A0A3Q0KFJ8_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A3Q0KFJ8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 316 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	45.4	Very low	50.2	Low	213 Å²	213	144 Å²	144	100%	1.049	69%	0.688	S	S	*	*				0	4.1	0	-78.5	-75.4	179.4	0	0	114.2
2	N	49.4	Very low	51.9	Low	137 Å²	137	139.7 Å²	139.7	73%	0.733	67%	0.671	S	S	*	*			trans	-94.5	-3.1	-175.8	-82	-2.4	0	0	0	116.5
3	Y	48.7	Very low	53.8	Low	212 Å²	212	137.8 Å²	137.8	83%	0.831	67%	0.667	S	S	*	*	S	Bend	trans	-90.7	-15.1	-178	-81.9	-81.1	0	0	0	114.5
4	L	45.5	Very low	55.5	Low	116 Å²	116	138.4 Å²	138.4	61%	0.607	67%	0.665	S	S	*	*	S	Bend	trans	-80.2	-15.1	177.8	-100.3	141.4	0	0	0	113.6	I8	L4-I8 HydrophobicContact CD2-CD1 4.39Å
5	Y	48.2	Very low	57.2	Low	167 Å²	167	132.8 Å²	132.8	66%	0.655	64%	0.642	S	S	*	*	H	α-helix	trans	-81.4	-23.4	-176.8	-109.3	-90.7	0	0	0	113.9	Y9	Y5-Y9 HydrophobicContact CD1-CD2 4.24Å; Y5-Y9 AromaticContact CD1-CE2 3.93Å; Y5-Y9 HydrophobicContact CD1-CE2 3.93Å; Y5-Y9 AromaticContact CE1-CE2 3.98Å; Y5-Y9 HydrophobicContact CE1-CE2 3.98Å
6	I	52.3	Low	58.9	Low	128 Å²	128	129.9 Å²	129.9	66%	0.656	63%	0.63	S	S	*	*	H	α-helix	trans	-86.4	-26.5	-171.5	-60.3	175.6	0	0	0	111.8	P10	I6-P10 WeakPolarHBondContact O-CD 3.48Å
7	T	50.1	Low	60.4	Low	102 Å²	102	125.8 Å²	125.8	63%	0.626	61%	0.614	S	S	*	*	H	α-helix	trans	-87.7	-22.1	-176.3	50.2	0	0	0	0	114.2
8	I	51.8	Low	61.9	Low	98 Å²	98	121.9 Å²	121.9	50%	0.503	60%	0.6	S	S	.	*	H	α-helix	trans	-88.2	-27.6	-176	-57.5	174.6	0	0	0	112.3	L4 N12	L4-I8 HydrophobicContact CD2-CD1 4.39Å; I8-N12 PolarHBondContact O-N 3.2Å
9	Y	50.6	Low	63.3	Low	164 Å²	164	120.9 Å²	120.9	64%	0.643	60%	0.596	S	S	*	*	H	α-helix	trans	-65.9	-43.7	-174.5	-108.5	-88.4	0	0	0	116.2	Y5 F11 N12 L13	Y5-Y9 HydrophobicContact CD1-CD2 4.24Å; Y5-Y9 AromaticContact CD1-CE2 3.93Å; Y5-Y9 HydrophobicContact CD1-CE2 3.93Å; Y5-Y9 AromaticContact CE1-CE2 3.98Å; Y5-Y9 HydrophobicContact CE1-CE2 3.98Å; Y9-F11 VanDerWaalsContact C-N 3.28Å; Y9-F11 PolarHBondContact O-N 3.12Å; Y9-N12 PolarHBondContact O-N 3.38Å; Y9-L13 PolarHBondContact O-N 3.32Å
10	P	53.9	Low	64.5	Low	85 Å²	85	120.2 Å²	120.2	55%	0.552	59%	0.594	S	S	*	*	H	α-helix	trans	-69.1	-29.4	-178.9	25.6	-32	0	0	0	112.2	I6 N12 F14	I6-P10 WeakPolarHBondContact O-CD 3.48Å; P10-N12 VanDerWaalsContact C-N 3.34Å; P10-N12 PolarHBondContact O-N 2.99Å; P10-F14 PolarHBondContact O-N 2.72Å
11	F	56.6	Low	65.6	Low	162 Å²	162	121.4 Å²	121.4	71%	0.711	59%	0.592	S	S	*	*	H	α-helix	trans	-66.6	-37.9	177.8	-126.1	-88.7	0	0	0	111.7	Y9 T15	Y9-F11 VanDerWaalsContact C-N 3.28Å; Y9-F11 PolarHBondContact O-N 3.12Å; F11-T15 WeakPolarHBondContact O-CG2 3.31Å; F11-T15 PolarHBondContact O-N 3.47Å; F11-T15 VanDerWaalsContact O-N 3.17Å; F11-T15 PolarHBondContact O-OG1 3.44Å; F11-T15 VanDerWaalsContact O-OG1 3.11Å
12	N	70.1	Confident	67.7	Low	92 Å²	92	115.5 Å²	115.5	49%	0.492	56%	0.564	S	S	.	*	H	α-helix	trans	-73.1	-35.7	179.8	-116.8	-13.3	0	0	0	112.9	I8 Y9 P10 T15 I16	I8-N12 PolarHBondContact O-N 3.2Å; Y9-N12 PolarHBondContact O-N 3.38Å; P10-N12 VanDerWaalsContact C-N 3.34Å; P10-N12 PolarHBondContact O-N 2.99Å; N12-T15 WeakPolarHBondContact CA-OG1 3.32Å; N12-T15 PolarHBondContact O-OG1 3.08Å; N12-I16 WeakPolarHBondContact O-CB 3.26Å; N12-I16 VanDerWaalsContact O-CD1 3.3Å; N12-I16 WeakPolarHBondContact O-CD1 3.48Å; N12-I16 WeakPolarHBondContact O-CG1 3.33Å; N12-I16 PolarHBondContact O-N 2.79Å
13	L	77.1	Confident	69.6	Low	116 Å²	116	113.3 Å²	113.3	61%	0.607	55%	0.552	S	S	*	*	H	α-helix	trans	-69.3	-38.8	177.6	-170.2	65.2	0	0	0	111.5	Y9 T17	Y9-L13 PolarHBondContact O-N 3.32Å; L13-T17 WeakPolarHBondContact O-CB 3.17Å; L13-T17 VanDerWaalsContact O-CG2 3.3Å; L13-T17 WeakPolarHBondContact O-CG2 3.39Å; L13-T17 PolarHBondContact O-N 3.48Å; L13-T17 PolarHBondContact O-OG1 3.25Å
14	F	77.1	Confident	71.3	Confident	146 Å²	146	107.8 Å²	107.8	64%	0.64	54%	0.537	S	S	*	.	H	α-helix	trans	-67	-40.9	177	-171.1	-96.8	0	0	0	112.3	P10 T17 T18	P10-F14 PolarHBondContact O-N 2.72Å; F14-T17 WeakPolarHBondContact CA-OG1 3.41Å; F14-T17 PolarHBondContact O-OG1 2.76Å; F14-T18 VanDerWaalsContact O-CB 3.31Å; F14-T18 WeakPolarHBondContact O-CB 3.4Å; F14-T18 PolarHBondContact O-N 3.23Å; F14-T18 PolarHBondContact O-OG1 3.46Å
15	T	81.8	Confident	73.2	Confident	54 Å²	54	106.8 Å²	106.8	33%	0.331	53%	0.531	S	S	.	.	H	α-helix	trans	-67.7	-42.7	176.7	52.2	0	0	0	0	111.9	F11 N12 T18 L19	F11-T15 WeakPolarHBondContact O-CG2 3.31Å; F11-T15 PolarHBondContact O-N 3.47Å; F11-T15 VanDerWaalsContact O-N 3.17Å; F11-T15 PolarHBondContact O-OG1 3.44Å; F11-T15 VanDerWaalsContact O-OG1 3.11Å; N12-T15 WeakPolarHBondContact CA-OG1 3.32Å; N12-T15 PolarHBondContact O-OG1 3.08Å; T15-T18 PolarHBondContact O-N 3.3Å; T15-L19 WeakPolarHBondContact O-CB 3.33Å; T15-L19 PolarHBondContact O-N 2.84Å
16	I	83.7	Confident	75	Confident	87 Å²	87	106.1 Å²	106.1	45%	0.446	53%	0.532	S	S	.	.	H	α-helix	trans	-63.4	-46.4	177.5	-69.7	166.3	0	0	0	111.1	N12 T18 L19 L20	N12-I16 WeakPolarHBondContact O-CB 3.26Å; N12-I16 VanDerWaalsContact O-CD1 3.3Å; N12-I16 WeakPolarHBondContact O-CD1 3.48Å; N12-I16 WeakPolarHBondContact O-CG1 3.33Å; N12-I16 PolarHBondContact O-N 2.79Å; I16-T18 VanDerWaalsContact C-N 3.33Å; I16-T18 PolarHBondContact O-N 2.64Å; I16-L19 PolarHBondContact O-N 3.06Å; I16-L20 HydrophobicContact CG2-CD1 3.84Å; I16-L20 WeakPolarHBondContact O-CB 3.12Å; I16-L20 WeakPolarHBondContact O-CG 3.39Å; I16-L20 PolarHBondContact O-N 3.4Å
17	T	84.9	Confident	76.4	Confident	59 Å²	59	104.3 Å²	104.3	36%	0.362	52%	0.523	S	S	.	.	H	α-helix	trans	-64.2	-38.3	178.1	47.9	0	0	0	0	111.9	L13 F14 R21	L13-T17 WeakPolarHBondContact O-CB 3.17Å; L13-T17 VanDerWaalsContact O-CG2 3.3Å; L13-T17 WeakPolarHBondContact O-CG2 3.39Å; L13-T17 PolarHBondContact O-N 3.48Å; L13-T17 PolarHBondContact O-OG1 3.25Å; F14-T17 WeakPolarHBondContact CA-OG1 3.41Å; F14-T17 PolarHBondContact O-OG1 2.76Å; T17-R21 WeakPolarHBondContact O-CG 3.38Å; T17-R21 PolarHBondContact O-N 2.67Å
18	T	87	Confident	77.7	Confident	57 Å²	57	104 Å²	104	35%	0.35	52%	0.517	S	S	.	.	H	α-helix	trans	-66.6	-43.7	175.6	-55	0	0	0	0	111.8	F14 T15 I16 R21 L22	F14-T18 VanDerWaalsContact O-CB 3.31Å; F14-T18 WeakPolarHBondContact O-CB 3.4Å; F14-T18 PolarHBondContact O-N 3.23Å; F14-T18 PolarHBondContact O-OG1 3.46Å; T15-T18 PolarHBondContact O-N 3.3Å; I16-T18 VanDerWaalsContact C-N 3.33Å; I16-T18 PolarHBondContact O-N 2.64Å; T18-R21 PolarHBondContact O-N 2.91Å; T18-L22 HydrophobicContact CG2-CD1 4.47Å; T18-L22 WeakPolarHBondContact O-CG 3.08Å; T18-L22 PolarHBondContact O-N 3.26Å
19	L	88.7	Confident	78.9	Confident	102 Å²	102	105.1 Å²	105.1	53%	0.534	52%	0.519	S	S	.	.	H	α-helix	trans	-61.6	-45.2	174.9	-90.2	155.9	0	0	0	112.2	T15 I16 R21 L22 I23	T15-L19 WeakPolarHBondContact O-CB 3.33Å; T15-L19 PolarHBondContact O-N 2.84Å; I16-L19 PolarHBondContact O-N 3.06Å; L19-R21 VanDerWaalsContact C-N 3.32Å; L19-R21 PolarHBondContact O-N 2.92Å; L19-L22 PolarHBondContact O-N 2.93Å; L19-I23 VanDerWaalsContact O-CG1 3.31Å; L19-I23 WeakPolarHBondContact O-CG1 3.37Å; L19-I23 PolarHBondContact O-N 2.89Å
20	L	88.1	Confident	79.9	Confident	107 Å²	107	105.2 Å²	105.2	56%	0.56	52%	0.52	S	S	*	.	H	α-helix	trans	-59.9	-42.1	175.6	-81.3	162.6	0	0	0	111.6	I16 I23 N24	I16-L20 HydrophobicContact CG2-CD1 3.84Å; I16-L20 WeakPolarHBondContact O-CB 3.12Å; I16-L20 WeakPolarHBondContact O-CG 3.39Å; I16-L20 PolarHBondContact O-N 3.4Å; L20-I23 PolarHBondContact O-N 3.14Å; L20-N24 VanDerWaalsContact O-CB 3.3Å; L20-N24 WeakPolarHBondContact O-CB 3.4Å; L20-N24 PolarHBondContact O-N 2.97Å
21	R	86.6	Confident	80.5	Confident	145 Å²	145	106.1 Å²	106.1	55%	0.547	52%	0.519	S	S	.	.	H	α-helix	trans	-62.2	-44.8	174.9	-76.3	179.7	179.4	-167.5	0.9	111.9	T17 T18 L19 N24 I25	T17-R21 WeakPolarHBondContact O-CG 3.38Å; T17-R21 PolarHBondContact O-N 2.67Å; T18-R21 PolarHBondContact O-N 2.91Å; L19-R21 VanDerWaalsContact C-N 3.32Å; L19-R21 PolarHBondContact O-N 2.92Å; R21-N24 PolarHBondContact O-N 3.48Å; R21-I25 VanDerWaalsContact O-CG1 3.25Å; R21-I25 WeakPolarHBondContact O-CG1 3.42Å; R21-I25 PolarHBondContact O-N 2.99Å
22	L	89.7	Confident	80.7	Confident	89 Å²	89	102.1 Å²	102.1	47%	0.466	51%	0.508	S	S	.	.	H	α-helix	trans	-62	-47.5	176.8	-71.2	171.5	0	0	0	111.5	T18 L19 N24 I25 F26	T18-L22 HydrophobicContact CG2-CD1 4.47Å; T18-L22 WeakPolarHBondContact O-CG 3.08Å; T18-L22 PolarHBondContact O-N 3.26Å; L19-L22 PolarHBondContact O-N 2.93Å; L22-N24 VanDerWaalsContact C-N 3.28Å; L22-N24 PolarHBondContact O-N 3.12Å; L22-I25 PolarHBondContact O-N 3.35Å; L22-F26 VanDerWaalsContact O-CD2 3.27Å; L22-F26 WeakPolarHBondContact O-CD2 3.45Å; L22-F26 PolarHBondContact O-N 2.89Å
23	I	88.9	Confident	80	Confident	92 Å²	92	102.3 Å²	102.3	47%	0.472	51%	0.513	S	S	.	.	H	α-helix	trans	-58.9	-42.1	177	-69.8	165.7	0	0	0	110.8	L19 L20 F26 L27	L19-I23 VanDerWaalsContact O-CG1 3.31Å; L19-I23 WeakPolarHBondContact O-CG1 3.37Å; L19-I23 PolarHBondContact O-N 2.89Å; L20-I23 PolarHBondContact O-N 3.14Å; I23-F26 PolarHBondContact O-N 3.43Å; I23-L27 HydrophobicContact CG2-CD1 3.87Å; I23-L27 WeakPolarHBondContact O-CB 3.34Å; I23-L27 PolarHBondContact O-N 2.92Å
24	N	84.8	Confident	78.7	Confident	95 Å²	95	99.4 Å²	99.4	51%	0.508	51%	0.506	S	S	.	.	H	α-helix	trans	-67.7	-40.1	179.3	-150.7	-6.9	0	0	0	111.7	L20 R21 L22 L27 I28	L20-N24 VanDerWaalsContact O-CB 3.3Å; L20-N24 WeakPolarHBondContact O-CB 3.4Å; L20-N24 PolarHBondContact O-N 2.97Å; R21-N24 PolarHBondContact O-N 3.48Å; L22-N24 VanDerWaalsContact C-N 3.28Å; L22-N24 PolarHBondContact O-N 3.12Å; N24-L27 PolarHBondContact O-N 3.4Å; N24-I28 WeakPolarHBondContact O-CB 3.3Å; N24-I28 WeakPolarHBondContact O-CG1 3.48Å; N24-I28 PolarHBondContact O-N 3.28Å
25	I	85.8	Confident	77.7	Confident	95 Å²	95	101.7 Å²	101.7	49%	0.487	51%	0.51	S	S	.	.	H	α-helix	trans	-60.8	-46.3	172	-68.1	163.6	0	0	0	110.5	R21 L22 L27 I28 Q29	R21-I25 VanDerWaalsContact O-CG1 3.25Å; R21-I25 WeakPolarHBondContact O-CG1 3.42Å; R21-I25 PolarHBondContact O-N 2.99Å; L22-I25 PolarHBondContact O-N 3.35Å; I25-L27 PolarHBondContact O-N 3.45Å; I25-I28 PolarHBondContact O-N 2.96Å; I25-Q29 WeakPolarHBondContact O-CB 3.24Å; I25-Q29 PolarHBondContact O-N 2.89Å
26	F	85.1	Confident	76.5	Confident	154 Å²	154	107.9 Å²	107.9	68%	0.675	53%	0.533	S	S	*	.	H	α-helix	trans	-63.2	-39.9	177	-89.9	-76.6	0	0	0	112.4	L22 I23 Q29 Y30	L22-F26 VanDerWaalsContact O-CD2 3.27Å; L22-F26 WeakPolarHBondContact O-CD2 3.45Å; L22-F26 PolarHBondContact O-N 2.89Å; I23-F26 PolarHBondContact O-N 3.43Å; F26-Q29 PolarHBondContact O-N 3.4Å; F26-Y30 WeakPolarHBondContact O-CB 3.28Å; F26-Y30 PolarHBondContact O-N 2.75Å
27	L	82	Confident	75.7	Confident	89 Å²	89	109.6 Å²	109.6	47%	0.466	54%	0.539	S	S	.	.	H	α-helix	trans	-66.3	-46.9	175.6	-94	159.1	0	0	0	111.5	I23 N24 I25 Q29 Y30 L31	I23-L27 HydrophobicContact CG2-CD1 3.87Å; I23-L27 WeakPolarHBondContact O-CB 3.34Å; I23-L27 PolarHBondContact O-N 2.92Å; N24-L27 PolarHBondContact O-N 3.4Å; I25-L27 PolarHBondContact O-N 3.45Å; L27-Q29 VanDerWaalsContact C-N 3.31Å; L27-Q29 PolarHBondContact O-N 2.98Å; L27-Y30 PolarHBondContact O-N 3.32Å; L27-L31 VanDerWaalsContact O-CB 3.26Å; L27-L31 WeakPolarHBondContact O-CB 3.31Å; L27-L31 WeakPolarHBondContact O-CG 3.33Å; L27-L31 PolarHBondContact O-N 3.43Å
28	I	78.3	Confident	75.4	Confident	97 Å²	97	107.8 Å²	107.8	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-60.9	-44.5	176.2	-68.8	165.6	0	0	0	109.6	N24 I25 L31 T32	N24-I28 WeakPolarHBondContact O-CB 3.3Å; N24-I28 WeakPolarHBondContact O-CG1 3.48Å; N24-I28 PolarHBondContact O-N 3.28Å; I25-I28 PolarHBondContact O-N 2.96Å; I28-L31 PolarHBondContact O-N 3.43Å; I28-T32 HydrophobicContact CG2-CG2 4.36Å; I28-T32 WeakPolarHBondContact O-CB 3.41Å; I28-T32 WeakPolarHBondContact O-CG2 3.3Å; I28-T32 PolarHBondContact O-N 2.94Å; I28-T32 PolarHBondContact O-OG1 3.35Å
29	Q	76.3	Confident	75	Confident	120 Å²	120	105.3 Å²	105.3	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-67.7	-38.5	178.4	-168.3	141.9	-7.7	0	0	112.4	I25 F26 L27 T32 T33	I25-Q29 WeakPolarHBondContact O-CB 3.24Å; I25-Q29 PolarHBondContact O-N 2.89Å; F26-Q29 PolarHBondContact O-N 3.4Å; L27-Q29 VanDerWaalsContact C-N 3.31Å; L27-Q29 PolarHBondContact O-N 2.98Å; Q29-T32 VanDerWaalsContact CA-OG1 3.28Å; Q29-T32 WeakPolarHBondContact CA-OG1 3.47Å; Q29-T32 PolarHBondContact O-OG1 2.69Å; Q29-T33 WeakPolarHBondContact O-CB 3.28Å; Q29-T33 PolarHBondContact O-N 3.34Å; Q29-T33 PolarHBondContact O-OG1 3Å
30	Y	72.4	Confident	74.7	Confident	166 Å²	166	103.7 Å²	103.7	65%	0.651	50%	0.504	S	S	*	.	H	α-helix	trans	-63.9	-44.7	172.6	-180	-96	0	0	0	110.6	F26 L27 T33 A34	F26-Y30 WeakPolarHBondContact O-CB 3.28Å; F26-Y30 PolarHBondContact O-N 2.75Å; L27-Y30 PolarHBondContact O-N 3.32Å; Y30-T33 CarbonylContact O-C 3.59Å; Y30-T33 PolarHBondContact O-N 3.18Å; Y30-A34 HydrophobicContact CD1-CB 4.48Å; Y30-A34 HydrophobicContact CE1-CB 4.31Å; Y30-A34 WeakPolarHBondContact O-CA 3.49Å; Y30-A34 WeakPolarHBondContact O-CB 3.35Å; Y30-A34 PolarHBondContact O-N 3.25Å
31	L	66.1	Low	74.3	Confident	104 Å²	104	101.9 Å²	101.9	55%	0.545	50%	0.495	S	S	.	.	H	α-helix	trans	-67.4	-38.4	178.4	-71.7	168.9	0	0	0	112.2	L27 I28 A34 R35	L27-L31 VanDerWaalsContact O-CB 3.26Å; L27-L31 WeakPolarHBondContact O-CB 3.31Å; L27-L31 WeakPolarHBondContact O-CG 3.33Å; L27-L31 PolarHBondContact O-N 3.43Å; I28-L31 PolarHBondContact O-N 3.43Å; L31-A34 PolarHBondContact O-N 2.94Å; L31-R35 PolarHBondContact O-N 3.5Å
