBondContact O-N 2.94Å; K56-G58 VanDerWaalsContact C-N 3.26Å; K56-G58 PolarHBondContact O-N 3.15Å; G58-E60 VanDerWaalsContact C-N 3.27Å; G58-E60 PolarHBondContact O-N 2.9Å
59	V	25.7	Very low	28.7	Very low	77 Å²	77	108.2 Å²	108.2	47%	0.467	67%	0.666	S	S	.	*			trans	-78.9	82.1	178	-174	0	0	0	0	108	L54 M57 L61	L54-V59 PolarHBondContact O-N 3.48Å; M57-V59 HydrophobicContact CB-CG2 4.06Å; M57-V59 PolarHBondContact O-N 3.32Å; M57-V59 VanDerWaalsContact O-N 3.15Å; V59-L61 PolarHBondContact O-N 3.37Å
60	E	27.7	Very low	28.1	Very low	174 Å²	174	109 Å²	109	81%	0.813	68%	0.684	S	S	*	*			trans	-66.1	111.4	152.1	-76.8	-169.6	157.4	0	0	106.7	G58 A62	G58-E60 VanDerWaalsContact C-N 3.27Å; G58-E60 PolarHBondContact O-N 2.9Å; E60-A62 PolarHBondContact O-N 3.45Å
61	L	25.2	Very low	27.7	Very low	170 Å²	170	114 Å²	114	89%	0.89	70%	0.697	S	S	*	*			trans	-64.4	71.7	162.7	-87.1	153.2	0	0	0	108	V59 A63	V59-L61 PolarHBondContact O-N 3.37Å; L61-A63 PolarHBondContact O-N 2.89Å
62	A	25.2	Very low	27.2	Very low	83 Å²	83	120.5 Å²	120.5	69%	0.686	72%	0.72	S	S	*	*			trans	-82.5	106.7	177.7	0	0	0	0	0	108.3	E60	E60-A62 PolarHBondContact O-N 3.45Å
63	A	23.1	Very low	26.7	Very low	88 Å²	88	126.4 Å²	126.4	73%	0.727	74%	0.739	S	S	*	*			trans	-59.1	133.3	170.9	0	0	0	0	0	111.1	L61	L61-A63 PolarHBondContact O-N 2.89Å
64	S	23.3	Very low	26.3	Very low	121 Å²	121	128.6 Å²	128.6	85%	0.846	75%	0.752	S	S	*	*			trans	64.8	126.1	154.9	74.4	0	0	0	0	119.2
65	G	22.9	Very low	25.9	Very low	60 Å²	60	132.5 Å²	132.5	62%	0.619	77%	0.771	S	S	*	*				119.4	123.3	122.3	0	0	0	0	0	116.3
66	T	26.4	Very low	25.5	Very low	155 Å²	155	130.7 Å²	130.7	95%	0.951	77%	0.771	S	S	*	*			trans	74.4	122.1	157.9	71.4	0	0	0	0	114.5
67	G	22.7	Very low	25	Very low	84 Å²	84	129.2 Å²	129.2	87%	0.866	77%	0.767	S	S	*	*			cis	142.8	103.7	19.7	0	0	0	0	0	105.5
68	G	24	Very low	24.9	Very low	76 Å²	76	130.3 Å²	130.3	78%	0.784	78%	0.782	S	S	*	*			trans	173.1	81.6	-174.8	0	0	0	0	0	114.3
69	R	24.5	Very low	25	Very low	249 Å²	249	132.3 Å²	132.3	94%	0.94	78%	0.777	S	S	*	*	S	Bend	trans	30.6	110	154.3	-55.3	-175.2	-164.5	-136.4	3.3	118.1
70	G	23.4	Very low	25.1	Very low	77 Å²	77	132.3 Å²	132.3	79%	0.794	78%	0.778	S	S	*	*				118	8.8	129.5	0	0	0	0	0	120.5
71	Y	25.9	Very low	25.3	Very low	220 Å²	220	130.2 Å²	130.2	86%	0.863	78%	0.78	S	S	*	*			trans	-117	124.6	168.9	-67.8	-87.2	0	0	0	109.3	E73	Y71-E73 PolarHBondContact O-N 3.33Å
72	E	25	Very low	25.6	Very low	200 Å²	200	130 Å²	130	94%	0.935	77%	0.774	S	S	*	*			trans	-59.1	104.8	163.6	-79.4	-175.3	152.7	0	0	107.3
73	E	24.4	Very low	25.9	Very low	172 Å²	172	131.6 Å²	131.6	80%	0.804	77%	0.767	S	S	*	*			trans	-55.8	134.1	168	-78	-179.6	152.2	0	0	108.3	Y71 I75	Y71-E73 PolarHBondContact O-N 3.33Å; E73-I75 PolarHBondContact O-N 2.93Å; E73-I75 VanDerWaalsContact O-N 3.11Å
74	P	27.3	Very low	26	Very low	109 Å²	109	133 Å²	133	71%	0.708	77%	0.769	S	S	*	*			trans	-56.4	124.6	171.1	23.1	-30.3	0	0	0	107.8	V76	P74-V76 VanDerWaalsContact C-N 3.29Å; P74-V76 PolarHBondContact O-N 2.93Å
75	I	23.3	Very low	26.1	Very low	154 Å²	154	130.6 Å²	130.6	79%	0.79	76%	0.763	S	S	*	*			trans	-62	95.4	174.9	-56.8	174.3	0	0	0	107	E73 E77	E73-I75 PolarHBondContact O-N 2.93Å; E73-I75 VanDerWaalsContact O-N 3.11Å; I75-E77 VanDerWaalsContact C-N 3.32Å; I75-E77 HydrophobicContact CG2-CG 3.85Å; I75-E77 PolarHBondContact O-N 3.49Å
76	V	25.6	Very low	26.2	Very low	123 Å²	123	132.1 Å²	132.1	75%	0.745	76%	0.76	S	S	*	*			trans	-82.4	86	167.3	-176.2	0	0	0	0	105.9	P74 P78	P74-V76 VanDerWaalsContact C-N 3.29Å; P74-V76 PolarHBondContact O-N 2.93Å; V76-P78 WeakPolarHBondContact O-CD 3.43Å
77	E	24.6	Very low	26.3	Very low	161 Å²	161	129 Å²	129	75%	0.752	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-61.7	124.1	167	-74.3	-167.8	154.2	0	0	108.6	I75 L79	I75-E77 VanDerWaalsContact C-N 3.32Å; I75-E77 HydrophobicContact CG2-CG 3.85Å; I75-E77 PolarHBondContact O-N 3.49Å; E77-L79 PolarHBondContact O-N 3.43Å; E77-L79 VanDerWaalsContact O-N 3.13Å
78	P	27.3	Very low	26.4	Very low	121 Å²	121	131.3 Å²	131.3	79%	0.786	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-63.9	117.9	174.7	24	-30.2	0	0	0	109.1	V76	V76-P78 WeakPolarHBondContact O-CD 3.43Å
79	L	28.6	Very low	26.6	Very low	105 Å²	105	130.9 Å²	130.9	55%	0.55	72%	0.717	S	S	.	*	P	Polyproline II helix	trans	-56.1	144.2	176	-83.8	159.8	0	0	0	111	E77 V86	E77-L79 PolarHBondContact O-N 3.43Å; E77-L79 VanDerWaalsContact O-N 3.13Å; L79-V86 HydrophobicContact CD1-CB 4.18Å; L79-V86 HydrophobicContact CD1-CG2 4.25Å
80	P	27.5	Very low	26.7	Very low	77 Å²	77	122.3 Å²	122.3	50%	0.5	70%	0.699	S	S	.	*	P	Polyproline II helix	trans	-52.2	140.4	173.6	-22.8	30.6	0	0	0	111.2	E82 H83	P80-E82 PolarHBondContact O-N 2.89Å; P80-H83 PolarHBondContact O-N 3.47Å; P80-H83 VanDerWaalsContact O-N 3.15Å
81	P	31.3	Very low	26.9	Very low	130 Å²	130	121.6 Å²	121.6	84%	0.844	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-3.8	-174.9	23.7	-33.4	0	0	0	114.7	H83	P81-H83 VanDerWaalsContact C-N 3.31Å
82	E	32.3	Very low	27.2	Very low	165 Å²	165	116.3 Å²	116.3	77%	0.771	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-4.9	177.3	-58.3	-167.9	165	0	0	113.6	P80	P80-E82 PolarHBondContact O-N 2.89Å
83	H	31.3	Very low	27.5	Very low	116 Å²	116	107.9 Å²	107.9	54%	0.537	63%	0.629	S	S	.	*			trans	-131	69.4	-178.4	-58.3	-48.5	0	0	0	113.6	P80 P81 G85	P80-H83 PolarHBondContact O-N 3.47Å; P80-H83 VanDerWaalsContact O-N 3.15Å; P81-H83 VanDerWaalsContact C-N 3.31Å; H83-G85 PolarHBondContact O-N 2.87Å
84	P	25	Very low	27.9	Very low	119 Å²	119	101 Å²	101	77%	0.773	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	101.7	172	32.3	-28.9	0	0	0	108.8
85	G	25	Very low	28.3	Very low	70 Å²	70	99.3 Å²	99.3	72%	0.722	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	138.7	24.2	169.3	0	0	0	0	0	117.3	H83 V87	H83-G85 PolarHBondContact O-N 2.87Å; G85-V87 PolarHBondContact O-N 3.1Å; G85-V87 VanDerWaalsContact O-N 3.13Å
86	V	25.5	Very low	28.9	Very low	91 Å²	91	97.7 Å²	97.7	55%	0.552	56%	0.564	S	S	*	*			trans	-76.7	102.4	169.5	-174.8	0	0	0	0	107.9	L79 V88	L79-V86 HydrophobicContact CD1-CB 4.18Å; L79-V86 HydrophobicContact CD1-CG2 4.25Å; V86-V88 PolarHBondContact O-N 3.26Å
87	V	27.4	Very low	29.5	Very low	91 Å²	91	94.6 Å²	94.6	55%	0.552	54%	0.539	S	S	*	.			trans	-54.2	107.6	164.7	-177.5	0	0	0	0	106.5	G85 L89	G85-V87 PolarHBondContact O-N 3.1Å; G85-V87 VanDerWaalsContact O-N 3.13Å; V87-L89 HydrophobicContact CB-CG 4.47Å; V87-L89 HydrophobicContact CG1-CD2 3.86Å; V87-L89 HydrophobicContact CG1-CG 3.8Å; V87-L89 PolarHBondContact O-N 2.89Å
88	V	26.2	Very low	30	Very low	132 Å²	132	90 Å²	90	80%	0.8	52%	0.515	S	S	*	.			trans	-66.1	83.4	165.4	179.2	0	0	0	0	105.6	V86 A90	V86-V88 PolarHBondContact O-N 3.26Å; V88-A90 PolarHBondContact O-N 3.39Å; V88-A90 VanDerWaalsContact O-N 3.15Å
89	L	27.3	Very low	30.6	Very low	67 Å²	67	90.3 Å²	90.3	35%	0.351	50%	0.504	S	S	.	.			trans	-66.3	113.6	168.8	-75.1	168.9	0	0	0	106.2	V87 V91 L160 F242	V87-L89 HydrophobicContact CB-CG 4.47Å; V87-L89 HydrophobicContact CG1-CD2 3.86Å; V87-L89 HydrophobicContact CG1-CG 3.8Å; V87-L89 PolarHBondContact O-N 2.89Å; L89-V91 HydrophobicContact CB-CG2 4.21Å; L89-V91 PolarHBondContact O-N 3.29Å; L89-L160 HydrophobicContact CD1-CD1 3.7Å; L89-L160 HydrophobicContact CD1-CD2 3.92Å; L89-L160 HydrophobicContact CD1-CG 4.47Å; L89-F242 HydrophobicContact CD1-CZ 4.22Å; L89-F242 HydrophobicContact CD2-CE2 4.19Å; L89-F242 HydrophobicContact CD2-CZ 3.89Å
90	A	26.5	Very low	30.9	Very low	68 Å²	68	89 Å²	89	56%	0.562	49%	0.492	S	S	*	.			trans	-64.9	78	174.3	0	0	0	0	0	110	V88 N92 P93	V88-A90 PolarHBondContact O-N 3.39Å; V88-A90 VanDerWaalsContact O-N 3.15Å; A90-N92 PolarHBondContact O-N 3.29Å; A90-P93 WeakPolarHBondContact O-CD 3.45Å
91	V	28.7	Very low	31.2	Very low	63 Å²	63	88.8 Å²	88.8	38%	0.382	49%	0.486	S	S	.	.			trans	-83.6	12.9	170.7	-172.2	0	0	0	0	110.7	L89 I173	L89-V91 HydrophobicContact CB-CG2 4.21Å; L89-V91 PolarHBondContact O-N 3.29Å; V91-I173 HydrophobicContact CG1-CG1 4.38Å; V91-I173 HydrophobicContact CG2-CD1 4Å; V91-I173 HydrophobicContact CG2-CG1 4.18Å
92	N	31.8	Very low	31.2	Very low	108 Å²	108	91.3 Å²	91.3	58%	0.578	48%	0.479	S	S	*	.	H	α-helix	trans	-86.9	-26.7	-171.1	-142.1	-19.7	0	0	0	116.1	A90	A90-N92 PolarHBondContact O-N 3.29Å
93	P	30.3	Very low	31.1	Very low	23 Å²	23	94 Å²	94	15%	0.149	48%	0.482	C	S	.	.	H	α-helix	trans	-69.6	-36.6	176.7	-18.8	30.9	0	0	0	112.8	A90 Y97 L278 T308	A90-P93 WeakPolarHBondContact O-CD 3.45Å; P93-Y97 WeakPolarHBondContact O-CB 3.44Å; P93-Y97 PolarHBondContact O-N 3.14Å; P93-L278 HydrophobicContact CB-CD1 4.49Å; P93-T308 HydrophobicContact CB-CG2 4.41Å; P93-T308 HydrophobicContact CG-CG2 4.39Å
94	L	33.2	Very low	30.9	Very low	29 Å²	29	92.5 Å²	92.5	15%	0.152	48%	0.477	C	S	.	.	H	α-helix	trans	-85.2	-31.8	-172.2	-79.6	135.6	0	0	0	114.5	R96 Y97 R98 Y149 L153	L94-R96 VanDerWaalsContact C-N 3.31Å; L94-Y97 PolarHBondContact O-N 3.25Å; L94-R98 VanDerWaalsContact O-CB 3.27Å; L94-R98 WeakPolarHBondContact O-CB 3.43Å; L94-R98 VanDerWaalsContact O-CG 3.31Å; L94-R98 WeakPolarHBondContact O-CG 3.42Å; L94-R98 PolarHBondContact O-N 2.95Å; L94-Y149 HydrophobicContact CD1-CE1 3.69Å; L94-Y149 HydrophobicContact CD2-CD1 4.17Å; L94-Y149 HydrophobicContact CD2-CE1 3.81Å; L94-Y149 HydrophobicContact CG-CE1 4.09Å; L94-L153 HydrophobicContact CB-CD1 4.43Å; L94-L153 HydrophobicContact CD1-CD1 3.17Å; L94-L153 HydrophobicContact CD1-CD2 3.58Å; L94-L153 HydrophobicContact CD1-CG 3.97Å; L94-L153 HydrophobicContact CD2-CD1 3.17Å; L94-L153 HydrophobicContact CG-CD1 3.63Å
95	E	36.6	Very low	31	Very low	72 Å²	72	95.3 Å²	95.3	34%	0.336	48%	0.477	S	S	.	.	H	α-helix	trans	-65.4	-38.7	170.3	-114.3	-155.1	-157.1	0	0	111.2	K99	E95-K99 WeakPolarHBondContact O-CB 3.22Å; E95-K99 VanDerWaalsContact O-CG 3.28Å; E95-K99 WeakPolarHBondContact O-CG 3.33Å; E95-K99 PolarHBondContact O-N 3.11Å; E95-K99 IonicContact OE2-NZ 3.42Å; E95-K99 PolarHBondContact OE2-NZ 3.35Å
96	R	35.5	Very low	31.2	Very low	120 Å²	120	97.5 Å²	97.5	45%	0.453	48%	0.479	S	S	.	.	H	α-helix	trans	-64	-44	171.4	-91.3	-176.7	175	176.5	4.1	111.7	L94 K99 R100 D307	L94-R96 VanDerWaalsContact C-N 3.31Å; R96-K99 PolarHBondContact O-N 3.12Å; R96-R100 WeakPolarHBondContact O-CG 3.48Å; R96-R100 PolarHBondContact O-N 3.07Å; R96-D307 IonicContact NH1-OD1 2.63Å; R96-D307 PolarHBondContact NH1-OD1 3.47Å; R96-D307 IonicContact NH1-OD2 3.96Å; R96-D307 PolarHBondContact NH1-OD2 3.47Å
97	Y	37.1	Very low	31.5	Very low	58 Å²	58	99.2 Å²	99.2	23%	0.227	49%	0.492	C	S	.	.	H	α-helix	trans	-63.5	-45.6	176.6	-168.5	-111.3	0	0	0	112.1	P93 L94 K99 R100 I101 L278	P93-Y97 WeakPolarHBondContact O-CB 3.44Å; P93-Y97 PolarHBondContact O-N 3.14Å; L94-Y97 PolarHBondContact O-N 3.25Å; Y97-K99 PolarHBondContact O-N 3.44Å; Y97-R100 PolarHBondContact O-N 2.97Å; Y97-R100 VanDerWaalsContact O-N 3.08Å; Y97-I101 HydrophobicContact CD1-CD1 3.74Å; Y97-I101 HydrophobicContact CD1-CG1 4.4Å; Y97-I101 HydrophobicContact CE1-CD1 3.16Å; Y97-I101 HydrophobicContact CE1-CG1 4.14Å; Y97-I101 HydrophobicContact CE2-CD1 4.11Å; Y97-I101 HydrophobicContact CE2-CG1 4.42Å; Y97-I101 HydrophobicContact CG-CD1 4.44Å; Y97-I101 PolarHBondContact O-N 3.46Å; Y97-L278 HydrophobicContact CD2-CD2 3.75Å; Y97-L278 HydrophobicContact CE2-CD2 4.33Å; Y97-L278 HydrophobicContact CG-CD2 4.48Å
98	R	36.8	Very low	31.4	Very low	64 Å²	64	99.6 Å²	99.6	24%	0.242	50%	0.495	C	S	.	.	H	α-helix	trans	-60	-40.7	173.5	-79.2	177.8	167.8	169.2	1.9	112.6	L94 R100 R102 E157	L94-R98 VanDerWaalsContact O-CB 3.27Å; L94-R98 WeakPolarHBondContact O-CB 3.43Å; L94-R98 VanDerWaalsContact O-CG 3.31Å; L94-R98 WeakPolarHBondContact O-CG 3.42Å; L94-R98 PolarHBondContact O-N 2.95Å; R98-R100 VanDerWaalsContact C-N 3.32Å; R98-R102 WeakPolarHBondContact O-CG 3.4Å; R98-R102 PolarHBondContact O-N 2.85Å; R98-E157 IonicContact NH1-OE2 2.75Å; R98-E157 PolarHBondContact NH1-OE2 2.83Å
99	K	38.5	Very low	31.4	Very low	129 Å²	129	98.5 Å²	98.5	56%	0.561	49%	0.49	S	S	*	.	H	α-helix	trans	-67.4	-29.5	174.7	-77.8	169	179.1	156.5	0	112.3	E95 R96 Y97	E95-K99 WeakPolarHBondContact O-CB 3.22Å; E95-K99 VanDerWaalsContact O-CG 3.28Å; E95-K99 WeakPolarHBondContact O-CG 3.33Å; E95-K99 PolarHBondContact O-N 3.11Å; E95-K99 IonicContact OE2-NZ 3.42Å; E95-K99 PolarHBondContact OE2-NZ 3.35Å; R96-K99 PolarHBondContact O-N 3.12Å; Y97-K99 PolarHBondContact O-N 3.44Å
100	R	34.4	Very low	31.3	Very low	77 Å²	77	99 Å²	99	29%	0.291	49%	0.492	S	S	.	.	H	α-helix	trans	-82.9	-42.7	177.6	-73.7	-176.9	-167.6	-174.7	8.1	113.4	R96 Y97 R98 R102 R103 F281	R96-R100 WeakPolarHBondContact O-CG 3.48Å; R96-R100 PolarHBondContact O-N 3.07Å; Y97-R100 PolarHBondContact O-N 2.97Å; Y97-R100 VanDerWaalsContact O-N 3.08Å; R98-R100 VanDerWaalsContact C-N 3.32Å; R100-R102 VanDerWaalsContact C-N 3.35Å; R100-R102 PolarHBondContact O-N 3.37Å; R100-R103 WeakPolarHBondContact O-CB 3.46Å; R100-R103 PolarHBondContact O-N 3.41Å; R100-F281 HydrophobicContact CB-CE1 4.17Å; R100-F281 HydrophobicContact CB-CZ 4.43Å
101	I	35	Very low	31.2	Very low	72 Å²	72	102.4 Å²	102.4	37%	0.369	50%	0.501	S	S	.	.	H	α-helix	trans	-63.7	-37.5	176.3	-73.4	-173.5	0	0	0	112.1	Y97 R103 L104	Y97-I101 HydrophobicContact CD1-CD1 3.74Å; Y97-I101 HydrophobicContact CD1-CG1 4.4Å; Y97-I101 HydrophobicContact CE1-CD1 3.16Å; Y97-I101 HydrophobicContact CE1-CG1 4.14Å; Y97-I101 HydrophobicContact CE2-CD1 4.11Å; Y97-I101 HydrophobicContact CE2-CG1 4.42Å; Y97-I101 HydrophobicContact CG-CD1 4.44Å; Y97-I101 PolarHBondContact O-N 3.46Å; I101-R103 PolarHBondContact O-N 2.9Å; I101-R103 VanDerWaalsContact O-N 3.12Å; I101-L104 WeakPolarHBondContact O-CA 3.31Å; I101-L104 WeakPolarHBondContact O-CB 3.48Å; I101-L104 PolarHBondContact O-N 2.84Å
102	R	30.8	Very low	31.1	Very low	184 Å²	184	100.7 Å²	100.7	69%	0.694	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.9	177.4	-76.1	-179.3	179.1	168.7	1.7	114.3	R98 R100 L104	R98-R102 WeakPolarHBondContact O-CG 3.4Å; R98-R102 PolarHBondContact O-N 2.85Å; R100-R102 VanDerWaalsContact C-N 3.35Å; R100-R102 PolarHBondContact O-N 3.37Å; R102-L104 VanDerWaalsContact C-N 3.33Å
103	R	30.2	Very low	30.9	Very low	222 Å²	222	98.7 Å²	98.7	84%	0.838	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-12.5	171.2	-66.3	-178.6	177	-173.7	-3	112.7	R100 I101 K105	R100-R103 WeakPolarHBondContact O-CB 3.46Å; R100-R103 PolarHBondContact O-N 3.41Å; I101-R103 PolarHBondContact O-N 2.9Å; I101-R103 VanDerWaalsContact O-N 3.12Å; R103-K105 PolarHBondContact O-N 3.16Å
104	L	26.3	Very low	30.8	Very low	84 Å²	84	100 Å²	100	44%	0.44	50%	0.499	S	S	.	.			trans	-92.3	80.3	175	-63.9	165.7	0	0	0	109.1	I101 R102 F281	I101-L104 WeakPolarHBondContact O-CA 3.31Å; I101-L104 WeakPolarHBondContact O-CB 3.48Å; I101-L104 PolarHBondContact O-N 2.84Å; R102-L104 VanDerWaalsContact C-N 3.33Å; L104-F281 HydrophobicContact CD1-CE2 3.79Å; L104-F281 HydrophobicContact CD1-CZ 3.93Å
105	K	27.5	Very low	30.6	Very low	177 Å²	177	106.7 Å²	106.7	77%	0.77	54%	0.535	S	S	*	.			trans	-76.2	127.3	156.5	-79.3	-177.3	178.1	176.6	0	107.7	R103	R103-K105 PolarHBondContact O-N 3.16Å
106	P	29.8	Very low	30.2	Very low	117 Å²	117	109.4 Å²	109.4	76%	0.76	54%	0.543	S	S	*	.	S	Bend	trans	-73.4	150.8	163	30.7	-29	0	0	0	109.3
107	P	31.5	Very low	30.1	Very low	126 Å²	126	106 Å²	106	82%	0.818	54%	0.537	S	S	*	.			cis	-119.6	95.3	18.5	35.4	-17.9	0	0	0	111
108	T	26.3	Very low	30	Very low	100 Å²	100	106.2 Å²	106.2	61%	0.613	55%	0.546	S	S	*	.			trans	-107	113.7	164.3	-31.4	0	0	0	0	107.7	L110	T108-L110 PolarHBondContact O-N 3.41Å
109	P	25	Very low	30.2	Very low	108 Å²	108	107.8 Å²	107.8	70%	0.701	56%	0.559	S	S	*	*			trans	-56.3	126.4	177	20.6	-28.5	0	0	0	109.2	N111	P109-N111 PolarHBondContact O-N 3.24Å; P109-N111 VanDerWaalsContact O-N 3.14Å
110	L	25.7	Very low	30.2	Very low	77 Å²	77	106 Å²	106	40%	0.403	55%	0.553	S	S	.	*			trans	-73.5	99.9	-178.8	-75	152.3	0	0	0	108.8	T108 L112 R288	T108-L110 PolarHBondContact O-N 3.41Å; L110-L112 VanDerWaalsContact C-N 3.35Å; L110-L112 HydrophobicContact CB-CG 4.32Å; L110-L112 PolarHBondContact O-N 2.92Å; L110-L112 VanDerWaalsContact O-N 3.11Å; L110-R288 VanDerWaalsContact CD2-NH1 3.34Å
111	N	24.5	Very low	30.5	Very low	141 Å²	141	104.4 Å²	104.4	75%	0.754	55%	0.55	S	S	*	.			trans	-70.5	98	158.7	-73.2	-15.2	0	0	0	107.1	P109	P109-N111 PolarHBondContact O-N 3.24Å; P109-N111 VanDerWaalsContact O-N 3.14Å
112	L	26	Very low	31.1	Very low	26 Å²	26	102 Å²	102	14%	0.136	54%	0.538	C	S	.	.			trans	-77.7	150.5	176.8	-70.8	166.1	0	0	0	110.2	L110 G114 Y116 P118 L121 E284	L110-L112 VanDerWaalsContact C-N 3.35Å; L110-L112 HydrophobicContact CB-CG 4.32Å; L110-L112 PolarHBondContact O-N 2.92Å; L110-L112 VanDerWaalsContact O-N 3.11Å; L112-G114 PolarHBondContact O-N 2.8Å; L112-G114 VanDerWaalsContact O-N 3.12Å; L112-Y116 WeakPolarHBondContact CD1-O 3.29Å; L112-P118 HydrophobicContact CD1-CG 3.88Å; L112-L121 HydrophobicContact CD1-CD1 3.8Å; L112-L121 HydrophobicContact CD2-CD1 3.7Å; L112-L121 HydrophobicContact CG-CD1 4.26Å; L112-E284 HydrophobicContact CD2-CG 3.32Å
113	V	26.9	Very low	32	Very low	66 Å²	66	99.9 Å²	99.9	40%	0.4	53%	0.534	S	S	.	.	S	Bend	trans	-67.2	105.1	175.3	-166.6	0	0	0	0	108.3	D287	V113-D287 WeakPolarHBondContact CG1-OD2 3.43Å; V113-D287 HydrophobicContact CG2-CB 3.84Å; V113-D287 WeakPolarHBondContact CG2-OD2 3.28Å
114	G	29.9	Very low	32.7	Very low	50 Å²	50	92.4 Å²	92.4	52%	0.515	52%	0.515	S	S	.	.	S	Bend	trans	85.9	168.7	-176.2	0	0	0	0	0	114.4	L112 Y116	L112-G114 PolarHBondContact O-N 2.8Å; L112-G114 VanDerWaalsContact O-N 3.12Å; G114-Y116 PolarHBondContact O-N 3.15Å
115	D	28.9	Very low	33.9	Very low	170 Å²	170	88.8 Å²	88.8	91%	0.909	50%	0.495	S	S	*	.	S	Bend	trans	-64.2	17.4	-176.3	-70.8	-34.8	0	0	0	115	S117 Q120	D115-S117 PolarHBondContact O-N 3.29Å; D115-Q120 PolarHBondContact O-OE1 3.25Å
116	Y	27.4	Very low	35	Very low	129 Å²	129	80.9 Å²	80.9	51%	0.506	46%	0.462	S	S	.	.			trans	-79.4	122.1	-177.9	-62.8	-73.4	0	0	0	111.3	L112 G114 Q120 L121	L112-Y116 WeakPolarHBondContact CD1-O 3.29Å; G114-Y116 PolarHBondContact O-N 3.15Å; Y116-Q120 VanDerWaalsContact CA-OE1 3.23Å; Y116-Q120 HydrophobicContact CD1-CB 4.22Å; Y116-L121 HydrophobicContact CG-CD2 4.24Å
117	S	33.1	Very low	36	Very low	48 Å²	48	77.9 Å²	77.9	34%	0.336	45%	0.447	S	S	.	.			trans	-71.3	154.3	166.7	71.3	0	0	0	0	110.6	D115 D119 Q120 L121	D115-S117 PolarHBondContact O-N 3.29Å; S117-D119 PolarHBondContact O-N 3.46Å; S117-D119 VanDerWaalsContact O-N 3.1Å; S117-Q120 VanDerWaalsContact N-OE1 3.07Å; S117-Q120 WeakPolarHBondContact O-CA 3.28Å; S117-Q120 WeakPolarHBondContact O-CB 3.43Å; S117-Q120 PolarHBondContact O-N 3.34Å; S117-Q120 WeakPolarHBondContact OG-CG 3.4Å; S117-Q120 PolarHBondContact OG-N 2.82Å; S117-L121 PolarHBondContact O-N 3.5Å; S117-L121 VanDerWaalsContact O-N 3.14Å
118	P	35.7	Very low	36.8	Very low	64 Å²	64	75.4 Å²	75.4	42%	0.416	42%	0.421	S	S	.	.	H	α-helix	trans	-49.4	-37.2	173.5	-27	33.2	0	0	0	113	L112 Q120 L121 D122	L112-P118 HydrophobicContact CD1-CG 3.88Å; P118-Q120 PolarHBondContact O-N 3.45Å; P118-L121 PolarHBondContact O-N 3.23Å; P118-D122 WeakPolarHBondContact O-CB 3.29Å; P118-D122 PolarHBondContact O-N 2.82Å
119	D	41.4	Very low	37.9	Very low	97 Å²	97	70.8 Å²	70.8	52%	0.519	39%	0.393	S	S	.	.	H	α-helix	trans	-67.2	-31.6	176.2	-66.5	-23.4	0	0	0	113.6	S117 K123	S117-D119 PolarHBondContact O-N 3.46Å; S117-D119 VanDerWaalsContact O-N 3.1Å; D119-K123 WeakPolarHBondContact O-CB 3.32Å; D119-K123 WeakPolarHBondContact O-CD 3.39Å; D119-K123 WeakPolarHBondContact O-CG 3.49Å; D119-K123 PolarHBondContact O-N 2.98Å
120	Q	38.6	Very low	39.1	Very low	92 Å²	92	67.9 Å²	67.9	43%	0.43	37%	0.371	S	S	.	.	H	α-helix	trans	-74.1	-41.6	177.7	-76.6	174.8	-20	0	0	111.3	D115 Y116 S117 P118 K123 C124	D115-Q120 PolarHBondContact O-OE1 3.25Å; Y116-Q120 VanDerWaalsContact CA-OE1 3.23Å; Y116-Q120 HydrophobicContact CD1-CB 4.22Å; S117-Q120 VanDerWaalsContact N-OE1 3.07Å; S117-Q120 WeakPolarHBondContact O-CA 3.28Å; S117-Q120 WeakPolarHBondContact O-CB 3.43Å; S117-Q120 PolarHBondContact O-N 3.34Å; S117-Q120 WeakPolarHBondContact OG-CG 3.4Å; S117-Q120 PolarHBondContact OG-N 2.82Å; P118-Q120 PolarHBondContact O-N 3.45Å; Q120-K123 PolarHBondContact O-N 3.11Å; Q120-C124 WeakPolarHBondContact O-CB 3.49Å; Q120-C124 PolarHBondContact O-N 2.79Å; Q120-C124 PolarHBondContact O-SG 2.9Å