32	T	61.5	Low	74.1	Confident	78 Å²	78	102.5 Å²	102.5	48%	0.479	50%	0.504	S	S	.	.	H	α-helix	trans	-70.6	-34.3	174.2	52.6	0	0	0	0	112	I28 Q29	I28-T32 HydrophobicContact CG2-CG2 4.36Å; I28-T32 WeakPolarHBondContact O-CB 3.41Å; I28-T32 WeakPolarHBondContact O-CG2 3.3Å; I28-T32 PolarHBondContact O-N 2.94Å; I28-T32 PolarHBondContact O-OG1 3.35Å; Q29-T32 VanDerWaalsContact CA-OG1 3.28Å; Q29-T32 WeakPolarHBondContact CA-OG1 3.47Å; Q29-T32 PolarHBondContact O-OG1 2.69Å
33	T	54.3	Low	74	Confident	96 Å²	96	103 Å²	103	59%	0.589	50%	0.504	S	S	*	.	H	α-helix	trans	-75.4	-34.7	173.9	-50.7	0	0	0	0	111.8	Q29 Y30 R35 K36	Q29-T33 WeakPolarHBondContact O-CB 3.28Å; Q29-T33 PolarHBondContact O-N 3.34Å; Q29-T33 PolarHBondContact O-OG1 3Å; Y30-T33 CarbonylContact O-C 3.59Å; Y30-T33 PolarHBondContact O-N 3.18Å; T33-R35 VanDerWaalsContact C-N 3.33Å; T33-K36 PolarHBondContact O-N 3.43Å
34	A	50.1	Low	73.9	Confident	55 Å²	55	99.2 Å²	99.2	46%	0.455	48%	0.484	S	S	.	.	H	α-helix	trans	-74.4	-22.5	177.1	0	0	0	0	0	112.3	Y30 L31 K36	Y30-A34 HydrophobicContact CD1-CB 4.48Å; Y30-A34 HydrophobicContact CE1-CB 4.31Å; Y30-A34 WeakPolarHBondContact O-CA 3.49Å; Y30-A34 WeakPolarHBondContact O-CB 3.35Å; Y30-A34 PolarHBondContact O-N 3.25Å; L31-A34 PolarHBondContact O-N 2.94Å; A34-K36 PolarHBondContact O-N 3.3Å
35	R	55	Low	74	Confident	195 Å²	195	95.7 Å²	95.7	74%	0.736	47%	0.465	S	S	*	.	S	Bend	trans	-65.7	64.5	152.8	-77.2	-175.5	176.7	164.9	-0.1	109	L31 T33 Q37	L31-R35 PolarHBondContact O-N 3.5Å; T33-R35 VanDerWaalsContact C-N 3.33Å; R35-Q37 PolarHBondContact O-N 2.99Å
36	K	57.2	Low	74.2	Confident	184 Å²	184	94.6 Å²	94.6	80%	0.8	46%	0.46	S	S	*	.			trans	-54.1	112.4	167.9	-72.8	-176.6	178	179.5	0	106.1	T33 A34 C38	T33-K36 PolarHBondContact O-N 3.43Å; A34-K36 PolarHBondContact O-N 3.3Å; K36-C38 PolarHBondContact O-N 3.36Å; K36-C38 VanDerWaalsContact O-N 3.13Å
37	Q	67.7	Low	74.5	Confident	122 Å²	122	91.4 Å²	91.4	57%	0.57	44%	0.444	S	S	*	.			trans	-57.7	121.9	167.4	-65.6	177.7	-5.3	0	0	106.2	R35 F39	R35-Q37 PolarHBondContact O-N 2.99Å; Q37-F39 PolarHBondContact O-N 3.04Å
38	C	78.6	Confident	75.1	Confident	21 Å²	21	87.1 Å²	87.1	14%	0.142	42%	0.422	C	S	.	.	S	Bend	trans	-56	-24	179.5	65.4	0	0	0	0	112	K36 S97 C98 E104	K36-C38 PolarHBondContact O-N 3.36Å; K36-C38 VanDerWaalsContact O-N 3.13Å; C38-S97 WeakPolarHBondContact CB-O 3.24Å; C38-S97 WeakPolarHBondContact O-CB 3.47Å; C38-C98 VanDerWaalsContact C-SG 3.54Å; C38-C98 HydrophobicContact CB-CB 3.87Å; C38-C98 WeakPolarHBondContact CB-SG 3.47Å; C38-C98 WeakPolarHBondContact SG-CB 3.28Å; C38-C98 CovalentContact SG-SG 2.04Å; C38-C98 PolarHBondContact SG-SG 3.12Å; C38-E104 HydrophobicContact CB-CG 3.93Å
39	F	78.4	Confident	75.7	Confident	6 Å²	6	83.1 Å²	83.1	3%	0.026	40%	0.402	C	S	.	.			trans	-143.5	127.4	176.1	-177.5	-91.4	0	0	0	110	Q37 L41 E44 M90 A94 C98 W111 L115	Q37-F39 PolarHBondContact O-N 3.04Å; F39-L41 HydrophobicContact CE1-CB 4.12Å; F39-L41 HydrophobicContact CE1-CD1 3.95Å; F39-L41 HydrophobicContact CZ-CD1 4.42Å; F39-E44 HydrophobicContact CD2-CB 4.32Å; F39-E44 HydrophobicContact CD2-CG 3.7Å; F39-E44 HydrophobicContact CE1-CB 4.32Å; F39-E44 HydrophobicContact CE1-CG 4.47Å; F39-E44 HydrophobicContact CE2-CB 3.57Å; F39-E44 HydrophobicContact CE2-CG 3.45Å; F39-E44 VanDerWaalsContact CE2-CG 3.45Å; F39-E44 HydrophobicContact CG-CG 4.31Å; F39-E44 HydrophobicContact CZ-CB 3.57Å; F39-E44 HydrophobicContact CZ-CG 3.89Å; F39-M90 HydrophobicContact CE2-CB 4.48Å; F39-M90 WeakPolarHBondContact CE2-O 3.41Å; F39-M90 HydrophobicContact CZ-CB 4.11Å; F39-A94 VanDerWaalsContact CD2-CA 3.47Å; F39-A94 HydrophobicContact CD2-CB 3.49Å; F39-A94 VanDerWaalsContact CD2-CB 3.49Å; F39-A94 HydrophobicContact CE2-CB 3.68Å; F39-A94 HydrophobicContact CG-CB 4.05Å; F39-A94 HydrophobicContact CZ-CB 4.38Å; F39-C98 VanDerWaalsContact CB-SG 3.59Å; F39-W111 AromaticContact CD1-CD2 3.74Å; F39-W111 HydrophobicContact CD1-CD2 3.74Å; F39-W111 AromaticContact CD1-CE2 3.32Å; F39-W111 HydrophobicContact CD1-CE3 4.21Å; F39-W111 HydrophobicContact CD1-CG 4.27Å; F39-W111 HydrophobicContact CD1-CH2 4.04Å; F39-W111 AromaticContact CD1-CZ2 3.51Å; F39-W111 HydrophobicContact CD1-CZ2 3.51Å; F39-W111 HydrophobicContact CD1-CZ3 4.36Å; F39-W111 AromaticContact CD1-NE1 3.56Å; F39-W111 AromaticContact CE1-CD2 3.94Å; F39-W111 HydrophobicContact CE1-CD2 3.94Å; F39-W111 AromaticContact CE1-CE2 3.94Å; F39-W111 AromaticContact CE1-CE3 3.98Å; F39-W111 HydrophobicContact CE1-CE3 3.98Å; F39-W111 HydrophobicContact CE1-CH2 4.11Å; F39-W111 HydrophobicContact CE1-CZ2 4.04Å; F39-W111 HydrophobicContact CE1-CZ3 4.07Å; F39-W111 AromaticContact CG-NE1 3.89Å; F39-L115 HydrophobicContact CZ-CD1 4.19Å
40	N	82.5	Confident	76.5	Confident	67 Å²	67	84.7 Å²	84.7	36%	0.358	40%	0.403	S	S	.	.			trans	-111.4	108.4	174.3	176.1	-45.2	0	0	0	108.9	E42 H43 E44	N40-E42 VanDerWaalsContact C-N 3.32Å; N40-E42 PolarHBondContact O-N 3.21Å; N40-E42 PolarHBondContact OD1-N 2.93Å; N40-E42 VanDerWaalsContact OD1-N 3.12Å; N40-H43 HydrophobicContact CB-CB 3.98Å; N40-H43 PolarHBondContact O-N 3.47Å; N40-H43 PolarHBondContact OD1-N 2.93Å; N40-E44 WeakPolarHBondContact O-CB 3.45Å; N40-E44 WeakPolarHBondContact O-CG 3.48Å; N40-E44 PolarHBondContact O-N 3.18Å
41	L	79.8	Confident	77.6	Confident	70 Å²	70	82.7 Å²	82.7	37%	0.366	40%	0.398	S	S	.	.	H	α-helix	trans	-55.2	-42.7	-173.1	-178.8	65.3	0	0	0	113.6	F39 L45 M90 W111	F39-L41 HydrophobicContact CE1-CB 4.12Å; F39-L41 HydrophobicContact CE1-CD1 3.95Å; F39-L41 HydrophobicContact CZ-CD1 4.42Å; L41-L45 WeakPolarHBondContact O-CB 3.49Å; L41-L45 PolarHBondContact O-N 3.15Å; L41-M90 HydrophobicContact CD1-SD 4.08Å; L41-W111 HydrophobicContact CB-CH2 3.93Å; L41-W111 HydrophobicContact CB-CZ3 4.34Å; L41-W111 HydrophobicContact CD1-CH2 4.49Å; L41-W111 HydrophobicContact CD1-CZ3 4.05Å; L41-W111 HydrophobicContact CD2-CH2 4.4Å; L41-W111 HydrophobicContact CD2-CZ3 4.3Å; L41-W111 HydrophobicContact CG-CZ3 4.47Å
42	E	82.5	Confident	78.8	Confident	158 Å²	158	80.7 Å²	80.7	74%	0.738	39%	0.386	S	S	*	.	H	α-helix	trans	-70	-46.1	-176.9	-66.6	179.9	175.7	0	0	111.7	N40 E44 L45 D46	N40-E42 VanDerWaalsContact C-N 3.32Å; N40-E42 PolarHBondContact O-N 3.21Å; N40-E42 PolarHBondContact OD1-N 2.93Å; N40-E42 VanDerWaalsContact OD1-N 3.12Å; E42-E44 VanDerWaalsContact C-N 3.3Å; E42-E44 PolarHBondContact O-N 3.14Å; E42-L45 PolarHBondContact O-N 2.86Å; E42-D46 PolarHBondContact O-N 2.94Å
43	H	86.5	Confident	80.2	Confident	100 Å²	100	86.1 Å²	86.1	46%	0.463	40%	0.403	S	S	.	.	H	α-helix	trans	-60.4	-43	175.4	174.5	-92.7	0	0	0	111.5	N40 D46 Y47	N40-H43 HydrophobicContact CB-CB 3.98Å; N40-H43 PolarHBondContact O-N 3.47Å; N40-H43 PolarHBondContact OD1-N 2.93Å; H43-D46 PolarHBondContact O-N 2.89Å; H43-Y47 WeakPolarHBondContact O-CB 3.47Å; H43-Y47 PolarHBondContact O-N 3Å
44	E	88.3	Confident	81.7	Confident	11 Å²	11	82.2 Å²	82.2	5%	0.051	38%	0.379	C	S	.	.	H	α-helix	trans	-71.5	-36.9	-177.1	-67.9	-65.8	138.4	0	0	111.7	F39 N40 E42 Y47 C48 M90 R93	F39-E44 HydrophobicContact CD2-CB 4.32Å; F39-E44 HydrophobicContact CD2-CG 3.7Å; F39-E44 HydrophobicContact CE1-CB 4.32Å; F39-E44 HydrophobicContact CE1-CG 4.47Å; F39-E44 HydrophobicContact CE2-CB 3.57Å; F39-E44 HydrophobicContact CE2-CG 3.45Å; F39-E44 VanDerWaalsContact CE2-CG 3.45Å; F39-E44 HydrophobicContact CG-CG 4.31Å; F39-E44 HydrophobicContact CZ-CB 3.57Å; F39-E44 HydrophobicContact CZ-CG 3.89Å; N40-E44 WeakPolarHBondContact O-CB 3.45Å; N40-E44 WeakPolarHBondContact O-CG 3.48Å; N40-E44 PolarHBondContact O-N 3.18Å; E42-E44 VanDerWaalsContact C-N 3.3Å; E42-E44 PolarHBondContact O-N 3.14Å; E44-Y47 PolarHBondContact O-N 3.36Å; E44-C48 VanDerWaalsContact O-CB 3.3Å; E44-C48 WeakPolarHBondContact O-CB 3.39Å; E44-C48 PolarHBondContact O-N 2.97Å; E44-C48 PolarHBondContact O-SG 2.77Å; E44-C48 VanDerWaalsContact O-SG 3.33Å; E44-M90 HydrophobicContact CB-CG 4.39Å; E44-R93 IonicContact OE1-CZ 2.86Å; E44-R93 IonicContact OE1-NE 2.63Å; E44-R93 PolarHBondContact OE1-NE 3.24Å; E44-R93 IonicContact OE1-NH2 3.97Å; E44-R93 PolarHBondContact OE1-NH2 3.26Å; E44-R93 WeakPolarHBondContact OE2-CB 3.01Å; E44-R93 WeakPolarHBondContact OE2-CD 3.48Å; E44-R93 IonicContact OE2-CZ 3.14Å; E44-R93 IonicContact OE2-NE 3.77Å; E44-R93 PolarHBondContact OE2-NE 3.14Å; E44-R93 IonicContact OE2-NH2 3.54Å
45	L	86.6	Confident	83.1	Confident	21 Å²	21	87 Å²	87	11%	0.11	39%	0.391	C	S	.	.	H	α-helix	trans	-62.1	-47	171.4	-174.9	72.2	0	0	0	111.9	L41 E42 C48 S49 I56 V86 M90	L41-L45 WeakPolarHBondContact O-CB 3.49Å; L41-L45 PolarHBondContact O-N 3.15Å; E42-L45 PolarHBondContact O-N 2.86Å; L45-C48 PolarHBondContact O-N 3.34Å; L45-S49 VanDerWaalsContact O-CB 3.29Å; L45-S49 WeakPolarHBondContact O-CB 3.35Å; L45-S49 PolarHBondContact O-N 3.44Å; L45-S49 PolarHBondContact O-OG 3.44Å; L45-I56 HydrophobicContact CD1-CD1 3.47Å; L45-I56 VanDerWaalsContact CD1-CD1 3.47Å; L45-I56 HydrophobicContact CD2-CD1 4.04Å; L45-I56 HydrophobicContact CG-CD1 3.44Å; L45-I56 VanDerWaalsContact CG-CD1 3.44Å; L45-V86 HydrophobicContact CD1-CG1 3.75Å; L45-M90 HydrophobicContact CB-SD 3.86Å; L45-M90 HydrophobicContact CD1-CE 3.85Å; L45-M90 HydrophobicContact CD1-SD 3.72Å; L45-M90 HydrophobicContact CG-SD 4.44Å
46	D	88.5	Confident	84	Confident	73 Å²	73	79 Å²	79	39%	0.39	36%	0.363	S	S	.	.	H	α-helix	trans	-66.4	-37.3	177.4	177.8	61.6	0	0	0	112.8	E42 H43 S49 R50	E42-D46 PolarHBondContact O-N 2.94Å; H43-D46 PolarHBondContact O-N 2.89Å; D46-S49 WeakPolarHBondContact CA-OG 3.49Å; D46-S49 PolarHBondContact O-OG 3.22Å; D46-R50 WeakPolarHBondContact O-CG 3.29Å; D46-R50 PolarHBondContact O-N 3.31Å; D46-R50 PolarHBondContact O-NE 3.48Å; D46-R50 VanDerWaalsContact O-NE 3.15Å; D46-R50 IonicContact OD1-NE 3.2Å; D46-R50 IonicContact OD2-CZ 3.8Å; D46-R50 IonicContact OD2-NE 3.3Å; D46-R50 PolarHBondContact OD2-NE 3.15Å; D46-R50 IonicContact OD2-NH1 2.8Å; D46-R50 IonicContact OD2-NH2 3.46Å; D46-R50 PolarHBondContact OD2-NH2 3.01Å
47	Y	92.6	Very high	84.6	Confident	86 Å²	86	71.2 Å²	71.2	34%	0.337	33%	0.331	S	S	.	.	H	α-helix	trans	-63.1	-50.6	172.8	175.6	-89.6	0	0	0	111.3	H43 E44 S49 R50 K51 R93	H43-Y47 WeakPolarHBondContact O-CB 3.47Å; H43-Y47 PolarHBondContact O-N 3Å; E44-Y47 PolarHBondContact O-N 3.36Å; Y47-S49 PolarHBondContact O-N 2.91Å; Y47-R50 PolarHBondContact O-N 3.39Å; Y47-K51 HydrophobicContact CE1-CD 4.07Å; Y47-K51 WeakPolarHBondContact O-CB 3.28Å; Y47-K51 PolarHBondContact O-N 3.16Å; Y47-R93 VanDerWaalsContact CD1-CD 3.48Å
48	C	93.1	Very high	84.6	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-68.9	-34.4	-176.6	-73.1	0	0	0	0	112.6	E44 L45 K51 H52 V86 C89 M90	E44-C48 VanDerWaalsContact O-CB 3.3Å; E44-C48 WeakPolarHBondContact O-CB 3.39Å; E44-C48 PolarHBondContact O-N 2.97Å; E44-C48 PolarHBondContact O-SG 2.77Å; E44-C48 VanDerWaalsContact O-SG 3.33Å; L45-C48 PolarHBondContact O-N 3.34Å; C48-K51 PolarHBondContact O-N 3.25Å; C48-H52 PolarHBondContact O-CD2 3.18Å; C48-H52 VanDerWaalsContact O-CD2 3.25Å; C48-H52 PolarHBondContact O-N 3.33Å; C48-H52 VanDerWaalsContact O-N 3.07Å; C48-V86 HydrophobicContact CB-CG1 4.13Å; C48-C89 VanDerWaalsContact CA-SG 3.53Å; C48-C89 HydrophobicContact CB-CB 3.67Å; C48-C89 WeakPolarHBondContact CB-SG 3.39Å; C48-C89 WeakPolarHBondContact SG-CB 3.48Å; C48-C89 CovalentContact SG-SG 2.04Å; C48-C89 PolarHBondContact SG-SG 3.27Å; C48-M90 HydrophobicContact CB-CG 4.12Å; C48-M90 PolarHBondContact SG-N 2.88Å; C48-M90 VanDerWaalsContact SG-N 3.35Å
49	S	90.9	Very high	84.1	Confident	12 Å²	12	73.2 Å²	73.2	8%	0.084	35%	0.353	C	S	.	.	H	α-helix	trans	-62	-47.8	174.5	71.4	0	0	0	0	111.9	L45 D46 Y47 H52 K53 V54	L45-S49 VanDerWaalsContact O-CB 3.29Å; L45-S49 WeakPolarHBondContact O-CB 3.35Å; L45-S49 PolarHBondContact O-N 3.44Å; L45-S49 PolarHBondContact O-OG 3.44Å; D46-S49 WeakPolarHBondContact CA-OG 3.49Å; D46-S49 PolarHBondContact O-OG 3.22Å; Y47-S49 PolarHBondContact O-N 2.91Å; S49-H52 CarbonylContact O-C 3.57Å; S49-H52 PolarHBondContact O-N 3.26Å; S49-K53 PolarHBondContact O-N 3.32Å; S49-V54 WeakPolarHBondContact O-CG2 3.43Å; S49-V54 PolarHBondContact O-N 3.43Å
50	R	94.1	Very high	83.7	Confident	154 Å²	154	75.5 Å²	75.5	58%	0.581	36%	0.364	S	S	*	.	H	α-helix	trans	-64.3	-43.1	177.2	-72.5	-175.8	-67.6	-177.6	-4.1	111.8	D46 Y47 H52 K53	D46-R50 WeakPolarHBondContact O-CG 3.29Å; D46-R50 PolarHBondContact O-N 3.31Å; D46-R50 PolarHBondContact O-NE 3.48Å; D46-R50 VanDerWaalsContact O-NE 3.15Å; D46-R50 IonicContact OD1-NE 3.2Å; D46-R50 IonicContact OD2-CZ 3.8Å; D46-R50 IonicContact OD2-NE 3.3Å; D46-R50 PolarHBondContact OD2-NE 3.15Å; D46-R50 IonicContact OD2-NH1 2.8Å; D46-R50 IonicContact OD2-NH2 3.46Å; D46-R50 PolarHBondContact OD2-NH2 3.01Å; Y47-R50 PolarHBondContact O-N 3.39Å; R50-H52 VanDerWaalsContact C-N 3.26Å; R50-H52 PolarHBondContact O-N 3.45Å; R50-K53 PolarHBondContact O-N 3.28Å
51	K	94.8	Very high	83.2	Confident	123 Å²	123	74.3 Å²	74.3	54%	0.535	36%	0.357	S	S	.	.	H	α-helix	trans	-56.2	-41.8	176.1	-178.6	177.3	179.5	177.2	0	112	Y47 C48	Y47-K51 HydrophobicContact CE1-CD 4.07Å; Y47-K51 WeakPolarHBondContact O-CB 3.28Å; Y47-K51 PolarHBondContact O-N 3.16Å; C48-K51 PolarHBondContact O-N 3.25Å
52	H	92.1	Very high	83.1	Confident	62 Å²	62	72.1 Å²	72.1	29%	0.287	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	3.9	179	-69.5	-68.6	0	0	0	114	C48 S49 R50 V54	C48-H52 PolarHBondContact O-CD2 3.18Å; C48-H52 VanDerWaalsContact O-CD2 3.25Å; C48-H52 PolarHBondContact O-N 3.33Å; C48-H52 VanDerWaalsContact O-N 3.07Å; S49-H52 CarbonylContact O-C 3.57Å; S49-H52 PolarHBondContact O-N 3.26Å; R50-H52 VanDerWaalsContact C-N 3.26Å; R50-H52 PolarHBondContact O-N 3.45Å; H52-V54 VanDerWaalsContact C-N 3.26Å; H52-V54 HydrophobicContact CB-CG1 4.33Å; H52-V54 HydrophobicContact CB-CG2 4.16Å; H52-V54 WeakPolarHBondContact O-CG1 3.44Å; H52-V54 PolarHBondContact O-N 3.02Å
53	K	91.1	Very high	83.1	Confident	192 Å²	192	64.7 Å²	64.7	84%	0.835	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	41.1	-179.6	-56.7	179.6	180	179.9	0	112.9	S49 R50	S49-K53 PolarHBondContact O-N 3.32Å; R50-K53 PolarHBondContact O-N 3.28Å
54	V	85.3	Confident	83.1	Confident	15 Å²	15	60 Å²	60	9%	0.091	29%	0.292	C	S	.	.			trans	-113.4	136	-177.5	-66	0	0	0	0	110	S49 H52 W82 V86	S49-V54 WeakPolarHBondContact O-CG2 3.43Å; S49-V54 PolarHBondContact O-N 3.43Å; H52-V54 VanDerWaalsContact C-N 3.26Å; H52-V54 HydrophobicContact CB-CG1 4.33Å; H52-V54 HydrophobicContact CB-CG2 4.16Å; H52-V54 WeakPolarHBondContact O-CG1 3.44Å; H52-V54 PolarHBondContact O-N 3.02Å; V54-W82 HydrophobicContact CB-CB 4.11Å; V54-W82 HydrophobicContact CB-CE3 4.34Å; V54-W82 HydrophobicContact CB-CG 4.48Å; V54-W82 HydrophobicContact CG1-CB 3.41Å; V54-W82 VanDerWaalsContact CG1-CB 3.41Å; V54-W82 HydrophobicContact CG1-CG 4.2Å; V54-W82 HydrophobicContact CG2-CB 4.48Å; V54-W82 HydrophobicContact CG2-CE3 4.05Å; V54-V86 HydrophobicContact CG2-CG2 3.66Å
55	H	80.3	Confident	82.9	Confident	155 Å²	155	60.2 Å²	60.2	72%	0.718	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-84.9	116.4	171.9	-175.5	64.8	0	0	0	108.6
56	I	73.7	Confident	82.7	Confident	28 Å²	28	59.3 Å²	59.3	14%	0.144	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-82.6	127.8	174.9	-62.3	-177.3	0	0	0	108	L45 T58 W82 V86	L45-I56 HydrophobicContact CD1-CD1 3.47Å; L45-I56 VanDerWaalsContact CD1-CD1 3.47Å; L45-I56 HydrophobicContact CD2-CD1 4.04Å; L45-I56 HydrophobicContact CG-CD1 3.44Å; L45-I56 VanDerWaalsContact CG-CD1 3.44Å; I56-T58 PolarHBondContact O-N 3.37Å; I56-W82 HydrophobicContact CG1-CH2 4.48Å; I56-W82 HydrophobicContact CG1-CZ3 3.96Å; I56-V86 HydrophobicContact CD1-CG1 4.43Å
57	P	69.3	Low	81.9	Confident	20 Å²	20	56 Å²	56	13%	0.13	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-55.1	138.1	172.6	-26.9	36.9	0	0	0	111.6	S59 Y68	P57-S59 PolarHBondContact O-N 3.22Å; P57-Y68 WeakPolarHBondContact CG-O 3.47Å
58	T	66.9	Low	80.7	Confident	150 Å²	150	54.1 Å²	54.1	92%	0.92	27%	0.266	S	S	*	.	S	Bend	trans	-57.5	-33.6	-177.1	49	0	0	0	0	113.1	I56	I56-T58 PolarHBondContact O-N 3.37Å
59	S	69.6	Low	79.9	Confident	35 Å²	35	54.1 Å²	54.1	25%	0.245	27%	0.266	C	S	.	.			trans	-107.7	110.4	167.8	170	0	0	0	0	110.1	P57 L61 S62 E152	P57-S59 PolarHBondContact O-N 3.22Å; S59-L61 PolarHBondContact O-N 3.38Å; S59-L61 PolarHBondContact OG-N 3.19Å; S59-S62 WeakPolarHBondContact CB-OG 3.44Å; S59-S62 VanDerWaalsContact O-CB 3.31Å; S59-S62 WeakPolarHBondContact O-CB 3.48Å; S59-S62 PolarHBondContact O-N 3.45Å; S59-S62 VanDerWaalsContact O-N 3.08Å; S59-S62 PolarHBondContact O-OG 3.43Å; S59-S62 PolarHBondContact OG-N 3.45Å; S59-S62 PolarHBondContact OG-OG 2.87Å; S59-E152 PolarHBondContact OG-OE1 3.09Å
60	Q	69.1	Low	79.7	Confident	54 Å²	54	54.7 Å²	54.7	25%	0.252	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.8	169.6	-74.7	178.5	11.7	0	0	112.8	S65 Y68	Q60-S65 PolarHBondContact O-OG 3.27Å; Q60-Y68 HydrophobicContact CB-CD1 3.46Å; Q60-Y68 VanDerWaalsContact CB-CD1 3.46Å; Q60-Y68 HydrophobicContact CB-CE1 3.86Å; Q60-Y68 HydrophobicContact CB-CG 4.22Å; Q60-Y68 HydrophobicContact CG-CD1 3.76Å; Q60-Y68 HydrophobicContact CG-CE1 4.07Å; Q60-Y68 HydrophobicContact CG-CG 4.13Å; Q60-Y68 WeakPolarHBondContact O-CD1 3.47Å
61	L	71.2	Confident	79.4	Confident	41 Å²	41	47.4 Å²	47.4	22%	0.215	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	1.9	179.7	-57.4	-173.3	0	0	0	112.8	S59 G63 E152 A155	S59-L61 PolarHBondContact O-N 3.38Å; S59-L61 PolarHBondContact OG-N 3.19Å; L61-G63 PolarHBondContact O-N 3.44Å; L61-E152 WeakPolarHBondContact O-CG 3.38Å; L61-A155 HydrophobicContact CB-CB 4.24Å; L61-A155 HydrophobicContact CD1-CB 4.27Å; L61-A155 HydrophobicContact CD2-CB 3.91Å; L61-A155 HydrophobicContact CG-CB 4.36Å
62	S	77.7	Confident	79.1	Confident	24 Å²	24	45.1 Å²	45.1	17%	0.168	24%	0.236	C	C	.	.	S	Bend	trans	-51.8	130.8	-176.8	-62	0	0	0	0	111.4	S59 Y64 S65 G69	S59-S62 WeakPolarHBondContact CB-OG 3.44Å; S59-S62 VanDerWaalsContact O-CB 3.31Å; S59-S62 WeakPolarHBondContact O-CB 3.48Å; S59-S62 PolarHBondContact O-N 3.45Å; S59-S62 VanDerWaalsContact O-N 3.08Å; S59-S62 PolarHBondContact O-OG 3.43Å; S59-S62 PolarHBondContact OG-N 3.45Å; S59-S62 PolarHBondContact OG-OG 2.87Å; S62-Y64 PolarHBondContact O-N 2.92Å; S62-S65 PolarHBondContact O-N 2.74Å; S62-S65 VanDerWaalsContact O-N 3.11Å; S62-G69 CarbonylContact O-C 3.6Å
63	G	83	Confident	78.9	Confident	3 Å²	3	44.5 Å²	44.5	3%	0.031	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	-129.9	176	0	0	0	0	0	114.1	L61 S65 E148 A151 E152	L61-G63 PolarHBondContact O-N 3.44Å; G63-S65 VanDerWaalsContact C-N 3.32Å; G63-E148 WeakPolarHBondContact CA-O 3.1Å; G63-A151 CarbonylContact O-C 3.55Å; G63-E152 VanDerWaalsContact O-CA 3.25Å; G63-E152 WeakPolarHBondContact O-CA 3.46Å; G63-E152 PolarHBondContact O-N 3.25Å
64	Y	86.7	Confident	78.9	Confident	1 Å²	1	35.4 Å²	35.4	0%	0.004	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-24.3	177.9	-63.8	-86.8	0	0	0	112.7	S62 F66 L71 L144 E148 A151 K202 L206 L210 I222 F226	S62-Y64 PolarHBondContact O-N 2.92Å; Y64-F66 VanDerWaalsContact CB-CE2 3.5Å; Y64-F66 HydrophobicContact CD1-CZ 4.44Å; Y64-F66 AromaticContact CD2-CE2 3.94Å; Y64-F66 HydrophobicContact CD2-CE2 3.94Å; Y64-F66 HydrophobicContact CD2-CZ 4.34Å; Y64-F66 AromaticContact CG-CE2 3.85Å; Y64-F66 HydrophobicContact CG-CE2 3.85Å; Y64-F66 AromaticContact CG-CZ 3.86Å; Y64-F66 HydrophobicContact CG-CZ 3.86Å; Y64-L71 HydrophobicContact CD2-CB 4.37Å; Y64-L71 HydrophobicContact CD2-CD1 4.31Å; Y64-L71 HydrophobicContact CE2-CD1 4.4Å; Y64-L144 HydrophobicContact CE2-CB 4.44Å; Y64-L144 WeakPolarHBondContact CE2-O 3.4Å; Y64-L144 PolarHBondContact OH-O 3Å; Y64-E148 HydrophobicContact CD2-CG 4.44Å; Y64-E148 HydrophobicContact CE2-CB 4.18Å; Y64-E148 HydrophobicContact CE2-CG 4.41Å; Y64-A151 HydrophobicContact CD1-CB 3.65Å; Y64-A151 HydrophobicContact CE1-CB 3.6Å; Y64-A151 HydrophobicContact CG-CB 4.18Å; Y64-K202 PolarHBondContact O-NZ 3.25Å; Y64-L206 HydrophobicContact CD1-CD2 4.08Å; Y64-L206 HydrophobicContact CE1-CD2 4.37Å; Y64-L210 HydrophobicContact CE1-CD1 4.24Å; Y64-L210 HydrophobicContact CE1-CD2 4.12Å; Y64-I222 HydrophobicContact CD1-CG2 3.82Å; Y64-I222 HydrophobicContact CE1-CD1 4.5Å; Y64-I222 HydrophobicContact CE1-CG2 4.11Å; Y64-F226 WeakPolarHBondContact O-CZ 3.33Å
65	S	84	Confident	79.2	Confident	16 Å²	16	38 Å²	38	11%	0.112	21%	0.206	C	C	.	.			trans	67.2	57.6	-171.2	-165.7	0	0	0	0	113.4	Q60 S62 G63 G67 G69	Q60-S65 PolarHBondContact O-OG 3.27Å; S62-S65 PolarHBondContact O-N 2.74Å; S62-S65 VanDerWaalsContact O-N 3.11Å; G63-S65 VanDerWaalsContact C-N 3.32Å; S65-G67 PolarHBondContact O-N 3.3Å; S65-G69 WeakPolarHBondContact CA-O 3.35Å; S65-G69 PolarHBondContact N-O 3.02Å
66	F	82.4	Confident	79.7	Confident	1 Å²	1	34.2 Å²	34.2	0%	0.004	19%	0.186	C	C	.	.	S	Bend	trans	-75	98.3	167.7	-60.5	-60.2	0	0	0	109.4	Y64 Y68 L71 T74 M77 I127 I222 Y225 F226	Y64-F66 VanDerWaalsContact CB-CE2 3.5Å; Y64-F66 HydrophobicContact CD1-CZ 4.44Å; Y64-F66 AromaticContact CD2-CE2 3.94Å; Y64-F66 HydrophobicContact CD2-CE2 3.94Å; Y64-F66 HydrophobicContact CD2-CZ 4.34Å; Y64-F66 AromaticContact CG-CE2 3.85Å; Y64-F66 HydrophobicContact CG-CE2 3.85Å; Y64-F66 AromaticContact CG-CZ 3.86Å; Y64-F66 HydrophobicContact CG-CZ 3.86Å; F66-Y68 VanDerWaalsContact C-N 3.26Å; F66-Y68 PolarHBondContact O-N 3.42Å; F66-L71 HydrophobicContact CE2-CD1 3.85Å; F66-T74 HydrophobicContact CB-CG2 4.32Å; F66-T74 HydrophobicContact CD2-CG2 4.21Å; F66-T74 WeakPolarHBondContact CD2-OG1 3.08Å; F66-T74 HydrophobicContact CG-CG2 4.29Å; F66-M77 VanDerWaalsContact C-SD 3.56Å; F66-M77 HydrophobicContact CB-SD 4.07Å; F66-M77 VanDerWaalsContact O-SD 3.34Å; F66-I127 HydrophobicContact CD1-CD1 3.65Å; F66-I127 HydrophobicContact CD2-CD1 4.47Å; F66-I127 HydrophobicContact CE1-CD1 3.63Å; F66-I127 HydrophobicContact CE2-CD1 4.41Å; F66-I127 HydrophobicContact CG-CD1 4.13Å; F66-I127 HydrophobicContact CZ-CD1 4.04Å; F66-I222 HydrophobicContact CE1-CD1 4.38Å; F66-I222 HydrophobicContact CE2-CD1 4.3Å; F66-I222 HydrophobicContact CZ-CD1 3.51Å; F66-I222 HydrophobicContact CZ-CG2 4.46Å; F66-Y225 AromaticContact CD1-CD1 3.53Å; F66-Y225 HydrophobicContact CD1-CD1 3.53Å; F66-Y225 HydrophobicContact CD1-CD2 4.13Å; F66-Y225 AromaticContact CD1-CE1 3.43Å; F66-Y225 HydrophobicContact CD1-CE1 3.43Å; F66-Y225 VanDerWaalsContact CD1-CE1 3.43Å; F66-Y225 AromaticContact CD1-CE2 3.99Å; F66-Y225 HydrophobicContact CD1-CE2 3.99Å; F66-Y225 AromaticContact CD1-CG 3.9Å; F66-Y225 HydrophobicContact CD1-CG 3.9Å; F66-Y225 AromaticContact CD1-CZ 3.66Å; F66-Y225 AromaticContact CE1-CD1 3.57Å; F66-Y225 HydrophobicContact CE1-CD1 3.57Å; F66-Y225 HydrophobicContact CE1-CD2 4.49Å; F66-Y225 AromaticContact CE1-CE1 3.95Å; F66-Y225 HydrophobicContact CE1-CE1 3.95Å; F66-Y225 AromaticContact CE1-CG 3.89Å; F66-Y225 HydrophobicContact CE1-CG 3.89Å; F66-F226 HydrophobicContact CD1-CZ 4.46Å; F66-F226 HydrophobicContact CE1-CE2 4.1Å; F66-F226 HydrophobicContact CE1-CZ 4.2Å
67	G	71.1	Confident	80.4	Confident	4 Å²	4	32.9 Å²	32.9	4%	0.041	18%	0.179	C	C	.	.	S	Bend	trans	62.3	29.5	179.1	0	0	0	0	0	114.5	S65 W82 H83 Y225	S65-G67 PolarHBondContact O-N 3.3Å; G67-W82 WeakPolarHBondContact O-CZ2 3.18Å; G67-H83 WeakPolarHBondContact O-CB 3.4Å; G67-Y225 PolarHBondContact N-OH 2.89Å
68	Y	68.4	Low	81.6	Confident	47 Å²	47	32.8 Å²	32.8	18%	0.184	18%	0.179	C	C	.	.	S	Bend	trans	71.2	87.1	-169.2	-54.4	-57.5	0	0	0	114.7	P57 Q60 F66 W82 F87	P57-Y68 WeakPolarHBondContact CG-O 3.47Å; Q60-Y68 HydrophobicContact CB-CD1 3.46Å; Q60-Y68 VanDerWaalsContact CB-CD1 3.46Å; Q60-Y68 HydrophobicContact CB-CE1 3.86Å; Q60-Y68 HydrophobicContact CB-CG 4.22Å; Q60-Y68 HydrophobicContact CG-CD1 3.76Å; Q60-Y68 HydrophobicContact CG-CE1 4.07Å; Q60-Y68 HydrophobicContact CG-CG 4.13Å; Q60-Y68 WeakPolarHBondContact O-CD1 3.47Å; F66-Y68 VanDerWaalsContact C-N 3.26Å; F66-Y68 PolarHBondContact O-N 3.42Å; Y68-W82 WeakPolarHBondContact O-CH2 3.49Å; Y68-W82 WeakPolarHBondContact O-CZ2 3.48Å; Y68-F87 HydrophobicContact CD2-CE1 4.3Å; Y68-F87 AromaticContact CD2-CZ 3.91Å; Y68-F87 HydrophobicContact CD2-CZ 3.91Å; Y68-F87 HydrophobicContact CE2-CD1 4.34Å; Y68-F87 AromaticContact CE2-CE1 3.21Å; Y68-F87 HydrophobicContact CE2-CE1 3.21Å; Y68-F87 HydrophobicContact CE2-CE2 4.06Å; Y68-F87 AromaticContact CE2-CZ 3.02Å; Y68-F87 HydrophobicContact CE2-CZ 3.02Å; Y68-F87 AromaticContact CZ-CE1 3.67Å; Y68-F87 AromaticContact CZ-CZ 3.45Å; Y68-F87 VanDerWaalsContact CZ-CZ 3.45Å; Y68-F87 WeakPolarHBondContact OH-CE1 3.36Å; Y68-F87 WeakPolarHBondContact OH-CZ 3.47Å
69	G	75.8	Confident	82.8	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.169	C	C	.	.	S	Bend	trans	161.6	173.4	173.7	0	0	0	0	0	112.5	S62 S65	S62-G69 CarbonylContact O-C 3.6Å; S65-G69 WeakPolarHBondContact CA-O 3.35Å; S65-G69 PolarHBondContact N-O 3.02Å
70	S	86.3	Confident	83.8	Confident	23 Å²	23	35 Å²	35	16%	0.161	17%	0.169	C	C	.	.			trans	-68	168.2	174.3	71.8	0	0	0	0	111.1	N72 D73 E148	S70-N72 PolarHBondContact O-N 3.29Å; S70-N72 VanDerWaalsContact O-N 3.14Å; S70-N72 PolarHBondContact OG-N 3.33Å; S70-D73 WeakPolarHBondContact CB-OD2 3.33Å; S70-D73 PolarHBondContact N-OD2 3.2Å; S70-D73 WeakPolarHBondContact O-CB 3.35Å; S70-D73 PolarHBondContact O-N 2.91Å; S70-D73 PolarHBondContact OG-OD2 3.22Å; S70-E148 VanDerWaalsContact CA-OE1 3.32Å; S70-E148 WeakPolarHBondContact CA-OE1 3.45Å; S70-E148 VanDerWaalsContact CB-OE1 3.25Å; S70-E148 WeakPolarHBondContact CB-OE1 3.4Å
71	L	88.8	Confident	84.9	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.01	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-50.8	-35.2	170	-177.3	65.3	0	0	0	112.1	Y64 F66 D73 T74 L136 Q140 L144 K145 E148	Y64-L71 HydrophobicContact CD2-CB 4.37Å; Y64-L71 HydrophobicContact CD2-CD1 4.31Å; Y64-L71 HydrophobicContact CE2-CD1 4.4Å; F66-L71 HydrophobicContact CE2-CD1 3.85Å; L71-D73 VanDerWaalsContact C-N 3.27Å; L71-D73 PolarHBondContact O-N 3.09Å; L71-T74 WeakPolarHBondContact O-CB 3.43Å; L71-T74 PolarHBondContact O-N 2.97Å; L71-T74 PolarHBondContact O-OG1 3.45Å; L71-L136 HydrophobicContact CD1-CD1 3.73Å; L71-Q140 HydrophobicContact CD2-CB 4.43Å; L71-Q140 HydrophobicContact CD2-CG 3.79Å; L71-Q140 HydrophobicContact CG-CG 4.02Å; L71-L144 HydrophobicContact CD1-CB 4.41Å; L71-L144 HydrophobicContact CD1-CD1 4.37Å; L71-L144 HydrophobicContact CD2-CB 3.66Å; L71-K145 HydrophobicContact CD2-CB 4.28Å; L71-E148 WeakPolarHBondContact CB-OE1 3.44Å; L71-E148 PolarHBondContact N-OE1 2.88Å
72	N	88.8	Confident	85.8	Confident	74 Å²	74	34.7 Å²	34.7	40%	0.396	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-70.7	-22.4	-179.7	-68.4	-14.9	0	0	0	113.2	S70 T74 Q140	S70-N72 PolarHBondContact O-N 3.29Å; S70-N72 VanDerWaalsContact O-N 3.14Å; S70-N72 PolarHBondContact OG-N 3.33Å; N72-T74 VanDerWaalsContact C-N 3.28Å; N72-T74 PolarHBondContact O-N 3.17Å; N72-Q140 PolarHBondContact OD1-NE2 3.16Å