121	L	40.6	Very low	40.3	Very low	42 Å²	42	70.6 Å²	70.6	22%	0.22	38%	0.382	C	S	.	.	H	α-helix	trans	-62.2	-46.6	175.7	-73.3	177.3	0	0	0	110.4	L112 Y116 S117 P118 K123 C124 F125 Y280	L112-L121 HydrophobicContact CD1-CD1 3.8Å; L112-L121 HydrophobicContact CD2-CD1 3.7Å; L112-L121 HydrophobicContact CG-CD1 4.26Å; Y116-L121 HydrophobicContact CG-CD2 4.24Å; S117-L121 PolarHBondContact O-N 3.5Å; S117-L121 VanDerWaalsContact O-N 3.14Å; P118-L121 PolarHBondContact O-N 3.23Å; L121-K123 PolarHBondContact O-N 3.41Å; L121-C124 PolarHBondContact O-N 3.17Å; L121-F125 VanDerWaalsContact O-CB 3.32Å; L121-F125 WeakPolarHBondContact O-CB 3.41Å; L121-F125 PolarHBondContact O-N 3.5Å; L121-Y280 HydrophobicContact CB-CE2 3.41Å; L121-Y280 VanDerWaalsContact CB-CE2 3.41Å; L121-Y280 WeakPolarHBondContact CB-OH 3.44Å; L121-Y280 HydrophobicContact CG-CE2 4.44Å
122	D	47.3	Very low	41.3	Very low	23 Å²	23	67.4 Å²	67.4	12%	0.123	37%	0.365	C	S	.	.	H	α-helix	trans	-60	-43.8	176.1	-83.1	-17.6	0	0	0	112.4	P118 F125 V126 V139 R143 Y280	P118-D122 WeakPolarHBondContact O-CB 3.29Å; P118-D122 PolarHBondContact O-N 2.82Å; D122-F125 WeakPolarHBondContact O-CB 3.39Å; D122-F125 PolarHBondContact O-N 3.48Å; D122-V126 WeakPolarHBondContact O-CB 3.37Å; D122-V126 VanDerWaalsContact O-CG2 3.23Å; D122-V126 WeakPolarHBondContact O-CG2 3.18Å; D122-V126 PolarHBondContact O-N 3.03Å; D122-V139 HydrophobicContact CB-CB 4.29Å; D122-V139 HydrophobicContact CB-CG1 3.54Å; D122-V139 HydrophobicContact CB-CG2 3.74Å; D122-R143 IonicContact OD2-CZ 2.88Å; D122-R143 IonicContact OD2-NE 3.28Å; D122-R143 PolarHBondContact OD2-NE 2.89Å; D122-R143 IonicContact OD2-NH2 3.5Å; D122-R143 PolarHBondContact OD2-NH2 3.4Å; D122-Y280 PolarHBondContact OD1-OH 3.47Å
123	K	49.5	Very low	42.2	Very low	139 Å²	139	67.9 Å²	67.9	60%	0.604	37%	0.365	S	S	*	.	H	α-helix	trans	-65.1	-41.5	176.2	-76	170.5	-175.2	175.1	0	112.3	D119 Q120 L121 F125 V126 A127 V139	D119-K123 WeakPolarHBondContact O-CB 3.32Å; D119-K123 WeakPolarHBondContact O-CD 3.39Å; D119-K123 WeakPolarHBondContact O-CG 3.49Å; D119-K123 PolarHBondContact O-N 2.98Å; Q120-K123 PolarHBondContact O-N 3.11Å; L121-K123 PolarHBondContact O-N 3.41Å; K123-F125 VanDerWaalsContact C-N 3.34Å; K123-V126 PolarHBondContact O-N 2.95Å; K123-A127 WeakPolarHBondContact O-CB 3.13Å; K123-A127 PolarHBondContact O-N 2.7Å; K123-V139 HydrophobicContact CG-CG2 4.29Å
124	C	45.9	Very low	43.1	Very low	65 Å²	65	67.4 Å²	67.4	44%	0.439	37%	0.374	S	S	.	.	H	α-helix	trans	-64.7	-40.6	176.6	-76.2	0	0	0	0	111.7	Q120 L121 R128	Q120-C124 WeakPolarHBondContact O-CB 3.49Å; Q120-C124 PolarHBondContact O-N 2.79Å; Q120-C124 PolarHBondContact O-SG 2.9Å; L121-C124 PolarHBondContact O-N 3.17Å; C124-R128 WeakPolarHBondContact O-CB 3.39Å; C124-R128 WeakPolarHBondContact O-CG 3.36Å; C124-R128 PolarHBondContact O-N 2.84Å
125	F	51.1	Low	43.9	Very low	7 Å²	7	66.4 Å²	66.4	3%	0.031	36%	0.358	C	S	.	.	H	α-helix	trans	-57.8	-53	174.7	177.9	-96	0	0	0	112	L121 D122 K123 R128 C129 V142 L273 C276 Y280 W297	L121-F125 VanDerWaalsContact O-CB 3.32Å; L121-F125 WeakPolarHBondContact O-CB 3.41Å; L121-F125 PolarHBondContact O-N 3.5Å; D122-F125 WeakPolarHBondContact O-CB 3.39Å; D122-F125 PolarHBondContact O-N 3.48Å; K123-F125 VanDerWaalsContact C-N 3.34Å; F125-R128 PolarHBondContact O-N 3.47Å; F125-C129 VanDerWaalsContact CE1-SG 3.6Å; F125-C129 PolarHBondContact O-N 3.38Å; F125-C129 PolarHBondContact O-SG 3.49Å; F125-V142 HydrophobicContact CD1-CG1 3.92Å; F125-V142 HydrophobicContact CD1-CG2 4Å; F125-V142 HydrophobicContact CE1-CB 4.2Å; F125-V142 HydrophobicContact CE1-CG1 3.4Å; F125-V142 HydrophobicContact CE1-CG2 3.73Å; F125-V142 HydrophobicContact CZ-CG1 4.31Å; F125-L273 HydrophobicContact CE1-CD1 4.46Å; F125-C276 HydrophobicContact CD2-CB 4.43Å; F125-C276 HydrophobicContact CE2-CB 3.26Å; F125-C276 WeakPolarHBondContact CE2-O 3.14Å; F125-C276 HydrophobicContact CZ-CB 3.4Å; F125-Y280 HydrophobicContact CB-CD2 4.05Å; F125-Y280 HydrophobicContact CB-CE2 4.32Å; F125-Y280 HydrophobicContact CD2-CD2 4.05Å; F125-Y280 HydrophobicContact CD2-CG 4.42Å; F125-Y280 HydrophobicContact CG-CD2 4.31Å; F125-W297 AromaticContact CD2-CH2 3.57Å; F125-W297 HydrophobicContact CD2-CH2 3.57Å; F125-W297 HydrophobicContact CD2-CZ2 4.21Å; F125-W297 HydrophobicContact CD2-CZ3 4.41Å; F125-W297 AromaticContact CE2-CH2 3.83Å; F125-W297 HydrophobicContact CE2-CH2 3.83Å; F125-W297 HydrophobicContact CE2-CZ2 4.3Å
126	V	49.8	Very low	45.3	Very low	12 Å²	12	67.3 Å²	67.3	7%	0.073	35%	0.353	C	S	.	.	H	α-helix	trans	-64.5	-44.1	-179.9	170.3	0	0	0	0	111.4	D122 K123 R128 C129 N130 M137 V139 V142	D122-V126 WeakPolarHBondContact O-CB 3.37Å; D122-V126 VanDerWaalsContact O-CG2 3.23Å; D122-V126 WeakPolarHBondContact O-CG2 3.18Å; D122-V126 PolarHBondContact O-N 3.03Å; K123-V126 PolarHBondContact O-N 2.95Å; V126-R128 VanDerWaalsContact C-N 3.29Å; V126-R128 PolarHBondContact O-N 3.2Å; V126-C129 PolarHBondContact O-N 3.17Å; V126-N130 WeakPolarHBondContact O-CB 3.27Å; V126-N130 PolarHBondContact O-N 2.8Å; V126-N130 PolarHBondContact O-ND2 3.3Å; V126-M137 WeakPolarHBondContact CG1-O 3.41Å; V126-V139 HydrophobicContact CB-CG2 4.36Å; V126-V139 HydrophobicContact CG2-CB 4.19Å; V126-V139 HydrophobicContact CG2-CG2 3.66Å; V126-V142 HydrophobicContact CG2-CG2 3.73Å
127	A	50.7	Low	46.5	Very low	53 Å²	53	61.5 Å²	61.5	44%	0.438	33%	0.331	S	S	.	.	H	α-helix	trans	-57	-44.8	176.1	0	0	0	0	0	110.9	K123 N130 E131	K123-A127 WeakPolarHBondContact O-CB 3.13Å; K123-A127 PolarHBondContact O-N 2.7Å; A127-N130 PolarHBondContact O-N 3.38Å; A127-E131 VanDerWaalsContact O-CB 3.28Å; A127-E131 WeakPolarHBondContact O-CB 3.28Å; A127-E131 PolarHBondContact O-N 2.78Å
128	R	49.2	Very low	47.5	Very low	75 Å²	75	62.2 Å²	62.2	28%	0.283	33%	0.334	S	S	.	.	H	α-helix	trans	-68	-37.3	176.5	-76.7	-175.1	174	171.8	3.7	113.3	C124 F125 V126 N130 N132 W297	C124-R128 WeakPolarHBondContact O-CB 3.39Å; C124-R128 WeakPolarHBondContact O-CG 3.36Å; C124-R128 PolarHBondContact O-N 2.84Å; F125-R128 PolarHBondContact O-N 3.47Å; V126-R128 VanDerWaalsContact C-N 3.29Å; V126-R128 PolarHBondContact O-N 3.2Å; R128-N130 VanDerWaalsContact C-N 3.32Å; R128-N132 VanDerWaalsContact O-CB 3.29Å; R128-N132 WeakPolarHBondContact O-CB 3.13Å; R128-N132 PolarHBondContact O-N 2.84Å; R128-N132 PolarHBondContact O-ND2 3.46Å; R128-W297 VanDerWaalsContact NH1-CD1 3.27Å
129	C	49.1	Very low	48	Very low	2 Å²	2	60.6 Å²	60.6	1%	0.014	32%	0.323	C	S	.	.	H	α-helix	trans	-64.7	-40.7	174.5	-68.8	0	0	0	0	111	F125 V126 Y133	F125-C129 VanDerWaalsContact CE1-SG 3.6Å; F125-C129 PolarHBondContact O-N 3.38Å; F125-C129 PolarHBondContact O-SG 3.49Å; V126-C129 PolarHBondContact O-N 3.17Å; C129-Y133 WeakPolarHBondContact O-CB 3.42Å; C129-Y133 WeakPolarHBondContact O-CD2 3.21Å; C129-Y133 PolarHBondContact O-N 3.25Å
130	N	49.9	Very low	48.3	Very low	47 Å²	47	60.1 Å²	60.1	25%	0.251	32%	0.32	S	S	.	.	H	α-helix	trans	-68.6	-42	178.3	-71.3	-16.4	0	0	0	112.8	V126 A127 R128 G134 K136 M137	V126-N130 WeakPolarHBondContact O-CB 3.27Å; V126-N130 PolarHBondContact O-N 2.8Å; V126-N130 PolarHBondContact O-ND2 3.3Å; A127-N130 PolarHBondContact O-N 3.38Å; R128-N130 VanDerWaalsContact C-N 3.32Å; N130-G134 VanDerWaalsContact O-CA 3.27Å; N130-G134 WeakPolarHBondContact O-CA 3.48Å; N130-G134 PolarHBondContact O-N 3.31Å; N130-K136 VanDerWaalsContact OD1-CA 3.28Å; N130-K136 WeakPolarHBondContact OD1-CA 3.48Å; N130-K136 PolarHBondContact OD1-N 3.29Å; N130-M137 PolarHBondContact ND2-O 3.18Å; N130-M137 PolarHBondContact OD1-N 3.33Å
131	E	50.7	Low	48.6	Very low	134 Å²	134	55.9 Å²	55.9	63%	0.626	30%	0.3	S	S	*	.	H	α-helix	trans	-65.8	-46.6	178.2	-174	177	-163.1	0	0	111.5	A127	A127-E131 VanDerWaalsContact O-CB 3.28Å; A127-E131 WeakPolarHBondContact O-CB 3.28Å; A127-E131 PolarHBondContact O-N 2.78Å
132	N	44.9	Very low	48.9	Very low	75 Å²	75	54.3 Å²	54.3	40%	0.401	29%	0.292	S	S	.	.	H	α-helix	trans	-81.7	-29.3	-173.3	-68.9	-52.8	0	0	0	113.9	R128	R128-N132 VanDerWaalsContact O-CB 3.29Å; R128-N132 WeakPolarHBondContact O-CB 3.13Å; R128-N132 PolarHBondContact O-N 2.84Å; R128-N132 PolarHBondContact O-ND2 3.46Å
133	Y	45	Very low	48.9	Very low	35 Å²	35	58.9 Å²	58.9	14%	0.137	31%	0.308	C	S	.	.	H	α-helix	trans	-124.9	-1.4	-170.3	-53.1	-72.5	0	0	0	113.8	C129 V135 P266 I272 W314 L317	C129-Y133 WeakPolarHBondContact O-CB 3.42Å; C129-Y133 WeakPolarHBondContact O-CD2 3.21Å; C129-Y133 PolarHBondContact O-N 3.25Å; Y133-V135 HydrophobicContact CG-CG2 4.47Å; Y133-V135 PolarHBondContact O-N 3.35Å; Y133-P266 WeakPolarHBondContact O-CG 3.17Å; Y133-I272 HydrophobicContact CD1-CD1 3.81Å; Y133-I272 HydrophobicContact CD1-CG2 3.84Å; Y133-I272 HydrophobicContact CD2-CG2 3.55Å; Y133-I272 HydrophobicContact CE1-CB 4.42Å; Y133-I272 HydrophobicContact CE1-CD1 3.67Å; Y133-I272 HydrophobicContact CE1-CG1 4.06Å; Y133-I272 HydrophobicContact CE1-CG2 3.51Å; Y133-I272 HydrophobicContact CE2-CG2 3.22Å; Y133-I272 HydrophobicContact CG-CG2 3.85Å; Y133-W314 WeakPolarHBondContact OH-CH2 3.49Å; Y133-W314 WeakPolarHBondContact OH-CZ3 3.41Å; Y133-L317 HydrophobicContact CE1-CD1 4.36Å
134	G	45.9	Very low	48.7	Very low	56 Å²	56	55.4 Å²	55.4	58%	0.577	29%	0.291	S	S	*	.			trans	65.1	17.7	176.9	0	0	0	0	0	114.6	N130 K136	N130-G134 VanDerWaalsContact O-CA 3.27Å; N130-G134 WeakPolarHBondContact O-CA 3.48Å; N130-G134 PolarHBondContact O-N 3.31Å; G134-K136 VanDerWaalsContact C-N 3.3Å; G134-K136 PolarHBondContact O-N 3.33Å
135	V	47.5	Very low	48.7	Very low	30 Å²	30	52.3 Å²	52.3	18%	0.182	27%	0.27	C	S	.	.			trans	-78	-10.8	-167	-144.3	0	0	0	0	113.7	Y133 M137 M232	Y133-V135 HydrophobicContact CG-CG2 4.47Å; Y133-V135 PolarHBondContact O-N 3.35Å; V135-M137 HydrophobicContact CB-CG 3.86Å; V135-M137 HydrophobicContact CB-SD 3.99Å; V135-M137 HydrophobicContact CG1-CG 3.86Å; V135-M137 HydrophobicContact CG1-SD 3.76Å; V135-M137 PolarHBondContact O-N 2.69Å; V135-M137 VanDerWaalsContact O-N 3.15Å; V135-M232 HydrophobicContact CG1-CE 3.61Å
136	K	58.3	Low	48.4	Very low	188 Å²	188	54 Å²	54	82%	0.817	28%	0.278	S	S	*	.			trans	45.5	42.2	179.4	-63.5	-174.6	179.8	-179.8	0	114	N130 G134	N130-K136 VanDerWaalsContact OD1-CA 3.28Å; N130-K136 WeakPolarHBondContact OD1-CA 3.48Å; N130-K136 PolarHBondContact OD1-N 3.29Å; G134-K136 VanDerWaalsContact C-N 3.3Å; G134-K136 PolarHBondContact O-N 3.33Å
137	M	53.2	Low	48.2	Very low	7 Å²	7	57.7 Å²	57.7	3%	0.034	30%	0.296	C	S	.	.			trans	-83.3	156.1	178.9	-65.7	178.5	81.3	0	0	112.1	V126 N130 V135 D141 V142 A145 M232 L273	V126-M137 WeakPolarHBondContact CG1-O 3.41Å; N130-M137 PolarHBondContact ND2-O 3.18Å; N130-M137 PolarHBondContact OD1-N 3.33Å; V135-M137 HydrophobicContact CB-CG 3.86Å; V135-M137 HydrophobicContact CB-SD 3.99Å; V135-M137 HydrophobicContact CG1-CG 3.86Å; V135-M137 HydrophobicContact CG1-SD 3.76Å; V135-M137 PolarHBondContact O-N 2.69Å; V135-M137 VanDerWaalsContact O-N 3.15Å; M137-D141 WeakPolarHBondContact CA-OD2 3.47Å; M137-D141 HydrophobicContact CB-CB 4.04Å; M137-D141 HydrophobicContact CE-CB 3.84Å; M137-D141 HydrophobicContact CG-CB 4.37Å; M137-V142 HydrophobicContact CE-CG2 4.15Å; M137-A145 HydrophobicContact CE-CB 4.47Å; M137-M232 HydrophobicContact CE-CE 3.74Å; M137-M232 HydrophobicContact CG-CE 4.33Å; M137-M232 HydrophobicContact SD-CE 3.62Å; M137-L273 HydrophobicContact CE-CD1 3.74Å; M137-L273 HydrophobicContact CE-CD2 3.99Å; M137-L273 HydrophobicContact SD-CD1 3.65Å
138	T	53.1	Low	47.8	Very low	64 Å²	64	56.8 Å²	56.8	39%	0.393	28%	0.283	S	S	.	.			trans	-100	170.8	165.7	78	0	0	0	0	110.9	D140 D141 V142	T138-D140 PolarHBondContact O-N 3.5Å; T138-D140 PolarHBondContact OG1-N 2.88Å; T138-D141 VanDerWaalsContact N-CG 3.29Å; T138-D141 PolarHBondContact N-OD2 3.42Å; T138-D141 WeakPolarHBondContact O-CB 3.36Å; T138-D141 PolarHBondContact O-N 3.28Å; T138-D141 PolarHBondContact OG1-N 3.39Å; T138-D141 VanDerWaalsContact OG1-N 3.09Å; T138-D141 PolarHBondContact OG1-OD1 3.12Å; T138-V142 WeakPolarHBondContact O-CG2 3.26Å; T138-V142 PolarHBondContact O-N 3.06Å
139	V	47.2	Very low	47.6	Very low	30 Å²	30	54.2 Å²	54.2	18%	0.182	27%	0.273	C	S	.	.	H	α-helix	trans	-59.8	-39.9	172.8	172.3	0	0	0	0	110.8	D122 K123 V126 D141 V142 R143	D122-V139 HydrophobicContact CB-CB 4.29Å; D122-V139 HydrophobicContact CB-CG1 3.54Å; D122-V139 HydrophobicContact CB-CG2 3.74Å; K123-V139 HydrophobicContact CG-CG2 4.29Å; V126-V139 HydrophobicContact CB-CG2 4.36Å; V126-V139 HydrophobicContact CG2-CB 4.19Å; V126-V139 HydrophobicContact CG2-CG2 3.66Å; V139-D141 VanDerWaalsContact C-N 3.32Å; V139-D141 PolarHBondContact O-N 2.65Å; V139-V142 PolarHBondContact O-N 2.69Å; V139-R143 WeakPolarHBondContact O-CG 3.22Å; V139-R143 PolarHBondContact O-N 2.77Å
140	D	46.1	Very low	47.4	Very low	86 Å²	86	58.7 Å²	58.7	46%	0.46	29%	0.294	S	S	.	.	H	α-helix	trans	-67.4	-35.7	178.9	-66.6	-34.6	0	0	0	111.1	T138 V142 R143 R144	T138-D140 PolarHBondContact O-N 3.5Å; T138-D140 PolarHBondContact OG1-N 2.88Å; D140-V142 VanDerWaalsContact C-N 3.32Å; D140-V142 PolarHBondContact O-N 2.92Å; D140-R143 PolarHBondContact O-N 3.33Å; D140-R144 WeakPolarHBondContact O-CB 3.16Å; D140-R144 VanDerWaalsContact O-CG 3.28Å; D140-R144 WeakPolarHBondContact O-CG 3.39Å; D140-R144 PolarHBondContact O-N 3.28Å
141	D	46.4	Very low	47.2	Very low	3 Å²	3	61.2 Å²	61.2	2%	0.016	30%	0.301	C	S	.	.	H	α-helix	trans	-62.2	-41.8	175.5	-55.6	-4.5	0	0	0	111.2	M137 T138 V139 A145 D225	M137-D141 WeakPolarHBondContact CA-OD2 3.47Å; M137-D141 HydrophobicContact CB-CB 4.04Å; M137-D141 HydrophobicContact CE-CB 3.84Å; M137-D141 HydrophobicContact CG-CB 4.37Å; T138-D141 VanDerWaalsContact N-CG 3.29Å; T138-D141 PolarHBondContact N-OD2 3.42Å; T138-D141 WeakPolarHBondContact O-CB 3.36Å; T138-D141 PolarHBondContact O-N 3.28Å; T138-D141 PolarHBondContact OG1-N 3.39Å; T138-D141 VanDerWaalsContact OG1-N 3.09Å; T138-D141 PolarHBondContact OG1-OD1 3.12Å; V139-D141 VanDerWaalsContact C-N 3.32Å; V139-D141 PolarHBondContact O-N 2.65Å; D141-A145 VanDerWaalsContact O-CB 3.22Å; D141-A145 WeakPolarHBondContact O-CB 2.99Å; D141-A145 PolarHBondContact O-N 3.18Å; D141-D225 VanDerWaalsContact OD1-CB 3.23Å; D141-D225 WeakPolarHBondContact OD1-CB 3.43Å
142	V	47	Very low	46.8	Very low	10 Å²	10	55.2 Å²	55.2	6%	0.061	27%	0.274	C	S	.	.	H	α-helix	trans	-63.7	-49.4	176.4	175.2	0	0	0	0	110.1	F125 V126 M137 T138 V139 D140 R144 A145 F146 L273	F125-V142 HydrophobicContact CD1-CG1 3.92Å; F125-V142 HydrophobicContact CD1-CG2 4Å; F125-V142 HydrophobicContact CE1-CB 4.2Å; F125-V142 HydrophobicContact CE1-CG1 3.4Å; F125-V142 HydrophobicContact CE1-CG2 3.73Å; F125-V142 HydrophobicContact CZ-CG1 4.31Å; V126-V142 HydrophobicContact CG2-CG2 3.73Å; M137-V142 HydrophobicContact CE-CG2 4.15Å; T138-V142 WeakPolarHBondContact O-CG2 3.26Å; T138-V142 PolarHBondContact O-N 3.06Å; V139-V142 PolarHBondContact O-N 2.69Å; D140-V142 VanDerWaalsContact C-N 3.32Å; D140-V142 PolarHBondContact O-N 2.92Å; V142-R144 VanDerWaalsContact C-N 3.34Å; V142-R144 PolarHBondContact O-N 2.88Å; V142-A145 WeakPolarHBondContact O-CB 3.49Å; V142-A145 PolarHBondContact O-N 3.38Å; V142-F146 HydrophobicContact CG1-CD2 3.9Å; V142-F146 HydrophobicContact CG1-CE2 3.59Å; V142-F146 WeakPolarHBondContact O-CD2 3.28Å; V142-F146 PolarHBondContact O-N 3.09Å; V142-L273 HydrophobicContact CG2-CD1 4.16Å
143	R	45.9	Very low	46.9	Very low	119 Å²	119	53.2 Å²	53.2	45%	0.449	26%	0.263	S	S	.	.	H	α-helix	trans	-60.7	-43.2	179.5	-71.9	174.7	175	-174.9	-2.7	111.5	D122 V139 D140 F146 I147	D122-R143 IonicContact OD2-CZ 2.88Å; D122-R143 IonicContact OD2-NE 3.28Å; D122-R143 PolarHBondContact OD2-NE 2.89Å; D122-R143 IonicContact OD2-NH2 3.5Å; D122-R143 PolarHBondContact OD2-NH2 3.4Å; V139-R143 WeakPolarHBondContact O-CG 3.22Å; V139-R143 PolarHBondContact O-N 2.77Å; D140-R143 PolarHBondContact O-N 3.33Å; R143-F146 PolarHBondContact O-N 3.34Å; R143-I147 WeakPolarHBondContact O-CG1 3.26Å; R143-I147 PolarHBondContact O-N 3.41Å
144	R	46.4	Very low	47	Very low	65 Å²	65	54 Å²	54	25%	0.245	27%	0.269	C	S	.	.	H	α-helix	trans	-66.1	-38.8	175	-72.4	-177.3	-174	174.5	12	112.1	D140 V142 F146 I147 H148 S223 D225 D226	D140-R144 WeakPolarHBondContact O-CB 3.16Å; D140-R144 VanDerWaalsContact O-CG 3.28Å; D140-R144 WeakPolarHBondContact O-CG 3.39Å; D140-R144 PolarHBondContact O-N 3.28Å; V142-R144 VanDerWaalsContact C-N 3.34Å; V142-R144 PolarHBondContact O-N 2.88Å; R144-F146 VanDerWaalsContact C-N 3.3Å; R144-F146 PolarHBondContact O-N 3.35Å; R144-I147 PolarHBondContact O-N 3.4Å; R144-I147 VanDerWaalsContact O-N 3.14Å; R144-H148 PolarHBondContact O-CD2 3.27Å; R144-H148 PolarHBondContact O-N 3.45Å; R144-S223 PolarHBondContact NH1-OG 3.46Å; R144-D225 IonicContact NH1-OD2 3.95Å; R144-D226 WeakPolarHBondContact CD-OD1 3.47Å; R144-D226 IonicContact CZ-OD1 3.39Å; R144-D226 IonicContact NE-OD1 3.06Å; R144-D226 IonicContact NH1-OD1 3.12Å; R144-D226 PolarHBondContact NH1-OD1 3.06Å; R144-D226 VanDerWaalsContact NH1-OD1 3.12Å; R144-D226 IonicContact NH1-OD2 3.99Å
145	A	44.6	Very low	47.1	Very low	1 Å²	1	53 Å²	53	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-58	-42.2	174.1	0	0	0	0	0	112.4	M137 D141 V142 Y149 V229 L273	M137-A145 HydrophobicContact CE-CB 4.47Å; D141-A145 VanDerWaalsContact O-CB 3.22Å; D141-A145 WeakPolarHBondContact O-CB 2.99Å; D141-A145 PolarHBondContact O-N 3.18Å; V142-A145 WeakPolarHBondContact O-CB 3.49Å; V142-A145 PolarHBondContact O-N 3.38Å; A145-Y149 WeakPolarHBondContact O-CB 3.33Å; A145-Y149 PolarHBondContact O-N 3.05Å; A145-V229 HydrophobicContact CB-CG1 4.13Å; A145-V229 HydrophobicContact CB-CG2 3.75Å; A145-L273 HydrophobicContact CB-CD2 3.28Å
146	F	45.7	Very low	46.9	Very low	43 Å²	43	52.8 Å²	52.8	19%	0.189	25%	0.249	C	C	.	.	H	α-helix	trans	-61.8	-43.7	174.2	-81.6	-70.8	0	0	0	112.4	V142 R143 R144 E150 L274	V142-F146 HydrophobicContact CG1-CD2 3.9Å; V142-F146 HydrophobicContact CG1-CE2 3.59Å; V142-F146 WeakPolarHBondContact O-CD2 3.28Å; V142-F146 PolarHBondContact O-N 3.09Å; R143-F146 PolarHBondContact O-N 3.34Å; R144-F146 VanDerWaalsContact C-N 3.3Å; R144-F146 PolarHBondContact O-N 3.35Å; F146-E150 PolarHBondContact O-N 2.58Å; F146-L274 HydrophobicContact CD1-CD2 3.96Å; F146-L274 HydrophobicContact CE1-CD2 3.56Å; F146-L274 HydrophobicContact CZ-CD2 4.32Å
147	I	44.5	Very low	46.3	Very low	88 Å²	88	45.6 Å²	45.6	45%	0.451	22%	0.218	S	C	.	.	H	α-helix	trans	-64.2	-50.3	178.4	-66.3	168.3	0	0	0	110.9	R143 R144 Y149 E150 Y151	R143-I147 WeakPolarHBondContact O-CG1 3.26Å; R143-I147 PolarHBondContact O-N 3.41Å; R144-I147 PolarHBondContact O-N 3.4Å; R144-I147 VanDerWaalsContact O-N 3.14Å; I147-Y149 VanDerWaalsContact C-N 3.33Å; I147-Y149 PolarHBondContact O-N 2.94Å; I147-E150 WeakPolarHBondContact O-CB 3.25Å; I147-E150 PolarHBondContact O-N 2.85Å; I147-Y151 HydrophobicContact CG2-CD2 3.91Å; I147-Y151 HydrophobicContact CG2-CE2 3.57Å; I147-Y151 WeakPolarHBondContact O-CD2 3.44Å; I147-Y151 PolarHBondContact O-N 3.07Å; I147-Y151 VanDerWaalsContact O-N 3.14Å
148	H	43.6	Very low	46.1	Very low	35 Å²	35	50.1 Å²	50.1	16%	0.162	24%	0.235	C	C	.	.	H	α-helix	trans	-65.7	-36	179.6	-76	-70.6	0	0	0	112.5	R144 E150 Y151 A152 D226 V229 I233	R144-H148 PolarHBondContact O-CD2 3.27Å; R144-H148 PolarHBondContact O-N 3.45Å; H148-E150 VanDerWaalsContact C-N 3.34Å; H148-Y151 PolarHBondContact O-N 2.77Å; H148-A152 WeakPolarHBondContact O-CB 3.45Å; H148-A152 PolarHBondContact O-N 2.85Å; H148-D226 IonicContact NE2-OD1 2.69Å; H148-V229 HydrophobicContact CB-CG1 3.44Å; H148-V229 VanDerWaalsContact CB-CG1 3.44Å; H148-I233 HydrophobicContact CB-CD1 3.48Å; H148-I233 VanDerWaalsContact CB-CD1 3.48Å
149	Y	43.9	Very low	45.9	Very low	20 Å²	20	50.2 Å²	50.2	8%	0.078	23%	0.231	C	C	.	.	H	α-helix	trans	-63	-41.6	174	-176.4	-117.5	0	0	0	111.5	L94 A145 I147 Y151 A152 L153 Y236 L270 L274	L94-Y149 HydrophobicContact CD1-CE1 3.69Å; L94-Y149 HydrophobicContact CD2-CD1 4.17Å; L94-Y149 HydrophobicContact CD2-CE1 3.81Å; L94-Y149 HydrophobicContact CG-CE1 4.09Å; A145-Y149 WeakPolarHBondContact O-CB 3.33Å; A145-Y149 PolarHBondContact O-N 3.05Å; I147-Y149 VanDerWaalsContact C-N 3.33Å; I147-Y149 PolarHBondContact O-N 2.94Å; Y149-Y151 VanDerWaalsContact C-N 3.32Å; Y149-Y151 PolarHBondContact O-N 3.14Å; Y149-A152 PolarHBondContact O-N 3.41Å; Y149-L153 HydrophobicContact CD1-CD1 3.6Å; Y149-L153 HydrophobicContact CD1-CG 4.35Å; Y149-L153 HydrophobicContact CD2-CD1 4.47Å; Y149-L153 HydrophobicContact CD2-CG 4.39Å; Y149-L153 HydrophobicContact CE1-CD1 3.44Å; Y149-L153 VanDerWaalsContact CE1-CD1 3.44Å; Y149-L153 HydrophobicContact CE1-CD2 4.45Å; Y149-L153 HydrophobicContact CE1-CG 4.14Å; Y149-L153 HydrophobicContact CE2-CD1 4.33Å; Y149-L153 HydrophobicContact CE2-CD2 4.23Å; Y149-L153 HydrophobicContact CE2-CG 4.16Å; Y149-L153 HydrophobicContact CG-CD1 4.17Å; Y149-L153 WeakPolarHBondContact O-CB 3.14Å; Y149-L153 WeakPolarHBondContact O-CD1 3.49Å; Y149-L153 WeakPolarHBondContact O-CG 3.43Å; Y149-L153 PolarHBondContact O-N 2.85Å; Y149-Y236 HydrophobicContact CE2-CE1 4.38Å; Y149-L270 HydrophobicContact CD2-CD1 4.14Å; Y149-L270 HydrophobicContact CD2-CD2 3.53Å; Y149-L270 HydrophobicContact CD2-CG 4.06Å; Y149-L270 HydrophobicContact CE2-CD2 3.63Å; Y149-L270 HydrophobicContact CE2-CG 4.18Å; Y149-L274 HydrophobicContact CD1-CD1 3.8Å; Y149-L274 HydrophobicContact CD1-CD2 3.33Å; Y149-L274 HydrophobicContact CD1-CG 4.18Å; Y149-L274 HydrophobicContact CD2-CD1 4.13Å; Y149-L274 HydrophobicContact CE1-CD1 3.21Å; Y149-L274 HydrophobicContact CE1-CD2 3.49Å; Y149-L274 VanDerWaalsContact CE1-CD2 3.49Å; Y149-L274 HydrophobicContact CE1-CG 3.97Å; Y149-L274 HydrophobicContact CE2-CD1 3.63Å; Y149-L274 HydrophobicContact CG-CD1 4.19Å; Y149-L274 HydrophobicContact CG-CD2 3.97Å; Y149-L274 WeakPolarHBondContact OH-CD1 3.35Å
150	E	45.1	Very low	45.8	Very low	96 Å²	96	50.2 Å²	50.2	45%	0.449	23%	0.23	S	C	.	.	H	α-helix	trans	-59.2	-42.4	174.2	-175.7	170.8	-163.1	0	0	112.1	F146 I147 H148 L154	F146-E150 PolarHBondContact O-N 2.58Å; I147-E150 WeakPolarHBondContact O-CB 3.25Å; I147-E150 PolarHBondContact O-N 2.85Å; H148-E150 VanDerWaalsContact C-N 3.34Å; E150-L154 WeakPolarHBondContact O-CG 3.11Å; E150-L154 PolarHBondContact O-N 3.49Å
151	Y	45.7	Very low	45.9	Very low	101 Å²	101	49.7 Å²	49.7	40%	0.396	22%	0.221	S	C	.	.	H	α-helix	trans	-65.5	-44.2	174.6	-75.7	-66.1	0	0	0	112.8	I147 H148 Y149 L153 L154 D155	I147-Y151 HydrophobicContact CG2-CD2 3.91Å; I147-Y151 HydrophobicContact CG2-CE2 3.57Å; I147-Y151 WeakPolarHBondContact O-CD2 3.44Å; I147-Y151 PolarHBondContact O-N 3.07Å; I147-Y151 VanDerWaalsContact O-N 3.14Å; H148-Y151 PolarHBondContact O-N 2.77Å; Y149-Y151 VanDerWaalsContact C-N 3.32Å; Y149-Y151 PolarHBondContact O-N 3.14Å; Y151-L153 VanDerWaalsContact C-N 3.28Å; Y151-L153 PolarHBondContact O-N 3.36Å; Y151-L154 WeakPolarHBondContact O-CB 3.37Å; Y151-L154 PolarHBondContact O-N 3.46Å; Y151-D155 PolarHBondContact O-N 3.29Å
152	A	43.4	Very low	46.2	Very low	7 Å²	7	56.9 Å²	56.9	6%	0.058	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-39.8	178.3	0	0	0	0	0	111.6	H148 Y149 D155 V156 I233 F249	H148-A152 WeakPolarHBondContact O-CB 3.45Å; H148-A152 PolarHBondContact O-N 2.85Å; Y149-A152 PolarHBondContact O-N 3.41Å; A152-D155 PolarHBondContact O-N 3.36Å; A152-V156 WeakPolarHBondContact O-CG2 3.18Å; A152-V156 PolarHBondContact O-N 2.92Å; A152-I233 HydrophobicContact CB-CD1 4.31Å; A152-I233 HydrophobicContact CB-CG2 3.54Å; A152-F249 HydrophobicContact CB-CE2 4.22Å
153	L	46.2	Very low	46	Very low	33 Å²	33	60.3 Å²	60.3	17%	0.173	26%	0.264	C	S	.	.	H	α-helix	trans	-66.9	-40.3	174.9	-70.7	163.5	0	0	0	112.9	L94 Y149 Y151 D155 V156 E157	L94-L153 HydrophobicContact CB-CD1 4.43Å; L94-L153 HydrophobicContact CD1-CD1 3.17Å; L94-L153 HydrophobicContact CD1-CD2 3.58Å; L94-L153 HydrophobicContact CD1-CG 3.97Å; L94-L153 HydrophobicContact CD2-CD1 3.17Å; L94-L153 HydrophobicContact CG-CD1 3.63Å; Y149-L153 HydrophobicContact CD1-CD1 3.6Å; Y149-L153 HydrophobicContact CD1-CG 4.35Å; Y149-L153 HydrophobicContact CD2-CD1 4.47Å; Y149-L153 HydrophobicContact CD2-CG 4.39Å; Y149-L153 HydrophobicContact CE1-CD1 3.44Å; Y149-L153 VanDerWaalsContact CE1-CD1 3.44Å; Y149-L153 HydrophobicContact CE1-CD2 4.45Å; Y149-L153 HydrophobicContact CE1-CG 4.14Å; Y149-L153 HydrophobicContact CE2-CD1 4.33Å; Y149-L153 HydrophobicContact CE2-CD2 4.23Å; Y149-L153 HydrophobicContact CE2-CG 4.16Å; Y149-L153 HydrophobicContact CG-CD1 4.17Å; Y149-L153 WeakPolarHBondContact O-CB 3.14Å; Y149-L153 WeakPolarHBondContact O-CD1 3.49Å; Y149-L153 WeakPolarHBondContact O-CG 3.43Å; Y149-L153 PolarHBondContact O-N 2.85Å; Y151-L153 VanDerWaalsContact C-N 3.28Å; Y151-L153 PolarHBondContact O-N 3.36Å; L153-D155 PolarHBondContact O-N 3.02Å; L153-V156 PolarHBondContact O-N 3.32Å; L153-E157 WeakPolarHBondContact O-CB 3.32Å; L153-E157 PolarHBondContact O-N 2.96Å
154	L	47.4	Very low	45.9	Very low	51 Å²	51	55.5 Å²	55.5	27%	0.267	25%	0.248	S	C	.	.	H	α-helix	trans	-60.4	-37	173.5	-75.5	169.4	0	0	0	111	E150 Y151 R158	E150-L154 WeakPolarHBondContact O-CG 3.11Å; E150-L154 PolarHBondContact O-N 3.49Å; Y151-L154 WeakPolarHBondContact O-CB 3.37Å; Y151-L154 PolarHBondContact O-N 3.46Å; L154-R158 WeakPolarHBondContact O-CB 3.39Å; L154-R158 WeakPolarHBondContact O-CD 3.42Å; L154-R158 WeakPolarHBondContact O-CG 3.33Å; L154-R158 PolarHBondContact O-N 3.41Å
155	D	47.7	Very low	46.1	Very low	36 Å²	36	60 Å²	60	19%	0.193	27%	0.272	C	S	.	.	H	α-helix	trans	-73	-38.5	176.3	-82.6	-10	0	0	0	113.3	Y151 A152 L153 E157 R158 H159	Y151-D155 PolarHBondContact O-N 3.29Å; A152-D155 PolarHBondContact O-N 3.36Å; L153-D155 PolarHBondContact O-N 3.02Å; D155-E157 VanDerWaalsContact C-N 3.35Å; D155-R158 PolarHBondContact O-N 3.06Å; D155-R158 IonicContact OD1-CZ 3.42Å; D155-R158 IonicContact OD1-NH1 3.12Å; D155-R158 PolarHBondContact OD1-NH1 3.01Å; D155-H159 WeakPolarHBondContact O-CB 3.26Å; D155-H159 PolarHBondContact O-N 3.27Å
156	V	43.8	Very low	46	Very low	25 Å²	25	66.6 Å²	66.6	15%	0.152	31%	0.306	C	S	.	.	H	α-helix	trans	-62.3	-44.2	170.1	172.1	0	0	0	0	110.4	A152 L153 R158 H159 L160 L237	A152-V156 WeakPolarHBondContact O-CG2 3.18Å; A152-V156 PolarHBondContact O-N 2.92Å; L153-V156 PolarHBondContact O-N 3.32Å; V156-R158 PolarHBondContact O-N 3.5Å; V156-H159 PolarHBondContact O-N 3.49Å; V156-L160 HydrophobicContact CG1-CD1 3.82Å; V156-L160 HydrophobicContact CG1-CG 4.31Å; V156-L160 WeakPolarHBondContact O-CB 3.15Å; V156-L160 VanDerWaalsContact O-CG 3.28Å; V156-L160 WeakPolarHBondContact O-CG 3.39Å; V156-L160 PolarHBondContact O-N 3.25Å; V156-L237 HydrophobicContact CG2-CD2 3.82Å
157	E	45.6	Very low	45.6	Very low	37 Å²	37	68.2 Å²	68.2	17%	0.173	32%	0.32	C	S	.	.	H	α-helix	trans	-58.9	-46.7	175.9	-162.9	-170.6	147.8	0	0	110.8	R98 L153 D155 H159 L160 R161 I173	R98-E157 IonicContact NH1-OE2 2.75Å; R98-E157 PolarHBondContact NH1-OE2 2.83Å; L153-E157 WeakPolarHBondContact O-CB 3.32Å; L153-E157 PolarHBondContact O-N 2.96Å; D155-E157 VanDerWaalsContact C-N 3.35Å; E157-H159 PolarHBondContact O-N 2.83Å; E157-L160 PolarHBondContact O-N 3.47Å; E157-R161 WeakPolarHBondContact O-CB 3.36Å; E157-R161 WeakPolarHBondContact O-CG 3.32Å; E157-R161 PolarHBondContact O-N 3.37Å; E157-R161 IonicContact OE1-CZ 3.23Å; E157-R161 IonicContact OE1-NE 2.7Å; E157-R161 PolarHBondContact OE1-NE 3.1Å; E157-R161 IonicContact OE1-NH2 2.95Å; E157-R161 PolarHBondContact OE1-NH2 3.16Å; E157-I173 HydrophobicContact CG-CD1 4.36Å; E157-I173 HydrophobicContact CG-CG2 3.44Å; E157-I173 VanDerWaalsContact CG-CG2 3.44Å
158	R	49.7	Very low	45.1	Very low	103 Å²	103	67.2 Å²	67.2	39%	0.389	33%	0.331	S	S	.	.	H	α-helix	trans	-60.9	-43.2	174.6	-75.8	164.3	179	176	-1.5	112	L154 D155 V156 R161 R162	L154-R158 WeakPolarHBondContact O-CB 3.39Å; L154-R158 WeakPolarHBondContact O-CD 3.42Å; L154-R158 WeakPolarHBondContact O-CG 3.33Å; L154-R158 PolarHBondContact O-N 3.41Å; D155-R158 PolarHBondContact O-N 3.06Å; D155-R158 IonicContact OD1-CZ 3.42Å; D155-R158 IonicContact OD1-NH1 3.12Å; D155-R158 PolarHBondContact OD1-NH1 3.01Å; V156-R158 PolarHBondContact O-N 3.5Å; R158-R161 PolarHBondContact O-N 2.83Å; R158-R162 WeakPolarHBondContact O-CG 3.07Å; R158-R162 PolarHBondContact O-N 3.42Å
159	H	47.6	Very low	44.7	Very low	66 Å²	66	71 Å²	71	31%	0.306	35%	0.351	S	S	.	.	H	α-helix	trans	-64.8	-45.1	178.8	-170.2	85.4	0	0	0	110.9	D155 V156 E157 R161 R162 Q163	D155-H159 WeakPolarHBondContact O-CB 3.26Å; D155-H159 PolarHBondContact O-N 3.27Å; V156-H159 PolarHBondContact O-N 3.49Å; E157-H159 PolarHBondContact O-N 2.83Å; H159-R161 PolarHBondContact O-N 3.3Å; H159-R162 PolarHBondContact O-N 3.28Å; H159-Q163 PolarHBondContact NE2-NE2 3.15Å; H159-Q163 WeakPolarHBondContact O-CG 3.19Å; H159-Q163 PolarHBondContact O-N 3.27Å
160	L	44.5	Very low	44.4	Very low	30 Å²	30	74.9 Å²	74.9	16%	0.157	37%	0.37	C	S	.	.	H	α-helix	trans	-62.3	-43.2	176.9	-71.2	169.9	0	0	0	111.7	L89 V156 E157 Q163 C164 I173	L89-L160 HydrophobicContact CD1-CD1 3.7Å; L89-L160 HydrophobicContact CD1-CD2 3.92Å; L89-L160 HydrophobicContact CD1-CG 4.47Å; V156-L160 HydrophobicContact CG1-CD1 3.82Å; V156-L160 HydrophobicContact CG1-CG 4.31Å; V156-L160 WeakPolarHBondContact O-CB 3.15Å; V156-L160 VanDerWaalsContact O-CG 3.28Å; V156-L160 WeakPolarHBondContact O-CG 3.39Å; V156-L160 PolarHBondContact O-N 3.25Å; E157-L160 PolarHBondContact O-N 3.47Å; L160-Q163 PolarHBondContact O-N 2.81Å; L160-C164 WeakPolarHBondContact O-CB 3.21Å; L160-C164 PolarHBondContact O-N 2.86Å; L160-C164 PolarHBondContact O-SG 2.88Å; L160-I173 HydrophobicContact CB-CD1 4.28Å; L160-I173 HydrophobicContact CD1-CD1 3.5Å
161	R	50	Low	44	Very low	74 Å²	74	71.9 Å²	71.9	28%	0.279	36%	0.36	S	S	.	.	H	α-helix	trans	-59.2	-46.9	174.4	-73.8	173.6	-175.9	-119.4	2.1	111.8	E157 R158 H159 Q163 C164 E165 I173 D177	E157-R161 WeakPolarHBondContact O-CB 3.36Å; E157-R161 WeakPolarHBondContact O-CG 3.32Å; E157-R161 PolarHBondContact O-N 3.37Å; E157-R161 IonicContact OE1-CZ 3.23Å; E157-R161 IonicContact OE1-NE 2.7Å; E157-R161 PolarHBondContact OE1-NE 3.1Å; E157-R161 IonicContact OE1-NH2 2.95Å; E157-R161 PolarHBondContact OE1-NH2 3.16Å; R158-R161 PolarHBondContact O-N 2.83Å; H159-R161 PolarHBondContact O-N 3.3Å; R161-Q163 VanDerWaalsContact C-N 3.33Å; R161-Q163 PolarHBondContact O-N 2.89Å; R161-C164 WeakPolarHBondContact O-CB 3.26Å; R161-C164 PolarHBondContact O-N 2.89Å; R161-C164 VanDerWaalsContact O-N 3.16Å; R161-E165 WeakPolarHBondContact O-CG 3.43Å; R161-E165 PolarHBondContact O-N 3.43Å; R161-I173 HydrophobicContact CG-CG2 4.46Å; R161-D177 IonicContact CZ-OD2 3.52Å; R161-D177 VanDerWaalsContact CZ-OD2 3.23Å; R161-D177 IonicContact NH1-OD2 2.85Å; R161-D177 PolarHBondContact NH1-OD2 3.26Å; R161-D177 IonicContact NH2-OD2 3.78Å; R161-D177 PolarHBondContact NH2-OD2 2.73Å
162	R	51.7	Low	43.4	Very low	154 Å²	154	73.2 Å²	73.2	58%	0.581	37%	0.373	S	S	*	.	H	α-helix	trans	-59.7	-41.9	174.8	-72.6	177.9	-174.8	178.7	2.6	112.4	R158 H159 E165 L166	R158-R162 WeakPolarHBondContact O-CG 3.07Å; R158-R162 PolarHBondContact O-N 3.42Å; H159-R162 PolarHBondContact O-N 3.28Å; R162-E165 PolarHBondContact O-N 2.81Å; R162-L166 WeakPolarHBondContact O-CB 3.31Å; R162-L166 WeakPolarHBondContact O-CG 3.36Å; R162-L166 PolarHBondContact O-N 2.8Å
163	Q	43.4	Very low	43.1	Very low	83 Å²	83	73.7 Å²	73.7	39%	0.388	38%	0.375	S	S	.	.	H	α-helix	trans	-65.7	-39	176.2	-69.3	-66.2	-19.5	0	0	111.6	H159 L160 R161 L166 T167	H159-Q163 PolarHBondContact NE2-NE2 3.15Å; H159-Q163 WeakPolarHBondContact O-CG 3.19Å; H159-Q163 PolarHBondContact O-N 3.27Å; L160-Q163 PolarHBondContact O-N 2.81Å; R161-Q163 VanDerWaalsContact C-N 3.33Å; R161-Q163 PolarHBondContact O-N 2.89Å; Q163-L166 PolarHBondContact O-N 2.84Å; Q163-T167 VanDerWaalsContact O-CB 3.31Å; Q163-T167 WeakPolarHBondContact O-CB 3.5Å; Q163-T167 VanDerWaalsContact O-CG2 3.28Å; Q163-T167 WeakPolarHBondContact O-CG2 3.04Å; Q163-T167 PolarHBondContact O-N 2.72Å; Q163-T167 PolarHBondContact O-OG1 3.39Å
164	C	44	Very low	42.5	Very low	17 Å²	17	73.5 Å²	73.5	12%	0.115	38%	0.376	C	S	.	.	H	α-helix	trans	-63.2	-44.2	175.1	-67	0	0	0	0	111.5	L160 R161 T167 G168 I169 C171 C174	L160-C164 WeakPolarHBondContact O-CB 3.21Å; L160-C164 PolarHBondContact O-N 2.86Å; L160-C164 PolarHBondContact O-SG 2.88Å; R161-C164 WeakPolarHBondContact O-CB 3.26Å; R161-C164 PolarHBondContact O-N 2.89Å; R161-C164 VanDerWaalsContact O-N 3.16Å; C164-T167 PolarHBondContact O-N 3.46Å; C164-G168 WeakPolarHBondContact O-CA 3.41Å; C164-G168 PolarHBondContact O-N 3.25Å; C164-I169 VanDerWaalsContact CA-O 3.27Å; C164-I169 WeakPolarHBondContact CA-O 3.48Å; C164-I169 WeakPolarHBondContact CB-O 3.27Å; C164-I169 PolarHBondContact O-N 2.79Å; C164-I169 PolarHBondContact SG-O 2.66Å; C164-C171 PolarHBondContact SG-SG 3.14Å; C164-C174 VanDerWaalsContact SG-SG 3.68Å
165	E	49	Very low	41.7	Very low	159 Å²	159	76.9 Å²	76.9	74%	0.743	39%	0.385	S	S	*	.	H	α-helix	trans	-60.4	-43.8	174.6	-72.7	170.5	-175.1	0	0	111.9	R161 R162	R161-E165 WeakPolarHBondContact O-CG 3.43Å; R161-E165 PolarHBondContact O-N 3.43Å; R162-E165 PolarHBondContact O-N 2.81Å
166	L	42.5	Very low	41.3	Very low	140 Å²	140	77.3 Å²	77.3	73%	0.733	39%	0.391	S	S	*	.	H	α-helix	trans	-72	-33	-179.6	-71.3	169.2	0	0	0	113.4	R162 Q163	R162-L166 WeakPolarHBondContact O-CB 3.31Å; R162-L166 WeakPolarHBondContact O-CG 3.36Å; R162-L166 PolarHBondContact O-N 2.8Å; Q163-L166 PolarHBondContact O-N 2.84Å
167	T	38.6	Very low	41	Very low	78 Å²	78	80.2 Å²	80.2	48%	0.479	41%	0.406	S	S	.	.	H	α-helix	trans	-96.7	-15.2	-175.9	59	0	0	0	0	113.6	Q163 C164 I169	Q163-T167 VanDerWaalsContact O-CB 3.31Å; Q163-T167 WeakPolarHBondContact O-CB 3.5Å; Q163-T167 VanDerWaalsContact O-CG2 3.28Å; Q163-T167 WeakPolarHBondContact O-CG2 3.04Å; Q163-T167 PolarHBondContact O-N 2.72Å; Q163-T167 PolarHBondContact O-OG1 3.39Å; C164-T167 PolarHBondContact O-N 3.46Å; T167-I169 PolarHBondContact O-N 3.4Å; T167-I169 PolarHBondContact OG1-N 2.82Å
168	G	33.8	Very low	40.5	Very low	67 Å²	67	85.8 Å²	85.8	69%	0.691	43%	0.432	S	S	*	.			trans	69.8	7.3	-170.6	0	0	0	0	0	113.9	C164	C164-G168 WeakPolarHBondContact O-CA 3.41Å; C164-G168 PolarHBondContact O-N 3.25Å
169	I	35.5	Very low	39.9	Very low	113 Å²	113	88.5 Å²	88.5	58%	0.579	45%	0.449	S	S	*	.			trans	-89.7	113.6	179.6	-59.6	173.1	0	0	0	107.8	C164 T167 C171	C164-I169 VanDerWaalsContact CA-O 3.27Å; C164-I169 WeakPolarHBondContact CA-O 3.48Å; C164-I169 WeakPolarHBondContact CB-O 3.27Å; C164-I169 PolarHBondContact O-N 2.79Å; C164-I169 PolarHBondContact SG-O 2.66Å; T167-I169 PolarHBondContact O-N 3.4Å; T167-I169 PolarHBondContact OG1-N 2.82Å; I169-C171 PolarHBondContact O-N 2.78Å
170	Q	36.5	Very low	39.1	Very low	103 Å²	103	89.3 Å²	89.3	48%	0.481	45%	0.453	S	S	.	.			trans	-75.4	119.1	172.5	-70.9	-177.8	-22.7	0	0	110.1	R175	Q170-R175 HydrophobicContact CB-CG 4.24Å
171	C	36.6	Very low	38.6	Very low	33 Å²	33	92.4 Å²	92.4	22%	0.223	48%	0.475	C	S	.	.			trans	-86.9	165.6	167.2	71.8	0	0	0	0	111.3	C164 I169 I173 C174 R175	C164-C171 PolarHBondContact SG-SG 3.14Å; I169-C171 PolarHBondContact O-N 2.78Å; C171-I173 PolarHBondContact O-N 2.76Å; C171-I173 VanDerWaalsContact O-N 3.12Å; C171-I173 VanDerWaalsContact SG-CB 3.59Å; C171-C174 CarbonylContact O-C 3.55Å; C171-C174 WeakPolarHBondContact O-CA 3.48Å; C171-C174 WeakPolarHBondContact O-CB 3.49Å; C171-C174 PolarHBondContact O-N 3.41Å; C171-C174 PolarHBondContact SG-SG 2.93Å; C171-R175 PolarHBondContact O-N 3.35Å
172	N	34	Very low	37.9	Very low	128 Å²	128	95.1 Å²	95.1	68%	0.684	50%	0.502	S	S	*	.	H	α-helix	trans	-58.5	-26.2	178.7	-73.4	-11.2	0	0	0	113.5	C174 R175 S176	N172-C174 VanDerWaalsContact C-N 3.35Å; N172-R175 PolarHBondContact O-N 3.28Å; N172-S176 PolarHBondContact O-N 3.21Å; N172-S176 VanDerWaalsContact O-N 3.14Å; N172-S176 PolarHBondContact O-OG 3.27Å
173	I	37.2	Very low	37.3	Very low	18 Å²	18	95.5 Å²	95.5	9%	0.092	52%	0.516	C	S	.	.	H	α-helix	trans	-67.6	-36.1	172.3	-54.7	172.7	0	0	0	111.2	V91 E157 L160 R161 C171 S176	V91-I173 HydrophobicContact CG1-CG1 4.38Å; V91-I173 HydrophobicContact CG2-CD1 4Å; V91-I173 HydrophobicContact CG2-CG1 4.18Å; E157-I173 HydrophobicContact CG-CD1 4.36Å; E157-I173 HydrophobicContact CG-CG2 3.44Å; E157-I173 VanDerWaalsContact CG-CG2 3.44Å; L160-I173 HydrophobicContact CB-CD1 4.28Å; L160-I173 HydrophobicContact CD1-CD1 3.5Å; R161-I173 HydrophobicContact CG-CG2 4.46Å; C171-I173 PolarHBondContact O-N 2.76Å; C171-I173 VanDerWaalsContact O-N 3.12Å; C171-I173 VanDerWaalsContact SG-CB 3.59Å; I173-S176 PolarHBondContact O-OG 2.99Å; I173-S176 VanDerWaalsContact O-OG 3.11Å
174	C	32.7	Very low	37.1	Very low	28 Å²	28	98.2 Å²	98.2	19%	0.189	52%	0.522	C	S	.	.	H	α-helix	trans	-81	-26.7	177.7	-60.8	0	0	0	0	111.9	C164 C171 N172	C164-C174 VanDerWaalsContact SG-SG 3.68Å; C171-C174 CarbonylContact O-C 3.55Å; C171-C174 WeakPolarHBondContact O-CA 3.48Å; C171-C174 WeakPolarHBondContact O-CB 3.49Å; C171-C174 PolarHBondContact O-N 3.41Å; C171-C174 PolarHBondContact SG-SG 2.93Å; N172-C174 VanDerWaalsContact C-N 3.35Å
175	R	31.5	Very low	36.9	Very low	123 Å²	123	100.3 Å²	100.3	46%	0.464	54%	0.537	S	S	.	.	H	α-helix	trans	-74	-33.9	175.9	-73.3	-176.3	168.5	177.6	-5.4	113.2	Q170 C171 N172 D177 E178 E179	Q170-R175 HydrophobicContact CB-CG 4.24Å; C171-R175 PolarHBondContact O-N 3.35Å; N172-R175 PolarHBondContact O-N 3.28Å; R175-D177 PolarHBondContact O-N 3.05Å; R175-E178 PolarHBondContact O-N 3.38Å; R175-E178 VanDerWaalsContact O-N 3.11Å; R175-E179 PolarHBondContact O-N 2.97Å
176	S	38.7	Very low	36.3	Very low	45 Å²	45	101.4 Å²	101.4	32%	0.315	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-18.3	-178.5	57	0	0	0	0	114.4	N172 I173	N172-S176 PolarHBondContact O-N 3.21Å; N172-S176 VanDerWaalsContact O-N 3.14Å; N172-S176 PolarHBondContact O-OG 3.27Å; I173-S176 PolarHBondContact O-OG 2.99Å; I173-S176 VanDerWaalsContact O-OG 3.11Å
177	D	38	Very low	35.8	Very low	86 Å²	86	100.1 Å²	100.1	46%	0.46	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-21.1	172.7	-85	-21.5	0	0	0	113.2	R161 R175	R161-D177 IonicContact CZ-OD2 3.52Å; R161-D177 VanDerWaalsContact CZ-OD2 3.23Å; R161-D177 IonicContact NH1-OD2 2.85Å; R161-D177 PolarHBondContact NH1-OD2 3.26Å; R161-D177 IonicContact NH2-OD2 3.78Å; R161-D177 PolarHBondContact NH2-OD2 2.73Å; R175-D177 PolarHBondContact O-N 3.05Å
178	E	36.1	Very low	35.8	Very low	153 Å²	153	100.4 Å²	100.4	72%	0.715	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-16.7	-178.6	-66.8	-155.7	151.9	0	0	114.3	R175	R175-E178 PolarHBondContact O-N 3.38Å; R175-E178 VanDerWaalsContact O-N 3.11Å
179	E	35.2	Very low	35.9	Very low	160 Å²	160	101.6 Å²	101.6	75%	0.748	52%	0.519	S	S	*	.	S	Bend	trans	-101.7	5.7	-177.2	-73.5	-175	161	0	0	115.2	R175	R175-E179 PolarHBondContact O-N 2.97Å
180	E	32.7	Very low	35.6	Very low	83 Å²	83	101.8 Å²	101.8	39%	0.388	52%	0.517	S	S	.	.	S	Bend	trans	-72.4	127.1	175.4	-96.2	-169.6	168.9	0	0	111.7	R184 R192	E180-R184 IonicContact OE1-CZ 3.36Å; E180-R184 IonicContact OE1-NH1 3.6Å; E180-R184 PolarHBondContact OE1-NH1 3.37Å; E180-R184 IonicContact OE2-NH1 3.59Å; E180-R192 IonicContact OE1-CZ 3.17Å; E180-R192 IonicContact OE1-NH1 3.39Å; E180-R192 PolarHBondContact OE1-NH1 3.08Å; E180-R192 IonicContact OE1-NH2 2.69Å; E180-R192 PolarHBondContact OE1-NH2 2.99Å; E180-R192 VanDerWaalsContact OE1-NH2 3.12Å; E180-R192 IonicContact OE2-CZ 2.79Å; E180-R192 IonicContact OE2-NH1 3.86Å; E180-R192 PolarHBondContact OE2-NH1 2.99Å; E180-R192 IonicContact OE2-NH2 3.49Å; E180-R192 PolarHBondContact OE2-NH2 3.26Å
181	P	32.5	Very low	35.3	Very low	96 Å²	96	105.6 Å²	105.6	62%	0.623	53%	0.527	S	S	*	.			trans	-64.2	144	-178.4	23	-31.8	0	0	0	112.1	N183	P181-N183 PolarHBondContact O-N 3.43Å
182	P	35.5	Very low	35	Very low	130 Å²	130	108.3 Å²	108.3	84%	0.844	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	10.4	-167.2	26.8	-35.6	0	0	0	116.3
183	N	39.6	Very low	34.7	Very low	163 Å²	163	109.4 Å²	109.4	87%	0.872	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	10.6	-171.6	-94.1	-4	0	0	0	115.2	P181	P181-N183 PolarHBondContact O-N 3.43Å
184	R	38.7	Very low	34.2	Very low	139 Å²	139	113.4 Å²	113.4	53%	0.525	55%	0.548	S	S	.	.	S	Bend	trans	-82.1	129.1	170.1	-75.9	-171	171.7	168.8	4.9	110.5	E180 R192	E180-R184 IonicContact OE1-CZ 3.36Å; E180-R184 IonicContact OE1-NH1 3.6Å; E180-R184 PolarHBondContact OE1-NH1 3.37Å; E180-R184 IonicContact OE2-NH1 3.59Å; R184-R192 VanDerWaalsContact NH1-NH2 3.15Å
185	S	41	Very low	33.8	Very low	62 Å²	62	121.2 Å²	121.2	43%	0.434	58%	0.575	S	S	.	*			trans	-42.8	139.2	-171.4	73.2	0	0	0	0	112.9	L187 D188 E189	S185-L187 PolarHBondContact O-N 2.79Å; S185-D188 PolarHBondContact O-N 2.85Å; S185-D188 PolarHBondContact OG-N 3.37Å; S185-E189 PolarHBondContact O-N 3Å; S185-E189 VanDerWaalsContact O-N 3.15Å
186	K	35.4	Very low	33.5	Very low	181 Å²	181	119.5 Å²	119.5	79%	0.787	58%	0.58	S	S	*	*	H	α-helix	trans	-51.5	-21.3	174.1	-72.6	178.6	177.8	173.6	0	113.2	Q190	K186-Q190 VanDerWaalsContact O-CB 3.26Å; K186-Q190 WeakPolarHBondContact O-CB 3.32Å; K186-Q190 PolarHBondContact O-N 2.85Å