73	D	88.2	Confident	86.2	Confident	49 Å²	49	33.6 Å²	33.6	26%	0.262	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-81.4	-11.4	-179.9	-57.8	-55.3	0	0	0	112	S70 L71 E75 Y76 M77	S70-D73 WeakPolarHBondContact CB-OD2 3.33Å; S70-D73 PolarHBondContact N-OD2 3.2Å; S70-D73 WeakPolarHBondContact O-CB 3.35Å; S70-D73 PolarHBondContact O-N 2.91Å; S70-D73 PolarHBondContact OG-OD2 3.22Å; L71-D73 VanDerWaalsContact C-N 3.27Å; L71-D73 PolarHBondContact O-N 3.09Å; D73-E75 PolarHBondContact O-N 2.78Å; D73-Y76 PolarHBondContact O-N 3.5Å; D73-M77 VanDerWaalsContact O-CB 3.27Å; D73-M77 WeakPolarHBondContact O-CB 3.46Å; D73-M77 PolarHBondContact O-N 2.95Å
74	T	90.9	Very high	86.6	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.006	16%	0.157	C	C	.	.	H	α-helix	trans	-61	-43.7	-172.7	-45.6	0	0	0	0	113	F66 L71 N72 M77 C78 I127 L136	F66-T74 HydrophobicContact CB-CG2 4.32Å; F66-T74 HydrophobicContact CD2-CG2 4.21Å; F66-T74 WeakPolarHBondContact CD2-OG1 3.08Å; F66-T74 HydrophobicContact CG-CG2 4.29Å; L71-T74 WeakPolarHBondContact O-CB 3.43Å; L71-T74 PolarHBondContact O-N 2.97Å; L71-T74 PolarHBondContact O-OG1 3.45Å; N72-T74 VanDerWaalsContact C-N 3.28Å; N72-T74 PolarHBondContact O-N 3.17Å; T74-M77 HydrophobicContact CG2-CE 4.07Å; T74-M77 WeakPolarHBondContact O-CB 3.39Å; T74-M77 PolarHBondContact O-N 3.29Å; T74-C78 WeakPolarHBondContact O-CB 3.3Å; T74-C78 PolarHBondContact O-N 2.88Å; T74-C78 PolarHBondContact O-SG 3.15Å; T74-I127 HydrophobicContact CG2-CD1 3.83Å; T74-I127 HydrophobicContact CG2-CG1 4.3Å; T74-L136 HydrophobicContact CG2-CD2 3.53Å
75	E	91.5	Very high	86.9	Confident	71 Å²	71	37.6 Å²	37.6	33%	0.332	18%	0.176	S	C	.	.	H	α-helix	trans	-68.6	-39.7	178.8	-68.5	-156	-163.1	0	0	112	D73 M77 C78 R79 R137	D73-E75 PolarHBondContact O-N 2.78Å; E75-M77 VanDerWaalsContact C-N 3.33Å; E75-C78 PolarHBondContact O-N 2.05Å; E75-R79 WeakPolarHBondContact O-CB 3.36Å; E75-R79 PolarHBondContact O-N 3.35Å; E75-R137 WeakPolarHBondContact OE1-CG 3.47Å; E75-R137 IonicContact OE1-CZ 3.44Å; E75-R137 IonicContact OE1-NE 3.66Å; E75-R137 PolarHBondContact OE1-NE 3.37Å; E75-R137 IonicContact OE1-NH2 3.55Å; E75-R137 IonicContact OE2-CZ 3.84Å; E75-R137 IonicContact OE2-NE 2.94Å; E75-R137 IonicContact OE2-NH2 3.59Å; E75-R137 PolarHBondContact OE2-NH2 3.09Å
76	Y	89.4	Confident	87.2	Confident	75 Å²	75	37 Å²	37	29%	0.294	17%	0.171	S	C	.	.	H	α-helix	trans	-62.6	-43.1	173.9	176.3	-107.1	0	0	0	111.2	D73 C78 R79 T80 W82	D73-Y76 PolarHBondContact O-N 3.5Å; Y76-C78 VanDerWaalsContact C-N 3.33Å; Y76-C78 PolarHBondContact O-N 3.39Å; Y76-R79 PolarHBondContact O-N 3.06Å; Y76-T80 HydrophobicContact CD2-CG2 3.97Å; Y76-T80 HydrophobicContact CE2-CG2 3.54Å; Y76-T80 PolarHBondContact O-N 3.32Å; Y76-T80 PolarHBondContact O-OG1 3.47Å; Y76-W82 AromaticContact CD1-CD1 3.62Å; Y76-W82 AromaticContact CD1-NE1 3.74Å; Y76-W82 AromaticContact CE1-CD1 3.49Å; Y76-W82 VanDerWaalsContact CE1-CD1 3.49Å; Y76-W82 HydrophobicContact CE1-CG 4.14Å; Y76-W82 AromaticContact CE1-NE1 3.89Å
77	M	90.2	Very high	87.5	Confident	0 Å²	0	37 Å²	37	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-57.3	-45.2	172.8	-178.3	-150.1	66.9	0	0	111.1	F66 D73 T74 E75 R81 H83 I127	F66-M77 VanDerWaalsContact C-SD 3.56Å; F66-M77 HydrophobicContact CB-SD 4.07Å; F66-M77 VanDerWaalsContact O-SD 3.34Å; D73-M77 VanDerWaalsContact O-CB 3.27Å; D73-M77 WeakPolarHBondContact O-CB 3.46Å; D73-M77 PolarHBondContact O-N 2.95Å; T74-M77 HydrophobicContact CG2-CE 4.07Å; T74-M77 WeakPolarHBondContact O-CB 3.39Å; T74-M77 PolarHBondContact O-N 3.29Å; E75-M77 VanDerWaalsContact C-N 3.33Å; M77-R81 WeakPolarHBondContact O-CA 3.13Å; M77-R81 PolarHBondContact O-N 3.32Å; M77-H83 WeakPolarHBondContact CG-CE1 3.26Å; M77-H83 WeakPolarHBondContact CG-ND1 3.48Å; M77-H83 VanDerWaalsContact SD-CE1 3.55Å; M77-I127 HydrophobicContact CE-CG2 3.89Å
78	C	93.2	Very high	88.5	Confident	17 Å²	17	40.6 Å²	40.6	12%	0.115	19%	0.187	C	C	.	.	H	α-helix	trans	-66	-41.4	179	-73.8	0	0	0	0	113.3	T74 E75 Y76 C128	T74-C78 WeakPolarHBondContact O-CB 3.3Å; T74-C78 PolarHBondContact O-N 2.88Å; T74-C78 PolarHBondContact O-SG 3.15Å; E75-C78 PolarHBondContact O-N 2.05Å; Y76-C78 VanDerWaalsContact C-N 3.33Å; Y76-C78 PolarHBondContact O-N 3.39Å; C78-C128 WeakPolarHBondContact CA-SG 3.46Å; C78-C128 HydrophobicContact CB-CB 3.59Å; C78-C128 WeakPolarHBondContact CB-SG 3.47Å; C78-C128 WeakPolarHBondContact SG-CA 3.26Å; C78-C128 WeakPolarHBondContact SG-CB 3.45Å; C78-C128 CovalentContact SG-SG 2.03Å; C78-C128 PolarHBondContact SG-SG 3.11Å
79	R	92.4	Very high	89.7	Confident	192 Å²	192	38.8 Å²	38.8	73%	0.725	18%	0.181	S	C	*	.	H	α-helix	trans	-68.3	-39.4	-179.7	-180	169	60.5	94.5	-6.9	113.1	E75 Y76	E75-R79 WeakPolarHBondContact O-CB 3.36Å; E75-R79 PolarHBondContact O-N 3.35Å; Y76-R79 PolarHBondContact O-N 3.06Å
80	T	91.1	Very high	90.3	Very high	40 Å²	40	38.8 Å²	38.8	25%	0.245	18%	0.181	C	C	.	.	H	α-helix	trans	-104.6	-19.7	-170.8	60.5	0	0	0	0	113.8	Y76 W82	Y76-T80 HydrophobicContact CD2-CG2 3.97Å; Y76-T80 HydrophobicContact CE2-CG2 3.54Å; Y76-T80 PolarHBondContact O-N 3.32Å; Y76-T80 PolarHBondContact O-OG1 3.47Å; T80-W82 PolarHBondContact O-N 3.13Å; T80-W82 VanDerWaalsContact O-N 3.09Å; T80-W82 WeakPolarHBondContact OG1-CB 3.38Å; T80-W82 VanDerWaalsContact OG1-CD1 3.3Å; T80-W82 PolarHBondContact OG1-N 2.88Å
81	R	91.7	Very high	90.4	Very high	85 Å²	85	41.4 Å²	41.4	32%	0.321	19%	0.187	S	C	.	.			trans	50.2	29.6	-169.9	-59.3	-64.2	-173.7	123.9	-3.3	112.7	M77 H83 I84 L85	M77-R81 WeakPolarHBondContact O-CA 3.13Å; M77-R81 PolarHBondContact O-N 3.32Å; R81-H83 VanDerWaalsContact C-N 3.29Å; R81-H83 PolarHBondContact O-N 3.25Å; R81-I84 HydrophobicContact CB-CD1 4.33Å; R81-I84 PolarHBondContact O-N 3.4Å; R81-I84 VanDerWaalsContact O-N 3.09Å; R81-L85 PolarHBondContact O-N 2.77Å
82	W	89.8	Confident	90.5	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.015	21%	0.212	C	C	.	.	H	α-helix	trans	-56.1	-41.1	-169.3	69.5	-96.7	0	0	0	113.5	V54 I56 G67 Y68 Y76 T80 I84 L85 V86	V54-W82 HydrophobicContact CB-CB 4.11Å; V54-W82 HydrophobicContact CB-CE3 4.34Å; V54-W82 HydrophobicContact CB-CG 4.48Å; V54-W82 HydrophobicContact CG1-CB 3.41Å; V54-W82 VanDerWaalsContact CG1-CB 3.41Å; V54-W82 HydrophobicContact CG1-CG 4.2Å; V54-W82 HydrophobicContact CG2-CB 4.48Å; V54-W82 HydrophobicContact CG2-CE3 4.05Å; I56-W82 HydrophobicContact CG1-CH2 4.48Å; I56-W82 HydrophobicContact CG1-CZ3 3.96Å; G67-W82 WeakPolarHBondContact O-CZ2 3.18Å; Y68-W82 WeakPolarHBondContact O-CH2 3.49Å; Y68-W82 WeakPolarHBondContact O-CZ2 3.48Å; Y76-W82 AromaticContact CD1-CD1 3.62Å; Y76-W82 AromaticContact CD1-NE1 3.74Å; Y76-W82 AromaticContact CE1-CD1 3.49Å; Y76-W82 VanDerWaalsContact CE1-CD1 3.49Å; Y76-W82 HydrophobicContact CE1-CG 4.14Å; Y76-W82 AromaticContact CE1-NE1 3.89Å; T80-W82 PolarHBondContact O-N 3.13Å; T80-W82 VanDerWaalsContact O-N 3.09Å; T80-W82 WeakPolarHBondContact OG1-CB 3.38Å; T80-W82 VanDerWaalsContact OG1-CD1 3.3Å; T80-W82 PolarHBondContact OG1-N 2.88Å; W82-I84 VanDerWaalsContact C-N 3.32Å; W82-I84 PolarHBondContact O-N 3.12Å; W82-L85 WeakPolarHBondContact O-CB 3.04Å; W82-L85 PolarHBondContact O-N 3.16Å; W82-L85 VanDerWaalsContact O-N 3.14Å; W82-V86 HydrophobicContact CE3-CG2 4.06Å; W82-V86 HydrophobicContact CZ3-CG2 4.5Å; W82-V86 WeakPolarHBondContact O-CG2 2.98Å; W82-V86 PolarHBondContact O-N 3.12Å
83	H	86.9	Confident	90.5	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-60.7	-38.9	-179.3	67.1	-70.7	0	0	0	112.7	G67 M77 R81 F87	G67-H83 WeakPolarHBondContact O-CB 3.4Å; M77-H83 WeakPolarHBondContact CG-CE1 3.26Å; M77-H83 WeakPolarHBondContact CG-ND1 3.48Å; M77-H83 VanDerWaalsContact SD-CE1 3.55Å; R81-H83 VanDerWaalsContact C-N 3.29Å; R81-H83 PolarHBondContact O-N 3.25Å; H83-F87 VanDerWaalsContact O-CD2 3.22Å; H83-F87 WeakPolarHBondContact O-CD2 3.42Å; H83-F87 WeakPolarHBondContact O-CG 3.33Å; H83-F87 PolarHBondContact O-N 2.94Å
84	I	91.6	Very high	90.4	Very high	14 Å²	14	44.1 Å²	44.1	7%	0.072	19%	0.192	C	C	.	.	H	α-helix	trans	-66.7	-43.1	174.9	-69.5	155.5	0	0	0	110.4	R81 W82 V86 F87 H88 E121 A124	R81-I84 HydrophobicContact CB-CD1 4.33Å; R81-I84 PolarHBondContact O-N 3.4Å; R81-I84 VanDerWaalsContact O-N 3.09Å; W82-I84 VanDerWaalsContact C-N 3.32Å; W82-I84 PolarHBondContact O-N 3.12Å; I84-V86 PolarHBondContact O-N 3.46Å; I84-F87 PolarHBondContact O-N 3.22Å; I84-H88 WeakPolarHBondContact O-CB 3.47Å; I84-H88 PolarHBondContact O-CD2 3.37Å; I84-H88 PolarHBondContact O-N 2.95Å; I84-E121 HydrophobicContact CD1-CB 4.47Å; I84-E121 HydrophobicContact CD1-CG 3.83Å; I84-E121 HydrophobicContact CG1-CG 4.02Å; I84-E121 HydrophobicContact CG2-CG 3.95Å; I84-A124 HydrophobicContact CD1-CB 4.07Å
85	L	92.2	Very high	90.1	Very high	74 Å²	74	47.7 Å²	47.7	39%	0.387	21%	0.208	S	C	.	.	H	α-helix	trans	-61.9	-44.1	177.8	-63.2	175.9	0	0	0	111.7	R81 W82 H88 C89	R81-L85 PolarHBondContact O-N 2.77Å; W82-L85 WeakPolarHBondContact O-CB 3.04Å; W82-L85 PolarHBondContact O-N 3.16Å; W82-L85 VanDerWaalsContact O-N 3.14Å; L85-H88 PolarHBondContact O-N 2.96Å; L85-C89 WeakPolarHBondContact O-CB 3.26Å; L85-C89 PolarHBondContact O-N 3.27Å
86	V	90.4	Very high	89.9	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.012	22%	0.216	C	C	.	.	H	α-helix	trans	-63	-43.9	176.8	171.1	0	0	0	0	110.8	L45 C48 V54 I56 W82 I84 C89 M90	L45-V86 HydrophobicContact CD1-CG1 3.75Å; C48-V86 HydrophobicContact CB-CG1 4.13Å; V54-V86 HydrophobicContact CG2-CG2 3.66Å; I56-V86 HydrophobicContact CD1-CG1 4.43Å; W82-V86 HydrophobicContact CE3-CG2 4.06Å; W82-V86 HydrophobicContact CZ3-CG2 4.5Å; W82-V86 WeakPolarHBondContact O-CG2 2.98Å; W82-V86 PolarHBondContact O-N 3.12Å; I84-V86 PolarHBondContact O-N 3.46Å; V86-C89 WeakPolarHBondContact O-CB 3.48Å; V86-C89 PolarHBondContact O-N 2.82Å; V86-M90 HydrophobicContact CG1-CE 4.05Å; V86-M90 WeakPolarHBondContact O-CG 3.18Å; V86-M90 PolarHBondContact O-N 3.44Å
87	F	88.9	Confident	89.5	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.009	22%	0.216	C	C	.	.	H	α-helix	trans	-64.2	-44.6	175.9	-73	-40.1	0	0	0	113.6	Y68 H83 I84 C89 M90 R91 L115 T117 F120	Y68-F87 HydrophobicContact CD2-CE1 4.3Å; Y68-F87 AromaticContact CD2-CZ 3.91Å; Y68-F87 HydrophobicContact CD2-CZ 3.91Å; Y68-F87 HydrophobicContact CE2-CD1 4.34Å; Y68-F87 AromaticContact CE2-CE1 3.21Å; Y68-F87 HydrophobicContact CE2-CE1 3.21Å; Y68-F87 HydrophobicContact CE2-CE2 4.06Å; Y68-F87 AromaticContact CE2-CZ 3.02Å; Y68-F87 HydrophobicContact CE2-CZ 3.02Å; Y68-F87 AromaticContact CZ-CE1 3.67Å; Y68-F87 AromaticContact CZ-CZ 3.45Å; Y68-F87 VanDerWaalsContact CZ-CZ 3.45Å; Y68-F87 WeakPolarHBondContact OH-CE1 3.36Å; Y68-F87 WeakPolarHBondContact OH-CZ 3.47Å; H83-F87 VanDerWaalsContact O-CD2 3.22Å; H83-F87 WeakPolarHBondContact O-CD2 3.42Å; H83-F87 WeakPolarHBondContact O-CG 3.33Å; H83-F87 PolarHBondContact O-N 2.94Å; I84-F87 PolarHBondContact O-N 3.22Å; F87-C89 VanDerWaalsContact C-N 3.28Å; F87-C89 PolarHBondContact O-N 3.06Å; F87-M90 HydrophobicContact CD1-CE 3.46Å; F87-M90 VanDerWaalsContact CD1-CE 3.46Å; F87-M90 HydrophobicContact CE1-CE 3.96Å; F87-M90 PolarHBondContact O-N 2.03Å; F87-R91 VanDerWaalsContact O-CB 3.32Å; F87-R91 WeakPolarHBondContact O-CB 3.32Å; F87-R91 PolarHBondContact O-N 3.31Å; F87-L115 HydrophobicContact CD1-CD2 4.11Å; F87-T117 HydrophobicContact CB-CG2 3.57Å; F87-F120 AromaticContact CD2-CD2 3.68Å; F87-F120 HydrophobicContact CD2-CD2 3.68Å; F87-F120 HydrophobicContact CD2-CE2 4.06Å; F87-F120 HydrophobicContact CD2-CG 4.26Å; F87-F120 HydrophobicContact CE2-CD1 4.29Å; F87-F120 AromaticContact CE2-CD2 3.41Å; F87-F120 HydrophobicContact CE2-CD2 3.41Å; F87-F120 VanDerWaalsContact CE2-CD2 3.41Å; F87-F120 HydrophobicContact CE2-CE1 4.37Å; F87-F120 AromaticContact CE2-CE2 3.49Å; F87-F120 HydrophobicContact CE2-CE2 3.49Å; F87-F120 VanDerWaalsContact CE2-CE2 3.49Å; F87-F120 AromaticContact CE2-CG 3.84Å; F87-F120 HydrophobicContact CE2-CG 3.84Å; F87-F120 AromaticContact CE2-CZ 3.99Å; F87-F120 HydrophobicContact CE2-CZ 3.99Å; F87-F120 HydrophobicContact CZ-CD2 4.27Å; F87-F120 AromaticContact CZ-CE2 3.89Å; F87-F120 HydrophobicContact CZ-CE2 3.89Å; F87-F120 HydrophobicContact CZ-CZ 4.15Å
88	H	92	Very high	88.9	Confident	79 Å²	79	47.8 Å²	47.8	37%	0.366	22%	0.216	S	C	.	.	H	α-helix	trans	-59.4	-41.9	175	-85.4	-46.6	0	0	0	111.7	I84 L85 R91 K92 T117 E121	I84-H88 WeakPolarHBondContact O-CB 3.47Å; I84-H88 PolarHBondContact O-CD2 3.37Å; I84-H88 PolarHBondContact O-N 2.95Å; L85-H88 PolarHBondContact O-N 2.96Å; H88-R91 PolarHBondContact O-N 2.79Å; H88-K92 WeakPolarHBondContact O-CB 3.4Å; H88-K92 PolarHBondContact O-N 2.99Å; H88-T117 PolarHBondContact CE1-OG1 3.44Å; H88-T117 PolarHBondContact NE2-OG1 3.44Å; H88-E121 IonicContact CD2-OE1 2.6Å; H88-E121 IonicContact CE1-OE1 2.98Å; H88-E121 IonicContact NE2-OE1 3.63Å; H88-E121 PolarHBondContact NE2-OE1 3Å
89	C	92.7	Very high	87.9	Confident	9 Å²	9	51 Å²	51	6%	0.061	23%	0.232	C	C	.	.	H	α-helix	trans	-60.6	-50.1	175	172.7	0	0	0	0	111.8	C48 L85 V86 F87 R91 K92 R93	C48-C89 VanDerWaalsContact CA-SG 3.53Å; C48-C89 HydrophobicContact CB-CB 3.67Å; C48-C89 WeakPolarHBondContact CB-SG 3.39Å; C48-C89 WeakPolarHBondContact SG-CB 3.48Å; C48-C89 CovalentContact SG-SG 2.04Å; C48-C89 PolarHBondContact SG-SG 3.27Å; L85-C89 WeakPolarHBondContact O-CB 3.26Å; L85-C89 PolarHBondContact O-N 3.27Å; V86-C89 WeakPolarHBondContact O-CB 3.48Å; V86-C89 PolarHBondContact O-N 2.82Å; F87-C89 VanDerWaalsContact C-N 3.28Å; F87-C89 PolarHBondContact O-N 3.06Å; C89-R91 VanDerWaalsContact C-N 3.35Å; C89-R91 PolarHBondContact O-N 3.24Å; C89-K92 PolarHBondContact O-N 3.16Å; C89-R93 WeakPolarHBondContact O-CG 3.01Å; C89-R93 PolarHBondContact O-N 3.29Å