187	L	32.9	Very low	32.8	Very low	114 Å²	114	125.8 Å²	125.8	60%	0.597	60%	0.597	S	S	*	*	H	α-helix	trans	-74.1	-39.9	174.3	-96.4	152.9	0	0	0	113.3	S185 R191	S185-L187 PolarHBondContact O-N 2.79Å; L187-R191 VanDerWaalsContact O-CB 3.31Å; L187-R191 WeakPolarHBondContact O-CB 3.38Å; L187-R191 VanDerWaalsContact O-CG 3.32Å; L187-R191 WeakPolarHBondContact O-CG 3.27Å; L187-R191 PolarHBondContact O-N 2.92Å
188	D	39	Very low	32	Very low	83 Å²	83	126.5 Å²	126.5	44%	0.444	61%	0.605	S	S	.	*	H	α-helix	trans	-71.8	-34.5	173.2	-87.1	-25.7	0	0	0	111.6	S185 R191 R192	S185-D188 PolarHBondContact O-N 2.85Å; S185-D188 PolarHBondContact OG-N 3.37Å; D188-R191 PolarHBondContact O-N 3.38Å; D188-R192 WeakPolarHBondContact O-CB 3.31Å; D188-R192 WeakPolarHBondContact O-CG 3.09Å; D188-R192 PolarHBondContact O-N 3.03Å
189	E	34.5	Very low	31.6	Very low	92 Å²	92	122.3 Å²	122.3	43%	0.43	59%	0.589	S	S	.	*	H	α-helix	trans	-72.4	-36.8	174.3	-151.8	-179.4	167.4	0	0	111.8	S185 R193	S185-E189 PolarHBondContact O-N 3Å; S185-E189 VanDerWaalsContact O-N 3.15Å; E189-R193 WeakPolarHBondContact O-CB 3.21Å; E189-R193 WeakPolarHBondContact O-CG 3.48Å; E189-R193 PolarHBondContact O-N 3.06Å; E189-R193 IonicContact OE1-CZ 3.06Å; E189-R193 IonicContact OE1-NE 3.1Å; E189-R193 IonicContact OE1-NH2 3.04Å; E189-R193 PolarHBondContact OE1-NH2 3.04Å
190	Q	29.6	Very low	31	Very low	118 Å²	118	124.6 Å²	124.6	55%	0.551	59%	0.592	S	S	*	*	H	α-helix	trans	-66.5	-41.3	168.3	-94.4	-177	-22.3	0	0	112	K186 R193 I194	K186-Q190 VanDerWaalsContact O-CB 3.26Å; K186-Q190 WeakPolarHBondContact O-CB 3.32Å; K186-Q190 PolarHBondContact O-N 2.85Å; Q190-R193 PolarHBondContact O-N 2.72Å; Q190-I194 HydrophobicContact CB-CD1 4.41Å; Q190-I194 WeakPolarHBondContact O-CB 3.39Å; Q190-I194 WeakPolarHBondContact O-CD1 3.27Å; Q190-I194 WeakPolarHBondContact O-CG1 3.31Å; Q190-I194 PolarHBondContact O-N 3.1Å
191	R	30.3	Very low	30.5	Very low	182 Å²	182	125 Å²	125	69%	0.687	60%	0.6	S	S	*	*	H	α-helix	trans	-66	-41.1	177.3	-81.7	179.9	172.6	-145	-2.1	111.7	L187 D188 Y195	L187-R191 VanDerWaalsContact O-CB 3.31Å; L187-R191 WeakPolarHBondContact O-CB 3.38Å; L187-R191 VanDerWaalsContact O-CG 3.32Å; L187-R191 WeakPolarHBondContact O-CG 3.27Å; L187-R191 PolarHBondContact O-N 2.92Å; D188-R191 PolarHBondContact O-N 3.38Å; R191-Y195 VanDerWaalsContact O-CB 3.26Å; R191-Y195 WeakPolarHBondContact O-CB 3.46Å; R191-Y195 PolarHBondContact O-N 2.85Å
192	R	29.4	Very low	30.2	Very low	90 Å²	90	123.4 Å²	123.4	34%	0.34	60%	0.601	S	S	.	*	H	α-helix	trans	-67.3	-43.4	171.8	-75.7	-174.2	-176.2	-173.5	9	112	E180 R184 D188 I194 Y195 C196	E180-R192 IonicContact OE1-CZ 3.17Å; E180-R192 IonicContact OE1-NH1 3.39Å; E180-R192 PolarHBondContact OE1-NH1 3.08Å; E180-R192 IonicContact OE1-NH2 2.69Å; E180-R192 PolarHBondContact OE1-NH2 2.99Å; E180-R192 VanDerWaalsContact OE1-NH2 3.12Å; E180-R192 IonicContact OE2-CZ 2.79Å; E180-R192 IonicContact OE2-NH1 3.86Å; E180-R192 PolarHBondContact OE2-NH1 2.99Å; E180-R192 IonicContact OE2-NH2 3.49Å; E180-R192 PolarHBondContact OE2-NH2 3.26Å; R184-R192 VanDerWaalsContact NH1-NH2 3.15Å; D188-R192 WeakPolarHBondContact O-CB 3.31Å; D188-R192 WeakPolarHBondContact O-CG 3.09Å; D188-R192 PolarHBondContact O-N 3.03Å; R192-I194 VanDerWaalsContact C-N 3.33Å; R192-I194 PolarHBondContact O-N 3.03Å; R192-Y195 PolarHBondContact O-N 3.24Å; R192-C196 WeakPolarHBondContact O-CB 3.35Å; R192-C196 PolarHBondContact O-N 3.26Å; R192-C196 PolarHBondContact O-SG 3.05Å; R192-C196 VanDerWaalsContact O-SG 3.41Å
193	R	27.6	Very low	29.7	Very low	151 Å²	151	125 Å²	125	57%	0.57	60%	0.602	S	S	*	*	H	α-helix	trans	-66	-33.7	175.8	-77.4	178.7	-165.4	-170.2	5.8	112.4	E189 Q190 R197	E189-R193 WeakPolarHBondContact O-CB 3.21Å; E189-R193 WeakPolarHBondContact O-CG 3.48Å; E189-R193 PolarHBondContact O-N 3.06Å; E189-R193 IonicContact OE1-CZ 3.06Å; E189-R193 IonicContact OE1-NE 3.1Å; E189-R193 IonicContact OE1-NH2 3.04Å; E189-R193 PolarHBondContact OE1-NH2 3.04Å; Q190-R193 PolarHBondContact O-N 2.72Å; R193-R197 WeakPolarHBondContact O-CA 3.36Å; R193-R197 WeakPolarHBondContact O-CB 3.39Å; R193-R197 WeakPolarHBondContact O-CG 3.21Å; R193-R197 PolarHBondContact O-N 3.18Å
194	I	26.9	Very low	29	Very low	103 Å²	103	125.9 Å²	125.9	53%	0.528	59%	0.593	S	S	.	*	H	α-helix	trans	-72.3	-51.2	174	-69.4	163.2	0	0	0	108.1	Q190 R192 C196 R197 T198	Q190-I194 HydrophobicContact CB-CD1 4.41Å; Q190-I194 WeakPolarHBondContact O-CB 3.39Å; Q190-I194 WeakPolarHBondContact O-CD1 3.27Å; Q190-I194 WeakPolarHBondContact O-CG1 3.31Å; Q190-I194 PolarHBondContact O-N 3.1Å; R192-I194 VanDerWaalsContact C-N 3.33Å; R192-I194 PolarHBondContact O-N 3.03Å; I194-C196 VanDerWaalsContact C-N 3.29Å; I194-C196 PolarHBondContact O-N 2.87Å; I194-R197 PolarHBondContact O-N 3.46Å; I194-R197 VanDerWaalsContact O-N 3.14Å; I194-T198 WeakPolarHBondContact O-CB 3.47Å; I194-T198 PolarHBondContact O-N 2.94Å; I194-T198 PolarHBondContact O-OG1 3.3Å
195	Y	25.3	Very low	28.4	Very low	192 Å²	192	121.5 Å²	121.5	75%	0.753	58%	0.582	S	S	*	*	H	α-helix	trans	-61.4	-35.6	179.2	-146.1	-95.2	0	0	0	113	R191 R192 V199	R191-Y195 VanDerWaalsContact O-CB 3.26Å; R191-Y195 WeakPolarHBondContact O-CB 3.46Å; R191-Y195 PolarHBondContact O-N 2.85Å; R192-Y195 PolarHBondContact O-N 3.24Å; Y195-V199 VanDerWaalsContact O-CG2 3.27Å; Y195-V199 WeakPolarHBondContact O-CG2 3.34Å
196	C	25.1	Very low	27.8	Very low	86 Å²	86	124.5 Å²	124.5	58%	0.581	60%	0.597	S	S	*	*	H	α-helix	trans	-75	-44.9	171.3	-70.6	0	0	0	0	112	R192 I194 V199 W200	R192-C196 WeakPolarHBondContact O-CB 3.35Å; R192-C196 PolarHBondContact O-N 3.26Å; R192-C196 PolarHBondContact O-SG 3.05Å; R192-C196 VanDerWaalsContact O-SG 3.41Å; I194-C196 VanDerWaalsContact C-N 3.29Å; I194-C196 PolarHBondContact O-N 2.87Å; C196-V199 CarbonylContact O-C 3.54Å; C196-V199 WeakPolarHBondContact O-CB 3.44Å; C196-V199 PolarHBondContact O-N 3.39Å; C196-W200 VanDerWaalsContact O-CB 3.27Å; C196-W200 WeakPolarHBondContact O-CB 3.19Å; C196-W200 PolarHBondContact O-N 2.75Å
197	R	22.6	Very low	27.3	Very low	178 Å²	178	121.8 Å²	121.8	67%	0.672	59%	0.587	S	S	*	*	H	α-helix	trans	-67	-34.7	178.5	-95.3	-177.1	156.5	167.2	-5.8	114.3	R193 I194 V199 W200 T201	R193-R197 WeakPolarHBondContact O-CA 3.36Å; R193-R197 WeakPolarHBondContact O-CB 3.39Å; R193-R197 WeakPolarHBondContact O-CG 3.21Å; R193-R197 PolarHBondContact O-N 3.18Å; I194-R197 PolarHBondContact O-N 3.46Å; I194-R197 VanDerWaalsContact O-N 3.14Å; R197-V199 PolarHBondContact O-N 2.68Å; R197-W200 WeakPolarHBondContact O-CA 3.31Å; R197-W200 WeakPolarHBondContact O-CB 3.43Å; R197-W200 PolarHBondContact O-N 3.29Å; R197-T201 PolarHBondContact O-N 2.81Å
198	T	23	Very low	27.1	Very low	100 Å²	100	119.4 Å²	119.4	61%	0.613	58%	0.58	S	S	*	*	H	α-helix	trans	-68	-23.5	176.8	-36.6	0	0	0	0	110.8	I194	I194-T198 WeakPolarHBondContact O-CB 3.47Å; I194-T198 PolarHBondContact O-N 2.94Å; I194-T198 PolarHBondContact O-OG1 3.3Å
199	V	26	Very low	26.6	Very low	65 Å²	65	119 Å²	119	39%	0.394	58%	0.578	S	S	.	*	H	α-helix	trans	-86.6	-14.3	169.2	178.1	0	0	0	0	112.1	Y195 C196 R197 T205	Y195-V199 VanDerWaalsContact O-CG2 3.27Å; Y195-V199 WeakPolarHBondContact O-CG2 3.34Å; C196-V199 CarbonylContact O-C 3.54Å; C196-V199 WeakPolarHBondContact O-CB 3.44Å; C196-V199 PolarHBondContact O-N 3.39Å; R197-V199 PolarHBondContact O-N 2.68Å; V199-T205 VanDerWaalsContact O-CG2 3.31Å; V199-T205 WeakPolarHBondContact O-CG2 3.46Å
200	W	24	Very low	26.2	Very low	209 Å²	209	116.8 Å²	116.8	79%	0.792	57%	0.572	S	S	*	*	H	α-helix	trans	-99.7	-11.4	-168.8	-142.4	59.3	0	0	0	115.3	C196 R197 G202	C196-W200 VanDerWaalsContact O-CB 3.27Å; C196-W200 WeakPolarHBondContact O-CB 3.19Å; C196-W200 PolarHBondContact O-N 2.75Å; R197-W200 WeakPolarHBondContact O-CA 3.31Å; R197-W200 WeakPolarHBondContact O-CB 3.43Å; R197-W200 PolarHBondContact O-N 3.29Å; W200-G202 VanDerWaalsContact C-N 3.33Å; W200-G202 PolarHBondContact O-N 2.9Å
201	T	22.8	Very low	26.1	Very low	92 Å²	92	114.4 Å²	114.4	56%	0.564	57%	0.566	S	S	*	*	S	Bend	trans	-77.9	90.5	169.4	54	0	0	0	0	108.7	R197 N203 R204	R197-T201 PolarHBondContact O-N 2.81Å; T201-N203 PolarHBondContact O-N 3.35Å; T201-R204 PolarHBondContact O-N 3.21Å
202	G	24.6	Very low	26	Very low	62 Å²	62	109.5 Å²	109.5	64%	0.639	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	26.4	-171.9	0	0	0	0	0	118.4	W200	W200-G202 VanDerWaalsContact C-N 3.33Å; W200-G202 PolarHBondContact O-N 2.9Å
203	N	24.8	Very low	26.1	Very low	162 Å²	162	111.2 Å²	111.2	87%	0.866	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.3	0.2	171.7	-76.3	-14.1	0	0	0	113.9	T201	T201-N203 PolarHBondContact O-N 3.35Å
204	R	25.1	Very low	26.3	Very low	182 Å²	182	111.7 Å²	111.7	69%	0.687	57%	0.569	S	S	*	*	S	Bend	trans	-119.6	-3.9	-180	-82.6	-172.4	-179.8	-173.9	0.2	116.2	T201 V206 E207 S208	T201-R204 PolarHBondContact O-N 3.21Å; R204-V206 VanDerWaalsContact C-N 3.35Å; R204-V206 PolarHBondContact O-N 3.06Å; R204-E207 PolarHBondContact O-N 3.49Å; R204-S208 PolarHBondContact O-N 2.86Å
205	T	27.3	Very low	26.3	Very low	48 Å²	48	113.7 Å²	113.7	29%	0.294	58%	0.578	S	S	.	*	H	α-helix	trans	-77	-16.1	-173.8	42.4	0	0	0	0	114.8	V199 S208 L209	V199-T205 VanDerWaalsContact O-CG2 3.31Å; V199-T205 WeakPolarHBondContact O-CG2 3.46Å; T205-S208 PolarHBondContact O-OG 2.89Å; T205-L209 WeakPolarHBondContact O-CD1 3.36Å
206	V	26.8	Very low	26.7	Very low	124 Å²	124	111.3 Å²	111.3	75%	0.752	58%	0.578	S	S	*	*	H	α-helix	trans	-79	-33.4	171.6	-174.2	0	0	0	0	110.7	R204 S210	R204-V206 VanDerWaalsContact C-N 3.35Å; R204-V206 PolarHBondContact O-N 3.06Å; V206-S210 PolarHBondContact O-N 2.77Å
207	E	25.7	Very low	27.1	Very low	124 Å²	124	108.6 Å²	108.6	58%	0.579	56%	0.56	S	S	*	*	H	α-helix	trans	-71.9	-41.7	176	-73.4	-178.5	153.4	0	0	111.5	R204 L209 S210 T211	R204-E207 PolarHBondContact O-N 3.49Å; E207-L209 VanDerWaalsContact C-N 3.35Å; E207-L209 PolarHBondContact O-N 3.22Å; E207-S210 CarbonylContact O-C 3.59Å; E207-S210 PolarHBondContact O-N 3.19Å; E207-S210 VanDerWaalsContact O-N 3.15Å; E207-S210 PolarHBondContact O-OG 2.92Å; E207-T211 WeakPolarHBondContact O-CB 3.33Å; E207-T211 PolarHBondContact O-N 3.36Å; E207-T211 PolarHBondContact O-OG1 3.2Å
208	S	28.4	Very low	27.9	Very low	64 Å²	64	110.4 Å²	110.4	45%	0.448	57%	0.573	S	S	.	*	H	α-helix	trans	-65.3	-34.4	179.2	62.9	0	0	0	0	113.6	R204 T205 T211 V212	R204-S208 PolarHBondContact O-N 2.86Å; T205-S208 PolarHBondContact O-OG 2.89Å; S208-T211 PolarHBondContact O-N 3.45Å; S208-V212 PolarHBondContact O-N 2.95Å; S208-V212 VanDerWaalsContact O-N 3.17Å
209	L	28.1	Very low	28.7	Very low	75 Å²	75	112.5 Å²	112.5	39%	0.393	58%	0.58	S	S	.	*	H	α-helix	trans	-69.7	-34.2	173.6	-86.6	159.8	0	0	0	112.3	T205 E207 T211 R213	T205-L209 WeakPolarHBondContact O-CD1 3.36Å; E207-L209 VanDerWaalsContact C-N 3.35Å; E207-L209 PolarHBondContact O-N 3.22Å; L209-T211 VanDerWaalsContact C-N 3.32Å; L209-R213 WeakPolarHBondContact O-CG 3.42Å; L209-R213 PolarHBondContact O-N 3.2Å
210	S	27.4	Very low	29.3	Very low	45 Å²	45	112.5 Å²	112.5	32%	0.315	59%	0.594	S	S	.	*	H	α-helix	trans	-73.2	-24.4	170.9	78.4	0	0	0	0	113.1	V206 E207 R213 K214	V206-S210 PolarHBondContact O-N 2.77Å; E207-S210 CarbonylContact O-C 3.59Å; E207-S210 PolarHBondContact O-N 3.19Å; E207-S210 VanDerWaalsContact O-N 3.15Å; E207-S210 PolarHBondContact O-OG 2.92Å; S210-R213 WeakPolarHBondContact O-CB 3.25Å; S210-K214 WeakPolarHBondContact O-CG 3.32Å; S210-K214 PolarHBondContact O-N 3.48Å
211	T	26.6	Very low	30.1	Very low	68 Å²	68	105.8 Å²	105.8	42%	0.417	58%	0.579	S	S	.	*	H	α-helix	trans	-80.3	-36.4	-177.4	-46.9	0	0	0	0	111.4	E207 S208 L209 R213 K214 M215	E207-T211 WeakPolarHBondContact O-CB 3.33Å; E207-T211 PolarHBondContact O-N 3.36Å; E207-T211 PolarHBondContact O-OG1 3.2Å; S208-T211 PolarHBondContact O-N 3.45Å; L209-T211 VanDerWaalsContact C-N 3.32Å; T211-R213 VanDerWaalsContact C-N 3.31Å; T211-K214 PolarHBondContact O-N 3Å; T211-K214 VanDerWaalsContact O-N 3.15Å; T211-M215 PolarHBondContact O-N 2.89Å
212	V	29.4	Very low	31.3	Very low	80 Å²	80	104.6 Å²	104.6	49%	0.485	57%	0.567	S	S	.	*	H	α-helix	trans	-66.3	-35.3	170.2	179.1	0	0	0	0	110.9	S208 K214 M215	S208-V212 PolarHBondContact O-N 2.95Å; S208-V212 VanDerWaalsContact O-N 3.17Å; V212-K214 PolarHBondContact O-N 3.46Å; V212-M215 PolarHBondContact O-N 3.34Å
213	R	31.4	Very low	32.5	Very low	126 Å²	126	103.3 Å²	103.3	48%	0.475	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-20.5	171.9	-76.5	179.6	-176.1	-173.5	-2.4	114.4	L209 S210 T211 E252	L209-R213 WeakPolarHBondContact O-CG 3.42Å; L209-R213 PolarHBondContact O-N 3.2Å; S210-R213 WeakPolarHBondContact O-CB 3.25Å; T211-R213 VanDerWaalsContact C-N 3.31Å; R213-E252 PolarHBondContact NH2-O 3.4Å
214	K	30.3	Very low	33.7	Very low	160 Å²	160	98.7 Å²	98.7	70%	0.696	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-7.8	180	-77.6	176.9	178.1	-177.9	0	113.5	S210 T211 V212	S210-K214 WeakPolarHBondContact O-CG 3.32Å; S210-K214 PolarHBondContact O-N 3.48Å; T211-K214 PolarHBondContact O-N 3Å; T211-K214 VanDerWaalsContact O-N 3.15Å; V212-K214 PolarHBondContact O-N 3.46Å
215	M	27.9	Very low	34.8	Very low	146 Å²	146	91.8 Å²	91.8	72%	0.719	51%	0.505	S	S	*	.	S	Bend	trans	-79.4	-20.9	-175.6	-83.5	-175.1	172.5	0	0	114.2	T211 V212	T211-M215 PolarHBondContact O-N 2.89Å; V212-M215 PolarHBondContact O-N 3.34Å
216	D	33.5	Very low	35.8	Very low	142 Å²	142	91 Å²	91	76%	0.759	50%	0.499	S	S	*	.	S	Bend	trans	-122.8	-5.2	-176	-80.3	-34	0	0	0	116.3
217	S	34	Very low	37.2	Very low	28 Å²	28	88.5 Å²	88.5	20%	0.196	48%	0.476	C	S	.	.			trans	-134.6	119.4	168.4	82	0	0	0	0	112.2	D219 G220 S221	S217-D219 PolarHBondContact O-N 3.34Å; S217-D219 VanDerWaalsContact O-N 3.13Å; S217-G220 PolarHBondContact O-N 2.85Å; S217-G220 WeakPolarHBondContact OG-CA 3.33Å; S217-G220 PolarHBondContact OG-N 3.34Å; S217-S221 WeakPolarHBondContact CB-O 3.46Å; S217-S221 PolarHBondContact OG-N 3.41Å; S217-S221 PolarHBondContact OG-O 3.45Å
218	K	37.8	Very low	38.6	Very low	217 Å²	217	83.8 Å²	83.8	94%	0.943	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-15	173.9	-78.4	-175.7	174.9	-179.9	0	112.8
219	D	40.2	Very low	39.9	Very low	143 Å²	143	80.9 Å²	80.9	77%	0.765	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	1.7	-172.6	-58.3	-30.2	0	0	0	113.9	S217 S221	S217-D219 PolarHBondContact O-N 3.34Å; S217-D219 VanDerWaalsContact O-N 3.13Å; D219-S221 PolarHBondContact O-N 3.16Å; D219-S221 VanDerWaalsContact O-N 3.09Å
220	G	38.7	Very low	41.2	Very low	66 Å²	66	77.4 Å²	77.4	68%	0.68	42%	0.416	S	S	*	.			trans	64.7	9.2	-174.8	0	0	0	0	0	114.1	S217	S217-G220 PolarHBondContact O-N 2.85Å; S217-G220 WeakPolarHBondContact OG-CA 3.33Å; S217-G220 PolarHBondContact OG-N 3.34Å
221	S	41.9	Very low	42.9	Very low	68 Å²	68	76.3 Å²	76.3	48%	0.476	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-74	128.6	171.2	53	0	0	0	0	109.2	S217 D219	S217-S221 WeakPolarHBondContact CB-O 3.46Å; S217-S221 PolarHBondContact OG-N 3.41Å; S217-S221 PolarHBondContact OG-O 3.45Å; D219-S221 PolarHBondContact O-N 3.16Å; D219-S221 VanDerWaalsContact O-N 3.09Å
222	Q	47.9	Very low	44.5	Very low	67 Å²	67	73.2 Å²	73.2	31%	0.313	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-70.9	133.3	164.6	-67	-174	-64.9	0	0	107.8	Y253 S255	Q222-Y253 VanDerWaalsContact CD-O 3.28Å; Q222-Y253 PolarHBondContact NE2-O 2.9Å; Q222-Y253 PolarHBondContact OE1-O 3.23Å; Q222-Y253 VanDerWaalsContact OE1-O 3.05Å; Q222-S255 PolarHBondContact OE1-OG 3.29Å
223	S	49.4	Very low	46	Very low	34 Å²	34	69.4 Å²	69.4	24%	0.238	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-64.1	156.2	172	68.3	0	0	0	0	109.5	R144 D225 D226 R227	R144-S223 PolarHBondContact NH1-OG 3.46Å; S223-D225 PolarHBondContact O-N 2.88Å; S223-D225 PolarHBondContact OG-N 2.85Å; S223-D226 PolarHBondContact N-OD2 2.89Å; S223-D226 VanDerWaalsContact N-OD2 3.08Å; S223-D226 PolarHBondContact O-N 3.24Å; S223-D226 PolarHBondContact OG-N 3.38Å; S223-D226 PolarHBondContact OG-OD1 3.3Å; S223-D226 PolarHBondContact OG-OD2 3.48Å; S223-R227 PolarHBondContact O-N 2.8Å
224	S	49.4	Very low	47.4	Very low	66 Å²	66	64.5 Å²	64.5	46%	0.462	35%	0.348	S	S	.	.	H	α-helix	trans	-50.9	-29.4	171.6	43.6	0	0	0	0	112.4	R227 I228	S224-R227 WeakPolarHBondContact O-CB 3.44Å; S224-I228 WeakPolarHBondContact O-CG1 3.35Å; S224-I228 PolarHBondContact O-N 3.44Å
225	D	47.7	Very low	48.9	Very low	37 Å²	37	58.1 Å²	58.1	20%	0.198	33%	0.326	C	S	.	.	H	α-helix	trans	-79.6	-41.8	-170.2	-47.5	-19.7	0	0	0	110.4	D141 R144 S223 R227 I228 V229	D141-D225 VanDerWaalsContact OD1-CB 3.23Å; D141-D225 WeakPolarHBondContact OD1-CB 3.43Å; R144-D225 IonicContact NH1-OD2 3.95Å; S223-D225 PolarHBondContact O-N 2.88Å; S223-D225 PolarHBondContact OG-N 2.85Å; D225-R227 PolarHBondContact O-N 3.09Å; D225-I228 PolarHBondContact O-N 2.95Å; D225-V229 WeakPolarHBondContact O-CG2 3.49Å; D225-V229 PolarHBondContact O-N 3.15Å
226	D	49.9	Very low	50.3	Low	31 Å²	31	53.6 Å²	53.6	17%	0.166	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-32.4	175.6	-52.6	-32.6	0	0	0	111.3	R144 H148 S223 A230	R144-D226 WeakPolarHBondContact CD-OD1 3.47Å; R144-D226 IonicContact CZ-OD1 3.39Å; R144-D226 IonicContact NE-OD1 3.06Å; R144-D226 IonicContact NH1-OD1 3.12Å; R144-D226 PolarHBondContact NH1-OD1 3.06Å; R144-D226 VanDerWaalsContact NH1-OD1 3.12Å; R144-D226 IonicContact NH1-OD2 3.99Å; H148-D226 IonicContact NE2-OD1 2.69Å; S223-D226 PolarHBondContact N-OD2 2.89Å; S223-D226 VanDerWaalsContact N-OD2 3.08Å; S223-D226 PolarHBondContact O-N 3.24Å; S223-D226 PolarHBondContact OG-N 3.38Å; S223-D226 PolarHBondContact OG-OD1 3.3Å; S223-D226 PolarHBondContact OG-OD2 3.48Å; D226-A230 WeakPolarHBondContact O-CB 3.39Å; D226-A230 PolarHBondContact O-N 3.18Å
227	R	55.3	Low	51.4	Low	71 Å²	71	47 Å²	47	27%	0.268	27%	0.266	S	S	.	.	H	α-helix	trans	-72.6	-44.3	178.8	-169.1	-177.9	68.7	174.4	1.2	112	S223 S224 D225 V229 A230 E231 P260	S223-R227 PolarHBondContact O-N 2.8Å; S224-R227 WeakPolarHBondContact O-CB 3.44Å; D225-R227 PolarHBondContact O-N 3.09Å; R227-V229 VanDerWaalsContact C-N 3.32Å; R227-V229 PolarHBondContact O-N 3.36Å; R227-A230 PolarHBondContact O-N 3.44Å; R227-E231 WeakPolarHBondContact CG-OE1 3.36Å; R227-E231 WeakPolarHBondContact O-CB 3.48Å; R227-E231 VanDerWaalsContact O-CG 3.28Å; R227-E231 WeakPolarHBondContact O-CG 3.28Å; R227-E231 PolarHBondContact O-N 3.31Å; R227-P260 VanDerWaalsContact CD-CG 3.46Å; R227-P260 HydrophobicContact CG-CG 4.21Å; R227-P260 VanDerWaalsContact NH2-CB 3.26Å; R227-P260 VanDerWaalsContact NH2-CG 3.31Å
228	I	54.5	Low	52.6	Low	26 Å²	26	48.3 Å²	48.3	13%	0.133	28%	0.278	C	S	.	.	H	α-helix	trans	-60.5	-45.7	175.8	-69.4	167.5	0	0	0	110.1	S224 D225 E231 M232 L261	S224-I228 WeakPolarHBondContact O-CG1 3.35Å; S224-I228 PolarHBondContact O-N 3.44Å; D225-I228 PolarHBondContact O-N 2.95Å; I228-E231 PolarHBondContact O-N 2.98Å; I228-M232 HydrophobicContact CG2-CE 3.44Å; I228-M232 VanDerWaalsContact CG2-CE 3.44Å; I228-M232 WeakPolarHBondContact O-CG 3.47Å; I228-M232 PolarHBondContact O-N 3.48Å; I228-L261 HydrophobicContact CG1-CD1 4.37Å
229	V	55.5	Low	53.6	Low	2 Å²	2	41.7 Å²	41.7	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-44.1	176.1	170.1	0	0	0	0	111.4	A145 H148 D225 R227 E231 M232 I233	A145-V229 HydrophobicContact CB-CG1 4.13Å; A145-V229 HydrophobicContact CB-CG2 3.75Å; H148-V229 HydrophobicContact CB-CG1 3.44Å; H148-V229 VanDerWaalsContact CB-CG1 3.44Å; D225-V229 WeakPolarHBondContact O-CG2 3.49Å; D225-V229 PolarHBondContact O-N 3.15Å; R227-V229 VanDerWaalsContact C-N 3.32Å; R227-V229 PolarHBondContact O-N 3.36Å; V229-E231 VanDerWaalsContact C-N 3.27Å; V229-E231 PolarHBondContact O-N 2.9Å; V229-M232 PolarHBondContact O-N 3.12Å; V229-I233 HydrophobicContact CG1-CD1 3.91Å; V229-I233 WeakPolarHBondContact O-CG1 3.29Å; V229-I233 PolarHBondContact O-N 3.5Å
230	A	57	Low	54.2	Low	2 Å²	2	38.6 Å²	38.6	2%	0.017	23%	0.234	C	C	.	.	H	α-helix	trans	-64	-36.3	179.2	0	0	0	0	0	112.4	D226 R227 I233 S234 F249	D226-A230 WeakPolarHBondContact O-CB 3.39Å; D226-A230 PolarHBondContact O-N 3.18Å; R227-A230 PolarHBondContact O-N 3.44Å; A230-I233 PolarHBondContact O-N 3.11Å; A230-S234 WeakPolarHBondContact O-CB 3.34Å; A230-S234 PolarHBondContact O-N 3.42Å; A230-F249 HydrophobicContact CB-CE1 3.92Å
231	E	61.8	Low	54.6	Low	23 Å²	23	36.1 Å²	36.1	11%	0.107	21%	0.209	C	C	.	.	H	α-helix	trans	-68.1	-39.8	173.4	-72.3	171.3	-154.1	0	0	112.3	R227 I228 V229 I233 S234 A235 P260 L261 I265	R227-E231 WeakPolarHBondContact CG-OE1 3.36Å; R227-E231 WeakPolarHBondContact O-CB 3.48Å; R227-E231 VanDerWaalsContact O-CG 3.28Å; R227-E231 WeakPolarHBondContact O-CG 3.28Å; R227-E231 PolarHBondContact O-N 3.31Å; I228-E231 PolarHBondContact O-N 2.98Å; V229-E231 VanDerWaalsContact C-N 3.27Å; V229-E231 PolarHBondContact O-N 2.9Å; E231-I233 VanDerWaalsContact C-N 3.33Å; E231-I233 PolarHBondContact O-N 3.35Å; E231-S234 PolarHBondContact O-N 3.23Å; E231-A235 VanDerWaalsContact O-CB 3.25Å; E231-A235 WeakPolarHBondContact O-CB 3.28Å; E231-A235 PolarHBondContact O-N 3.31Å; E231-P260 WeakPolarHBondContact OE1-CD 3.46Å; E231-P260 VanDerWaalsContact OE1-CG 3.25Å; E231-P260 WeakPolarHBondContact OE1-CG 2.9Å; E231-L261 WeakPolarHBondContact OE2-CD1 3.3Å; E231-I265 HydrophobicContact CB-CD1 3.41Å; E231-I265 VanDerWaalsContact CB-CD1 3.41Å
232	M	60.2	Low	55.1	Low	3 Å²	3	35 Å²	35	2%	0.015	20%	0.195	C	C	.	.	H	α-helix	trans	-61.5	-41.3	173.6	-70.2	-166.9	-145.6	0	0	112	V135 M137 I228 V229 A235 Y236 I265 A269 L270	V135-M232 HydrophobicContact CG1-CE 3.61Å; M137-M232 HydrophobicContact CE-CE 3.74Å; M137-M232 HydrophobicContact CG-CE 4.33Å; M137-M232 HydrophobicContact SD-CE 3.62Å; I228-M232 HydrophobicContact CG2-CE 3.44Å; I228-M232 VanDerWaalsContact CG2-CE 3.44Å; I228-M232 WeakPolarHBondContact O-CG 3.47Å; I228-M232 PolarHBondContact O-N 3.48Å; V229-M232 PolarHBondContact O-N 3.12Å; M232-A235 PolarHBondContact O-N 2.78Å; M232-Y236 WeakPolarHBondContact O-CB 3.18Å; M232-Y236 PolarHBondContact O-N 3.01Å; M232-I265 HydrophobicContact CG-CD1 4.43Å; M232-I265 HydrophobicContact CG-CG2 4.22Å; M232-A269 HydrophobicContact CG-CB 4.36Å; M232-A269 HydrophobicContact SD-CB 4.21Å; M232-L270 HydrophobicContact CB-CB 4.39Å; M232-L270 HydrophobicContact CB-CD1 4.5Å
233	I	60.7	Low	55.2	Low	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68	-43.3	177	-67.6	167.1	0	0	0	110.8	H148 A152 V229 A230 E231 Y236 L237 F249 L270	H148-I233 HydrophobicContact CB-CD1 3.48Å; H148-I233 VanDerWaalsContact CB-CD1 3.48Å; A152-I233 HydrophobicContact CB-CD1 4.31Å; A152-I233 HydrophobicContact CB-CG2 3.54Å; V229-I233 HydrophobicContact CG1-CD1 3.91Å; V229-I233 WeakPolarHBondContact O-CG1 3.29Å; V229-I233 PolarHBondContact O-N 3.5Å; A230-I233 PolarHBondContact O-N 3.11Å; E231-I233 VanDerWaalsContact C-N 3.33Å; E231-I233 PolarHBondContact O-N 3.35Å; I233-Y236 WeakPolarHBondContact O-CB 3.48Å; I233-Y236 PolarHBondContact O-N 3.3Å; I233-L237 HydrophobicContact CG2-CD1 4.03Å; I233-L237 HydrophobicContact CG2-CG 4.46Å; I233-L237 WeakPolarHBondContact O-CB 3.5Å; I233-L237 VanDerWaalsContact O-CG 3.25Å; I233-L237 WeakPolarHBondContact O-CG 3.35Å; I233-L237 PolarHBondContact O-N 2.98Å; I233-F249 HydrophobicContact CB-CD1 4.32Å; I233-F249 HydrophobicContact CB-CE1 3.71Å; I233-F249 HydrophobicContact CB-CZ 4.04Å; I233-F249 HydrophobicContact CD1-CE1 4.24Å; I233-F249 HydrophobicContact CD1-CZ 3.88Å; I233-F249 HydrophobicContact CG2-CD1 3.92Å; I233-F249 HydrophobicContact CG2-CD2 4.37Å; I233-F249 HydrophobicContact CG2-CE1 3.55Å; I233-F249 HydrophobicContact CG2-CE2 4.03Å; I233-F249 HydrophobicContact CG2-CG 4.32Å; I233-F249 HydrophobicContact CG2-CZ 3.61Å; I233-L270 HydrophobicContact CG1-CD1 4.4Å; I233-L270 HydrophobicContact CG1-CD2 4.05Å
234	S	60.9	Low	55.1	Low	22 Å²	22	39.2 Å²	39.2	15%	0.154	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-44.3	174.9	-175.3	0	0	0	0	111.7	A230 E231 L237 A238 A246	A230-S234 WeakPolarHBondContact O-CB 3.34Å; A230-S234 PolarHBondContact O-N 3.42Å; E231-S234 PolarHBondContact O-N 3.23Å; S234-L237 PolarHBondContact O-N 3.27Å; S234-A238 WeakPolarHBondContact O-CB 3.48Å; S234-A238 PolarHBondContact O-N 3.14Å; S234-A246 WeakPolarHBondContact O-CB 3.25Å; S234-A246 PolarHBondContact OG-O 3.38Å
235	A	61.7	Low	55.2	Low	27 Å²	27	37.6 Å²	37.6	22%	0.223	20%	0.204	C	C	.	.	H	α-helix	trans	-61.9	-44.5	175.9	0	0	0	0	0	111.6	E231 M232 L237 A238 Q239	E231-A235 VanDerWaalsContact O-CB 3.25Å; E231-A235 WeakPolarHBondContact O-CB 3.28Å; E231-A235 PolarHBondContact O-N 3.31Å; M232-A235 PolarHBondContact O-N 2.78Å; A235-L237 PolarHBondContact O-N 2.92Å; A235-A238 PolarHBondContact O-N 3.09Å; A235-Q239 VanDerWaalsContact O-CB 3.32Å; A235-Q239 WeakPolarHBondContact O-CB 3.26Å; A235-Q239 WeakPolarHBondContact O-CG 3.39Å; A235-Q239 PolarHBondContact O-N 3.41Å
236	Y	58.9	Low	55.5	Low	51 Å²	51	36 Å²	36	20%	0.2	20%	0.196	C	C	.	.	H	α-helix	trans	-58.4	-48.1	174.4	172.2	-100.1	0	0	0	112.1	Y149 M232 I233 A238 Q239 N240 L270 E271	Y149-Y236 HydrophobicContact CE2-CE1 4.38Å; M232-Y236 WeakPolarHBondContact O-CB 3.18Å; M232-Y236 PolarHBondContact O-N 3.01Å; I233-Y236 WeakPolarHBondContact O-CB 3.48Å; I233-Y236 PolarHBondContact O-N 3.3Å; Y236-A238 VanDerWaalsContact C-N 3.33Å; Y236-A238 PolarHBondContact O-N 3.13Å; Y236-Q239 PolarHBondContact O-N 2.68Å; Y236-N240 VanDerWaalsContact CD2-ND2 3.33Å; Y236-N240 WeakPolarHBondContact CD2-ND2 3.41Å; Y236-N240 VanDerWaalsContact CE2-ND2 3.26Å; Y236-N240 WeakPolarHBondContact CE2-ND2 3.47Å; Y236-N240 WeakPolarHBondContact O-CB 3.48Å; Y236-N240 PolarHBondContact O-N 3.21Å; Y236-N240 PolarHBondContact O-ND2 3.23Å; Y236-L270 VanDerWaalsContact CB-CD2 3.42Å; Y236-L270 HydrophobicContact CD1-CD2 3.94Å; Y236-L270 HydrophobicContact CD2-CB 4.48Å; Y236-L270 HydrophobicContact CD2-CD2 4.06Å; Y236-L270 HydrophobicContact CG-CD2 3.54Å; Y236-E271 HydrophobicContact CD2-CG 3.9Å; Y236-E271 WeakPolarHBondContact CD2-OE1 3.35Å; Y236-E271 HydrophobicContact CE2-CG 3.7Å
237	L	57	Low	55.6	Low	4 Å²	4	39.9 Å²	39.9	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-61	-44.1	178	-72.1	170	0	0	0	110.7	V156 I233 S234 A235 N240 G241 F242 T245 A246 F249	V156-L237 HydrophobicContact CG2-CD2 3.82Å; I233-L237 HydrophobicContact CG2-CD1 4.03Å; I233-L237 HydrophobicContact CG2-CG 4.46Å; I233-L237 WeakPolarHBondContact O-CB 3.5Å; I233-L237 VanDerWaalsContact O-CG 3.25Å; I233-L237 WeakPolarHBondContact O-CG 3.35Å; I233-L237 PolarHBondContact O-N 2.98Å; S234-L237 PolarHBondContact O-N 3.27Å; A235-L237 PolarHBondContact O-N 2.92Å; L237-N240 PolarHBondContact O-N 3.15Å; L237-G241 PolarHBondContact O-N 3.46Å; L237-F242 HydrophobicContact CB-CB 4.09Å; L237-F242 HydrophobicContact CD2-CB 3.97Å; L237-F242 HydrophobicContact CD2-CD2 4.26Å; L237-F242 HydrophobicContact CD2-CG 4.29Å; L237-F242 WeakPolarHBondContact O-CA 3.15Å; L237-F242 WeakPolarHBondContact O-CB 3.47Å; L237-F242 PolarHBondContact O-N 2.96Å; L237-T245 HydrophobicContact CD1-CG2 3.95Å; L237-T245 HydrophobicContact CD2-CG2 4.33Å; L237-A246 HydrophobicContact CB-CB 3.7Å; L237-F249 HydrophobicContact CD1-CB 4.23Å; L237-F249 HydrophobicContact CD1-CG 4.42Å
238	A	58.5	Low	55.7	Low	54 Å²	54	42.3 Å²	42.3	45%	0.446	23%	0.226	S	C	.	.	H	α-helix	trans	-64.6	-44	177.3	0	0	0	0	0	112.5	S234 A235 Y236 N240 G241 A246	S234-A238 WeakPolarHBondContact O-CB 3.48Å; S234-A238 PolarHBondContact O-N 3.14Å; A235-A238 PolarHBondContact O-N 3.09Å; Y236-A238 VanDerWaalsContact C-N 3.33Å; Y236-A238 PolarHBondContact O-N 3.13Å; A238-N240 PolarHBondContact O-N 3.28Å; A238-G241 PolarHBondContact O-N 3.03Å; A238-A246 HydrophobicContact CB-CB 4.09Å
239	Q	58.3	Low	55.7	Low	79 Å²	79	41.6 Å²	41.6	37%	0.369	22%	0.222	S	C	.	.	H	α-helix	trans	-63.1	-29.7	177.9	-74.3	167	14.6	0	0	112.5	A235 Y236	A235-Q239 VanDerWaalsContact O-CB 3.32Å; A235-Q239 WeakPolarHBondContact O-CB 3.26Å; A235-Q239 WeakPolarHBondContact O-CG 3.39Å; A235-Q239 PolarHBondContact O-N 3.41Å; Y236-Q239 PolarHBondContact O-N 2.68Å
240	N	52.3	Low	55.8	Low	77 Å²	77	43 Å²	43	41%	0.412	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	14.3	-179.8	-71.1	-82.4	0	0	0	113.9	Y236 L237 A238 F242	Y236-N240 VanDerWaalsContact CD2-ND2 3.33Å; Y236-N240 WeakPolarHBondContact CD2-ND2 3.41Å; Y236-N240 VanDerWaalsContact CE2-ND2 3.26Å; Y236-N240 WeakPolarHBondContact CE2-ND2 3.47Å; Y236-N240 WeakPolarHBondContact O-CB 3.48Å; Y236-N240 PolarHBondContact O-N 3.21Å; Y236-N240 PolarHBondContact O-ND2 3.23Å; L237-N240 PolarHBondContact O-N 3.15Å; A238-N240 PolarHBondContact O-N 3.28Å; N240-F242 HydrophobicContact CB-CD2 4.02Å; N240-F242 HydrophobicContact CB-CE2 4.16Å; N240-F242 WeakPolarHBondContact O-CD2 3.5Å
241	G	47.8	Very low	55.7	Low	15 Å²	15	49.6 Å²	49.6	16%	0.155	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	1.6	172.9	0	0	0	0	0	115.8	V23 L237 A238 S243	V23-G241 CarbonylContact C-O 3.57Å; V23-G241 CarbonylContact O-C 3.59Å; V23-G241 WeakPolarHBondContact O-CA 3.2Å; L237-G241 PolarHBondContact O-N 3.46Å; A238-G241 PolarHBondContact O-N 3.03Å; G241-S243 VanDerWaalsContact C-N 3.29Å; G241-S243 PolarHBondContact O-N 3.44Å
242	F	52.1	Low	55.6	Low	43 Å²	43	51.7 Å²	51.7	19%	0.189	28%	0.275	C	S	.	.			trans	-89.6	49.3	178.8	-58.8	-77.8	0	0	0	112.4	L89 L237 N240 E244 T245 A246	L89-F242 HydrophobicContact CD1-CZ 4.22Å; L89-F242 HydrophobicContact CD2-CE2 4.19Å; L89-F242 HydrophobicContact CD2-CZ 3.89Å; L237-F242 HydrophobicContact CB-CB 4.09Å; L237-F242 HydrophobicContact CD2-CB 3.97Å; L237-F242 HydrophobicContact CD2-CD2 4.26Å; L237-F242 HydrophobicContact CD2-CG 4.29Å; L237-F242 WeakPolarHBondContact O-CA 3.15Å; L237-F242 WeakPolarHBondContact O-CB 3.47Å; L237-F242 PolarHBondContact O-N 2.96Å; N240-F242 HydrophobicContact CB-CD2 4.02Å; N240-F242 HydrophobicContact CB-CE2 4.16Å; N240-F242 WeakPolarHBondContact O-CD2 3.5Å; F242-E244 VanDerWaalsContact C-N 3.34Å; F242-E244 PolarHBondContact O-N 3.16Å; F242-T245 PolarHBondContact O-N 3.47Å; F242-A246 WeakPolarHBondContact O-CB 3.33Å; F242-A246 PolarHBondContact O-N 3.11Å
243	S	51.3	Low	55.2	Low	52 Å²	52	52.6 Å²	52.6	36%	0.364	28%	0.278	S	S	.	.	H	α-helix	trans	-59.8	-37.4	-172.2	60.8	0	0	0	0	114.3	G25 G241 A246 L247	G25-S243 VanDerWaalsContact CA-OG 3.29Å; G25-S243 WeakPolarHBondContact CA-OG 3.35Å; G241-S243 VanDerWaalsContact C-N 3.29Å; G241-S243 PolarHBondContact O-N 3.44Å; S243-A246 PolarHBondContact O-N 2.94Å; S243-L247 WeakPolarHBondContact O-CB 3.42Å; S243-L247 PolarHBondContact O-N 3.38Å
244	E	46.8	Very low	54.9	Low	138 Å²	138	53.1 Å²	53.1	65%	0.645	28%	0.283	S	S	*	.	H	α-helix	trans	-66.9	-38.3	175.8	-173	178.9	174.5	0	0	111.8	F242 R248	F242-E244 VanDerWaalsContact C-N 3.34Å; F242-E244 PolarHBondContact O-N 3.16Å; E244-R248 WeakPolarHBondContact O-CB 3.14Å; E244-R248 PolarHBondContact O-N 3.48Å
245	T	51.1	Low	54.1	Low	32 Å²	32	56.6 Å²	56.6	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-72.5	-39.6	177.3	-51.3	0	0	0	0	110.5	L237 F242 L247 R248 F249	L237-T245 HydrophobicContact CD1-CG2 3.95Å; L237-T245 HydrophobicContact CD2-CG2 4.33Å; F242-T245 PolarHBondContact O-N 3.47Å; T245-L247 VanDerWaalsContact C-N 3.35Å; T245-L247 PolarHBondContact O-N 2.91Å; T245-R248 PolarHBondContact O-N 2.96Å; T245-F249 WeakPolarHBondContact O-CB 3.12Å; T245-F249 PolarHBondContact O-N 2.88Å
246	A	53.5	Low	53.2	Low	4 Å²	4	58 Å²	58	3%	0.033	32%	0.316	C	S	.	.	H	α-helix	trans	-58.1	-46.8	173.2	0	0	0	0	0	111.4	S234 L237 A238 F242 S243 F249 A250	S234-A246 WeakPolarHBondContact O-CB 3.25Å; S234-A246 PolarHBondContact OG-O 3.38Å; L237-A246 HydrophobicContact CB-CB 3.7Å; A238-A246 HydrophobicContact CB-CB 4.09Å; F242-A246 WeakPolarHBondContact O-CB 3.33Å; F242-A246 PolarHBondContact O-N 3.11Å; S243-A246 PolarHBondContact O-N 2.94Å; A246-F249 PolarHBondContact O-N 3.04Å; A246-A250 WeakPolarHBondContact O-CB 3.4Å; A246-A250 PolarHBondContact O-N 2.85Å
247	L	52.9	Low	52.2	Low	112 Å²	112	61.9 Å²	61.9	59%	0.586	35%	0.35	S	S	*	.	H	α-helix	trans	-62.8	-49.3	178.3	-176.7	69	0	0	0	111.4	S243 T245 F249 A250 M251	S243-L247 WeakPolarHBondContact O-CB 3.42Å; S243-L247 PolarHBondContact O-N 3.38Å; T245-L247 VanDerWaalsContact C-N 3.35Å; T245-L247 PolarHBondContact O-N 2.91Å; L247-F249 VanDerWaalsContact C-N 3.32Å; L247-F249 PolarHBondContact O-N 3.39Å; L247-A250 PolarHBondContact O-N 3.14Å; L247-M251 HydrophobicContact CG-SD 4.23Å; L247-M251 WeakPolarHBondContact O-CB 3.45Å; L247-M251 VanDerWaalsContact O-CG 3.28Å; L247-M251 WeakPolarHBondContact O-CG 3.35Å; L247-M251 PolarHBondContact O-N 3.2Å
248	R	56.1	Low	51.3	Low	123 Å²	123	68.8 Å²	68.8	46%	0.464	38%	0.382	S	S	.	.	H	α-helix	trans	-61.4	-42.5	178.1	-179.5	177.4	149.1	-139.5	-24.8	111.5	E244 T245 M251 E252	E244-R248 WeakPolarHBondContact O-CB 3.14Å; E244-R248 PolarHBondContact O-N 3.48Å; T245-R248 PolarHBondContact O-N 2.96Å; R248-M251 PolarHBondContact O-N 2.69Å; R248-E252 HydrophobicContact CG-CG 4.4Å; R248-E252 WeakPolarHBondContact CG-OE1 3.41Å; R248-E252 IonicContact CZ-OE1 3.81Å; R248-E252 IonicContact NE-OE1 3.97Å; R248-E252 PolarHBondContact NE-OE1 3.36Å; R248-E252 IonicContact NH2-OE1 3.91Å; R248-E252 PolarHBondContact NH2-OE1 3.4Å; R248-E252 IonicContact NH2-OE2 3.37Å; R248-E252 WeakPolarHBondContact O-CB 3.39Å; R248-E252 WeakPolarHBondContact O-CG 3.37Å; R248-E252 PolarHBondContact O-N 3.34Å
249	F	55.6	Low	50.1	Low	11 Å²	11	71 Å²	71	5%	0.048	39%	0.394	C	S	.	.	H	α-helix	trans	-64.4	-44.3	177.8	-169	-87.4	0	0	0	111.4	A152 A230 I233 L237 T245 A246 L247 M251 E252 Y253	A152-F249 HydrophobicContact CB-CE2 4.22Å; A230-F249 HydrophobicContact CB-CE1 3.92Å; I233-F249 HydrophobicContact CB-CD1 4.32Å; I233-F249 HydrophobicContact CB-CE1 3.71Å; I233-F249 HydrophobicContact CB-CZ 4.04Å; I233-F249 HydrophobicContact CD1-CE1 4.24Å; I233-F249 HydrophobicContact CD1-CZ 3.88Å; I233-F249 HydrophobicContact CG2-CD1 3.92Å; I233-F249 HydrophobicContact CG2-CD2 4.37Å; I233-F249 HydrophobicContact CG2-CE1 3.55Å; I233-F249 HydrophobicContact CG2-CE2 4.03Å; I233-F249 HydrophobicContact CG2-CG 4.32Å; I233-F249 HydrophobicContact CG2-CZ 3.61Å; L237-F249 HydrophobicContact CD1-CB 4.23Å; L237-F249 HydrophobicContact CD1-CG 4.42Å; T245-F249 WeakPolarHBondContact O-CB 3.12Å; T245-F249 PolarHBondContact O-N 2.88Å; A246-F249 PolarHBondContact O-N 3.04Å; L247-F249 VanDerWaalsContact C-N 3.32Å; L247-F249 PolarHBondContact O-N 3.39Å; F249-M251 VanDerWaalsContact C-N 3.35Å; F249-M251 PolarHBondContact O-N 2.83Å; F249-E252 PolarHBondContact O-N 2.86Å; F249-Y253 HydrophobicContact CD1-CD2 4.23Å; F249-Y253 AromaticContact CD2-CD2 3.76Å; F249-Y253 HydrophobicContact CD2-CD2 3.76Å; F249-Y253 AromaticContact CD2-CE2 3.87Å; F249-Y253 HydrophobicContact CD2-CE2 3.87Å; F249-Y253 HydrophobicContact CE1-CD2 4.16Å; F249-Y253 HydrophobicContact CE1-CG 4.24Å; F249-Y253 AromaticContact CE2-CD2 3.7Å; F249-Y253 HydrophobicContact CE2-CD2 3.7Å; F249-Y253 AromaticContact CE2-CE2 3.69Å; F249-Y253 HydrophobicContact CE2-CE2 3.69Å; F249-Y253 HydrophobicContact CE2-CG 4.34Å; F249-Y253 HydrophobicContact CG-CD2 4.03Å; F249-Y253 AromaticContact CZ-CD2 3.91Å; F249-Y253 HydrophobicContact CZ-CD2 3.91Å; F249-Y253 HydrophobicContact CZ-CE2 4.25Å; F249-Y253 HydrophobicContact CZ-CG 4.1Å; F249-Y253 WeakPolarHBondContact O-CB 3.22Å; F249-Y253 WeakPolarHBondContact O-CD2 3.34Å; F249-Y253 PolarHBondContact O-N 2.97Å
250	A	57.3	Low	48.8	Very low	30 Å²	30	69.3 Å²	69.3	25%	0.248	39%	0.39	C	S	.	.	H	α-helix	trans	-62.1	-40.6	173.6	0	0	0	0	0	112.1	A246 L247 A254	A246-A250 WeakPolarHBondContact O-CB 3.4Å; A246-A250 PolarHBondContact O-N 2.85Å; L247-A250 PolarHBondContact O-N 3.14Å; A250-A254 WeakPolarHBondContact O-CA 3.26Å; A250-A254 WeakPolarHBondContact O-CB 3.27Å; A250-A254 PolarHBondContact O-N 3.39Å
251	M	56	Low	47.9	Very low	142 Å²	142	68.7 Å²	68.7	70%	0.7	39%	0.386	S	S	*	.	H	α-helix	trans	-65.9	-37.9	175.5	-71.5	179.4	71.5	0	0	112.4	L247 R248 F249	L247-M251 HydrophobicContact CG-SD 4.23Å; L247-M251 WeakPolarHBondContact O-CB 3.45Å; L247-M251 VanDerWaalsContact O-CG 3.28Å; L247-M251 WeakPolarHBondContact O-CG 3.35Å; L247-M251 PolarHBondContact O-N 3.2Å; R248-M251 PolarHBondContact O-N 2.69Å; F249-M251 VanDerWaalsContact C-N 3.35Å; F249-M251 PolarHBondContact O-N 2.83Å
252	E	58.8	Low	47	Very low	67 Å²	67	72.7 Å²	72.7	31%	0.313	43%	0.428	S	S	.	.	H	α-helix	trans	-75.8	-33.8	179.7	-76.5	175.7	-169.7	0	0	112.5	R213 R248 F249	R213-E252 PolarHBondContact NH2-O 3.4Å; R248-E252 HydrophobicContact CG-CG 4.4Å; R248-E252 WeakPolarHBondContact CG-OE1 3.41Å; R248-E252 IonicContact CZ-OE1 3.81Å; R248-E252 IonicContact NE-OE1 3.97Å; R248-E252 PolarHBondContact NE-OE1 3.36Å; R248-E252 IonicContact NH2-OE1 3.91Å; R248-E252 PolarHBondContact NH2-OE1 3.4Å; R248-E252 IonicContact NH2-OE2 3.37Å; R248-E252 WeakPolarHBondContact O-CB 3.39Å; R248-E252 WeakPolarHBondContact O-CG 3.37Å; R248-E252 PolarHBondContact O-N 3.34Å; F249-E252 PolarHBondContact O-N 2.86Å
253	Y	52.5	Low	46.3	Very low	21 Å²	21	72.7 Å²	72.7	8%	0.082	44%	0.44	C	S	.	.	H	α-helix	trans	-123.6	-10.8	-166.9	-69.2	-90.9	0	0	0	115.9	Q222 F249	Q222-Y253 VanDerWaalsContact CD-O 3.28Å; Q222-Y253 PolarHBondContact NE2-O 2.9Å; Q222-Y253 PolarHBondContact OE1-O 3.23Å; Q222-Y253 VanDerWaalsContact OE1-O 3.05Å; F249-Y253 HydrophobicContact CD1-CD2 4.23Å; F249-Y253 AromaticContact CD2-CD2 3.76Å; F249-Y253 HydrophobicContact CD2-CD2 3.76Å; F249-Y253 AromaticContact CD2-CE2 3.87Å; F249-Y253 HydrophobicContact CD2-CE2 3.87Å; F249-Y253 HydrophobicContact CE1-CD2 4.16Å; F249-Y253 HydrophobicContact CE1-CG 4.24Å; F249-Y253 AromaticContact CE2-CD2 3.7Å; F249-Y253 HydrophobicContact CE2-CD2 3.7Å; F249-Y253 AromaticContact CE2-CE2 3.69Å; F249-Y253 HydrophobicContact CE2-CE2 3.69Å; F249-Y253 HydrophobicContact CE2-CG 4.34Å; F249-Y253 HydrophobicContact CG-CD2 4.03Å; F249-Y253 AromaticContact CZ-CD2 3.91Å; F249-Y253 HydrophobicContact CZ-CD2 3.91Å; F249-Y253 HydrophobicContact CZ-CE2 4.25Å; F249-Y253 HydrophobicContact CZ-CG 4.1Å; F249-Y253 WeakPolarHBondContact O-CB 3.22Å; F249-Y253 WeakPolarHBondContact O-CD2 3.34Å; F249-Y253 PolarHBondContact O-N 2.97Å
254	A	52.7	Low	46.2	Very low	11 Å²	11	75.8 Å²	75.8	9%	0.091	46%	0.462	C	S	.	.	S	Bend	trans	-105.2	-5.5	178.8	0	0	0	0	0	113.6	A250 S256	A250-A254 WeakPolarHBondContact O-CA 3.26Å; A250-A254 WeakPolarHBondContact O-CB 3.27Å; A250-A254 PolarHBondContact O-N 3.39Å; A254-S256 PolarHBondContact O-N 3.21Å; A254-S256 PolarHBondContact O-OG 2.79Å
255	S	45.6	Very low	46.5	Very low	96 Å²	96	71 Å²	71	67%	0.671	44%	0.44	S	S	*	.			trans	47.4	-5.8	172.1	-52.3	0	0	0	0	118.7	Q222	Q222-S255 PolarHBondContact OE1-OG 3.29Å
256	S	41.8	Very low	46.6	Very low	57 Å²	57	71.4 Å²	71.4	40%	0.399	44%	0.443	S	S	.	.			trans	-144.4	130.5	-173.1	61.3	0	0	0	0	110.3	A254 E258	A254-S256 PolarHBondContact O-N 3.21Å; A254-S256 PolarHBondContact O-OG 2.79Å; S256-E258 PolarHBondContact O-N 3.26Å; S256-E258 PolarHBondContact OG-O 2.83Å
257	S	37.9	Very low	46.7	Very low	131 Å²	131	77.4 Å²	77.4	92%	0.916	48%	0.475	S	S	*	.	S	Bend	trans	-63.8	1.3	169.2	51.8	0	0	0	0	114.1
258	E	38.8	Very low	47	Very low	150 Å²	150	75.3 Å²	75.3	70%	0.701	46%	0.459	S	S	*	.	S	Bend	trans	-105.1	102.9	179.2	-67.3	-173.9	161.3	0	0	107.9	S256 P260	S256-E258 PolarHBondContact O-N 3.26Å; S256-E258 PolarHBondContact OG-O 2.83Å; E258-P260 WeakPolarHBondContact O-CD 3.2Å
259	S	33.7	Very low	46.9	Very low	100 Å²	100	70 Å²	70	70%	0.699	44%	0.441	S	S	*	.			trans	-56.5	108.4	166.8	-140.9	0	0	0	0	106.6	L261	S259-L261 VanDerWaalsContact C-N 3.26Å; S259-L261 PolarHBondContact O-N 2.93Å
260	P	29.5	Very low	47.1	Very low	44 Å²	44	69.5 Å²	69.5	29%	0.286	44%	0.439	S	S	.	.			trans	-92	6.2	-167.4	34.7	-26.9	0	0	0	112.5	R227 E231 E258	R227-P260 VanDerWaalsContact CD-CG 3.46Å; R227-P260 HydrophobicContact CG-CG 4.21Å; R227-P260 VanDerWaalsContact NH2-CB 3.26Å; R227-P260 VanDerWaalsContact NH2-CG 3.31Å; E231-P260 WeakPolarHBondContact OE1-CD 3.46Å; E231-P260 VanDerWaalsContact OE1-CG 3.25Å; E231-P260 WeakPolarHBondContact OE1-CG 2.9Å; E258-P260 WeakPolarHBondContact O-CD 3.2Å
261	L	33.2	Very low	47.1	Very low	63 Å²	63	69 Å²	69	33%	0.33	43%	0.432	S	S	.	.			trans	-100	98.9	163.6	-66.5	173.3	0	0	0	107.9	I228 E231 S259 G263 I265	I228-L261 HydrophobicContact CG1-CD1 4.37Å; E231-L261 WeakPolarHBondContact OE2-CD1 3.3Å; S259-L261 VanDerWaalsContact C-N 3.26Å; S259-L261 PolarHBondContact O-N 2.93Å; L261-G263 WeakPolarHBondContact CB-O 3.33Å; L261-G263 PolarHBondContact O-N 3.32Å; L261-I265 HydrophobicContact CD1-CD1 4.01Å; L261-I265 HydrophobicContact CD1-CG1 3.71Å
262	G	29	Very low	47.1	Very low	99 Å²	99	63.2 Å²	63.2	100%	1.021	40%	0.404	S	S	*	.	S	Bend	trans	-64.5	32.5	155.4	0	0	0	0	0	112.9