90	M	89.4	Confident	86.9	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-42.1	179.7	-74.5	-168.2	-59.9	0	0	111.7	F39 L41 E44 L45 C48 V86 F87 R93 A94 L115	F39-M90 HydrophobicContact CE2-CB 4.48Å; F39-M90 WeakPolarHBondContact CE2-O 3.41Å; F39-M90 HydrophobicContact CZ-CB 4.11Å; L41-M90 HydrophobicContact CD1-SD 4.08Å; E44-M90 HydrophobicContact CB-CG 4.39Å; L45-M90 HydrophobicContact CB-SD 3.86Å; L45-M90 HydrophobicContact CD1-CE 3.85Å; L45-M90 HydrophobicContact CD1-SD 3.72Å; L45-M90 HydrophobicContact CG-SD 4.44Å; C48-M90 HydrophobicContact CB-CG 4.12Å; C48-M90 PolarHBondContact SG-N 2.88Å; C48-M90 VanDerWaalsContact SG-N 3.35Å; V86-M90 HydrophobicContact CG1-CE 4.05Å; V86-M90 WeakPolarHBondContact O-CG 3.18Å; V86-M90 PolarHBondContact O-N 3.44Å; F87-M90 HydrophobicContact CD1-CE 3.46Å; F87-M90 VanDerWaalsContact CD1-CE 3.46Å; F87-M90 HydrophobicContact CE1-CE 3.96Å; F87-M90 PolarHBondContact O-N 2.03Å; M90-R93 PolarHBondContact O-N 2.86Å; M90-A94 WeakPolarHBondContact O-CB 3.44Å; M90-A94 PolarHBondContact O-N 3.26Å; M90-L115 HydrophobicContact CB-CD1 4.04Å; M90-L115 HydrophobicContact CB-CD2 4.34Å; M90-L115 HydrophobicContact CE-CD2 3.87Å
91	R	88.9	Confident	86	Confident	78 Å²	78	48.9 Å²	48.9	29%	0.294	23%	0.233	S	C	.	.	H	α-helix	trans	-59.2	-50.2	177.4	178.1	178.5	169.5	169.9	-0.3	111.2	F87 H88 C89 R93 A94 E95 L115	F87-R91 VanDerWaalsContact O-CB 3.32Å; F87-R91 WeakPolarHBondContact O-CB 3.32Å; F87-R91 PolarHBondContact O-N 3.31Å; H88-R91 PolarHBondContact O-N 2.79Å; C89-R91 VanDerWaalsContact C-N 3.35Å; C89-R91 PolarHBondContact O-N 3.24Å; R91-R93 VanDerWaalsContact C-N 3.27Å; R91-R93 PolarHBondContact O-N 3.07Å; R91-A94 WeakPolarHBondContact O-CB 3.29Å; R91-A94 PolarHBondContact O-N 3.44Å; R91-E95 WeakPolarHBondContact CG-OE1 3.41Å; R91-E95 IonicContact CZ-OE1 3.74Å; R91-E95 IonicContact NE-OE1 2.65Å; R91-E95 PolarHBondContact NE-OE1 2.89Å; R91-E95 IonicContact NH2-OE1 3.22Å; R91-E95 PolarHBondContact NH2-OE1 2.99Å; R91-E95 WeakPolarHBondContact O-CG 3.42Å; R91-E95 PolarHBondContact O-N 3.39Å; R91-L115 HydrophobicContact CB-CB 4.06Å; R91-L115 HydrophobicContact CB-CD1 4.35Å
92	K	90.6	Very high	84.9	Confident	121 Å²	121	49.9 Å²	49.9	53%	0.526	24%	0.244	S	C	.	.	H	α-helix	trans	-57.3	-42.6	177.4	177.5	170.3	176.9	170.4	0	111.5	H88 C89 E95 E96	H88-K92 WeakPolarHBondContact O-CB 3.4Å; H88-K92 PolarHBondContact O-N 2.99Å; C89-K92 PolarHBondContact O-N 3.16Å; K92-E95 PolarHBondContact O-N 3.37Å; K92-E96 WeakPolarHBondContact CE-OE1 3.43Å; K92-E96 IonicContact NZ-OE1 2.79Å; K92-E96 WeakPolarHBondContact O-CB 2.97Å; K92-E96 VanDerWaalsContact O-CG 3.31Å; K92-E96 WeakPolarHBondContact O-CG 3.21Å; K92-E96 PolarHBondContact O-N 2.79Å
93	R	89.3	Confident	83.9	Confident	57 Å²	57	54.9 Å²	54.9	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-69.2	-35.4	179.3	-69.5	-175.8	61.5	77.3	10.9	113.1	E44 Y47 C89 M90 R91 S97	E44-R93 IonicContact OE1-CZ 2.86Å; E44-R93 IonicContact OE1-NE 2.63Å; E44-R93 PolarHBondContact OE1-NE 3.24Å; E44-R93 IonicContact OE1-NH2 3.97Å; E44-R93 PolarHBondContact OE1-NH2 3.26Å; E44-R93 WeakPolarHBondContact OE2-CB 3.01Å; E44-R93 WeakPolarHBondContact OE2-CD 3.48Å; E44-R93 IonicContact OE2-CZ 3.14Å; E44-R93 IonicContact OE2-NE 3.77Å; E44-R93 PolarHBondContact OE2-NE 3.14Å; E44-R93 IonicContact OE2-NH2 3.54Å; Y47-R93 VanDerWaalsContact CD1-CD 3.48Å; C89-R93 WeakPolarHBondContact O-CG 3.01Å; C89-R93 PolarHBondContact O-N 3.29Å; M90-R93 PolarHBondContact O-N 2.86Å; R91-R93 VanDerWaalsContact C-N 3.27Å; R91-R93 PolarHBondContact O-N 3.07Å; R93-S97 VanDerWaalsContact O-CB 3.28Å; R93-S97 WeakPolarHBondContact O-CB 3.46Å; R93-S97 PolarHBondContact O-N 3.37Å; R93-S97 VanDerWaalsContact O-N 3.08Å; R93-S97 PolarHBondContact O-OG 3.46Å
94	A	85.7	Confident	83.1	Confident	3 Å²	3	56.9 Å²	56.9	3%	0.025	28%	0.277	C	S	.	.	H	α-helix	trans	-63.9	-44.3	171.3	0	0	0	0	0	111.8	F39 M90 R91 S97 C98 W111 L115	F39-A94 VanDerWaalsContact CD2-CA 3.47Å; F39-A94 HydrophobicContact CD2-CB 3.49Å; F39-A94 VanDerWaalsContact CD2-CB 3.49Å; F39-A94 HydrophobicContact CE2-CB 3.68Å; F39-A94 HydrophobicContact CG-CB 4.05Å; F39-A94 HydrophobicContact CZ-CB 4.38Å; M90-A94 WeakPolarHBondContact O-CB 3.44Å; M90-A94 PolarHBondContact O-N 3.26Å; R91-A94 WeakPolarHBondContact O-CB 3.29Å; R91-A94 PolarHBondContact O-N 3.44Å; A94-S97 PolarHBondContact O-N 2.95Å; A94-C98 WeakPolarHBondContact O-CB 3.41Å; A94-C98 PolarHBondContact O-N 3.34Å; A94-W111 HydrophobicContact CB-CB 4.09Å; A94-W111 HydrophobicContact CB-CG 4.3Å; A94-L115 HydrophobicContact CB-CD1 4.46Å
95	E	85.3	Confident	82.2	Confident	76 Å²	76	60 Å²	60	36%	0.355	29%	0.291	S	S	.	.	H	α-helix	trans	-64.1	-37.9	177.7	-71.9	170	179.5	0	0	112.3	R91 K92	R91-E95 WeakPolarHBondContact CG-OE1 3.41Å; R91-E95 IonicContact CZ-OE1 3.74Å; R91-E95 IonicContact NE-OE1 2.65Å; R91-E95 PolarHBondContact NE-OE1 2.89Å; R91-E95 IonicContact NH2-OE1 3.22Å; R91-E95 PolarHBondContact NH2-OE1 2.99Å; R91-E95 WeakPolarHBondContact O-CG 3.42Å; R91-E95 PolarHBondContact O-N 3.39Å; K92-E95 PolarHBondContact O-N 3.37Å
96	E	85.6	Confident	81.3	Confident	106 Å²	106	59 Å²	59	50%	0.495	28%	0.283	S	S	.	.	H	α-helix	trans	-71.7	-31.3	176.8	-73.6	170	177	0	0	113	K92	K92-E96 WeakPolarHBondContact CE-OE1 3.43Å; K92-E96 IonicContact NZ-OE1 2.79Å; K92-E96 WeakPolarHBondContact O-CB 2.97Å; K92-E96 VanDerWaalsContact O-CG 3.31Å; K92-E96 WeakPolarHBondContact O-CG 3.21Å; K92-E96 PolarHBondContact O-N 2.79Å
97	S	82.6	Confident	80.5	Confident	42 Å²	42	62.9 Å²	62.9	29%	0.294	30%	0.297	S	S	.	.	H	α-helix	trans	-100.5	-24	-170.1	-49.2	0	0	0	0	114.3	C38 R93 A94	C38-S97 WeakPolarHBondContact CB-O 3.24Å; C38-S97 WeakPolarHBondContact O-CB 3.47Å; R93-S97 VanDerWaalsContact O-CB 3.28Å; R93-S97 WeakPolarHBondContact O-CB 3.46Å; R93-S97 PolarHBondContact O-N 3.37Å; R93-S97 VanDerWaalsContact O-N 3.08Å; R93-S97 PolarHBondContact O-OG 3.46Å; A94-S97 PolarHBondContact O-N 2.95Å
98	C	77	Confident	79.9	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	31%	0.311	C	S	.	.	S	Bend	trans	-113.9	57.7	-173.3	-61.1	0	0	0	0	113.3	C38 F39 A94 E104 Q108	C38-C98 VanDerWaalsContact C-SG 3.54Å; C38-C98 HydrophobicContact CB-CB 3.87Å; C38-C98 WeakPolarHBondContact CB-SG 3.47Å; C38-C98 WeakPolarHBondContact SG-CB 3.28Å; C38-C98 CovalentContact SG-SG 2.04Å; C38-C98 PolarHBondContact SG-SG 3.12Å; F39-C98 VanDerWaalsContact CB-SG 3.59Å; A94-C98 WeakPolarHBondContact O-CB 3.41Å; A94-C98 PolarHBondContact O-N 3.34Å; C98-E104 HydrophobicContact CB-CB 4.27Å; C98-Q108 HydrophobicContact CB-CB 4.43Å
99	N	71.9	Confident	79.2	Confident	85 Å²	85	63.4 Å²	63.4	46%	0.455	30%	0.301	S	S	.	.			trans	-123.5	1.7	-177.1	79	23.5	0	0	0	115.9	E104	N99-E104 PolarHBondContact N-OE2 3.22Å
100	H	71.7	Confident	78.6	Confident	142 Å²	142	65.2 Å²	65.2	66%	0.657	31%	0.309	S	S	*	.	S	Bend	trans	-99	-24.8	-162.6	-50.9	90.6	0	0	0	114.1	E104	H100-E104 WeakPolarHBondContact CA-OE2 3.34Å; H100-E104 VanDerWaalsContact CB-OE2 3.27Å; H100-E104 WeakPolarHBondContact CB-OE2 3.36Å; H100-E104 IonicContact CG-OE2 2.74Å; H100-E104 PolarHBondContact N-OE2 3.02Å; H100-E104 IonicContact ND1-OE2 3.62Å; H100-E104 PolarHBondContact ND1-OE2 3.3Å
101	S	71.7	Confident	78.2	Confident	46 Å²	46	67.3 Å²	67.3	32%	0.322	32%	0.317	S	S	.	.	S	Bend	trans	-133.4	163.7	-177.2	71.8	0	0	0	0	113.3	E103 E104 K105	S101-E103 VanDerWaalsContact C-N 3.3Å; S101-E103 PolarHBondContact O-N 2.65Å; S101-E104 CarbonylContact O-C 3.58Å; S101-E104 WeakPolarHBondContact O-CA 3.39Å; S101-E104 WeakPolarHBondContact O-CB 3.23Å; S101-E104 PolarHBondContact O-N 3.08Å; S101-E104 VanDerWaalsContact O-N 3.1Å; S101-E104 WeakPolarHBondContact OG-CB 3.46Å; S101-E104 VanDerWaalsContact OG-CG 3.24Å; S101-E104 WeakPolarHBondContact OG-CG 3.4Å; S101-E104 PolarHBondContact OG-N 3.47Å; S101-K105 WeakPolarHBondContact O-CG 3.33Å; S101-K105 PolarHBondContact O-N 2.79Å
102	D	68.5	Low	77.8	Confident	105 Å²	105	65.8 Å²	65.8	56%	0.561	32%	0.319	S	S	*	.	H	α-helix	trans	-66.3	-31.5	177.9	-69	-26.3	0	0	0	112.9	E104 K105 F106	D102-E104 VanDerWaalsContact C-N 3.34Å; D102-K105 PolarHBondContact O-N 3.38Å; D102-K105 IonicContact OD1-NZ 3.58Å; D102-K105 PolarHBondContact OD1-NZ 3.36Å; D102-F106 PolarHBondContact O-N 2.92Å
103	E	68.7	Low	77.3	Confident	110 Å²	110	60.9 Å²	60.9	51%	0.514	30%	0.298	S	S	.	.	H	α-helix	trans	-64.5	-41.3	169.9	-170.5	-173.4	157	0	0	110.7	S101 F106 R107	S101-E103 VanDerWaalsContact C-N 3.3Å; S101-E103 PolarHBondContact O-N 2.65Å; E103-F106 PolarHBondContact O-N 3.18Å; E103-R107 WeakPolarHBondContact O-CG 3.36Å; E103-R107 PolarHBondContact O-N 3.47Å; E103-R107 IonicContact OE1-CZ 2.82Å; E103-R107 IonicContact OE1-NE 3.42Å; E103-R107 PolarHBondContact OE1-NE 2.86Å; E103-R107 IonicContact OE1-NH2 3.89Å; E103-R107 PolarHBondContact OE1-NH2 2.72Å
104	E	71.4	Confident	76.8	Confident	42 Å²	42	61 Å²	61	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-66	-38.9	175.3	-74.1	174.1	-159.7	0	0	112.3	C38 C98 N99 H100 S101 D102 F106 R107 Q108	C38-E104 HydrophobicContact CB-CG 3.93Å; C98-E104 HydrophobicContact CB-CB 4.27Å; N99-E104 PolarHBondContact N-OE2 3.22Å; H100-E104 WeakPolarHBondContact CA-OE2 3.34Å; H100-E104 VanDerWaalsContact CB-OE2 3.27Å; H100-E104 WeakPolarHBondContact CB-OE2 3.36Å; H100-E104 IonicContact CG-OE2 2.74Å; H100-E104 PolarHBondContact N-OE2 3.02Å; H100-E104 IonicContact ND1-OE2 3.62Å; H100-E104 PolarHBondContact ND1-OE2 3.3Å; S101-E104 CarbonylContact O-C 3.58Å; S101-E104 WeakPolarHBondContact O-CA 3.39Å; S101-E104 WeakPolarHBondContact O-CB 3.23Å; S101-E104 PolarHBondContact O-N 3.08Å; S101-E104 VanDerWaalsContact O-N 3.1Å; S101-E104 WeakPolarHBondContact OG-CB 3.46Å; S101-E104 VanDerWaalsContact OG-CG 3.24Å; S101-E104 WeakPolarHBondContact OG-CG 3.4Å; S101-E104 PolarHBondContact OG-N 3.47Å; D102-E104 VanDerWaalsContact C-N 3.34Å; E104-F106 VanDerWaalsContact C-N 3.34Å; E104-F106 PolarHBondContact O-N 3.05Å; E104-R107 CarbonylContact O-C 3.57Å; E104-R107 WeakPolarHBondContact O-CB 3.34Å; E104-R107 PolarHBondContact O-N 2.8Å; E104-Q108 WeakPolarHBondContact O-CB 3.48Å; E104-Q108 PolarHBondContact O-N 3.5Å
105	K	72	Confident	76.7	Confident	81 Å²	81	61 Å²	61	35%	0.352	31%	0.307	S	S	.	.	H	α-helix	trans	-60.5	-42.1	173.1	-70.5	176.1	-166.9	156	0	112	S101 D102 R107 Q108 I109 Y184	S101-K105 WeakPolarHBondContact O-CG 3.33Å; S101-K105 PolarHBondContact O-N 2.79Å; D102-K105 PolarHBondContact O-N 3.38Å; D102-K105 IonicContact OD1-NZ 3.58Å; D102-K105 PolarHBondContact OD1-NZ 3.36Å; K105-R107 VanDerWaalsContact C-N 3.34Å; K105-R107 PolarHBondContact O-N 3.2Å; K105-Q108 WeakPolarHBondContact O-CB 3.4Å; K105-Q108 PolarHBondContact O-N 3.48Å; K105-I109 WeakPolarHBondContact O-CG1 3.36Å; K105-I109 PolarHBondContact O-N 3.16Å; K105-Y184 WeakPolarHBondContact CB-OH 3.32Å
106	F	73.1	Confident	76.7	Confident	53 Å²	53	58.7 Å²	58.7	23%	0.232	30%	0.297	C	S	.	.	H	α-helix	trans	-60.1	-45.5	174.1	175.3	-101.5	0	0	0	111.4	D102 E103 E104 Q108 I109 I110 L169 I187	D102-F106 PolarHBondContact O-N 2.92Å; E103-F106 PolarHBondContact O-N 3.18Å; E104-F106 VanDerWaalsContact C-N 3.34Å; E104-F106 PolarHBondContact O-N 3.05Å; F106-Q108 VanDerWaalsContact C-N 3.34Å; F106-Q108 PolarHBondContact O-N 3.03Å; F106-I109 PolarHBondContact O-N 3.43Å; F106-I110 HydrophobicContact CD1-CD1 3.93Å; F106-I110 HydrophobicContact CE1-CD1 3.36Å; F106-I110 HydrophobicContact CE1-CG1 4.42Å; F106-I110 HydrophobicContact CE2-CD1 4.47Å; F106-I110 HydrophobicContact CZ-CD1 3.68Å; F106-I110 HydrophobicContact CZ-CG1 4.45Å; F106-I110 PolarHBondContact O-N 3.47Å; F106-I110 VanDerWaalsContact O-N 3.17Å; F106-L169 HydrophobicContact CZ-CD1 4.26Å; F106-I187 HydrophobicContact CD2-CD1 3.56Å; F106-I187 HydrophobicContact CD2-CG2 4.4Å; F106-I187 HydrophobicContact CE2-CD1 3.61Å; F106-I187 HydrophobicContact CE2-CG1 4.16Å; F106-I187 HydrophobicContact CE2-CG2 3.9Å
107	R	73.7	Confident	76.8	Confident	82 Å²	82	53.8 Å²	53.8	31%	0.309	27%	0.274	S	S	.	.	H	α-helix	trans	-62.3	-41.3	174.2	-68.3	174.7	-173.9	-83.9	-0.7	111.7	E103 E104 K105 I109 I110 W111	E103-R107 WeakPolarHBondContact O-CG 3.36Å; E103-R107 PolarHBondContact O-N 3.47Å; E103-R107 IonicContact OE1-CZ 2.82Å; E103-R107 IonicContact OE1-NE 3.42Å; E103-R107 PolarHBondContact OE1-NE 2.86Å; E103-R107 IonicContact OE1-NH2 3.89Å; E103-R107 PolarHBondContact OE1-NH2 2.72Å; E104-R107 CarbonylContact O-C 3.57Å; E104-R107 WeakPolarHBondContact O-CB 3.34Å; E104-R107 PolarHBondContact O-N 2.8Å; K105-R107 VanDerWaalsContact C-N 3.34Å; K105-R107 PolarHBondContact O-N 3.2Å; R107-I109 VanDerWaalsContact C-N 3.28Å; R107-I109 PolarHBondContact O-N 3.39Å; R107-I110 WeakPolarHBondContact O-CB 3.41Å; R107-I110 PolarHBondContact O-N 3.25Å; R107-W111 PolarHBondContact O-N 2.86Å
108	Q	77.1	Confident	77.2	Confident	64 Å²	64	58.2 Å²	58.2	30%	0.299	28%	0.284	S	S	.	.	H	α-helix	trans	-58.9	-40.6	176.9	-169.3	-173.3	23	0	0	111.2	C98 E104 K105 F106 W111 S112	C98-Q108 HydrophobicContact CB-CB 4.43Å; E104-Q108 WeakPolarHBondContact O-CB 3.48Å; E104-Q108 PolarHBondContact O-N 3.5Å; K105-Q108 WeakPolarHBondContact O-CB 3.4Å; K105-Q108 PolarHBondContact O-N 3.48Å; F106-Q108 VanDerWaalsContact C-N 3.34Å; F106-Q108 PolarHBondContact O-N 3.03Å; Q108-W111 PolarHBondContact O-N 3.33Å; Q108-S112 VanDerWaalsContact O-CB 3.3Å; Q108-S112 WeakPolarHBondContact O-CB 3.46Å; Q108-S112 PolarHBondContact O-N 2.81Å; Q108-S112 PolarHBondContact O-OG 2.77Å