263	G	37.3	Very low	47	Very low	44 Å²	44	60.3 Å²	60.3	45%	0.454	39%	0.39	S	S	.	.	S	Bend	trans	-149.7	124.9	176.4	0	0	0	0	0	107.9	L261 I265	L261-G263 WeakPolarHBondContact CB-O 3.33Å; L261-G263 PolarHBondContact O-N 3.32Å; G263-I265 PolarHBondContact O-N 2.88Å
264	S	50	Low	47.3	Very low	117 Å²	117	60.1 Å²	60.1	82%	0.818	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-57	118.5	179.4	50.3	0	0	0	0	110.4
265	I	53	Low	47.3	Very low	37 Å²	37	59.6 Å²	59.6	19%	0.19	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-52.2	128.1	163	-66.1	178.5	0	0	0	106.7	E231 M232 L261 G263 D267 A269	E231-I265 HydrophobicContact CB-CD1 3.41Å; E231-I265 VanDerWaalsContact CB-CD1 3.41Å; M232-I265 HydrophobicContact CG-CD1 4.43Å; M232-I265 HydrophobicContact CG-CG2 4.22Å; L261-I265 HydrophobicContact CD1-CD1 4.01Å; L261-I265 HydrophobicContact CD1-CG1 3.71Å; G263-I265 PolarHBondContact O-N 2.88Å; I265-D267 PolarHBondContact O-N 3.34Å; I265-A269 HydrophobicContact CG2-CB 3.54Å
266	P	52.6	Low	47.6	Very low	40 Å²	40	55.2 Å²	55.2	26%	0.26	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-54.2	139.8	179.1	-24.3	31.9	0	0	0	111.1	Y133 R268 A269	Y133-P266 WeakPolarHBondContact O-CG 3.17Å; P266-R268 PolarHBondContact O-N 3.08Å; P266-A269 HydrophobicContact CB-CB 4.39Å; P266-A269 VanDerWaalsContact O-CB 3.29Å; P266-A269 WeakPolarHBondContact O-CB 3.36Å; P266-A269 PolarHBondContact O-N 3.32Å
267	D	56.5	Low	48.1	Very low	130 Å²	130	52.9 Å²	52.9	70%	0.695	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	134.3	169.2	-77.6	-17.6	0	0	0	108.9	I265 A269	I265-D267 PolarHBondContact O-N 3.34Å; D267-A269 VanDerWaalsContact C-N 3.3Å; D267-A269 PolarHBondContact O-N 3.02Å
268	R	58.4	Low	48.9	Very low	69 Å²	69	48 Å²	48	26%	0.26	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	24.9	-176.1	-51.1	-166.9	177	-155	3	116.9	P266 L270 E271 I272 F313	P266-R268 PolarHBondContact O-N 3.08Å; R268-L270 PolarHBondContact O-N 3.18Å; R268-E271 VanDerWaalsContact C-OE2 3.29Å; R268-E271 WeakPolarHBondContact CA-OE2 3.38Å; R268-E271 HydrophobicContact CB-CB 4.38Å; R268-E271 PolarHBondContact O-N 2.85Å; R268-I272 WeakPolarHBondContact O-CB 3.49Å; R268-I272 WeakPolarHBondContact O-CD1 3.28Å; R268-I272 VanDerWaalsContact O-CG1 3.3Å; R268-I272 WeakPolarHBondContact O-CG1 3.25Å; R268-I272 PolarHBondContact O-N 3.28Å; R268-F313 VanDerWaalsContact CD-CZ 3.41Å; R268-F313 HydrophobicContact CG-CE1 4.48Å
269	A	54.3	Low	49.5	Very low	10 Å²	10	40.9 Å²	40.9	8%	0.083	27%	0.27	C	S	.	.	H	α-helix	trans	-53.4	-39.7	179.6	0	0	0	0	0	113.5	M232 I265 P266 D267 L273	M232-A269 HydrophobicContact CG-CB 4.36Å; M232-A269 HydrophobicContact SD-CB 4.21Å; I265-A269 HydrophobicContact CG2-CB 3.54Å; P266-A269 HydrophobicContact CB-CB 4.39Å; P266-A269 VanDerWaalsContact O-CB 3.29Å; P266-A269 WeakPolarHBondContact O-CB 3.36Å; P266-A269 PolarHBondContact O-N 3.32Å; D267-A269 VanDerWaalsContact C-N 3.3Å; D267-A269 PolarHBondContact O-N 3.02Å; A269-L273 WeakPolarHBondContact O-CB 3.45Å; A269-L273 PolarHBondContact O-N 3.26Å
270	L	59.7	Low	50.3	Low	2 Å²	2	37.7 Å²	37.7	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-68.8	-46.1	179.3	-173.5	63.2	0	0	0	111.5	Y149 M232 I233 Y236 R268 I272 L273 L274	Y149-L270 HydrophobicContact CD2-CD1 4.14Å; Y149-L270 HydrophobicContact CD2-CD2 3.53Å; Y149-L270 HydrophobicContact CD2-CG 4.06Å; Y149-L270 HydrophobicContact CE2-CD2 3.63Å; Y149-L270 HydrophobicContact CE2-CG 4.18Å; M232-L270 HydrophobicContact CB-CB 4.39Å; M232-L270 HydrophobicContact CB-CD1 4.5Å; I233-L270 HydrophobicContact CG1-CD1 4.4Å; I233-L270 HydrophobicContact CG1-CD2 4.05Å; Y236-L270 VanDerWaalsContact CB-CD2 3.42Å; Y236-L270 HydrophobicContact CD1-CD2 3.94Å; Y236-L270 HydrophobicContact CD2-CB 4.48Å; Y236-L270 HydrophobicContact CD2-CD2 4.06Å; Y236-L270 HydrophobicContact CG-CD2 3.54Å; R268-L270 PolarHBondContact O-N 3.18Å; L270-I272 VanDerWaalsContact C-N 3.28Å; L270-I272 PolarHBondContact O-N 3.18Å; L270-L273 WeakPolarHBondContact O-CB 3.44Å; L270-L273 PolarHBondContact O-N 3.05Å; L270-L274 HydrophobicContact CD1-CD1 4.48Å; L270-L274 HydrophobicContact CG-CD1 4.01Å; L270-L274 WeakPolarHBondContact O-CD1 3.49Å; L270-L274 WeakPolarHBondContact O-CG 3.39Å; L270-L274 PolarHBondContact O-N 2.61Å
271	E	58.5	Low	51.4	Low	20 Å²	20	37 Å²	37	9%	0.093	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-39.8	178.1	-60.3	96.1	136.4	0	0	111.5	Y236 R268 L274 T275 L310	Y236-E271 HydrophobicContact CD2-CG 3.9Å; Y236-E271 WeakPolarHBondContact CD2-OE1 3.35Å; Y236-E271 HydrophobicContact CE2-CG 3.7Å; R268-E271 VanDerWaalsContact C-OE2 3.29Å; R268-E271 WeakPolarHBondContact CA-OE2 3.38Å; R268-E271 HydrophobicContact CB-CB 4.38Å; R268-E271 PolarHBondContact O-N 2.85Å; E271-L274 PolarHBondContact O-N 3.38Å; E271-T275 WeakPolarHBondContact O-CB 3.42Å; E271-T275 PolarHBondContact O-N 3.25Å; E271-T275 PolarHBondContact O-OG1 3.48Å; E271-L310 VanDerWaalsContact C-CD1 3.44Å; E271-L310 HydrophobicContact CB-CD1 3.61Å; E271-L310 HydrophobicContact CB-CD2 3.76Å; E271-L310 HydrophobicContact CB-CG 4.13Å; E271-L310 HydrophobicContact CG-CD2 4.39Å; E271-L310 VanDerWaalsContact O-CD1 3.28Å; E271-L310 WeakPolarHBondContact O-CD1 2.92Å
272	I	55.7	Low	52.4	Low	20 Å²	20	34.4 Å²	34.4	10%	0.103	22%	0.223	C	C	.	.	H	α-helix	trans	-57.7	-52.5	172.9	-73.9	162.9	0	0	0	110.2	Y133 R268 L270 L274 T275 C276	Y133-I272 HydrophobicContact CD1-CD1 3.81Å; Y133-I272 HydrophobicContact CD1-CG2 3.84Å; Y133-I272 HydrophobicContact CD2-CG2 3.55Å; Y133-I272 HydrophobicContact CE1-CB 4.42Å; Y133-I272 HydrophobicContact CE1-CD1 3.67Å; Y133-I272 HydrophobicContact CE1-CG1 4.06Å; Y133-I272 HydrophobicContact CE1-CG2 3.51Å; Y133-I272 HydrophobicContact CE2-CG2 3.22Å; Y133-I272 HydrophobicContact CG-CG2 3.85Å; R268-I272 WeakPolarHBondContact O-CB 3.49Å; R268-I272 WeakPolarHBondContact O-CD1 3.28Å; R268-I272 VanDerWaalsContact O-CG1 3.3Å; R268-I272 WeakPolarHBondContact O-CG1 3.25Å; R268-I272 PolarHBondContact O-N 3.28Å; L270-I272 VanDerWaalsContact C-N 3.28Å; L270-I272 PolarHBondContact O-N 3.18Å; I272-L274 VanDerWaalsContact C-N 3.31Å; I272-L274 PolarHBondContact O-N 2.88Å; I272-T275 PolarHBondContact O-N 2.92Å; I272-C276 WeakPolarHBondContact O-CB 2.87Å; I272-C276 PolarHBondContact O-N 2.95Å; I272-C276 PolarHBondContact O-SG 3.17Å
273	L	57.1	Low	53.5	Low	6 Å²	6	31.7 Å²	31.7	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-56.9	-45.7	-179.5	-169.9	79.3	0	0	0	112	F125 M137 V142 A145 A269 L270 C276 G277	F125-L273 HydrophobicContact CE1-CD1 4.46Å; M137-L273 HydrophobicContact CE-CD1 3.74Å; M137-L273 HydrophobicContact CE-CD2 3.99Å; M137-L273 HydrophobicContact SD-CD1 3.65Å; V142-L273 HydrophobicContact CG2-CD1 4.16Å; A145-L273 HydrophobicContact CB-CD2 3.28Å; A269-L273 WeakPolarHBondContact O-CB 3.45Å; A269-L273 PolarHBondContact O-N 3.26Å; L270-L273 WeakPolarHBondContact O-CB 3.44Å; L270-L273 PolarHBondContact O-N 3.05Å; L273-C276 PolarHBondContact O-N 3.28Å; L273-G277 PolarHBondContact O-N 3.03Å
274	L	58	Low	54.3	Low	17 Å²	17	31.5 Å²	31.5	9%	0.089	17%	0.172	C	C	.	.	H	α-helix	trans	-65.4	-41	179.2	-66.3	165.8	0	0	0	111.9	F146 Y149 L270 E271 I272 C276 G277 L278	F146-L274 HydrophobicContact CD1-CD2 3.96Å; F146-L274 HydrophobicContact CE1-CD2 3.56Å; F146-L274 HydrophobicContact CZ-CD2 4.32Å; Y149-L274 HydrophobicContact CD1-CD1 3.8Å; Y149-L274 HydrophobicContact CD1-CD2 3.33Å; Y149-L274 HydrophobicContact CD1-CG 4.18Å; Y149-L274 HydrophobicContact CD2-CD1 4.13Å; Y149-L274 HydrophobicContact CE1-CD1 3.21Å; Y149-L274 HydrophobicContact CE1-CD2 3.49Å; Y149-L274 VanDerWaalsContact CE1-CD2 3.49Å; Y149-L274 HydrophobicContact CE1-CG 3.97Å; Y149-L274 HydrophobicContact CE2-CD1 3.63Å; Y149-L274 HydrophobicContact CG-CD1 4.19Å; Y149-L274 HydrophobicContact CG-CD2 3.97Å; Y149-L274 WeakPolarHBondContact OH-CD1 3.35Å; L270-L274 HydrophobicContact CD1-CD1 4.48Å; L270-L274 HydrophobicContact CG-CD1 4.01Å; L270-L274 WeakPolarHBondContact O-CD1 3.49Å; L270-L274 WeakPolarHBondContact O-CG 3.39Å; L270-L274 PolarHBondContact O-N 2.61Å; E271-L274 PolarHBondContact O-N 3.38Å; I272-L274 VanDerWaalsContact C-N 3.31Å; I272-L274 PolarHBondContact O-N 2.88Å; L274-C276 VanDerWaalsContact C-N 3.35Å; L274-G277 PolarHBondContact O-N 2.7Å; L274-L278 WeakPolarHBondContact O-CB 3.43Å; L274-L278 VanDerWaalsContact O-CG 3.31Å; L274-L278 WeakPolarHBondContact O-CG 3.44Å; L274-L278 PolarHBondContact O-N 3.15Å
275	T	53.9	Low	54.5	Low	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65	-43.3	177.7	-61.7	0	0	0	0	111	E271 I272 L278 A279 L301 A304 S305 T308 L310 W314	E271-T275 WeakPolarHBondContact O-CB 3.42Å; E271-T275 PolarHBondContact O-N 3.25Å; E271-T275 PolarHBondContact O-OG1 3.48Å; I272-T275 PolarHBondContact O-N 2.92Å; T275-L278 PolarHBondContact O-N 3.19Å; T275-A279 WeakPolarHBondContact O-CB 3.47Å; T275-A279 PolarHBondContact O-N 2.82Å; T275-L301 HydrophobicContact CG2-CD2 4.41Å; T275-A304 HydrophobicContact CG2-CB 3.96Å; T275-A304 WeakPolarHBondContact O-CB 3.41Å; T275-S305 VanDerWaalsContact CG2-OG 3.22Å; T275-S305 WeakPolarHBondContact CG2-OG 3.23Å; T275-T308 PolarHBondContact OG1-OG1 3.01Å; T275-L310 HydrophobicContact CG2-CD1 4.42Å; T275-L310 WeakPolarHBondContact OG1-CD1 3.19Å; T275-W314 HydrophobicContact CG2-CZ2 3.8Å
276	C	51.8	Low	54.6	Low	4 Å²	4	25.5 Å²	25.5	3%	0.027	13%	0.134	C	C	.	.	H	α-helix	trans	-58	-50.5	172.3	-67.3	0	0	0	0	109.6	F125 I272 L273 L274 L278 A279 Y280 W297 L301	F125-C276 HydrophobicContact CD2-CB 4.43Å; F125-C276 HydrophobicContact CE2-CB 3.26Å; F125-C276 WeakPolarHBondContact CE2-O 3.14Å; F125-C276 HydrophobicContact CZ-CB 3.4Å; I272-C276 WeakPolarHBondContact O-CB 2.87Å; I272-C276 PolarHBondContact O-N 2.95Å; I272-C276 PolarHBondContact O-SG 3.17Å; L273-C276 PolarHBondContact O-N 3.28Å; L274-C276 VanDerWaalsContact C-N 3.35Å; C276-L278 VanDerWaalsContact C-N 3.31Å; C276-L278 PolarHBondContact O-N 3.43Å; C276-A279 WeakPolarHBondContact O-CB 3.5Å; C276-A279 PolarHBondContact O-N 3.16Å; C276-A279 VanDerWaalsContact O-N 3.11Å; C276-Y280 PolarHBondContact O-N 3.21Å; C276-W297 HydrophobicContact CB-CZ2 4.33Å; C276-W297 WeakPolarHBondContact O-CH2 3.27Å; C276-L301 HydrophobicContact CB-CD2 4.48Å
277	G	51.5	Low	54.6	Low	7 Å²	7	28.7 Å²	28.7	7%	0.072	15%	0.149	C	C	.	.	H	α-helix	trans	-67.6	-29.6	-178	0	0	0	0	0	114	L273 L274 Y280 F281	L273-G277 PolarHBondContact O-N 3.03Å; L274-G277 PolarHBondContact O-N 2.7Å; G277-Y280 WeakPolarHBondContact O-CB 3.48Å; G277-F281 WeakPolarHBondContact O-CB 3.38Å; G277-F281 PolarHBondContact O-N 3.06Å
278	L	53.9	Low	54.3	Low	29 Å²	29	28.3 Å²	28.3	15%	0.152	14%	0.137	C	C	.	.	H	α-helix	trans	-66.7	-39.4	170	-75.2	173.4	0	0	0	111.9	P93 Y97 L274 T275 C276 F281 S282 A304 T308	P93-L278 HydrophobicContact CB-CD1 4.49Å; Y97-L278 HydrophobicContact CD2-CD2 3.75Å; Y97-L278 HydrophobicContact CE2-CD2 4.33Å; Y97-L278 HydrophobicContact CG-CD2 4.48Å; L274-L278 WeakPolarHBondContact O-CB 3.43Å; L274-L278 VanDerWaalsContact O-CG 3.31Å; L274-L278 WeakPolarHBondContact O-CG 3.44Å; L274-L278 PolarHBondContact O-N 3.15Å; T275-L278 PolarHBondContact O-N 3.19Å; C276-L278 VanDerWaalsContact C-N 3.31Å; C276-L278 PolarHBondContact O-N 3.43Å; L278-F281 PolarHBondContact O-N 3.24Å; L278-S282 WeakPolarHBondContact O-CB 3.33Å; L278-S282 PolarHBondContact O-N 3.23Å; L278-S282 PolarHBondContact O-OG 3.05Å; L278-A304 HydrophobicContact CB-CB 3.7Å; L278-T308 HydrophobicContact CD1-CG2 3.72Å
279	A	51.8	Low	54.1	Low	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.7	-43.7	175.1	0	0	0	0	0	111.5	T275 C276 F281 S282 L283 W297 A300 L301 A304	T275-A279 WeakPolarHBondContact O-CB 3.47Å; T275-A279 PolarHBondContact O-N 2.82Å; C276-A279 WeakPolarHBondContact O-CB 3.5Å; C276-A279 PolarHBondContact O-N 3.16Å; C276-A279 VanDerWaalsContact O-N 3.11Å; A279-F281 PolarHBondContact O-N 2.81Å; A279-S282 WeakPolarHBondContact O-CB 3.32Å; A279-S282 PolarHBondContact O-N 3.31Å; A279-S282 VanDerWaalsContact O-N 3.15Å; A279-L283 PolarHBondContact O-N 2.73Å; A279-W297 HydrophobicContact CB-CH2 4.19Å; A279-W297 HydrophobicContact CB-CZ2 4.49Å; A279-W297 HydrophobicContact CB-CZ3 4.46Å; A279-A300 VanDerWaalsContact CB-C 3.5Å; A279-A300 HydrophobicContact CB-CB 3.96Å; A279-L301 HydrophobicContact CB-CB 4.37Å; A279-L301 HydrophobicContact CB-CD2 3.64Å; A279-L301 HydrophobicContact CB-CG 3.91Å; A279-A304 HydrophobicContact CB-CB 4.06Å
280	Y	50.1	Low	54.2	Low	33 Å²	33	33.9 Å²	33.9	13%	0.129	18%	0.178	C	C	.	.	H	α-helix	trans	-52.7	-54.6	172	178	-83.9	0	0	0	111.5	L121 D122 F125 C276 G277 S282 L283 E284	L121-Y280 HydrophobicContact CB-CE2 3.41Å; L121-Y280 VanDerWaalsContact CB-CE2 3.41Å; L121-Y280 WeakPolarHBondContact CB-OH 3.44Å; L121-Y280 HydrophobicContact CG-CE2 4.44Å; D122-Y280 PolarHBondContact OD1-OH 3.47Å; F125-Y280 HydrophobicContact CB-CD2 4.05Å; F125-Y280 HydrophobicContact CB-CE2 4.32Å; F125-Y280 HydrophobicContact CD2-CD2 4.05Å; F125-Y280 HydrophobicContact CD2-CG 4.42Å; F125-Y280 HydrophobicContact CG-CD2 4.31Å; C276-Y280 PolarHBondContact O-N 3.21Å; G277-Y280 WeakPolarHBondContact O-CB 3.48Å; Y280-S282 PolarHBondContact O-N 3.25Å; Y280-L283 PolarHBondContact O-N 2.65Å; Y280-L283 VanDerWaalsContact O-N 3.16Å; Y280-E284 WeakPolarHBondContact CE1-OE2 3.39Å; Y280-E284 PolarHBondContact O-N 3.36Å
281	F	52.7	Low	54.1	Low	29 Å²	29	37.3 Å²	37.3	13%	0.127	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-33.2	179.7	-171.9	-93.9	0	0	0	112.1	R100 L104 G277 L278 A279 E284 S285	R100-F281 HydrophobicContact CB-CE1 4.17Å; R100-F281 HydrophobicContact CB-CZ 4.43Å; L104-F281 HydrophobicContact CD1-CE2 3.79Å; L104-F281 HydrophobicContact CD1-CZ 3.93Å; G277-F281 WeakPolarHBondContact O-CB 3.38Å; G277-F281 PolarHBondContact O-N 3.06Å; L278-F281 PolarHBondContact O-N 3.24Å; A279-F281 PolarHBondContact O-N 2.81Å; F281-E284 PolarHBondContact O-N 3.48Å; F281-S285 WeakPolarHBondContact O-CB 3.46Å; F281-S285 PolarHBondContact O-N 3.01Å; F281-S285 PolarHBondContact O-OG 2.99Å
282	S	54.7	Low	54	Low	10 Å²	10	41.3 Å²	41.3	7%	0.07	22%	0.219	C	C	.	.	H	α-helix	trans	-68.6	-37.7	177.7	-61.1	0	0	0	0	112.1	L278 A279 Y280 A286	L278-S282 WeakPolarHBondContact O-CB 3.33Å; L278-S282 PolarHBondContact O-N 3.23Å; L278-S282 PolarHBondContact O-OG 3.05Å; A279-S282 WeakPolarHBondContact O-CB 3.32Å; A279-S282 PolarHBondContact O-N 3.31Å; A279-S282 VanDerWaalsContact O-N 3.15Å; Y280-S282 PolarHBondContact O-N 3.25Å; S282-A286 WeakPolarHBondContact O-CA 3.39Å; S282-A286 WeakPolarHBondContact O-CB 3.39Å; S282-A286 PolarHBondContact O-N 3.38Å
283	L	52	Low	54.4	Low	41 Å²	41	45.2 Å²	45.2	22%	0.215	24%	0.236	C	C	.	.	H	α-helix	trans	-68.6	-44.8	171.7	-70.2	170.8	0	0	0	111.6	A279 Y280 S285 A286 W297 A300	A279-L283 PolarHBondContact O-N 2.73Å; Y280-L283 PolarHBondContact O-N 2.65Å; Y280-L283 VanDerWaalsContact O-N 3.16Å; L283-S285 PolarHBondContact O-N 2.83Å; L283-A286 WeakPolarHBondContact O-CB 3.29Å; L283-A286 PolarHBondContact O-N 2.86Å; L283-A286 VanDerWaalsContact O-N 3.13Å; L283-W297 HydrophobicContact CD1-CB 4.48Å; L283-W297 HydrophobicContact CD1-CD2 4.39Å; L283-W297 HydrophobicContact CD1-CE3 3.38Å; L283-W297 HydrophobicContact CD1-CZ3 3.94Å; L283-A300 HydrophobicContact CD1-CB 4.08Å; L283-A300 HydrophobicContact CD2-CB 3.82Å; L283-A300 HydrophobicContact CG-CB 3.58Å
284	E	54	Low	54.5	Low	41 Å²	41	45.3 Å²	45.3	19%	0.192	24%	0.237	C	C	.	.	H	α-helix	trans	-59.1	-33.1	178.9	-157.1	-170.6	164.6	0	0	112.1	L112 Y280 F281	L112-E284 HydrophobicContact CD2-CG 3.32Å; Y280-E284 WeakPolarHBondContact CE1-OE2 3.39Å; Y280-E284 PolarHBondContact O-N 3.36Å; F281-E284 PolarHBondContact O-N 3.48Å
285	S	54.2	Low	54.6	Low	23 Å²	23	49.9 Å²	49.9	16%	0.161	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-0.3	179.9	61.4	0	0	0	0	114.5	F281 L283 D287 R288 A289	F281-S285 WeakPolarHBondContact O-CB 3.46Å; F281-S285 PolarHBondContact O-N 3.01Å; F281-S285 PolarHBondContact O-OG 2.99Å; L283-S285 PolarHBondContact O-N 2.83Å; S285-D287 PolarHBondContact O-N 3.3Å; S285-R288 PolarHBondContact O-N 3.33Å; S285-R288 VanDerWaalsContact O-N 3.11Å; S285-A289 WeakPolarHBondContact O-CB 3.28Å; S285-A289 PolarHBondContact O-N 2.91Å
286	A	55.9	Low	54.7	Low	5 Å²	5	52.5 Å²	52.5	4%	0.041	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-46.2	-173.7	0	0	0	0	0	112.2	S282 L283 R288 A289 N290 R291 L294	S282-A286 WeakPolarHBondContact O-CA 3.39Å; S282-A286 WeakPolarHBondContact O-CB 3.39Å; S282-A286 PolarHBondContact O-N 3.38Å; L283-A286 WeakPolarHBondContact O-CB 3.29Å; L283-A286 PolarHBondContact O-N 2.86Å; L283-A286 VanDerWaalsContact O-N 3.13Å; A286-R288 PolarHBondContact O-N 3.28Å; A286-A289 PolarHBondContact O-N 2.71Å; A286-N290 PolarHBondContact O-N 3.05Å; A286-R291 PolarHBondContact O-N 2.85Å; A286-L294 HydrophobicContact CB-CB 3.81Å
287	D	51.1	Low	54.9	Low	107 Å²	107	54.1 Å²	54.1	57%	0.572	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-38.9	177.5	-77.9	5.5	0	0	0	112.1	V113 S285	V113-D287 WeakPolarHBondContact CG1-OD2 3.43Å; V113-D287 HydrophobicContact CG2-CB 3.84Å; V113-D287 WeakPolarHBondContact CG2-OD2 3.28Å; S285-D287 PolarHBondContact O-N 3.3Å
288	R	51.6	Low	55.1	Low	121 Å²	121	58 Å²	58	46%	0.457	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-31.2	-179	-67.8	-179.9	175.4	-168.6	-7.2	113.1	L110 S285 A286 N290	L110-R288 VanDerWaalsContact CD2-NH1 3.34Å; S285-R288 PolarHBondContact O-N 3.33Å; S285-R288 VanDerWaalsContact O-N 3.11Å; A286-R288 PolarHBondContact O-N 3.28Å; R288-N290 VanDerWaalsContact C-N 3.3Å
289	A	53.6	Low	55.5	Low	50 Å²	50	58.5 Å²	58.5	41%	0.413	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	5.4	-177.4	0	0	0	0	0	112.8	S285 A286 R291	S285-A289 WeakPolarHBondContact O-CB 3.28Å; S285-A289 PolarHBondContact O-N 2.91Å; A286-A289 PolarHBondContact O-N 2.71Å; A289-R291 VanDerWaalsContact C-N 3.27Å; A289-R291 HydrophobicContact CB-CG 3.96Å; A289-R291 PolarHBondContact O-N 3.18Å
290	N	57	Low	55.7	Low	147 Å²	147	58.5 Å²	58.5	79%	0.786	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	44.8	-176.9	-146.8	14.3	0	0	0	111.5	A286 R288 P292	A286-N290 PolarHBondContact O-N 3.05Å; R288-N290 VanDerWaalsContact C-N 3.3Å; N290-P292 WeakPolarHBondContact O-CD 3.37Å
291	R	56.7	Low	56	Low	73 Å²	73	57.2 Å²	57.2	28%	0.275	30%	0.301	S	S	.	.			trans	-110.7	72.3	-179	-66.7	-174.3	176	-153.5	-9.4	111	A286 A289 H293 L294 E303	A286-R291 PolarHBondContact O-N 2.85Å; A289-R291 VanDerWaalsContact C-N 3.27Å; A289-R291 HydrophobicContact CB-CG 3.96Å; A289-R291 PolarHBondContact O-N 3.18Å; R291-H293 PolarHBondContact O-N 3.21Å; R291-L294 HydrophobicContact CB-CB 4.47Å; R291-L294 HydrophobicContact CB-CD1 3.92Å; R291-L294 HydrophobicContact CB-CG 4.42Å; R291-L294 VanDerWaalsContact CD-CD1 3.47Å; R291-L294 HydrophobicContact CG-CD1 4.38Å; R291-L294 PolarHBondContact O-N 3.43Å; R291-L294 VanDerWaalsContact O-N 3.09Å; R291-E303 IonicContact NH1-OE2 2.65Å; R291-E303 PolarHBondContact NH1-OE2 3.23Å
292	P	57.4	Low	56.2	Low	105 Å²	105	62.7 Å²	62.7	68%	0.682	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-6.6	-174.5	29.8	-37.7	0	0	0	114.2	N290 T295	N290-P292 WeakPolarHBondContact O-CD 3.37Å; P292-T295 VanDerWaalsContact O-CG2 3.26Å; P292-T295 WeakPolarHBondContact O-CG2 3.39Å
293	H	62.6	Low	56.5	Low	102 Å²	102	64.7 Å²	64.7	47%	0.472	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-16.4	175	55	-83.4	0	0	0	112.8	R291 T295 E303	R291-H293 PolarHBondContact O-N 3.21Å; H293-T295 PolarHBondContact O-N 2.64Å; H293-E303 IonicContact CD2-OE1 3.33Å; H293-E303 PolarHBondContact CD2-OE1 3.47Å; H293-E303 IonicContact NE2-OE1 3.76Å; H293-E303 PolarHBondContact NE2-OE1 3.41Å
294	L	60	Low	56.5	Low	7 Å²	7	62.9 Å²	62.9	4%	0.037	32%	0.32	C	S	.	.			trans	-84.4	63.6	175.7	-77.9	171.4	0	0	0	110.2	A286 R291 T299 A300 E303	A286-L294 HydrophobicContact CB-CB 3.81Å; R291-L294 HydrophobicContact CB-CB 4.47Å; R291-L294 HydrophobicContact CB-CD1 3.92Å; R291-L294 HydrophobicContact CB-CG 4.42Å; R291-L294 VanDerWaalsContact CD-CD1 3.47Å; R291-L294 HydrophobicContact CG-CD1 4.38Å; R291-L294 PolarHBondContact O-N 3.43Å; R291-L294 VanDerWaalsContact O-N 3.09Å; L294-T299 HydrophobicContact CD2-CG2 4.16Å; L294-A300 VanDerWaalsContact CD2-CA 3.47Å; L294-A300 HydrophobicContact CD2-CB 3.85Å; L294-E303 HydrophobicContact CD2-CG 4.33Å; L294-E303 WeakPolarHBondContact CD2-OE1 3.28Å
295	T	59.3	Low	56.3	Low	113 Å²	113	60.9 Å²	60.9	69%	0.693	31%	0.311	S	S	*	.			trans	-93.1	-15.8	-179.2	49.7	0	0	0	0	113.2	P292 H293	P292-T295 VanDerWaalsContact O-CG2 3.26Å; P292-T295 WeakPolarHBondContact O-CG2 3.39Å; H293-T295 PolarHBondContact O-N 2.64Å
296	D	57.7	Low	56.3	Low	56 Å²	56	64.4 Å²	64.4	30%	0.299	33%	0.328	S	S	.	.	S	Bend	trans	-140.8	156.2	-172.5	75.7	82.2	0	0	0	112.3	Q298 T299 A300	D296-Q298 VanDerWaalsContact C-N 3.3Å; D296-Q298 PolarHBondContact O-N 2.98Å; D296-Q298 VanDerWaalsContact OD1-CA 3.32Å; D296-Q298 WeakPolarHBondContact OD1-CA 3.39Å; D296-Q298 VanDerWaalsContact OD1-CB 3.26Å; D296-Q298 WeakPolarHBondContact OD1-CB 3.49Å; D296-Q298 PolarHBondContact OD1-N 3.44Å; D296-T299 PolarHBondContact O-N 2.99Å; D296-T299 PolarHBondContact OD1-N 3.34Å; D296-T299 PolarHBondContact OD1-OG1 3.41Å; D296-T299 WeakPolarHBondContact OD2-CB 3.1Å; D296-T299 PolarHBondContact OD2-OG1 3Å; D296-A300 PolarHBondContact O-N 3.14Å
297	W	55.8	Low	55.9	Low	38 Å²	38	67.6 Å²	67.6	14%	0.144	34%	0.344	C	S	.	.	H	α-helix	trans	-62.7	-32.7	-178.2	-175.3	-103.8	0	0	0	113.7	F125 R128 C276 A279 L283 L301	F125-W297 AromaticContact CD2-CH2 3.57Å; F125-W297 HydrophobicContact CD2-CH2 3.57Å; F125-W297 HydrophobicContact CD2-CZ2 4.21Å; F125-W297 HydrophobicContact CD2-CZ3 4.41Å; F125-W297 AromaticContact CE2-CH2 3.83Å; F125-W297 HydrophobicContact CE2-CH2 3.83Å; F125-W297 HydrophobicContact CE2-CZ2 4.3Å; R128-W297 VanDerWaalsContact NH1-CD1 3.27Å; C276-W297 HydrophobicContact CB-CZ2 4.33Å; C276-W297 WeakPolarHBondContact O-CH2 3.27Å; A279-W297 HydrophobicContact CB-CH2 4.19Å; A279-W297 HydrophobicContact CB-CZ2 4.49Å; A279-W297 HydrophobicContact CB-CZ3 4.46Å; L283-W297 HydrophobicContact CD1-CB 4.48Å; L283-W297 HydrophobicContact CD1-CD2 4.39Å; L283-W297 HydrophobicContact CD1-CE3 3.38Å; L283-W297 HydrophobicContact CD1-CZ3 3.94Å; W297-L301 HydrophobicContact CD2-CG 4.41Å; W297-L301 HydrophobicContact CG-CD1 4.26Å; W297-L301 HydrophobicContact CG-CG 4.44Å; W297-L301 HydrophobicContact CZ2-CD1 4.42Å; W297-L301 HydrophobicContact CZ2-CD2 4.01Å; W297-L301 HydrophobicContact CZ2-CG 4.18Å; W297-L301 VanDerWaalsContact O-CB 3.25Å; W297-L301 WeakPolarHBondContact O-CB 3.34Å; W297-L301 VanDerWaalsContact O-CG 3.27Å; W297-L301 WeakPolarHBondContact O-CG 3.03Å; W297-L301 PolarHBondContact O-N 2.77Å
298	Q	56	Low	55.5	Low	89 Å²	89	63.5 Å²	63.5	42%	0.416	32%	0.323	S	S	.	.	H	α-helix	trans	-71.6	-38.6	-178.8	-59.6	177.5	-12.3	0	0	110.6	D296 R302	D296-Q298 VanDerWaalsContact C-N 3.3Å; D296-Q298 PolarHBondContact O-N 2.98Å; D296-Q298 VanDerWaalsContact OD1-CA 3.32Å; D296-Q298 WeakPolarHBondContact OD1-CA 3.39Å; D296-Q298 VanDerWaalsContact OD1-CB 3.26Å; D296-Q298 WeakPolarHBondContact OD1-CB 3.49Å; D296-Q298 PolarHBondContact OD1-N 3.44Å; Q298-R302 VanDerWaalsContact O-CB 3.26Å; Q298-R302 WeakPolarHBondContact O-CB 3.45Å; Q298-R302 PolarHBondContact O-N 2.63Å
299	T	60.9	Low	55.1	Low	39 Å²	39	61.7 Å²	61.7	24%	0.239	33%	0.329	C	S	.	.	H	α-helix	trans	-67.6	-44.9	174.7	-57.5	0	0	0	0	110.9	L294 D296 L301 R302 E303	L294-T299 HydrophobicContact CD2-CG2 4.16Å; D296-T299 PolarHBondContact O-N 2.99Å; D296-T299 PolarHBondContact OD1-N 3.34Å; D296-T299 PolarHBondContact OD1-OG1 3.41Å; D296-T299 WeakPolarHBondContact OD2-CB 3.1Å; D296-T299 PolarHBondContact OD2-OG1 3Å; T299-L301 PolarHBondContact O-N 3.12Å; T299-R302 WeakPolarHBondContact O-CB 3.42Å; T299-R302 PolarHBondContact O-N 3.32Å; T299-E303 PolarHBondContact O-N 3.15Å
300	A	57.2	Low	54.5	Low	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-42.1	176.1	0	0	0	0	0	113.1	A279 L283 L294 D296 E303 A304	A279-A300 VanDerWaalsContact CB-C 3.5Å; A279-A300 HydrophobicContact CB-CB 3.96Å; L283-A300 HydrophobicContact CD1-CB 4.08Å; L283-A300 HydrophobicContact CD2-CB 3.82Å; L283-A300 HydrophobicContact CG-CB 3.58Å; L294-A300 VanDerWaalsContact CD2-CA 3.47Å; L294-A300 HydrophobicContact CD2-CB 3.85Å; D296-A300 PolarHBondContact O-N 3.14Å; A300-E303 PolarHBondContact O-N 3.21Å; A300-A304 WeakPolarHBondContact O-CB 3.15Å; A300-A304 PolarHBondContact O-N 3.11Å
301	L	55.1	Low	53.4	Low	5 Å²	5	57.3 Å²	57.3	3%	0.026	29%	0.291	C	S	.	.	H	α-helix	trans	-62.9	-43.4	172.6	-81.1	175.8	0	0	0	111.6	T275 C276 A279 W297 T299 E303 A304 S305 W314	T275-L301 HydrophobicContact CG2-CD2 4.41Å; C276-L301 HydrophobicContact CB-CD2 4.48Å; A279-L301 HydrophobicContact CB-CB 4.37Å; A279-L301 HydrophobicContact CB-CD2 3.64Å; A279-L301 HydrophobicContact CB-CG 3.91Å; W297-L301 HydrophobicContact CD2-CG 4.41Å; W297-L301 HydrophobicContact CG-CD1 4.26Å; W297-L301 HydrophobicContact CG-CG 4.44Å; W297-L301 HydrophobicContact CZ2-CD1 4.42Å; W297-L301 HydrophobicContact CZ2-CD2 4.01Å; W297-L301 HydrophobicContact CZ2-CG 4.18Å; W297-L301 VanDerWaalsContact O-CB 3.25Å; W297-L301 WeakPolarHBondContact O-CB 3.34Å; W297-L301 VanDerWaalsContact O-CG 3.27Å; W297-L301 WeakPolarHBondContact O-CG 3.03Å; W297-L301 PolarHBondContact O-N 2.77Å; T299-L301 PolarHBondContact O-N 3.12Å; L301-E303 VanDerWaalsContact C-N 3.33Å; L301-E303 PolarHBondContact O-N 3.25Å; L301-A304 PolarHBondContact O-N 3.14Å; L301-S305 WeakPolarHBondContact O-CB 3.19Å; L301-S305 PolarHBondContact O-N 3.42Å; L301-S305 PolarHBondContact O-OG 3.29Å; L301-W314 HydrophobicContact CB-CZ3 4.48Å; L301-W314 HydrophobicContact CD1-CE3 4.31Å; L301-W314 HydrophobicContact CD1-CH2 3.74Å; L301-W314 HydrophobicContact CD1-CZ3 3.48Å; L301-W314 VanDerWaalsContact CD1-CZ3 3.48Å; L301-W314 HydrophobicContact CD2-CH2 3.54Å; L301-W314 HydrophobicContact CD2-CZ2 3.98Å; L301-W314 HydrophobicContact CD2-CZ3 4.14Å; L301-W314 HydrophobicContact CG-CH2 4.17Å; L301-W314 HydrophobicContact CG-CZ3 4.28Å
302	R	57.7	Low	52.3	Low	145 Å²	145	56.8 Å²	56.8	55%	0.547	30%	0.297	S	S	.	.	H	α-helix	trans	-60.7	-43.9	178.7	-170.1	-178.4	-58.8	-176.1	3.6	111.3	Q298 T299 S305 N306 Y311	Q298-R302 VanDerWaalsContact O-CB 3.26Å; Q298-R302 WeakPolarHBondContact O-CB 3.45Å; Q298-R302 PolarHBondContact O-N 2.63Å; T299-R302 WeakPolarHBondContact O-CB 3.42Å; T299-R302 PolarHBondContact O-N 3.32Å; R302-S305 PolarHBondContact O-N 3.33Å; R302-N306 PolarHBondContact O-N 3.29Å; R302-N306 PolarHBondContact O-ND2 3.4Å; R302-N306 PolarHBondContact O-OD1 3.29Å; R302-Y311 HydrophobicContact CG-CE2 4.39Å
303	E	60.1	Low	51.3	Low	51 Å²	51	55.6 Å²	55.6	24%	0.238	28%	0.281	C	S	.	.	H	α-helix	trans	-62.3	-49	174.5	-78.9	-169.8	-153.6	0	0	112.2	R291 H293 L294 T299 A300 L301 S305 N306 D307	R291-E303 IonicContact NH1-OE2 2.65Å; R291-E303 PolarHBondContact NH1-OE2 3.23Å; H293-E303 IonicContact CD2-OE1 3.33Å; H293-E303 PolarHBondContact CD2-OE1 3.47Å; H293-E303 IonicContact NE2-OE1 3.76Å; H293-E303 PolarHBondContact NE2-OE1 3.41Å; L294-E303 HydrophobicContact CD2-CG 4.33Å; L294-E303 WeakPolarHBondContact CD2-OE1 3.28Å; T299-E303 PolarHBondContact O-N 3.15Å; A300-E303 PolarHBondContact O-N 3.21Å; L301-E303 VanDerWaalsContact C-N 3.33Å; L301-E303 PolarHBondContact O-N 3.25Å; E303-S305 VanDerWaalsContact C-N 3.27Å; E303-S305 PolarHBondContact O-N 3.48Å; E303-N306 PolarHBondContact O-N 3.07Å; E303-D307 PolarHBondContact O-N 2.89Å
304	A	53.2	Low	50.2	Low	3 Å²	3	51.8 Å²	51.8	3%	0.025	26%	0.263	C	S	.	.	H	α-helix	trans	-61.8	-36.2	177.9	0	0	0	0	0	112.4	T275 L278 A279 A300 L301 D307 T308	T275-A304 HydrophobicContact CG2-CB 3.96Å; T275-A304 WeakPolarHBondContact O-CB 3.41Å; L278-A304 HydrophobicContact CB-CB 3.7Å; A279-A304 HydrophobicContact CB-CB 4.06Å; A300-A304 WeakPolarHBondContact O-CB 3.15Å; A300-A304 PolarHBondContact O-N 3.11Å; L301-A304 PolarHBondContact O-N 3.14Å; A304-D307 WeakPolarHBondContact O-CB 3.45Å; A304-D307 PolarHBondContact O-N 2.85Å; A304-T308 WeakPolarHBondContact O-CG2 3.42Å; A304-T308 PolarHBondContact O-N 3.47Å; A304-T308 VanDerWaalsContact O-N 3.09Å; A304-T308 PolarHBondContact O-OG1 3.37Å
305	S	50.1	Low	49	Very low	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-73.1	-31.5	-178.7	-58.9	0	0	0	0	113.3	T275 L301 R302 E303 D307 T308 S309 L310 Y311 W314	T275-S305 VanDerWaalsContact CG2-OG 3.22Å; T275-S305 WeakPolarHBondContact CG2-OG 3.23Å; L301-S305 WeakPolarHBondContact O-CB 3.19Å; L301-S305 PolarHBondContact O-N 3.42Å; L301-S305 PolarHBondContact O-OG 3.29Å; R302-S305 PolarHBondContact O-N 3.33Å; E303-S305 VanDerWaalsContact C-N 3.27Å; E303-S305 PolarHBondContact O-N 3.48Å; S305-D307 VanDerWaalsContact C-N 3.3Å; S305-T308 WeakPolarHBondContact CA-OG1 3.36Å; S305-T308 PolarHBondContact O-N 3.37Å; S305-S309 PolarHBondContact O-N 3.09Å; S305-L310 PolarHBondContact O-N 3.49Å; S305-L310 VanDerWaalsContact O-N 3.07Å; S305-Y311 PolarHBondContact O-N 3.31Å; S305-W314 VanDerWaalsContact CB-CD1 3.44Å; S305-W314 VanDerWaalsContact OG-CE2 3.29Å; S305-W314 PolarHBondContact OG-NE1 2.87Å
306	N	52.8	Low	47.7	Very low	97 Å²	97	58 Å²	58	52%	0.519	29%	0.292	S	S	.	.	H	α-helix	trans	-65.7	-38.9	171.4	-71.9	-15.7	0	0	0	110.3	R302 E303 T308 Y311	R302-N306 PolarHBondContact O-N 3.29Å; R302-N306 PolarHBondContact O-ND2 3.4Å; R302-N306 PolarHBondContact O-OD1 3.29Å; E303-N306 PolarHBondContact O-N 3.07Å; N306-T308 VanDerWaalsContact C-N 3.35Å; N306-Y311 WeakPolarHBondContact OD1-CD2 3.42Å
307	D	47.3	Very low	46.5	Very low	72 Å²	72	58.4 Å²	58.4	39%	0.385	29%	0.294	S	S	.	.	H	α-helix	trans	-68.8	-30.9	176	-87.7	-6.3	0	0	0	112.3	R96 E303 A304 S305	R96-D307 IonicContact NH1-OD1 2.63Å; R96-D307 PolarHBondContact NH1-OD1 3.47Å; R96-D307 IonicContact NH1-OD2 3.96Å; R96-D307 PolarHBondContact NH1-OD2 3.47Å; E303-D307 PolarHBondContact O-N 2.89Å; A304-D307 WeakPolarHBondContact O-CB 3.45Å; A304-D307 PolarHBondContact O-N 2.85Å; S305-D307 VanDerWaalsContact C-N 3.3Å
308	T	42.8	Very low	45.2	Very low	21 Å²	21	62.3 Å²	62.3	13%	0.129	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	7.3	-176.3	59.3	0	0	0	0	115.4	P93 T275 L278 A304 S305 N306 L310	P93-T308 HydrophobicContact CB-CG2 4.41Å; P93-T308 HydrophobicContact CG-CG2 4.39Å; T275-T308 PolarHBondContact OG1-OG1 3.01Å; L278-T308 HydrophobicContact CD1-CG2 3.72Å; A304-T308 WeakPolarHBondContact O-CG2 3.42Å; A304-T308 PolarHBondContact O-N 3.47Å; A304-T308 VanDerWaalsContact O-N 3.09Å; A304-T308 PolarHBondContact O-OG1 3.37Å; S305-T308 WeakPolarHBondContact CA-OG1 3.36Å; S305-T308 PolarHBondContact O-N 3.37Å; N306-T308 VanDerWaalsContact C-N 3.35Å; T308-L310 PolarHBondContact O-N 3.24Å; T308-L310 VanDerWaalsContact O-N 3.14Å; T308-L310 WeakPolarHBondContact OG1-CG 3.23Å
309	S	44.5	Very low	44.1	Very low	82 Å²	82	61.6 Å²	61.6	57%	0.573	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	19.7	-174.9	71.1	0	0	0	0	114.7	S305	S305-S309 PolarHBondContact O-N 3.09Å
310	L	41	Very low	42.5	Very low	2 Å²	2	64.8 Å²	64.8	1%	0.01	35%	0.346	C	S	.	.			trans	-88.1	-4	179.2	-67.2	-171.9	0	0	0	113.8	E271 T275 S305 T308 P312 F313	E271-L310 VanDerWaalsContact C-CD1 3.44Å; E271-L310 HydrophobicContact CB-CD1 3.61Å; E271-L310 HydrophobicContact CB-CD2 3.76Å; E271-L310 HydrophobicContact CB-CG 4.13Å; E271-L310 HydrophobicContact CG-CD2 4.39Å; E271-L310 VanDerWaalsContact O-CD1 3.28Å; E271-L310 WeakPolarHBondContact O-CD1 2.92Å; T275-L310 HydrophobicContact CG2-CD1 4.42Å; T275-L310 WeakPolarHBondContact OG1-CD1 3.19Å; S305-L310 PolarHBondContact O-N 3.49Å; S305-L310 VanDerWaalsContact O-N 3.07Å; T308-L310 PolarHBondContact O-N 3.24Å; T308-L310 VanDerWaalsContact O-N 3.14Å; T308-L310 WeakPolarHBondContact OG1-CG 3.23Å; L310-P312 WeakPolarHBondContact O-CD 3.41Å; L310-F313 HydrophobicContact CD2-CD2 4.15Å; L310-F313 WeakPolarHBondContact O-CB 3.45Å; L310-F313 PolarHBondContact O-N 3.43Å
311	Y	32.2	Very low	41.1	Very low	104 Å²	104	68.9 Å²	68.9	41%	0.408	38%	0.375	S	S	.	.	H	α-helix	trans	-41.5	-40.3	179.3	-167.1	-100.9	0	0	0	115.2	R302 S305 N306 F313 W314 N315	R302-Y311 HydrophobicContact CG-CE2 4.39Å; S305-Y311 PolarHBondContact O-N 3.31Å; N306-Y311 WeakPolarHBondContact OD1-CD2 3.42Å; Y311-F313 VanDerWaalsContact C-N 3.26Å; Y311-F313 PolarHBondContact O-N 2.74Å; Y311-W314 PolarHBondContact O-N 2.73Å; Y311-N315 VanDerWaalsContact CE1-ND2 3.27Å; Y311-N315 WeakPolarHBondContact CE1-ND2 3.17Å; Y311-N315 PolarHBondContact O-N 3.29Å
312	P	35.1	Very low	39.7	Very low	61 Å²	61	71.5 Å²	71.5	40%	0.396	39%	0.393	S	S	.	.	H	α-helix	trans	-63.2	-24.5	176.4	-22.2	34.5	0	0	0	115.3	L310 N316	L310-P312 WeakPolarHBondContact O-CD 3.41Å; P312-N316 PolarHBondContact O-ND2 2.79Å
313	F	36	Very low	38.2	Very low	80 Å²	80	72 Å²	72	35%	0.351	40%	0.401	S	S	.	.	H	α-helix	trans	-81.1	-34.5	179.1	-66.3	-90.8	0	0	0	111.3	R268 L310 Y311 N316	R268-F313 VanDerWaalsContact CD-CZ 3.41Å; R268-F313 HydrophobicContact CG-CE1 4.48Å; L310-F313 HydrophobicContact CD2-CD2 4.15Å; L310-F313 WeakPolarHBondContact O-CB 3.45Å; L310-F313 PolarHBondContact O-N 3.43Å; Y311-F313 VanDerWaalsContact C-N 3.26Å; Y311-F313 PolarHBondContact O-N 2.74Å; F313-N316 PolarHBondContact O-N 3.12Å
314	W	38.7	Very low	36.9	Very low	22 Å²	22	77.7 Å²	77.7	8%	0.083	42%	0.421	C	S	.	.	H	α-helix	trans	-75.7	-33.4	-176.3	-66.1	96.7	0	0	0	113.5	Y133 T275 L301 S305 Y311 N316 L317 F319	Y133-W314 WeakPolarHBondContact OH-CH2 3.49Å; Y133-W314 WeakPolarHBondContact OH-CZ3 3.41Å; T275-W314 HydrophobicContact CG2-CZ2 3.8Å; L301-W314 HydrophobicContact CB-CZ3 4.48Å; L301-W314 HydrophobicContact CD1-CE3 4.31Å; L301-W314 HydrophobicContact CD1-CH2 3.74Å; L301-W314 HydrophobicContact CD1-CZ3 3.48Å; L301-W314 VanDerWaalsContact CD1-CZ3 3.48Å; L301-W314 HydrophobicContact CD2-CH2 3.54Å; L301-W314 HydrophobicContact CD2-CZ2 3.98Å; L301-W314 HydrophobicContact CD2-CZ3 4.14Å; L301-W314 HydrophobicContact CG-CH2 4.17Å; L301-W314 HydrophobicContact CG-CZ3 4.28Å; S305-W314 VanDerWaalsContact CB-CD1 3.44Å; S305-W314 VanDerWaalsContact OG-CE2 3.29Å; S305-W314 PolarHBondContact OG-NE1 2.87Å; Y311-W314 PolarHBondContact O-N 2.73Å; W314-N316 PolarHBondContact O-N 3.08Å; W314-N316 VanDerWaalsContact O-N 3.16Å; W314-L317 HydrophobicContact CD2-CD1 4.3Å; W314-L317 HydrophobicContact CE3-CD1 3.9Å; W314-L317 HydrophobicContact CZ3-CD1 4.16Å; W314-L317 PolarHBondContact O-N 3.18Å; W314-L317 VanDerWaalsContact O-N 3.1Å; W314-F319 HydrophobicContact CE3-CE1 4.3Å; W314-F319 AromaticContact CE3-CE2 3.83Å; W314-F319 HydrophobicContact CE3-CE2 3.83Å; W314-F319 AromaticContact CE3-CZ 3.3Å; W314-F319 HydrophobicContact CE3-CZ 3.3Å; W314-F319 AromaticContact CZ3-CE1 3.96Å; W314-F319 HydrophobicContact CZ3-CE1 3.96Å; W314-F319 HydrophobicContact CZ3-CE2 4.31Å; W314-F319 AromaticContact CZ3-CZ 3.38Å; W314-F319 HydrophobicContact CZ3-CZ 3.38Å
315	N	35.6	Very low	35.7	Very low	109 Å²	109	85.2 Å²	85.2	58%	0.583	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-16.6	175.5	-83.4	-12.1	0	0	0	113.7	Y311	Y311-N315 VanDerWaalsContact CE1-ND2 3.27Å; Y311-N315 WeakPolarHBondContact CE1-ND2 3.17Å; Y311-N315 PolarHBondContact O-N 3.29Å
316	N	32.6	Very low	34.7	Very low	141 Å²	141	93.6 Å²	93.6	75%	0.754	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-3.1	176.7	-69.7	-39.2	0	0	0	113.5	P312 F313 W314	P312-N316 PolarHBondContact O-ND2 2.79Å; F313-N316 PolarHBondContact O-N 3.12Å; W314-N316 PolarHBondContact O-N 3.08Å; W314-N316 VanDerWaalsContact O-N 3.16Å
317	L	32.7	Very low	33.5	Very low	65 Å²	65	95.9 Å²	95.9	34%	0.34	51%	0.507	S	S	.	.			trans	-95.5	105.8	177.9	-67.6	169.7	0	0	0	108.9	Y133 W314 F319	Y133-L317 HydrophobicContact CE1-CD1 4.36Å; W314-L317 HydrophobicContact CD2-CD1 4.3Å; W314-L317 HydrophobicContact CE3-CD1 3.9Å; W314-L317 HydrophobicContact CZ3-CD1 4.16Å; W314-L317 PolarHBondContact O-N 3.18Å; W314-L317 VanDerWaalsContact O-N 3.1Å; L317-F319 HydrophobicContact CB-CD2 4.42Å; L317-F319 HydrophobicContact CB-CE1 4.35Å; L317-F319 HydrophobicContact CB-CE2 3.59Å; L317-F319 HydrophobicContact CB-CZ 3.51Å; L317-F319 HydrophobicContact CD1-CZ 3.94Å; L317-F319 HydrophobicContact CG-CZ 4.36Å; L317-F319 WeakPolarHBondContact O-CD2 3.36Å; L317-F319 VanDerWaalsContact O-CE2 3.28Å; L317-F319 WeakPolarHBondContact O-CE2 3.22Å; L317-F319 PolarHBondContact O-N 3.5Å; L317-F319 VanDerWaalsContact O-N 3.09Å
318	S	27.9	Very low	32.6	Very low	120 Å²	120	100.3 Å²	100.3	84%	0.839	53%	0.531	S	S	*	.			trans	-70.5	100	170.6	52.4	0	0	0	0	109.4	S320	S318-S320 PolarHBondContact O-N 3.04Å
319	F	32	Very low	31.8	Very low	75 Å²	75	102.5 Å²	102.5	33%	0.329	56%	0.558	S	S	.	*			trans	-77.6	107.7	174.4	-65.7	-76.5	0	0	0	110.1	W314 L317 S321	W314-F319 HydrophobicContact CE3-CE1 4.3Å; W314-F319 AromaticContact CE3-CE2 3.83Å; W314-F319 HydrophobicContact CE3-CE2 3.83Å; W314-F319 AromaticContact CE3-CZ 3.3Å; W314-F319 HydrophobicContact CE3-CZ 3.3Å; W314-F319 AromaticContact CZ3-CE1 3.96Å; W314-F319 HydrophobicContact CZ3-CE1 3.96Å; W314-F319 HydrophobicContact CZ3-CE2 4.31Å; W314-F319 AromaticContact CZ3-CZ 3.38Å; W314-F319 HydrophobicContact CZ3-CZ 3.38Å; L317-F319 HydrophobicContact CB-CD2 4.42Å; L317-F319 HydrophobicContact CB-CE1 4.35Å; L317-F319 HydrophobicContact CB-CE2 3.59Å; L317-F319 HydrophobicContact CB-CZ 3.51Å; L317-F319 HydrophobicContact CD1-CZ 3.94Å; L317-F319 HydrophobicContact CG-CZ 4.36Å; L317-F319 WeakPolarHBondContact O-CD2 3.36Å; L317-F319 VanDerWaalsContact O-CE2 3.28Å; L317-F319 WeakPolarHBondContact O-CE2 3.22Å; L317-F319 PolarHBondContact O-N 3.5Å; L317-F319 VanDerWaalsContact O-N 3.09Å; F319-S321 PolarHBondContact O-N 2.73Å
320	S	28.1	Very low	30.9	Very low	105 Å²	105	106.3 Å²	106.3	73%	0.734	57%	0.571	S	S	*	*			trans	-64.8	122.3	159.6	43.8	0	0	0	0	108.3	S318 C322	S318-S320 PolarHBondContact O-N 3.04Å; S320-C322 PolarHBondContact O-N 2.8Å; S320-C322 VanDerWaalsContact O-N 3.08Å
321	S	27.9	Very low	30.3	Very low	86 Å²	86	111.2 Å²	111.2	60%	0.601	61%	0.606	S	S	*	*			trans	-52.5	115.1	172.7	50.2	0	0	0	0	109.7	F319 H323	F319-S321 PolarHBondContact O-N 2.73Å; S321-H323 PolarHBondContact O-N 3.1Å
322	C	26	Very low	30	Very low	60 Å²	60	110.2 Å²	110.2	41%	0.405	61%	0.614	S	S	.	*			trans	-65	97.6	172.9	-112	0	0	0	0	109	S320 W324	S320-C322 PolarHBondContact O-N 2.8Å; S320-C322 VanDerWaalsContact O-N 3.08Å; C322-W324 PolarHBondContact O-N 3.15Å; C322-W324 PolarHBondContact SG-NE1 2.98Å; C322-W324 VanDerWaalsContact SG-NE1 3.44Å
323	H	25.8	Very low	29.6	Very low	156 Å²	156	113.9 Å²	113.9	72%	0.722	63%	0.63	S	S	*	*			trans	-80.7	97.4	170	-111.2	-74.2	0	0	0	108.4	S321	S321-H323 PolarHBondContact O-N 3.1Å
324	W	33.4	Very low	29.4	Very low	170 Å²	170	117 Å²	117	64%	0.644	66%	0.656	S	S	*	*			trans	-112	3.8	175.4	-78	94.3	0	0	0	114.3	C322 E326	C322-W324 PolarHBondContact O-N 3.15Å; C322-W324 PolarHBondContact SG-NE1 2.98Å; C322-W324 VanDerWaalsContact SG-NE1 3.44Å; W324-E326 PolarHBondContact O-N 3.4Å
325	D	27.5	Very low	28.9	Very low	162 Å²	162	124.5 Å²	124.5	87%	0.866	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	5.2	178.8	-88.2	-22.5	0	0	0	115.4
326	E	28.7	Very low	28.4	Very low	175 Å²	175	128.1 Å²	128.1	82%	0.818	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.9	8.9	-176.1	-71.8	-170.1	157.1	0	0	116.2	W324	W324-E326 PolarHBondContact O-N 3.4Å
327	Q	28.5	Very low	28.2	Very low	146 Å²	146	126.3 Å²	126.3	68%	0.682	70%	0.704	S	S	*	*			trans	-117.4	5.5	178.2	-77.4	-163.7	-7.3	0	0	117.1	G329	Q327-G329 PolarHBondContact O-N 3.47Å
328	N	27.7	Very low	27.7	Very low	164 Å²	164	129.7 Å²	129.7	88%	0.877	73%	0.731	S	S	*	*			trans	-81.3	56.9	164.4	-78.5	-11.6	0	0	0	111.5
329	G	25.2	Very low	27.6	Very low	68 Å²	68	128.8 Å²	128.8	70%	0.701	73%	0.725	S	S	*	*			trans	-109.5	40.3	162.4	0	0	0	0	0	110.4	Q327 S331	Q327-G329 PolarHBondContact O-N 3.47Å; G329-S331 VanDerWaalsContact C-N 3.26Å; G329-S331 PolarHBondContact O-N 3.36Å
330	L	27.6	Very low	27.2	Very low	161 Å²	161	134.2 Å²	134.2	84%	0.843	75%	0.751	S	S	*	*			trans	-81.6	83.8	173	-70.9	174.9	0	0	0	109
331	S	27.5	Very low	27.3	Very low	106 Å²	106	134.3 Å²	134.3	74%	0.741	75%	0.752	S	S	*	*			trans	-44	138.1	152.5	178.8	0	0	0	0	109.8	G329	G329-S331 VanDerWaalsContact C-N 3.26Å; G329-S331 PolarHBondContact O-N 3.36Å
332	S	25.8	Very low	27.1	Very low	82 Å²	82	138.8 Å²	138.8	57%	0.573	77%	0.768	S	S	*	*	S	Bend	trans	-50.8	153.2	173.4	56.2	0	0	0	0	112.5
333	D	27.3	Very low	27.2	Very low	138 Å²	138	143.4 Å²	143.4	74%	0.738	79%	0.787	S	S	*	*			trans	103.2	127.6	153.5	-51.7	-43.7	0	0	0	116.8
334	T	31.3	Very low	27.3	Very low	146 Å²	146	145.2 Å²	145.2	90%	0.896	79%	0.793	S	S	*	*			trans	102.2	118.9	155.8	56.4	0	0	0	0	119