109	I	77	Confident	77.9	Confident	29 Å²	29	59.1 Å²	59.1	15%	0.149	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-48.2	175.1	-69.7	161	0	0	0	110.8	K105 F106 R107 W111 S112 I113 Y184 I187	K105-I109 WeakPolarHBondContact O-CG1 3.36Å; K105-I109 PolarHBondContact O-N 3.16Å; F106-I109 PolarHBondContact O-N 3.43Å; R107-I109 VanDerWaalsContact C-N 3.28Å; R107-I109 PolarHBondContact O-N 3.39Å; I109-W111 VanDerWaalsContact C-N 3.29Å; I109-W111 PolarHBondContact O-N 3Å; I109-S112 PolarHBondContact O-N 3.35Å; I109-S112 PolarHBondContact O-OG 2.94Å; I109-I113 HydrophobicContact CG2-CD1 3.97Å; I109-I113 WeakPolarHBondContact O-CG1 3.28Å; I109-I113 PolarHBondContact O-N 2.72Å; I109-I113 VanDerWaalsContact O-N 3.15Å; I109-Y184 HydrophobicContact CD1-CD1 3.02Å; I109-Y184 HydrophobicContact CD1-CD2 4.18Å; I109-Y184 HydrophobicContact CD1-CE1 3.66Å; I109-Y184 HydrophobicContact CD1-CG 3.32Å; I109-I187 HydrophobicContact CG2-CG2 4.2Å
110	I	78.5	Confident	78.7	Confident	47 Å²	47	57 Å²	57	24%	0.241	28%	0.275	C	S	.	.	H	α-helix	trans	-55.7	-47	176.4	-68.2	171.4	0	0	0	110.5	F106 R107 I113 S114 L191	F106-I110 HydrophobicContact CD1-CD1 3.93Å; F106-I110 HydrophobicContact CE1-CD1 3.36Å; F106-I110 HydrophobicContact CE1-CG1 4.42Å; F106-I110 HydrophobicContact CE2-CD1 4.47Å; F106-I110 HydrophobicContact CZ-CD1 3.68Å; F106-I110 HydrophobicContact CZ-CG1 4.45Å; F106-I110 PolarHBondContact O-N 3.47Å; F106-I110 VanDerWaalsContact O-N 3.17Å; R107-I110 WeakPolarHBondContact O-CB 3.41Å; R107-I110 PolarHBondContact O-N 3.25Å; I110-I113 PolarHBondContact O-N 3.02Å; I110-S114 VanDerWaalsContact O-CB 3.31Å; I110-S114 WeakPolarHBondContact O-CB 3.2Å; I110-S114 PolarHBondContact O-N 3.44Å; I110-S114 PolarHBondContact O-OG 3.01Å; I110-L191 HydrophobicContact CG1-CD1 3.98Å
111	W	81.6	Confident	79.8	Confident	45 Å²	45	53.5 Å²	53.5	17%	0.17	26%	0.259	C	S	.	.	H	α-helix	trans	-67.4	-39.2	179.2	-65.1	130.9	0	0	0	112.6	F39 L41 A94 R107 Q108 I109 I113 S114 L115	F39-W111 AromaticContact CD1-CD2 3.74Å; F39-W111 HydrophobicContact CD1-CD2 3.74Å; F39-W111 AromaticContact CD1-CE2 3.32Å; F39-W111 HydrophobicContact CD1-CE3 4.21Å; F39-W111 HydrophobicContact CD1-CG 4.27Å; F39-W111 HydrophobicContact CD1-CH2 4.04Å; F39-W111 AromaticContact CD1-CZ2 3.51Å; F39-W111 HydrophobicContact CD1-CZ2 3.51Å; F39-W111 HydrophobicContact CD1-CZ3 4.36Å; F39-W111 AromaticContact CD1-NE1 3.56Å; F39-W111 AromaticContact CE1-CD2 3.94Å; F39-W111 HydrophobicContact CE1-CD2 3.94Å; F39-W111 AromaticContact CE1-CE2 3.94Å; F39-W111 AromaticContact CE1-CE3 3.98Å; F39-W111 HydrophobicContact CE1-CE3 3.98Å; F39-W111 HydrophobicContact CE1-CH2 4.11Å; F39-W111 HydrophobicContact CE1-CZ2 4.04Å; F39-W111 HydrophobicContact CE1-CZ3 4.07Å; F39-W111 AromaticContact CG-NE1 3.89Å; L41-W111 HydrophobicContact CB-CH2 3.93Å; L41-W111 HydrophobicContact CB-CZ3 4.34Å; L41-W111 HydrophobicContact CD1-CH2 4.49Å; L41-W111 HydrophobicContact CD1-CZ3 4.05Å; L41-W111 HydrophobicContact CD2-CH2 4.4Å; L41-W111 HydrophobicContact CD2-CZ3 4.3Å; L41-W111 HydrophobicContact CG-CZ3 4.47Å; A94-W111 HydrophobicContact CB-CB 4.09Å; A94-W111 HydrophobicContact CB-CG 4.3Å; R107-W111 PolarHBondContact O-N 2.86Å; Q108-W111 PolarHBondContact O-N 3.33Å; I109-W111 VanDerWaalsContact C-N 3.29Å; I109-W111 PolarHBondContact O-N 3Å; W111-I113 PolarHBondContact O-N 3.24Å; W111-S114 PolarHBondContact O-N 2.89Å; W111-L115 HydrophobicContact CB-CD1 4.22Å; W111-L115 HydrophobicContact CE3-CD1 4.43Å; W111-L115 WeakPolarHBondContact O-CA 3.33Å; W111-L115 WeakPolarHBondContact O-CB 3.09Å; W111-L115 WeakPolarHBondContact O-CG 3.18Å; W111-L115 PolarHBondContact O-N 3.34Å
112	S	80.4	Confident	80.9	Confident	46 Å²	46	56.1 Å²	56.1	32%	0.322	27%	0.265	S	S	.	.	H	α-helix	trans	-61	-33.9	178.4	75.1	0	0	0	0	112.8	Q108 I109 D116	Q108-S112 VanDerWaalsContact O-CB 3.3Å; Q108-S112 WeakPolarHBondContact O-CB 3.46Å; Q108-S112 PolarHBondContact O-N 2.81Å; Q108-S112 PolarHBondContact O-OG 2.77Å; I109-S112 PolarHBondContact O-N 3.35Å; I109-S112 PolarHBondContact O-OG 2.94Å; S112-D116 PolarHBondContact O-N 3.35Å
113	I	79.7	Confident	82.2	Confident	18 Å²	18	51.1 Å²	51.1	9%	0.092	24%	0.238	C	C	.	.	H	α-helix	trans	-79.6	-46.5	177.1	-63.5	164.9	0	0	0	110.2	I109 I110 W111 L115 D116 K119 K188 L191	I109-I113 HydrophobicContact CG2-CD1 3.97Å; I109-I113 WeakPolarHBondContact O-CG1 3.28Å; I109-I113 PolarHBondContact O-N 2.72Å; I109-I113 VanDerWaalsContact O-N 3.15Å; I110-I113 PolarHBondContact O-N 3.02Å; W111-I113 PolarHBondContact O-N 3.24Å; I113-L115 VanDerWaalsContact C-N 3.3Å; I113-L115 PolarHBondContact O-N 3.4Å; I113-D116 PolarHBondContact O-N 3.37Å; I113-K119 PolarHBondContact O-NZ 3.5Å; I113-K188 HydrophobicContact CD1-CB 4.22Å; I113-K188 HydrophobicContact CD1-CG 3.91Å; I113-K188 HydrophobicContact CG1-CG 4.43Å; I113-L191 HydrophobicContact CD1-CB 3.88Å; I113-L191 HydrophobicContact CD1-CD1 3.62Å; I113-L191 HydrophobicContact CD1-CG 4.4Å
114	S	80.2	Confident	83.4	Confident	58 Å²	58	45.9 Å²	45.9	41%	0.406	21%	0.213	S	C	.	.	H	α-helix	trans	-67	-32.1	-176.9	-56.7	0	0	0	0	112.5	I110 W111	I110-S114 VanDerWaalsContact O-CB 3.31Å; I110-S114 WeakPolarHBondContact O-CB 3.2Å; I110-S114 PolarHBondContact O-N 3.44Å; I110-S114 PolarHBondContact O-OG 3.01Å; W111-S114 PolarHBondContact O-N 2.89Å
115	L	83.6	Confident	84.6	Confident	5 Å²	5	46.5 Å²	46.5	3%	0.026	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	15.8	-177.6	-55	175.1	0	0	0	112.9	F39 F87 M90 R91 A94 W111 I113 T117	F39-L115 HydrophobicContact CZ-CD1 4.19Å; F87-L115 HydrophobicContact CD1-CD2 4.11Å; M90-L115 HydrophobicContact CB-CD1 4.04Å; M90-L115 HydrophobicContact CB-CD2 4.34Å; M90-L115 HydrophobicContact CE-CD2 3.87Å; R91-L115 HydrophobicContact CB-CB 4.06Å; R91-L115 HydrophobicContact CB-CD1 4.35Å; A94-L115 HydrophobicContact CB-CD1 4.46Å; W111-L115 HydrophobicContact CB-CD1 4.22Å; W111-L115 HydrophobicContact CE3-CD1 4.43Å; W111-L115 WeakPolarHBondContact O-CA 3.33Å; W111-L115 WeakPolarHBondContact O-CB 3.09Å; W111-L115 WeakPolarHBondContact O-CG 3.18Å; W111-L115 PolarHBondContact O-N 3.34Å; I113-L115 VanDerWaalsContact C-N 3.3Å; I113-L115 PolarHBondContact O-N 3.4Å; L115-T117 PolarHBondContact O-N 3.19Å; L115-T117 VanDerWaalsContact O-N 3.11Å
116	D	84.7	Confident	85.8	Confident	27 Å²	27	45 Å²	45	14%	0.144	22%	0.218	C	C	.	.			trans	-64.8	111.9	172.9	-171.7	-5.9	0	0	0	109.9	S112 I113 R118 K119 F120	S112-D116 PolarHBondContact O-N 3.35Å; I113-D116 PolarHBondContact O-N 3.37Å; D116-R118 WeakPolarHBondContact OD1-CB 3.37Å; D116-R118 WeakPolarHBondContact OD1-CG 3.27Å; D116-R118 PolarHBondContact OD1-N 3.33Å; D116-R118 IonicContact OD1-NE 2.86Å; D116-R118 PolarHBondContact OD1-NE 2.03Å; D116-R118 VanDerWaalsContact OD1-NE 3.14Å; D116-R118 IonicContact OD2-CZ 3.87Å; D116-R118 IonicContact OD2-NE 3.55Å; D116-R118 PolarHBondContact OD2-NE 3.08Å; D116-R118 IonicContact OD2-NH2 3.31Å; D116-R118 PolarHBondContact OD2-NH2 2.95Å; D116-K119 WeakPolarHBondContact O-CE 3.45Å; D116-F120 WeakPolarHBondContact O-CD2 3.38Å
117	T	87.8	Confident	86.9	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.012	21%	0.207	C	C	.	.			trans	-79.1	-21.1	-178	63.6	0	0	0	0	113.4	F87 H88 L115 K119 F120 E121	F87-T117 HydrophobicContact CB-CG2 3.57Å; H88-T117 PolarHBondContact CE1-OG1 3.44Å; H88-T117 PolarHBondContact NE2-OG1 3.44Å; L115-T117 PolarHBondContact O-N 3.19Å; L115-T117 VanDerWaalsContact O-N 3.11Å; T117-K119 PolarHBondContact O-N 3.39Å; T117-K119 VanDerWaalsContact O-N 3.16Å; T117-F120 CarbonylContact O-C 3.49Å; T117-F120 WeakPolarHBondContact O-CA 3.41Å; T117-F120 PolarHBondContact O-N 3.42Å; T117-E121 WeakPolarHBondContact CB-OE1 3.44Å; T117-E121 WeakPolarHBondContact O-CG 3.2Å; T117-E121 PolarHBondContact O-N 2.89Å; T117-E121 PolarHBondContact OG1-OE1 2.91Å
118	R	91.7	Very high	88	Confident	136 Å²	136	39.5 Å²	39.5	51%	0.513	20%	0.199	S	C	.	.	H	α-helix	trans	-57.5	-39.5	-170.2	-65.7	178	-62.5	158.3	9.5	111.8	D116 E121 K122	D116-R118 WeakPolarHBondContact OD1-CB 3.37Å; D116-R118 WeakPolarHBondContact OD1-CG 3.27Å; D116-R118 PolarHBondContact OD1-N 3.33Å; D116-R118 IonicContact OD1-NE 2.86Å; D116-R118 PolarHBondContact OD1-NE 2.03Å; D116-R118 VanDerWaalsContact OD1-NE 3.14Å; D116-R118 IonicContact OD2-CZ 3.87Å; D116-R118 IonicContact OD2-NE 3.55Å; D116-R118 PolarHBondContact OD2-NE 3.08Å; D116-R118 IonicContact OD2-NH2 3.31Å; D116-R118 PolarHBondContact OD2-NH2 2.95Å; R118-E121 PolarHBondContact O-N 3.49Å; R118-K122 WeakPolarHBondContact O-CG 3.49Å; R118-K122 PolarHBondContact O-N 3.43Å
119	K	90.1	Very high	88.9	Confident	19 Å²	19	42 Å²	42	8%	0.083	21%	0.21	C	C	.	.	H	α-helix	trans	-67.4	-39.4	177	69	-168.1	172	-167	0	112.5	I113 D116 T117 A123 E195	I113-K119 PolarHBondContact O-NZ 3.5Å; D116-K119 WeakPolarHBondContact O-CE 3.45Å; T117-K119 PolarHBondContact O-N 3.39Å; T117-K119 VanDerWaalsContact O-N 3.16Å; K119-A123 WeakPolarHBondContact O-CB 3.06Å; K119-A123 PolarHBondContact O-N 3Å; K119-E195 IonicContact NZ-OE1 2.98Å; K119-E195 PolarHBondContact NZ-OE1 3.47Å; K119-E195 IonicContact NZ-OE2 3.46Å
120	F	90.4	Very high	89.9	Confident	39 Å²	39	48.4 Å²	48.4	17%	0.171	24%	0.239	C	C	.	.	H	α-helix	trans	-72.1	-32.9	175.7	-59.6	-61.8	0	0	0	111.9	F87 D116 T117 A124 T229	F87-F120 AromaticContact CD2-CD2 3.68Å; F87-F120 HydrophobicContact CD2-CD2 3.68Å; F87-F120 HydrophobicContact CD2-CE2 4.06Å; F87-F120 HydrophobicContact CD2-CG 4.26Å; F87-F120 HydrophobicContact CE2-CD1 4.29Å; F87-F120 AromaticContact CE2-CD2 3.41Å; F87-F120 HydrophobicContact CE2-CD2 3.41Å; F87-F120 VanDerWaalsContact CE2-CD2 3.41Å; F87-F120 HydrophobicContact CE2-CE1 4.37Å; F87-F120 AromaticContact CE2-CE2 3.49Å; F87-F120 HydrophobicContact CE2-CE2 3.49Å; F87-F120 VanDerWaalsContact CE2-CE2 3.49Å; F87-F120 AromaticContact CE2-CG 3.84Å; F87-F120 HydrophobicContact CE2-CG 3.84Å; F87-F120 AromaticContact CE2-CZ 3.99Å; F87-F120 HydrophobicContact CE2-CZ 3.99Å; F87-F120 HydrophobicContact CZ-CD2 4.27Å; F87-F120 AromaticContact CZ-CE2 3.89Å; F87-F120 HydrophobicContact CZ-CE2 3.89Å; F87-F120 HydrophobicContact CZ-CZ 4.15Å; D116-F120 WeakPolarHBondContact O-CD2 3.38Å; T117-F120 CarbonylContact O-C 3.49Å; T117-F120 WeakPolarHBondContact O-CA 3.41Å; T117-F120 PolarHBondContact O-N 3.42Å; F120-A124 WeakPolarHBondContact O-CB 3.41Å; F120-A124 PolarHBondContact O-N 3.45Å; F120-T229 HydrophobicContact CD1-CG2 4.47Å
121	E	94.2	Very high	90.8	Very high	69 Å²	69	50.6 Å²	50.6	32%	0.322	25%	0.249	S	C	.	.	H	α-helix	trans	-64.1	-46.6	173.1	-73.1	167	-164.3	0	0	111.7	I84 H88 T117 R118 A124 A125	I84-E121 HydrophobicContact CD1-CB 4.47Å; I84-E121 HydrophobicContact CD1-CG 3.83Å; I84-E121 HydrophobicContact CG1-CG 4.02Å; I84-E121 HydrophobicContact CG2-CG 3.95Å; H88-E121 IonicContact CD2-OE1 2.6Å; H88-E121 IonicContact CE1-OE1 2.98Å; H88-E121 IonicContact NE2-OE1 3.63Å; H88-E121 PolarHBondContact NE2-OE1 3Å; T117-E121 WeakPolarHBondContact CB-OE1 3.44Å; T117-E121 WeakPolarHBondContact O-CG 3.2Å; T117-E121 PolarHBondContact O-N 2.89Å; T117-E121 PolarHBondContact OG1-OE1 2.91Å; R118-E121 PolarHBondContact O-N 3.49Å; E121-A124 PolarHBondContact O-N 3.33Å; E121-A125 VanDerWaalsContact O-CB 3.32Å; E121-A125 WeakPolarHBondContact O-CB 3.05Å; E121-A125 PolarHBondContact O-N 3.08Å
122	K	95.4	Very high	91.6	Very high	101 Å²	101	49.2 Å²	49.2	44%	0.439	25%	0.245	S	C	.	.	H	α-helix	trans	-59.1	-49.7	173.5	-69.9	176.4	-168.3	178.1	0	111.5	R118 A124 A125 Y126 E228 D232	R118-K122 WeakPolarHBondContact O-CG 3.49Å; R118-K122 PolarHBondContact O-N 3.43Å; K122-A124 PolarHBondContact O-N 3.28Å; K122-A125 WeakPolarHBondContact O-CB 3.23Å; K122-A125 PolarHBondContact O-N 3.26Å; K122-A125 VanDerWaalsContact O-N 3.16Å; K122-Y126 PolarHBondContact O-N 2.91Å; K122-E228 HydrophobicContact CB-CB 4.15Å; K122-D232 IonicContact NZ-OD1 3.03Å
123	A	94.7	Very high	92.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.9	-43.4	179.9	0	0	0	0	0	112.3	K119 Y126 I127 Y225 E228 T229	K119-A123 WeakPolarHBondContact O-CB 3.06Å; K119-A123 PolarHBondContact O-N 3Å; A123-Y126 WeakPolarHBondContact O-CB 3.46Å; A123-Y126 PolarHBondContact O-N 3.39Å; A123-I127 PolarHBondContact O-N 3.21Å; A123-Y225 HydrophobicContact CB-CD2 3.77Å; A123-Y225 HydrophobicContact CB-CE2 3.54Å; A123-Y225 HydrophobicContact CB-CG 4.42Å; A123-Y225 WeakPolarHBondContact CB-O 3.06Å; A123-Y225 VanDerWaalsContact O-CD2 3.28Å; A123-Y225 WeakPolarHBondContact O-CD2 3.46Å; A123-E228 HydrophobicContact CB-CB 3.85Å; A123-T229 HydrophobicContact CB-CG2 3.54Å
124	A	95	Very high	93.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.5	-40.1	174.2	0	0	0	0	0	111.7	I84 F120 E121 K122 Y126 C128	I84-A124 HydrophobicContact CD1-CB 4.07Å; F120-A124 WeakPolarHBondContact O-CB 3.41Å; F120-A124 PolarHBondContact O-N 3.45Å; E121-A124 PolarHBondContact O-N 3.33Å; K122-A124 PolarHBondContact O-N 3.28Å; A124-Y126 VanDerWaalsContact C-N 3.26Å; A124-Y126 PolarHBondContact O-N 2.78Å; A124-C128 WeakPolarHBondContact O-CB 3.34Å; A124-C128 PolarHBondContact O-N 3.2Å; A124-C128 PolarHBondContact O-SG 3.4Å
125	A	96.5	Very high	94	Very high	55 Å²	55	53 Å²	53	46%	0.455	25%	0.245	S	C	.	.	H	α-helix	trans	-59.3	-38.5	173.9	0	0	0	0	0	112	E121 K122 H129	E121-A125 VanDerWaalsContact O-CB 3.32Å; E121-A125 WeakPolarHBondContact O-CB 3.05Å; E121-A125 PolarHBondContact O-N 3.08Å; K122-A125 WeakPolarHBondContact O-CB 3.23Å; K122-A125 PolarHBondContact O-N 3.26Å; K122-A125 VanDerWaalsContact O-N 3.16Å; A125-H129 PolarHBondContact O-N 2.72Å
126	Y	97.4	Very high	94.6	Very high	49 Å²	49	52.9 Å²	52.9	19%	0.192	24%	0.244	C	C	.	.	H	α-helix	trans	-65.6	-63.7	174.8	175.2	-97.1	0	0	0	112.3	K122 A123 A124 C128 H129 N132 L221 N224 E228	K122-Y126 PolarHBondContact O-N 2.91Å; A123-Y126 WeakPolarHBondContact O-CB 3.46Å; A123-Y126 PolarHBondContact O-N 3.39Å; A124-Y126 VanDerWaalsContact C-N 3.26Å; A124-Y126 PolarHBondContact O-N 2.78Å; Y126-C128 VanDerWaalsContact C-N 3.29Å; Y126-C128 PolarHBondContact O-N 3.19Å; Y126-H129 WeakPolarHBondContact O-CB 3.11Å; Y126-H129 PolarHBondContact O-N 3.4Å; Y126-N132 WeakPolarHBondContact CE2-ND2 3.39Å; Y126-N132 WeakPolarHBondContact O-CB 3.48Å; Y126-N132 PolarHBondContact O-ND2 3.33Å; Y126-L221 HydrophobicContact CE1-CD1 4.03Å; Y126-L221 WeakPolarHBondContact CE1-O 3.3Å; Y126-N224 HydrophobicContact CD1-CB 4.39Å; Y126-N224 HydrophobicContact CE1-CB 3.64Å; Y126-N224 HydrophobicContact CE2-CB 3.91Å; Y126-N224 WeakPolarHBondContact OH-CB 3.43Å; Y126-N224 PolarHBondContact OH-ND2 3.24Å; Y126-E228 HydrophobicContact CG-CG 4.44Å
127	I	95.6	Very high	95.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-67.9	-30.4	-171.8	-165.1	167.5	0	0	0	112.6	F66 T74 M77 A123 H129 L133 L221 Y225	F66-I127 HydrophobicContact CD1-CD1 3.65Å; F66-I127 HydrophobicContact CD2-CD1 4.47Å; F66-I127 HydrophobicContact CE1-CD1 3.63Å; F66-I127 HydrophobicContact CE2-CD1 4.41Å; F66-I127 HydrophobicContact CG-CD1 4.13Å; F66-I127 HydrophobicContact CZ-CD1 4.04Å; T74-I127 HydrophobicContact CG2-CD1 3.83Å; T74-I127 HydrophobicContact CG2-CG1 4.3Å; M77-I127 HydrophobicContact CE-CG2 3.89Å; A123-I127 PolarHBondContact O-N 3.21Å; I127-H129 VanDerWaalsContact C-N 3.28Å; I127-H129 PolarHBondContact O-N 2.68Å; I127-L133 WeakPolarHBondContact O-CD2 3.38Å; I127-L133 WeakPolarHBondContact O-CG 3.31Å; I127-L221 HydrophobicContact CG1-CD1 4.35Å; I127-Y225 HydrophobicContact CB-CD2 3.66Å; I127-Y225 HydrophobicContact CB-CE2 4.34Å; I127-Y225 HydrophobicContact CB-CG 4.47Å; I127-Y225 HydrophobicContact CD1-CD2 4.07Å; I127-Y225 HydrophobicContact CD1-CG 4.33Å; I127-Y225 HydrophobicContact CG1-CD2 4.47Å; I127-Y225 HydrophobicContact CG2-CD2 3.56Å; I127-Y225 HydrophobicContact CG2-CE2 3.72Å
128	C	96.2	Very high	95.6	Very high	20 Å²	20	62.2 Å²	62.2	14%	0.135	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	0.6	179.9	-54.1	0	0	0	0	113.8	C78 A124 Y126 L133	C78-C128 WeakPolarHBondContact CA-SG 3.46Å; C78-C128 HydrophobicContact CB-CB 3.59Å; C78-C128 WeakPolarHBondContact CB-SG 3.47Å; C78-C128 WeakPolarHBondContact SG-CA 3.26Å; C78-C128 WeakPolarHBondContact SG-CB 3.45Å; C78-C128 CovalentContact SG-SG 2.03Å; C78-C128 PolarHBondContact SG-SG 3.11Å; A124-C128 WeakPolarHBondContact O-CB 3.34Å; A124-C128 PolarHBondContact O-N 3.2Å; A124-C128 PolarHBondContact O-SG 3.4Å; Y126-C128 VanDerWaalsContact C-N 3.29Å; Y126-C128 PolarHBondContact O-N 3.19Å; C128-L133 WeakPolarHBondContact O-CD1 3.35Å
129	H	97.3	Very high	95.8	Very high	116 Å²	116	56.2 Å²	56.2	54%	0.537	26%	0.259	S	S	.	.	S	Bend	trans	-65.4	139.3	170.8	-172	43.2	0	0	0	110	A125 Y126 I127 H131 N132 L133	A125-H129 PolarHBondContact O-N 2.72Å; Y126-H129 WeakPolarHBondContact O-CB 3.11Å; Y126-H129 PolarHBondContact O-N 3.4Å; I127-H129 VanDerWaalsContact C-N 3.28Å; I127-H129 PolarHBondContact O-N 2.68Å; H129-H131 VanDerWaalsContact C-N 3.3Å; H129-H131 PolarHBondContact O-N 3.16Å; H129-N132 HydrophobicContact CB-CB 4.42Å; H129-N132 WeakPolarHBondContact O-CA 3.49Å; H129-N132 WeakPolarHBondContact O-CB 3.32Å; H129-N132 PolarHBondContact O-N 3.26Å; H129-L133 PolarHBondContact O-N 2.84Å
130	E	96.6	Very high	96.1	Very high	164 Å²	164	56 Å²	56	77%	0.766	26%	0.258	S	S	*	.	H	α-helix	trans	-52.9	-44.6	-170.6	-175.2	-179.3	175.4	0	0	113.2	N132 L133 R134	E130-N132 VanDerWaalsContact C-N 3.35Å; E130-N132 PolarHBondContact O-N 2.79Å; E130-L133 PolarHBondContact O-N 2.86Å; E130-R134 PolarHBondContact O-N 3.14Å
131	H	97.7	Very high	96.3	Very high	94 Å²	94	62.3 Å²	62.3	44%	0.435	28%	0.282	S	S	.	.	H	α-helix	trans	-59.3	-44.5	176.1	178.1	79.7	0	0	0	112.6	H129 R134 I135	H129-H131 VanDerWaalsContact C-N 3.3Å; H129-H131 PolarHBondContact O-N 3.16Å; H131-R134 PolarHBondContact ND1-NH2 2.95Å; H131-R134 WeakPolarHBondContact O-CB 3.47Å; H131-R134 PolarHBondContact O-N 3Å; H131-I135 PolarHBondContact O-N 3.11Å
132	N	97.7	Very high	96.3	Very high	16 Å²	16	64.4 Å²	64.4	9%	0.086	29%	0.29	C	S	.	.	H	α-helix	trans	-71.9	-37.7	-178.3	-73	-22.2	0	0	0	111.7	Y126 H129 E130 R134 I135 L136 L221	Y126-N132 WeakPolarHBondContact CE2-ND2 3.39Å; Y126-N132 WeakPolarHBondContact O-CB 3.48Å; Y126-N132 PolarHBondContact O-ND2 3.33Å; H129-N132 HydrophobicContact CB-CB 4.42Å; H129-N132 WeakPolarHBondContact O-CA 3.49Å; H129-N132 WeakPolarHBondContact O-CB 3.32Å; H129-N132 PolarHBondContact O-N 3.26Å; E130-N132 VanDerWaalsContact C-N 3.35Å; E130-N132 PolarHBondContact O-N 2.79Å; N132-R134 VanDerWaalsContact C-N 3.3Å; N132-R134 PolarHBondContact O-N 2.71Å; N132-I135 PolarHBondContact O-N 2.98Å; N132-L136 PolarHBondContact O-N 3.14Å; N132-L221 HydrophobicContact CB-CD1 3.56Å
133	L	96	Very high	96.4	Very high	23 Å²	23	60 Å²	60	12%	0.12	27%	0.271	C	S	.	.	H	α-helix	trans	-62.6	-36.2	171.4	-77.2	179	0	0	0	112.3	I127 C128 H129 E130 L136 R137	I127-L133 WeakPolarHBondContact O-CD2 3.38Å; I127-L133 WeakPolarHBondContact O-CG 3.31Å; C128-L133 WeakPolarHBondContact O-CD1 3.35Å; H129-L133 PolarHBondContact O-N 2.84Å; E130-L133 PolarHBondContact O-N 2.86Å; L133-L136 HydrophobicContact CD2-CD2 4.15Å; L133-L136 WeakPolarHBondContact O-CB 3.37Å; L133-L136 PolarHBondContact O-N 2.89Å; L133-R137 WeakPolarHBondContact O-CG 3.32Å; L133-R137 PolarHBondContact O-N 3.49Å
134	R	97.5	Very high	96.4	Very high	160 Å²	160	60 Å²	60	60%	0.604	27%	0.271	S	S	*	.	H	α-helix	trans	-63.2	-44.1	174.5	-174.5	177.4	64	-176.4	1.8	111.6	E130 H131 N132 L136 R137 E138	E130-R134 PolarHBondContact O-N 3.14Å; H131-R134 PolarHBondContact ND1-NH2 2.95Å; H131-R134 WeakPolarHBondContact O-CB 3.47Å; H131-R134 PolarHBondContact O-N 3Å; N132-R134 VanDerWaalsContact C-N 3.3Å; N132-R134 PolarHBondContact O-N 2.71Å; R134-L136 VanDerWaalsContact C-N 3.33Å; R134-R137 PolarHBondContact O-N 3.21Å; R134-E138 WeakPolarHBondContact O-CB 3.25Å; R134-E138 PolarHBondContact O-N 2.87Å
135	I	97.7	Very high	96.4	Very high	19 Å²	19	63.8 Å²	63.8	10%	0.097	29%	0.288	C	S	.	.	H	α-helix	trans	-61.4	-44.4	174.2	-63	168.8	0	0	0	110.1	H131 N132 R137 E138 H139 N217 L221	H131-I135 PolarHBondContact O-N 3.11Å; N132-I135 PolarHBondContact O-N 2.98Å; I135-R137 PolarHBondContact O-N 3.41Å; I135-E138 PolarHBondContact O-N 3.14Å; I135-H139 PolarHBondContact O-CD2 2.9Å; I135-H139 VanDerWaalsContact O-CD2 3.25Å; I135-H139 PolarHBondContact O-N 3.28Å; I135-N217 HydrophobicContact CD1-CB 4.49Å; I135-N217 HydrophobicContact CG2-CB 4.24Å; I135-L221 HydrophobicContact CB-CD2 4.23Å; I135-L221 HydrophobicContact CG2-CB 4.32Å; I135-L221 HydrophobicContact CG2-CD2 3.94Å
136	L	96.2	Very high	96.3	Very high	1 Å²	1	67.7 Å²	67.7	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-55.1	-53.5	177.5	-173.2	71	0	0	0	111	L71 T74 N132 L133 R134 E138 H139 Q140 L144 L221	L71-L136 HydrophobicContact CD1-CD1 3.73Å; T74-L136 HydrophobicContact CG2-CD2 3.53Å; N132-L136 PolarHBondContact O-N 3.14Å; L133-L136 HydrophobicContact CD2-CD2 4.15Å; L133-L136 WeakPolarHBondContact O-CB 3.37Å; L133-L136 PolarHBondContact O-N 2.89Å; R134-L136 VanDerWaalsContact C-N 3.33Å; L136-E138 VanDerWaalsContact C-N 3.31Å; L136-E138 PolarHBondContact O-N 3.18Å; L136-H139 CarbonylContact O-C 3.37Å; L136-H139 PolarHBondContact O-N 2.91Å; L136-Q140 WeakPolarHBondContact O-CA 3.39Å; L136-Q140 VanDerWaalsContact O-CB 3.26Å; L136-Q140 WeakPolarHBondContact O-CB 3.37Å; L136-Q140 PolarHBondContact O-N 3.33Å; L136-L144 HydrophobicContact CD1-CD1 4Å; L136-L221 HydrophobicContact CB-CD2 3.84Å; L136-L221 HydrophobicContact CD1-CD2 3.96Å
137	R	96	Very high	96.1	Very high	133 Å²	133	66.2 Å²	66.2	50%	0.502	29%	0.292	S	S	.	.	H	α-helix	trans	-58.8	-41.7	179.7	-73.7	169.2	178.8	160	1.5	112.5	E75 L133 R134 I135 H139	E75-R137 WeakPolarHBondContact OE1-CG 3.47Å; E75-R137 IonicContact OE1-CZ 3.44Å; E75-R137 IonicContact OE1-NE 3.66Å; E75-R137 PolarHBondContact OE1-NE 3.37Å; E75-R137 IonicContact OE1-NH2 3.55Å; E75-R137 IonicContact OE2-CZ 3.84Å; E75-R137 IonicContact OE2-NE 2.94Å; E75-R137 IonicContact OE2-NH2 3.59Å; E75-R137 PolarHBondContact OE2-NH2 3.09Å; L133-R137 WeakPolarHBondContact O-CG 3.32Å; L133-R137 PolarHBondContact O-N 3.49Å; R134-R137 PolarHBondContact O-N 3.21Å; I135-R137 PolarHBondContact O-N 3.41Å; R137-H139 VanDerWaalsContact C-N 3.28Å; R137-H139 PolarHBondContact O-N 3.09Å
138	E	97.3	Very high	95.9	Very high	92 Å²	92	67 Å²	67	43%	0.43	30%	0.296	S	S	.	.	H	α-helix	trans	-60.7	-38.4	-179.9	-168.3	-164.2	161	0	0	112.1	R134 I135 L136 K142	R134-E138 WeakPolarHBondContact O-CB 3.25Å; R134-E138 PolarHBondContact O-N 2.87Å; I135-E138 PolarHBondContact O-N 3.14Å; L136-E138 VanDerWaalsContact C-N 3.31Å; L136-E138 PolarHBondContact O-N 3.18Å; E138-K142 WeakPolarHBondContact O-CD 3.04Å; E138-K142 WeakPolarHBondContact O-CE 3.44Å; E138-K142 PolarHBondContact O-NZ 3.43Å; E138-K142 IonicContact OE1-NZ 2.68Å
139	H	97.2	Very high	95.6	Very high	11 Å²	11	73.9 Å²	73.9	5%	0.051	32%	0.323	C	S	.	.	H	α-helix	trans	-107.2	-4.4	-173.7	-61.5	-61.3	0	0	0	114.3	I135 L136 R137 Y141 K142 C143 L144 P215 N217 A218	I135-H139 PolarHBondContact O-CD2 2.9Å; I135-H139 VanDerWaalsContact O-CD2 3.25Å; I135-H139 PolarHBondContact O-N 3.28Å; L136-H139 CarbonylContact O-C 3.37Å; L136-H139 PolarHBondContact O-N 2.91Å; R137-H139 VanDerWaalsContact C-N 3.28Å; R137-H139 PolarHBondContact O-N 3.09Å; H139-Y141 PolarHBondContact O-N 3.36Å; H139-K142 PolarHBondContact O-N 3.14Å; H139-C143 PolarHBondContact O-N 3.4Å; H139-L144 HydrophobicContact CB-CD1 4.03Å; H139-L144 HydrophobicContact CB-CG 4.16Å; H139-L144 WeakPolarHBondContact O-CB 3.39Å; H139-L144 PolarHBondContact O-N 2.04Å; H139-L144 VanDerWaalsContact O-N 3.12Å; H139-P215 VanDerWaalsContact CE1-CG 3.43Å; H139-P215 WeakPolarHBondContact CE1-CG 3.16Å; H139-P215 WeakPolarHBondContact ND1-CG 3.42Å; H139-N217 PolarHBondContact NE2-ND2 3.24Å; H139-A218 HydrophobicContact CB-CB 3.97Å
140	Q	94.6	Very high	95.3	Very high	14 Å²	14	72 Å²	72	7%	0.065	32%	0.316	C	S	.	.	I	π-helix	trans	-53.4	-58.3	-177.3	177.1	174.6	3.5	0	0	110.8	L71 N72 L136 K142 K145	L71-Q140 HydrophobicContact CD2-CB 4.43Å; L71-Q140 HydrophobicContact CD2-CG 3.79Å; L71-Q140 HydrophobicContact CG-CG 4.02Å; N72-Q140 PolarHBondContact OD1-NE2 3.16Å; L136-Q140 WeakPolarHBondContact O-CA 3.39Å; L136-Q140 VanDerWaalsContact O-CB 3.26Å; L136-Q140 WeakPolarHBondContact O-CB 3.37Å; L136-Q140 PolarHBondContact O-N 3.33Å; Q140-K142 VanDerWaalsContact C-N 3.33Å; Q140-K145 WeakPolarHBondContact O-CB 3.42Å; Q140-K145 PolarHBondContact O-N 3.44Å
141	Y	95.2	Very high	95	Very high	171 Å²	171	64.2 Å²	64.2	67%	0.671	28%	0.28	S	S	*	.	I	π-helix	trans	-90.8	5.3	-177.8	-58.7	-73.2	0	0	0	113.9	H139	H139-Y141 PolarHBondContact O-N 3.36Å
142	K	95	Very high	94.6	Very high	113 Å²	113	62.9 Å²	62.9	49%	0.491	27%	0.274	S	S	.	.	I	π-helix	trans	-94.5	-100.9	173.8	-60.1	-179.4	-172.9	165.9	0	108.4	E138 H139 Q140 Q146	E138-K142 WeakPolarHBondContact O-CD 3.04Å; E138-K142 WeakPolarHBondContact O-CE 3.44Å; E138-K142 PolarHBondContact O-NZ 3.43Å; E138-K142 IonicContact OE1-NZ 2.68Å; H139-K142 PolarHBondContact O-N 3.14Å; Q140-K142 VanDerWaalsContact C-N 3.33Å; K142-Q146 VanDerWaalsContact O-CD 3.27Å; K142-Q146 WeakPolarHBondContact O-CG 3.47Å
143	C	96.5	Very high	94.1	Very high	8 Å²	8	68.1 Å²	68.1	5%	0.054	30%	0.298	C	S	.	.	I	π-helix	trans	-83.3	-37.4	-176.3	77.6	0	0	0	0	113.1	H139 K145 Q146 Q147 E213 C214	H139-C143 PolarHBondContact O-N 3.4Å; C143-K145 PolarHBondContact O-N 3.36Å; C143-Q146 WeakPolarHBondContact O-CB 3.46Å; C143-Q146 PolarHBondContact O-N 3.37Å; C143-Q146 VanDerWaalsContact O-N 3.16Å; C143-Q147 WeakPolarHBondContact O-CG 3.48Å; C143-Q147 PolarHBondContact O-N 3.46Å; C143-E213 VanDerWaalsContact CB-O 3.26Å; C143-E213 WeakPolarHBondContact CB-O 2.83Å; C143-C214 HydrophobicContact CB-CB 4.02Å; C143-C214 WeakPolarHBondContact CB-SG 3.21Å; C143-C214 WeakPolarHBondContact SG-CA 3.28Å; C143-C214 WeakPolarHBondContact SG-CB 3.4Å; C143-C214 CovalentContact SG-SG 2.05Å; C143-C214 PolarHBondContact SG-SG 3.18Å
144	L	96	Very high	93.7	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	30%	0.296	C	S	.	.	I	π-helix	trans	-66	-41.6	-166.7	-68.9	176.2	0	0	0	112.6	Y64 L71 L136 H139 Q146 Q147 E148 L210 A218 I222	Y64-L144 HydrophobicContact CE2-CB 4.44Å; Y64-L144 WeakPolarHBondContact CE2-O 3.4Å; Y64-L144 PolarHBondContact OH-O 3Å; L71-L144 HydrophobicContact CD1-CB 4.41Å; L71-L144 HydrophobicContact CD1-CD1 4.37Å; L71-L144 HydrophobicContact CD2-CB 3.66Å; L136-L144 HydrophobicContact CD1-CD1 4Å; H139-L144 HydrophobicContact CB-CD1 4.03Å; H139-L144 HydrophobicContact CB-CG 4.16Å; H139-L144 WeakPolarHBondContact O-CB 3.39Å; H139-L144 PolarHBondContact O-N 2.04Å; H139-L144 VanDerWaalsContact O-N 3.12Å; L144-Q146 VanDerWaalsContact C-N 3.32Å; L144-Q146 PolarHBondContact O-N 2.93Å; L144-Q147 PolarHBondContact O-N 2.88Å; L144-E148 PolarHBondContact O-N 2.97Å; L144-L210 HydrophobicContact CD2-CD2 4.35Å; L144-A218 HydrophobicContact CD2-CB 4.43Å; L144-I222 HydrophobicContact CD1-CD1 4.19Å; L144-I222 HydrophobicContact CD2-CD1 3.76Å; L144-I222 HydrophobicContact CD2-CG1 3.73Å