335	E	27.5	Very low	27.1	Very low	180 Å²	180	147.3 Å²	147.3	84%	0.841	81%	0.806	S	S	*	*			trans	-73.5	174.8	-178.2	-53.2	-176.3	136.9	0	0	112.3
336	E	26	Very low	27.4	Very low	185 Å²	185	148.5 Å²	148.5	86%	0.864	81%	0.807	S	S	*	*			trans	78	103.1	159.7	-63.3	-171.9	137.8	0	0	118.4
337	S	27.6	Very low	27.5	Very low	103 Å²	103	149.1 Å²	149.1	72%	0.72	81%	0.81	S	S	*	*				139.7	111.6	106.2	-167.8	0	0	0	0	112.1
338	C	21.7	Very low	27.6	Very low	135 Å²	135	147.6 Å²	147.6	91%	0.912	81%	0.812	S	S	*	*			trans	-66.7	124.7	157.3	-81.6	0	0	0	0	108.9
339	S	26.9	Very low	28	Very low	101 Å²	101	147.7 Å²	147.7	71%	0.706	81%	0.813	S	S	*	*			trans	-148	133.7	156.2	-31.9	0	0	0	0	111.3
340	E	23.3	Very low	28.6	Very low	189 Å²	189	152.5 Å²	152.5	88%	0.883	82%	0.817	S	S	*	*			trans	-46.5	148.4	176	-60.6	157.5	126.8	0	0	114.6
341	S	29.7	Very low	28.9	Very low	107 Å²	107	153.7 Å²	153.7	75%	0.748	82%	0.818	S	S	*	*				-172.6	107.7	129.4	28.4	0	0	0	0	112.7	I343	S341-I343 PolarHBondContact O-N 2.86Å
342	L	24.3	Very low	29.2	Very low	180 Å²	180	152.4 Å²	152.4	94%	0.942	82%	0.822	S	S	*	*			trans	-56.1	119.1	151.2	-82.1	149.7	0	0	0	109.9
343	I	28.1	Very low	29.5	Very low	158 Å²	158	158.4 Å²	158.4	81%	0.81	84%	0.838	S	S	*	*			trans	-138.5	126.1	156.2	-58.8	-176.7	0	0	0	111	S341	S341-I343 PolarHBondContact O-N 2.86Å
344	K	28.7	Very low	30	Very low	193 Å²	193	160.8 Å²	160.8	84%	0.839	85%	0.845	S	S	*	*			trans	-52.6	138.9	176.1	-65.5	167.7	174.1	177.2	0	112.7
345	K	29.5	Very low	30.2	Very low	214 Å²	214	162 Å²	162	93%	0.93	84%	0.84	S	S	*	*			trans	-95.3	105.3	158	-93	-178.3	173.7	175.7	0	109.3
346	E	33	Very low	30.3	Very low	187 Å²	187	158.5 Å²	158.5	87%	0.874	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-77.2	155.8	154.8	-85.8	177	147.1	0	0	110
347	Q	30.5	Very low	30.7	Very low	189 Å²	189	159.2 Å²	159.2	88%	0.883	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-65.2	163.1	-170.1	-91.3	178.3	-28.2	0	0	115.3
348	P	31.3	Very low	31	Very low	113 Å²	113	163 Å²	163	73%	0.734	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-90.3	138.7	-171	35.5	-28.7	0	0	0	111.4
349	D	35.7	Very low	31.7	Very low	166 Å²	166	166.1 Å²	166.1	89%	0.888	85%	0.845	S	S	*	*			trans	-131.5	126.5	161.9	-83.1	-33.2	0	0	0	110.7
350	E	36.8	Very low	32	Very low	169 Å²	169	165.3 Å²	165.3	79%	0.79	85%	0.853	S	S	*	*			trans	-2.5	153.5	161.4	-70.4	-166.3	145.8	0	0	123.8
351	E	35.4	Very low	32.5	Very low	186 Å²	186	162.7 Å²	162.7	87%	0.869	85%	0.845	S	S	*	*			trans	85	114.9	149.1	-78.3	176.5	179.7	0	0	119.9
352	G	33.3	Very low	33	Very low	80 Å²	80	166.6 Å²	166.6	83%	0.825	85%	0.848	S	S	*	*			trans	156.8	81.8	157.1	0	0	0	0	0	115.1
353	K	32.7	Very low	33.4	Very low	207 Å²	207	164.8 Å²	164.8	90%	0.9	84%	0.839	S	S	*	*			trans	-61.9	141.5	169.7	-64.5	170.7	176.3	175	0	111.4
354	E	37	Very low	33.6	Very low	189 Å²	189	161.2 Å²	161.2	88%	0.883	84%	0.841	S	S	*	*				-167.8	157.4	129.8	-113.3	174.1	-177	0	0	113.6
355	E	35.2	Very low	33.7	Very low	170 Å²	170	160.6 Å²	160.6	79%	0.794	84%	0.842	S	S	*	*			trans	-84.9	144.7	-148.3	-70.5	171.9	143.8	0	0	117.6
356	C	29.5	Very low	33.7	Very low	108 Å²	108	157.5 Å²	157.5	73%	0.73	84%	0.84	S	S	*	*				46.9	124.8	124	-54.4	0	0	0	0	121.1
357	H	35	Very low	33.5	Very low	199 Å²	199	155.4 Å²	155.4	92%	0.921	83%	0.834	S	S	*	*			trans	-149.9	126.8	131.1	-91.9	-61.8	0	0	0	112
358	E	34.7	Very low	33.3	Very low	183 Å²	183	152.4 Å²	152.4	86%	0.855	83%	0.829	S	S	*	*			trans	-64	148.6	174	-63.5	169.2	128.7	0	0	113.2
359	Q	35.6	Very low	33.3	Very low	201 Å²	201	155.9 Å²	155.9	94%	0.939	84%	0.835	S	S	*	*				178.9	131.6	123.5	-101.8	170.3	4.2	0	0	111.7
360	G	32.6	Very low	32.9	Very low	84 Å²	84	152.5 Å²	152.5	87%	0.866	83%	0.83	S	S	*	*			trans	131	77.1	150	0	0	0	0	0	117.5
361	N	33.9	Very low	32.7	Very low	134 Å²	134	153.2 Å²	153.2	72%	0.717	83%	0.834	S	S	*	*			trans	-69.2	150.1	177.8	-163	14.4	0	0	0	114.6
362	K	39.9	Very low	32.3	Very low	188 Å²	188	147.6 Å²	147.6	82%	0.817	83%	0.825	S	S	*	*				176.2	104.3	126.3	-94.2	170.4	-173.3	-175.3	0	114.1
363	D	34	Very low	32.3	Very low	142 Å²	142	153.6 Å²	153.6	76%	0.759	83%	0.825	S	S	*	*				51.1	125.2	129.3	-56.6	-33.2	0	0	0	122.2
364	G	32.6	Very low	32.4	Very low	83 Å²	83	151.7 Å²	151.7	86%	0.856	82%	0.819	S	S	*	*			trans	166.1	54.2	159.8	0	0	0	0	0	116.5
365	Q	29.1	Very low	32	Very low	181 Å²	181	146.2 Å²	146.2	85%	0.846	81%	0.813	S	S	*	*			trans	-74.4	141.2	160.2	-75.7	178.3	-11	0	0	109.9
366	V	30.7	Very low	32.3	Very low	148 Å²	148	148.3 Å²	148.3	90%	0.897	82%	0.819	S	S	*	*			trans	-156	132.8	132.3	174.3	0	0	0	0	110.3
367	L	28.9	Very low	32.5	Very low	143 Å²	143	151.6 Å²	151.6	75%	0.749	82%	0.824	S	S	*	*			trans	-78.5	151.6	172.7	-84.2	110.9	0	0	0	113.6
368	V	26.8	Very low	32.7	Very low	127 Å²	127	151.4 Å²	151.4	77%	0.77	82%	0.823	S	S	*	*			trans	13.5	120.3	138.6	-172.7	0	0	0	0	117.7
369	E	31	Very low	32.8	Very low	185 Å²	185	149.1 Å²	149.1	86%	0.864	82%	0.817	S	S	*	*			trans	-147.9	136.6	137.8	-73.3	-164.5	154.5	0	0	110.9
370	A	27.3	Very low	32.9	Very low	95 Å²	95	147.2 Å²	147.2	79%	0.785	81%	0.813	S	S	*	*			trans	-105.2	121.4	169.9	0	0	0	0	0	108
371	E	32.6	Very low	33.3	Very low	185 Å²	185	149.7 Å²	149.7	86%	0.864	81%	0.807	S	S	*	*			trans	-145.8	123.2	162.3	-71.6	-165.2	156.7	0	0	108.7
372	G	26.4	Very low	33.5	Very low	67 Å²	67	150.3 Å²	150.3	69%	0.691	82%	0.815	S	S	*	*			trans	-86.6	157.5	160.3	0	0	0	0	0	110
373	Y	33.2	Very low	33.6	Very low	207 Å²	207	149.1 Å²	149.1	81%	0.812	81%	0.813	S	S	*	*			trans	-168	119.4	145.3	-121	-90.2	0	0	0	110.4
374	E	33.9	Very low	33.7	Very low	167 Å²	167	149.8 Å²	149.8	78%	0.78	82%	0.817	S	S	*	*			trans	28.7	132.4	143.3	-57.1	-178.8	161.1	0	0	122.7
375	G	29.6	Very low	33.8	Very low	73 Å²	73	149.5 Å²	149.5	75%	0.753	81%	0.814	S	S	*	*				108.2	106.9	109.8	0	0	0	0	0	117.1
376	K	40.5	Very low	34	Very low	214 Å²	214	148.2 Å²	148.2	93%	0.93	81%	0.812	S	S	*	*			trans	-165.1	109.9	138.5	-106.1	167.2	-172.6	-178	0	110.6
377	E	34	Very low	34.2	Very low	177 Å²	177	145.4 Å²	145.4	83%	0.827	80%	0.8	S	S	*	*			trans	-68.5	148.4	166.2	-64.7	173.3	151.7	0	0	110.7
378	E	38.8	Very low	34.5	Very low	195 Å²	195	147.2 Å²	147.2	91%	0.911	80%	0.804	S	S	*	*			trans	-153.3	136.3	143	-111.6	172.2	-157.3	0	0	109.4
379	N	38.4	Very low	34.8	Very low	135 Å²	135	149.2 Å²	149.2	72%	0.722	81%	0.805	S	S	*	*			trans	-74.4	158.7	-161.9	-52.3	-61.2	0	0	0	114.4
380	D	37.4	Very low	35	Very low	162 Å²	162	151.1 Å²	151.1	87%	0.866	80%	0.804	S	S	*	*				-164	130.9	111.5	-131.8	-11.8	0	0	0	111.8
381	D	40.7	Very low	35.5	Very low	135 Å²	135	154.6 Å²	154.6	72%	0.722	80%	0.802	S	S	*	*			trans	-75.8	146.6	177.8	-66.5	-57.5	0	0	0	111
382	T	38	Very low	35.4	Very low	147 Å²	147	153.8 Å²	153.8	90%	0.902	80%	0.798	S	S	*	*				-162.2	129.1	127.4	-51.4	0	0	0	0	110.3
383	E	41.1	Very low	35.7	Very low	163 Å²	163	158 Å²	158	76%	0.762	80%	0.804	S	S	*	*			trans	-69.3	167	-178.3	-60.8	174.7	132.5	0	0	115.3
384	D	36.6	Very low	35.7	Very low	157 Å²	157	157 Å²	157	84%	0.84	81%	0.808	S	S	*	*			trans	72.9	131.3	140.5	-75.4	-12.5	0	0	0	120.8
385	G	35.5	Very low	35.6	Very low	77 Å²	77	157.8 Å²	157.8	79%	0.794	81%	0.811	S	S	*	*			trans	154.8	89.9	151.4	0	0	0	0	0	115.9
386	N	33.3	Very low	35.7	Very low	153 Å²	153	162.5 Å²	162.5	82%	0.818	81%	0.813	S	S	*	*			trans	-59.3	148	175	-139.7	-0.6	0	0	0	114
387	S	34.7	Very low	35.3	Very low	90 Å²	90	160.9 Å²	160.9	63%	0.629	81%	0.809	S	S	*	*			trans	43.6	121.7	143.8	63.9	0	0	0	0	120.4
388	Q	34.5	Very low	35.2	Very low	180 Å²	180	160 Å²	160	84%	0.841	81%	0.805	S	S	*	*				-175.9	141.2	110.9	-139.3	161.3	-44.9	0	0	113
389	E	34.1	Very low	35.1	Very low	170 Å²	170	158.3 Å²	158.3	79%	0.794	80%	0.801	S	S	*	*			trans	-39.3	139.9	166.2	-58	164.9	128.4	0	0	114.7
390	R	35.6	Very low	34.8	Very low	224 Å²	224	159.7 Å²	159.7	85%	0.845	80%	0.803	S	S	*	*			trans	-176.3	116.1	131.2	-106.5	168.4	178.8	-168.1	-0.3	113.1
391	K	37.1	Very low	34.5	Very low	168 Å²	168	158.4 Å²	158.4	73%	0.73	80%	0.796	S	S	*	*				57.4	115.3	128.6	-65	-173.1	175.3	-163.9	0	119.7
392	E	30.1	Very low	34.2	Very low	169 Å²	169	160.1 Å²	160.1	79%	0.79	80%	0.8	S	S	*	*				39.1	115.1	122.5	-64.7	168.7	169.1	0	0	117.1
393	N	33.7	Very low	33.8	Very low	154 Å²	154	162.5 Å²	162.5	82%	0.824	79%	0.794	S	S	*	*				-158.1	116.5	128.6	-97.5	-16.3	0	0	0	110
394	E	31.2	Very low	33.6	Very low	188 Å²	188	160.1 Å²	160.1	88%	0.879	79%	0.785	S	S	*	*			trans	-54.6	126.6	156.9	-69.3	165	142.9	0	0	108.9
395	Q	33.7	Very low	33.5	Very low	183 Å²	183	161.3 Å²	161.3	86%	0.855	79%	0.786	S	S	*	*			trans	-126.1	102	155	-78.3	-171.3	6.3	0	0	107.8
396	Q	30	Very low	33.3	Very low	171 Å²	171	166 Å²	166	80%	0.799	78%	0.781	S	S	*	*			trans	-76.7	108.3	167	-168.8	160.7	3.4	0	0	106.2	E398	Q396-E398 PolarHBondContact O-N 3.06Å
397	E	33.7	Very low	33.4	Very low	181 Å²	181	165.8 Å²	165.8	85%	0.846	78%	0.78	S	S	*	*			trans	-79.7	94.9	166.6	-88.7	-175.4	158.7	0	0	108.1	I399	E397-I399 PolarHBondContact O-N 2.75Å
398	E	30.9	Very low	33.5	Very low	157 Å²	157	165.6 Å²	165.6	73%	0.734	78%	0.777	S	S	*	*			trans	-62.4	109.7	153.3	-78.1	175.7	149.1	0	0	107.7	Q396 E400	Q396-E398 PolarHBondContact O-N 3.06Å; E398-E400 PolarHBondContact O-N 3.1Å
399	I	36.3	Very low	33.4	Very low	160 Å²	160	163.9 Å²	163.9	82%	0.821	77%	0.774	S	S	*	*			trans	-83.7	96.2	158.1	-62.2	176.4	0	0	0	105	E397	E397-I399 PolarHBondContact O-N 2.75Å
400	E	33.1	Very low	33.7	Very low	165 Å²	165	161.7 Å²	161.7	77%	0.771	77%	0.773	S	S	*	*			trans	-57	136.6	173	-71.6	-179.8	148.6	0	0	111	E398 E402	E398-E400 PolarHBondContact O-N 3.1Å; E400-E402 PolarHBondContact O-N 3.22Å; E400-E402 VanDerWaalsContact O-N 3.15Å
401	D	30	Very low	33.7	Very low	134 Å²	134	158.2 Å²	158.2	72%	0.717	77%	0.77	S	S	*	*			trans	-59.7	104.3	171.4	-67.6	-55.4	0	0	0	111.2	Y403	D401-Y403 HydrophobicContact CB-CD2 3.7Å; D401-Y403 HydrophobicContact CB-CE2 3.74Å; D401-Y403 PolarHBondContact O-N 3.22Å
402	E	34.7	Very low	33.6	Very low	172 Å²	172	152.6 Å²	152.6	80%	0.804	76%	0.76	S	S	*	*			trans	-87.7	84.7	158.7	-156.4	170.6	-158	0	0	108.6	E400 L404	E400-E402 PolarHBondContact O-N 3.22Å; E400-E402 VanDerWaalsContact O-N 3.15Å; E402-L404 VanDerWaalsContact C-N 3.33Å; E402-L404 PolarHBondContact O-N 3.45Å
403	Y	29.9	Very low	33.7	Very low	197 Å²	197	153.1 Å²	153.1	77%	0.773	76%	0.763	S	S	*	*			trans	-61.5	93.7	162.8	-81.6	-89.4	0	0	0	109	D401 E405	D401-Y403 HydrophobicContact CB-CD2 3.7Å; D401-Y403 HydrophobicContact CB-CE2 3.74Å; D401-Y403 PolarHBondContact O-N 3.22Å; Y403-E405 PolarHBondContact O-N 3.09Å
404	L	36.5	Very low	34.1	Very low	113 Å²	113	153.1 Å²	153.1	59%	0.592	76%	0.758	S	S	*	*			trans	-79.4	98.1	159.3	-89.1	158.6	0	0	0	108.3	E402 Y406	E402-L404 VanDerWaalsContact C-N 3.33Å; E402-L404 PolarHBondContact O-N 3.45Å; L404-Y406 VanDerWaalsContact C-N 3.32Å; L404-Y406 HydrophobicContact CB-CD2 3.91Å; L404-Y406 HydrophobicContact CB-CE2 3.86Å; L404-Y406 HydrophobicContact CD1-CE2 4.18Å; L404-Y406 HydrophobicContact CD2-CE2 4.24Å; L404-Y406 HydrophobicContact CG-CE2 4.32Å; L404-Y406 PolarHBondContact O-N 3.13Å
405	E	34.2	Very low	34.3	Very low	182 Å²	182	152.6 Å²	152.6	85%	0.85	75%	0.753	S	S	*	*			trans	-49.2	98.2	153.1	-82.4	177.6	151.8	0	0	108.3	Y403	Y403-E405 PolarHBondContact O-N 3.09Å
406	Y	33.1	Very low	34.8	Very low	174 Å²	174	153.4 Å²	153.4	68%	0.682	75%	0.749	S	S	*	*			trans	-95.4	90.7	160.2	-88.3	-82.4	0	0	0	107.7	L404 C408	L404-Y406 VanDerWaalsContact C-N 3.32Å; L404-Y406 HydrophobicContact CB-CD2 3.91Å; L404-Y406 HydrophobicContact CB-CE2 3.86Å; L404-Y406 HydrophobicContact CD1-CE2 4.18Å; L404-Y406 HydrophobicContact CD2-CE2 4.24Å; L404-Y406 HydrophobicContact CG-CE2 4.32Å; L404-Y406 PolarHBondContact O-N 3.13Å; Y406-C408 PolarHBondContact O-N 3.24Å
407	D	33.6	Very low	35.1	Very low	150 Å²	150	154 Å²	154	80%	0.802	75%	0.752	S	S	*	*			trans	-56.9	93.1	149	-83.3	-25.3	0	0	0	107.4
408	C	37.2	Very low	35.2	Very low	85 Å²	85	153 Å²	153	57%	0.574	75%	0.753	S	S	*	*			trans	-113.1	81.6	165.8	-68	0	0	0	0	107.5	Y406 T410	Y406-C408 PolarHBondContact O-N 3.24Å; C408-T410 PolarHBondContact O-N 2.96Å; C408-T410 PolarHBondContact O-OG1 3.47Å; C408-T410 VanDerWaalsContact O-OG1 3.1Å
409	D	33.3	Very low	35.7	Very low	145 Å²	145	156.8 Å²	156.8	78%	0.775	76%	0.76	S	S	*	*			trans	-41	108.3	151.1	-71.6	-42.6	0	0	0	107.8
410	T	40.5	Very low	35.9	Very low	124 Å²	124	155.3 Å²	155.3	76%	0.761	75%	0.754	S	S	*	*			trans	-118.1	65.6	171.3	-37	0	0	0	0	107.7	C408 G412	C408-T410 PolarHBondContact O-N 2.96Å; C408-T410 PolarHBondContact O-OG1 3.47Å; C408-T410 VanDerWaalsContact O-OG1 3.1Å; T410-G412 PolarHBondContact O-N 2.92Å
411	D	35.7	Very low	36	Very low	150 Å²	150	156.6 Å²	156.6	80%	0.802	76%	0.76	S	S	*	*			trans	-59.8	75.1	147.5	40.3	-36.8	0	0	0	109.1
412	G	34.2	Very low	36.6	Very low	50 Å²	50	157.2 Å²	157.2	52%	0.515	76%	0.763	S	S	.	*			trans	-130.5	83.1	174.6	0	0	0	0	0	109.5	T410 E414	T410-G412 PolarHBondContact O-N 2.92Å; G412-E414 PolarHBondContact O-N 3.48Å
413	E	33.4	Very low	36.9	Very low	180 Å²	180	156.3 Å²	156.3	84%	0.841	76%	0.764	S	S	*	*			trans	-61.6	94	168.7	-67.1	-165.5	171.3	0	0	110.2	K415	E413-K415 PolarHBondContact O-N 3.48Å
414	E	40.8	Very low	37	Very low	154 Å²	154	158.2 Å²	158.2	72%	0.72	77%	0.771	S	S	*	*			trans	-91.3	95.1	159.7	-73.4	-162.2	167	0	0	109.4	G412 Y416	G412-E414 PolarHBondContact O-N 3.48Å; E414-Y416 HydrophobicContact CB-CE2 4.3Å; E414-Y416 PolarHBondContact O-N 2.97Å; E414-Y416 VanDerWaalsContact O-N 3.12Å
415	K	36.6	Very low	37.2	Very low	178 Å²	178	161.9 Å²	161.9	77%	0.774	79%	0.786	S	S	*	*			trans	-53.9	105.9	160.9	-73.4	178.8	174.7	-179.9	0	109.6	E413	E413-K415 PolarHBondContact O-N 3.48Å
416	Y	43.1	Very low	37	Very low	200 Å²	200	161.3 Å²	161.3	78%	0.784	78%	0.783	S	S	*	*			trans	-95.9	112.4	151.3	-75.7	-79.6	0	0	0	107.4	E414	E414-Y416 HydrophobicContact CB-CE2 4.3Å; E414-Y416 PolarHBondContact O-N 2.97Å; E414-Y416 VanDerWaalsContact O-N 3.12Å
417	E	36.7	Very low	36.9	Very low	184 Å²	184	158 Å²	158	86%	0.86	79%	0.791	S	S	*	*			trans	-54.8	134.6	-174.8	-62.9	179.4	157.1	0	0	111.9	R419	E417-R419 PolarHBondContact O-N 3.12Å
418	D	36.2	Very low	36.6	Very low	160 Å²	160	158.3 Å²	158.3	86%	0.856	79%	0.787	S	S	*	*			trans	-45.2	122	165.4	-64.9	-53.5	0	0	0	110.1
419	R	40.7	Very low	36.4	Very low	235 Å²	235	162.9 Å²	162.9	89%	0.887	80%	0.801	S	S	*	*			trans	-121.8	87	164.5	-157.3	174.1	-174.5	168.9	1.3	109.2	E417	E417-R419 PolarHBondContact O-N 3.12Å
420	D	40.4	Very low	36.2	Very low	130 Å²	130	162.9 Å²	162.9	70%	0.695	80%	0.801	S	S	*	*			trans	44.1	100.9	148	-55.2	-33.5	0	0	0	117.3	D422	D420-D422 PolarHBondContact O-N 3.02Å
421	E	35.4	Very low	35.5	Very low	192 Å²	192	163.4 Å²	163.4	90%	0.897	81%	0.807	S	S	*	*			trans	-45.3	118	145.9	-63.2	173.4	152.5	0	0	109.9
422	D	42	Very low	35.3	Very low	146 Å²	146	162.3 Å²	162.3	78%	0.781	81%	0.806	S	S	*	*			trans	-143.4	112.4	159.5	-87.8	-34.2	0	0	0	110	D420	D420-D422 PolarHBondContact O-N 3.02Å
423	D	42.3	Very low	34.9	Very low	153 Å²	153	166.8 Å²	166.8	82%	0.818	82%	0.818	S	S	*	*			trans	56	97.5	151.7	-78.2	-24.1	0	0	0	121.1
424	Y	31.8	Very low	34.8	Very low	237 Å²	237	165.9 Å²	165.9	93%	0.929	82%	0.817	S	S	*	*			trans	-63.2	119.9	143.4	-88.9	-102.4	0	0	0	110.5
425	E	40.3	Very low	34.3	Very low	191 Å²	191	166.8 Å²	166.8	89%	0.893	82%	0.819	S	S	*	*			trans	-118.8	126.7	151.2	-93.2	-166.2	170.8	0	0	111
426	E	30.1	Very low	34.2	Very low	170 Å²	170	166.4 Å²	166.4	79%	0.794	82%	0.82	S	S	*	*			trans	-75.8	115.3	-173.4	-173.3	174.2	-161.6	0	0	110.8	H428	E426-H428 IonicContact OE1-CD2 3.71Å
427	A	30.7	Very low	33.7	Very low	103 Å²	103	163.7 Å²	163.7	85%	0.851	82%	0.819	S	S	*	*			trans	-108.5	82.8	167.4	0	0	0	0	0	110.1	E429	A427-E429 PolarHBondContact O-N 3.31Å
428	H	27.8	Very low	33.4	Very low	157 Å²	157	162.9 Å²	162.9	73%	0.727	82%	0.815	S	S	*	*			trans	-62	116.1	159.2	-114.4	-81.5	0	0	0	108.9	E426	E426-H428 IonicContact OE1-CD2 3.71Å
429	E	33.4	Very low	33.5	Very low	182 Å²	182	166.3 Å²	166.3	85%	0.85	82%	0.817	S	S	*	*			trans	-163	115.3	155.7	-111.4	164.6	-146.9	0	0	114	A427	A427-E429 PolarHBondContact O-N 3.31Å
430	N	29.1	Very low	33.2	Very low	145 Å²	145	162.3 Å²	162.3	78%	0.775	81%	0.809	S	S	*	*			trans	65.9	83.3	155.5	-74.1	-23.2	0	0	0	121
431	C	24.2	Very low	32.8	Very low	134 Å²	134	164.5 Å²	164.5	91%	0.905	81%	0.814	S	S	*	*			trans	-86.5	102.7	148	-152	0	0	0	0	108.8
432	T	32.2	Very low	33	Very low	127 Å²	127	163.3 Å²	163.3	78%	0.779	81%	0.809	S	S	*	*			trans	-85.7	117.2	169.2	13.6	0	0	0	0	110.1
433	L	25.9	Very low	32.6	Very low	144 Å²	144	165.5 Å²	165.5	75%	0.754	81%	0.814	S	S	*	*			trans	-49.2	131.9	171.6	-76.5	96.5	0	0	0	112.3	K435	L433-K435 HydrophobicContact CD2-CG 4.2Å
434	I	31.7	Very low	32.4	Very low	162 Å²	162	166.6 Å²	166.6	83%	0.831	82%	0.815	S	S	*	*			trans	-106.1	107.4	148.7	-59.6	177.1	0	0	0	106.2
435	K	29.6	Very low	32.7	Very low	172 Å²	172	162.6 Å²	162.6	75%	0.748	81%	0.809	S	S	*	*			trans	-85.4	130.9	160.8	-73	-179.8	174.4	-178.2	0	106.8	L433	L433-K435 HydrophobicContact CD2-CG 4.2Å
436	E	34.4	Very low	32.5	Very low	171 Å²	171	158.6 Å²	158.6	80%	0.799	80%	0.803	S	S	*	*			trans	167.9	127.6	158.7	-97.5	163.9	-153.1	0	0	105.7
437	D	32.2	Very low	32.8	Very low	143 Å²	143	160 Å²	160	77%	0.765	80%	0.802	S	S	*	*			cis	-157.1	146.6	-10.5	-100.2	-26.7	0	0	0	106
438	H	31.9	Very low	33.1	Very low	167 Å²	167	161 Å²	161	77%	0.773	80%	0.797	S	S	*	*			trans	-62.1	132.6	174.1	-83	-94.9	0	0	0	111.6
439	Y	36.6	Very low	33.8	Very low	231 Å²	231	161.2 Å²	161.2	91%	0.906	80%	0.799	S	S	*	*			trans	-121.3	107.9	148.2	-90.9	-88.8	0	0	0	107.7
440	E	34.6	Very low	34.2	Very low	152 Å²	152	161.4 Å²	161.4	71%	0.71	80%	0.797	S	S	*	*			trans	-85.9	164.8	164	-70.1	-176.8	155.7	0	0	109.9
441	E	33.5	Very low	34.6	Very low	175 Å²	175	163.3 Å²	163.3	82%	0.818	80%	0.801	S	S	*	*			trans	84.3	128	164.8	-59.9	-173.4	157.2	0	0	115.5
442	E	38.9	Very low	35.3	Very low	167 Å²	167	162 Å²	162	78%	0.78	79%	0.794	S	S	*	*			cis	-144.8	142.2	24.7	-69.4	-179.6	149	0	0	112.1
443	E	33.3	Very low	35.7	Very low	192 Å²	192	163.2 Å²	163.2	90%	0.897	80%	0.795	S	S	*	*			trans	-69	128.6	157.4	-66.4	-178	148.2	0	0	108.8
444	E	38	Very low	36.4	Very low	177 Å²	177	167.7 Å²	167.7	83%	0.827	80%	0.804	S	S	*	*			trans	-147.7	98.7	155.2	-108.5	-176.8	-168.7	0	0	111.1
445	D	38.2	Very low	36.8	Very low	152 Å²	152	171.4 Å²	171.4	81%	0.813	81%	0.807	S	S	*	*			trans	48.5	116.2	137.8	-66.7	-20.8	0	0	0	121.8	Y447	D445-Y447 PolarHBondContact O-N 3.4Å
446	S	35.7	Very low	37.3	Very low	108 Å²	108	173.2 Å²	173.2	76%	0.755	83%	0.832	S	S	*	*			trans	-59.1	128.2	158.7	74.2	0	0	0	0	111.3
447	Y	37.8	Very low	37.5	Very low	198 Å²	198	173.4 Å²	173.4	78%	0.776	83%	0.834	S	S	*	*			trans	-120.8	97.3	158.3	-133.8	-96.4	0	0	0	109.8	D445 E449	D445-Y447 PolarHBondContact O-N 3.4Å; Y447-E449 HydrophobicContact CD1-CB 4.13Å; Y447-E449 HydrophobicContact CE1-CB 4.2Å; Y447-E449 HydrophobicContact CE1-CG 4.21Å
448	V	37.1	Very low	37.8	Very low	125 Å²	125	174.9 Å²	174.9	76%	0.758	84%	0.838	S	S	*	*			trans	-92.7	104.6	162.8	175.2	0	0	0	0	106.3
449	E	42.2	Very low	38.1	Very low	161 Å²	161	175.4 Å²	175.4	75%	0.752	84%	0.841	S	S	*	*			trans	-107.5	115.2	168	-143.1	173.7	-161.2	0	0	110.2	Y447	Y447-E449 HydrophobicContact CD1-CB 4.13Å; Y447-E449 HydrophobicContact CE1-CB 4.2Å; Y447-E449 HydrophobicContact CE1-CG 4.21Å
450	K	42.1	Very low	38.2	Very low	186 Å²	186	172.1 Å²	172.1	81%	0.809	84%	0.838	S	S	*	*			trans	-74.1	144.9	175.4	-78.1	175.1	174.1	173.4	0	110.4
451	Q	36.2	Very low	38.4	Very low	186 Å²	186	173.4 Å²	173.4	87%	0.869	85%	0.845	S	S	*	*			trans	-17.6	129.6	154.8	-66.8	171.4	-26.9	0	0	115.8
452	S	40.4	Very low	38.8	Very low	107 Å²	107	173.3 Å²	173.3	75%	0.748	85%	0.847	S	S	*	*				172.7	139.9	109.4	40.4	0	0	0	0	112.6
453	D	39.5	Very low	38.7	Very low	152 Å²	152	173.7 Å²	173.7	81%	0.813	85%	0.852	S	S	*	*			trans	61	102.1	152.7	-64	-16.7	0	0	0	121.3
454	Y	39.8	Very low	39.2	Very low	238 Å²	238	172.3 Å²	172.3	93%	0.933	85%	0.849	S	S	*	*			trans	-111.8	107.7	141.3	-96.6	-88.7	0	0	0	109.8
455	R	40.7	Very low	39.3	Very low	240 Å²	240	171.9 Å²	171.9	91%	0.906	85%	0.85	S	S	*	*			trans	-84.9	129.9	153.6	-93.7	-175.2	175.6	-175.7	-0.4	108.7
456	V	41.5	Very low	39.4	Very low	210 Å²	210	173.7 Å²	173.7	100%	1.273	85%	0.854	S	S	*	*			trans	-122.5	0	138.6	176.9	0	0	0	0	106.7

Retrieved 456 of 456 residues in 564.6 ms (Link to these results)

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