145	K	94.1	Very high	92.6	Very high	81 Å²	81	60.7 Å²	60.7	35%	0.352	27%	0.274	S	S	.	.	H	α-helix	trans	-64.3	-36.3	177.2	-174.9	65.1	179.1	175.5	0	112.4	L71 Q140 C143 Q147 E148	L71-K145 HydrophobicContact CD2-CB 4.28Å; Q140-K145 WeakPolarHBondContact O-CB 3.42Å; Q140-K145 PolarHBondContact O-N 3.44Å; C143-K145 PolarHBondContact O-N 3.36Å; K145-Q147 VanDerWaalsContact C-N 3.32Å; K145-E148 VanDerWaalsContact CD-OE2 3.31Å; K145-E148 WeakPolarHBondContact CD-OE2 3.45Å; K145-E148 WeakPolarHBondContact CE-OE2 3.5Å; K145-E148 IonicContact NZ-OE2 3.68Å; K145-E148 PolarHBondContact NZ-OE2 2.92Å; K145-E148 VanDerWaalsContact O-CB 3.32Å; K145-E148 WeakPolarHBondContact O-CB 3.3Å; K145-E148 PolarHBondContact O-N 3.32Å
146	Q	94.3	Very high	90.9	Very high	136 Å²	136	64.4 Å²	64.4	64%	0.636	30%	0.297	S	S	*	.	H	α-helix	trans	-66.5	-38	179.8	-63.9	174.8	-11.1	0	0	111.2	K142 C143 L144 E148	K142-Q146 VanDerWaalsContact O-CD 3.27Å; K142-Q146 WeakPolarHBondContact O-CG 3.47Å; C143-Q146 WeakPolarHBondContact O-CB 3.46Å; C143-Q146 PolarHBondContact O-N 3.37Å; C143-Q146 VanDerWaalsContact O-N 3.16Å; L144-Q146 VanDerWaalsContact C-N 3.32Å; L144-Q146 PolarHBondContact O-N 2.93Å; Q146-E148 VanDerWaalsContact C-N 3.34Å
147	Q	94.3	Very high	89	Confident	19 Å²	19	68.3 Å²	68.3	9%	0.089	32%	0.315	C	S	.	.	H	α-helix	trans	-84.7	-6.9	-179.1	-56.3	-49.2	-32.5	0	0	114	C143 L144 K145 K149 L150 A151 I209 L210 E213	C143-Q147 WeakPolarHBondContact O-CG 3.48Å; C143-Q147 PolarHBondContact O-N 3.46Å; L144-Q147 PolarHBondContact O-N 2.88Å; K145-Q147 VanDerWaalsContact C-N 3.32Å; Q147-K149 VanDerWaalsContact C-N 3.34Å; Q147-K149 PolarHBondContact O-N 3.24Å; Q147-L150 PolarHBondContact O-N 2.93Å; Q147-L150 VanDerWaalsContact O-N 3.13Å; Q147-A151 WeakPolarHBondContact O-CB 3.05Å; Q147-A151 PolarHBondContact O-N 3.31Å; Q147-I209 HydrophobicContact CB-CG2 3.8Å; Q147-I209 HydrophobicContact CG-CG2 4.15Å; Q147-L210 HydrophobicContact CB-CD2 4.06Å; Q147-L210 HydrophobicContact CG-CD2 4.29Å; Q147-E213 HydrophobicContact CG-CB 4.14Å
148	E	91.3	Very high	87.1	Confident	17 Å²	17	67.9 Å²	67.9	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-56.6	-42.7	-173.6	-175	172.4	-142.9	0	0	113.2	G63 Y64 S70 L71 L144 K145 Q146 L150 A151 E152	G63-E148 WeakPolarHBondContact CA-O 3.1Å; Y64-E148 HydrophobicContact CD2-CG 4.44Å; Y64-E148 HydrophobicContact CE2-CB 4.18Å; Y64-E148 HydrophobicContact CE2-CG 4.41Å; S70-E148 VanDerWaalsContact CA-OE1 3.32Å; S70-E148 WeakPolarHBondContact CA-OE1 3.45Å; S70-E148 VanDerWaalsContact CB-OE1 3.25Å; S70-E148 WeakPolarHBondContact CB-OE1 3.4Å; L71-E148 WeakPolarHBondContact CB-OE1 3.44Å; L71-E148 PolarHBondContact N-OE1 2.88Å; L144-E148 PolarHBondContact O-N 2.97Å; K145-E148 VanDerWaalsContact CD-OE2 3.31Å; K145-E148 WeakPolarHBondContact CD-OE2 3.45Å; K145-E148 WeakPolarHBondContact CE-OE2 3.5Å; K145-E148 IonicContact NZ-OE2 3.68Å; K145-E148 PolarHBondContact NZ-OE2 2.92Å; K145-E148 VanDerWaalsContact O-CB 3.32Å; K145-E148 WeakPolarHBondContact O-CB 3.3Å; K145-E148 PolarHBondContact O-N 3.32Å; Q146-E148 VanDerWaalsContact C-N 3.34Å; E148-L150 PolarHBondContact O-N 3.23Å; E148-A151 WeakPolarHBondContact O-CB 3.39Å; E148-A151 PolarHBondContact O-N 3Å; E148-E152 PolarHBondContact O-N 3.03Å; E148-E152 VanDerWaalsContact O-N 3.08Å
149	K	89.6	Confident	85	Confident	164 Å²	164	69.5 Å²	69.5	71%	0.713	33%	0.325	S	S	*	.	H	α-helix	trans	-69.5	-33.1	-179.7	-173.2	176.4	-179.3	-179.6	0	113	Q147	Q147-K149 VanDerWaalsContact C-N 3.34Å; Q147-K149 PolarHBondContact O-N 3.24Å
150	L	90.9	Very high	83.3	Confident	76 Å²	76	74.6 Å²	74.6	40%	0.398	35%	0.349	S	S	.	.	H	α-helix	trans	-72.2	-39.6	173.7	-61.5	179.7	0	0	0	109.9	Q147 E148 E152 Q153 I209	Q147-L150 PolarHBondContact O-N 2.93Å; Q147-L150 VanDerWaalsContact O-N 3.13Å; E148-L150 PolarHBondContact O-N 3.23Å; L150-E152 VanDerWaalsContact C-N 3.28Å; L150-E152 PolarHBondContact O-N 3.16Å; L150-Q153 WeakPolarHBondContact O-CB 3.43Å; L150-Q153 PolarHBondContact O-N 3.27Å; L150-Q153 VanDerWaalsContact O-N 3.09Å; L150-I209 HydrophobicContact CB-CD1 3.8Å; L150-I209 HydrophobicContact CB-CG1 4.25Å; L150-I209 HydrophobicContact CB-CG2 4.13Å; L150-I209 HydrophobicContact CD1-CG2 4.49Å; L150-I209 WeakPolarHBondContact O-CD1 3.41Å
151	A	91	Very high	82	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.008	35%	0.35	C	S	.	.	H	α-helix	trans	-61.3	-34.1	177.7	0	0	0	0	0	113	G63 Y64 Q147 E148 Q153 C154 L206	G63-A151 CarbonylContact O-C 3.55Å; Y64-A151 HydrophobicContact CD1-CB 3.65Å; Y64-A151 HydrophobicContact CE1-CB 3.6Å; Y64-A151 HydrophobicContact CG-CB 4.18Å; Q147-A151 WeakPolarHBondContact O-CB 3.05Å; Q147-A151 PolarHBondContact O-N 3.31Å; E148-A151 WeakPolarHBondContact O-CB 3.39Å; E148-A151 PolarHBondContact O-N 3Å; A151-Q153 PolarHBondContact O-N 3.34Å; A151-C154 VanDerWaalsContact O-CB 3.25Å; A151-C154 WeakPolarHBondContact O-CB 3.45Å; A151-C154 PolarHBondContact O-N 3.5Å; A151-L206 HydrophobicContact CB-CD2 3.71Å
152	E	88.1	Confident	80.6	Confident	66 Å²	66	70.8 Å²	70.8	31%	0.308	34%	0.34	S	S	.	.	H	α-helix	trans	-58.5	-34.1	175.1	177.2	162.2	-159	0	0	112	S59 L61 G63 E148 L150 C154 A155	S59-E152 PolarHBondContact OG-OE1 3.09Å; L61-E152 WeakPolarHBondContact O-CG 3.38Å; G63-E152 VanDerWaalsContact O-CA 3.25Å; G63-E152 WeakPolarHBondContact O-CA 3.46Å; G63-E152 PolarHBondContact O-N 3.25Å; E148-E152 PolarHBondContact O-N 3.03Å; E148-E152 VanDerWaalsContact O-N 3.08Å; L150-E152 VanDerWaalsContact C-N 3.28Å; L150-E152 PolarHBondContact O-N 3.16Å; E152-C154 PolarHBondContact O-N 3.03Å; E152-A155 PolarHBondContact O-N 2.93Å; E152-A155 VanDerWaalsContact O-N 3.16Å
153	Q	86.6	Confident	79.4	Confident	126 Å²	126	72 Å²	72	59%	0.589	35%	0.345	S	S	*	.	H	α-helix	trans	-66.9	-25.9	177.3	-55.9	178.4	-0.4	0	0	112.2	L150 A151 A155 V156	L150-Q153 WeakPolarHBondContact O-CB 3.43Å; L150-Q153 PolarHBondContact O-N 3.27Å; L150-Q153 VanDerWaalsContact O-N 3.09Å; A151-Q153 PolarHBondContact O-N 3.34Å; Q153-A155 PolarHBondContact O-N 3.38Å; Q153-V156 PolarHBondContact O-N 3.13Å
154	C	87.5	Confident	78.4	Confident	11 Å²	11	74.8 Å²	74.8	7%	0.074	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-14.8	176.6	-59.5	0	0	0	0	113.4	A151 E152 K202 C205 L206 I209	A151-C154 VanDerWaalsContact O-CB 3.25Å; A151-C154 WeakPolarHBondContact O-CB 3.45Å; A151-C154 PolarHBondContact O-N 3.5Å; E152-C154 PolarHBondContact O-N 3.03Å; C154-K202 HydrophobicContact CB-CG 4.2Å; C154-C205 WeakPolarHBondContact CA-SG 3.14Å; C154-C205 HydrophobicContact CB-CB 3.64Å; C154-C205 WeakPolarHBondContact CB-SG 3.31Å; C154-C205 WeakPolarHBondContact SG-CB 3.48Å; C154-C205 CovalentContact SG-SG 2.04Å; C154-C205 PolarHBondContact SG-SG 2.87Å; C154-L206 HydrophobicContact CB-CD2 4.15Å; C154-L206 HydrophobicContact CB-CG 4.14Å; C154-I209 WeakPolarHBondContact SG-CD1 3.46Å
155	A	75.3	Confident	77.5	Confident	16 Å²	16	75.7 Å²	75.7	13%	0.132	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-5.7	177.3	0	0	0	0	0	113.9	L61 E152 Q153	L61-A155 HydrophobicContact CB-CB 4.24Å; L61-A155 HydrophobicContact CD1-CB 4.27Å; L61-A155 HydrophobicContact CD2-CB 3.91Å; L61-A155 HydrophobicContact CG-CB 4.36Å; E152-A155 PolarHBondContact O-N 2.93Å; E152-A155 VanDerWaalsContact O-N 3.16Å; Q153-A155 PolarHBondContact O-N 3.38Å
156	V	61.4	Low	76.5	Confident	96 Å²	96	76 Å²	76	58%	0.582	37%	0.372	S	S	*	.			trans	-95	0.3	-160.5	177.2	0	0	0	0	115.1	Q153 R158	Q153-V156 PolarHBondContact O-N 3.13Å; V156-R158 PolarHBondContact O-N 3.28Å
157	H	57.2	Low	75.5	Confident	83 Å²	83	74.6 Å²	74.6	38%	0.384	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	51.7	179.8	-153.7	73.3	0	0	0	114.5	E160 T161	H157-E160 VanDerWaalsContact CE1-CD 3.42Å; H157-E160 IonicContact CE1-OE1 2.68Å; H157-E160 IonicContact CE1-OE2 3.21Å; H157-E160 PolarHBondContact CE1-OE2 2.63Å; H157-E160 IonicContact NE2-OE2 3.43Å; H157-E160 PolarHBondContact NE2-OE2 3.21Å; H157-T161 PolarHBondContact O-OG1 3.3Å
158	R	54.9	Low	74.6	Confident	125 Å²	125	74.6 Å²	74.6	47%	0.472	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-36.4	179.5	-82.5	-174.3	174.6	146.6	-0.5	113.9	V156 T161 I162	V156-R158 PolarHBondContact O-N 3.28Å; R158-T161 PolarHBondContact O-N 2.75Å; R158-I162 HydrophobicContact CB-CD1 4.04Å; R158-I162 WeakPolarHBondContact O-CB 3.41Å; R158-I162 WeakPolarHBondContact O-CD1 3.32Å; R158-I162 WeakPolarHBondContact O-CG1 3.25Å; R158-I162 PolarHBondContact O-N 3.48Å
159	N	53.3	Low	73.7	Confident	125 Å²	125	74.8 Å²	74.8	67%	0.668	37%	0.372	S	S	*	.	H	α-helix	trans	-68.8	-44.3	-168.3	-74	-13.9	0	0	0	114.1	I162 K163	N159-I162 PolarHBondContact O-N 2.68Å; N159-K163 PolarHBondContact O-N 3.17Å; N159-K163 VanDerWaalsContact O-N 3.13Å
160	E	61.4	Low	72.8	Confident	119 Å²	119	72.6 Å²	72.6	56%	0.556	36%	0.364	S	S	*	.	H	α-helix	trans	-66.1	-46.6	176.9	-70.5	175.3	-157.2	0	0	110.2	H157 I162 K163 E164	H157-E160 VanDerWaalsContact CE1-CD 3.42Å; H157-E160 IonicContact CE1-OE1 2.68Å; H157-E160 IonicContact CE1-OE2 3.21Å; H157-E160 PolarHBondContact CE1-OE2 2.63Å; H157-E160 IonicContact NE2-OE2 3.43Å; H157-E160 PolarHBondContact NE2-OE2 3.21Å; E160-I162 VanDerWaalsContact C-N 3.34Å; E160-I162 PolarHBondContact O-N 3.42Å; E160-K163 PolarHBondContact O-N 3.4Å; E160-E164 WeakPolarHBondContact O-CG 3.41Å; E160-E164 PolarHBondContact O-N 3.08Å
161	T	67.7	Low	71.9	Confident	14 Å²	14	73.4 Å²	73.4	9%	0.086	37%	0.369	C	S	.	.	H	α-helix	trans	-56.4	-44	175.2	-47.4	0	0	0	0	112.3	H157 R158 E164 V165 Y194	H157-T161 PolarHBondContact O-OG1 3.3Å; R158-T161 PolarHBondContact O-N 2.75Å; T161-E164 PolarHBondContact O-N 3.39Å; T161-V165 HydrophobicContact CG2-CG2 4.46Å; T161-V165 WeakPolarHBondContact O-CB 3.25Å; T161-V165 WeakPolarHBondContact O-CG2 3.37Å; T161-V165 PolarHBondContact O-N 2.82Å; T161-Y194 HydrophobicContact CG2-CD1 3.94Å
162	I	67.3	Low	70.9	Confident	91 Å²	91	75.4 Å²	75.4	47%	0.467	38%	0.379	S	S	.	.	H	α-helix	trans	-64.3	-44.5	178.8	-71.7	163.3	0	0	0	110.9	R158 N159 E160 E164 V165 V166	R158-I162 HydrophobicContact CB-CD1 4.04Å; R158-I162 WeakPolarHBondContact O-CB 3.41Å; R158-I162 WeakPolarHBondContact O-CD1 3.32Å; R158-I162 WeakPolarHBondContact O-CG1 3.25Å; R158-I162 PolarHBondContact O-N 3.48Å; N159-I162 PolarHBondContact O-N 2.68Å; E160-I162 VanDerWaalsContact C-N 3.34Å; E160-I162 PolarHBondContact O-N 3.42Å; I162-E164 PolarHBondContact O-N 2.81Å; I162-V165 PolarHBondContact O-N 3.44Å; I162-V166 HydrophobicContact CG2-CG2 4.31Å; I162-V166 VanDerWaalsContact O-CG2 3.29Å; I162-V166 WeakPolarHBondContact O-CG2 3.38Å; I162-V166 PolarHBondContact O-N 2.84Å
163	K	69	Low	69.8	Low	137 Å²	137	75 Å²	75	60%	0.596	38%	0.383	S	S	*	.	H	α-helix	trans	-60.9	-45.9	176.8	-74.2	-178.4	179.1	-177	0	111.2	N159 E160 V165 V166 L167	N159-K163 PolarHBondContact O-N 3.17Å; N159-K163 VanDerWaalsContact O-N 3.13Å; E160-K163 PolarHBondContact O-N 3.4Å; K163-V165 VanDerWaalsContact C-N 3.35Å; K163-V165 PolarHBondContact O-N 3.26Å; K163-V166 PolarHBondContact O-N 2.99Å; K163-L167 WeakPolarHBondContact O-CB 3.48Å; K163-L167 VanDerWaalsContact O-CG 3.29Å; K163-L167 WeakPolarHBondContact O-CG 3.22Å; K163-L167 PolarHBondContact O-N 2.94Å
164	E	75.7	Confident	68.6	Low	67 Å²	67	73.1 Å²	73.1	31%	0.313	38%	0.383	S	S	.	.	H	α-helix	trans	-60	-44	176.2	-69.4	-179.7	176.7	0	0	111.6	E160 T161 I162 L167 A168 Y194 K197	E160-E164 WeakPolarHBondContact O-CG 3.41Å; E160-E164 PolarHBondContact O-N 3.08Å; T161-E164 PolarHBondContact O-N 3.39Å; I162-E164 PolarHBondContact O-N 2.81Å; E164-L167 PolarHBondContact O-N 3.42Å; E164-A168 VanDerWaalsContact O-CB 3.28Å; E164-A168 WeakPolarHBondContact O-CB 3.31Å; E164-A168 PolarHBondContact O-N 3.01Å; E164-Y194 HydrophobicContact CB-CD1 4.45Å; E164-Y194 HydrophobicContact CB-CE1 3.48Å; E164-Y194 VanDerWaalsContact CB-CE1 3.48Å; E164-Y194 PolarHBondContact O-OH 2.93Å; E164-Y194 WeakPolarHBondContact OE2-CE1 3.35Å; E164-K197 IonicContact OE1-NZ 2.78Å; E164-K197 PolarHBondContact OE1-NZ 2.04Å; E164-K197 IonicContact OE2-NZ 3.88Å; E164-K197 PolarHBondContact OE2-NZ 3.33Å
165	V	77	Confident	67.3	Low	19 Å²	19	81.2 Å²	81.2	12%	0.115	41%	0.413	C	S	.	.	H	α-helix	trans	-59.5	-49.8	175.4	169.1	0	0	0	0	111	T161 I162 K163 L167 A168 L169 L191 Y194	T161-V165 HydrophobicContact CG2-CG2 4.46Å; T161-V165 WeakPolarHBondContact O-CB 3.25Å; T161-V165 WeakPolarHBondContact O-CG2 3.37Å; T161-V165 PolarHBondContact O-N 2.82Å; I162-V165 PolarHBondContact O-N 3.44Å; K163-V165 VanDerWaalsContact C-N 3.35Å; K163-V165 PolarHBondContact O-N 3.26Å; V165-L167 VanDerWaalsContact C-N 3.33Å; V165-L167 PolarHBondContact O-N 3.41Å; V165-A168 PolarHBondContact O-N 2.95Å; V165-L169 HydrophobicContact CG1-CD1 3.65Å; V165-L169 HydrophobicContact CG1-CG 4.21Å; V165-L169 WeakPolarHBondContact O-CB 3.5Å; V165-L169 VanDerWaalsContact O-CG 3.22Å; V165-L169 WeakPolarHBondContact O-CG 3.33Å; V165-L169 PolarHBondContact O-N 2.97Å; V165-L191 HydrophobicContact CG1-CD2 3.73Å; V165-Y194 HydrophobicContact CB-CD2 4.45Å; V165-Y194 HydrophobicContact CB-CG 4.45Å; V165-Y194 HydrophobicContact CG2-CD1 3.56Å; V165-Y194 HydrophobicContact CG2-CD2 3.55Å; V165-Y194 HydrophobicContact CG2-CE1 4.17Å; V165-Y194 HydrophobicContact CG2-CE2 4.18Å; V165-Y194 HydrophobicContact CG2-CG 3.21Å
166	V	72.8	Confident	66.4	Low	89 Å²	89	88.9 Å²	88.9	54%	0.539	45%	0.45	S	S	.	.	H	α-helix	trans	-60.8	-44.3	-179.3	170.3	0	0	0	0	110.7	I162 K163 L169 H170	I162-V166 HydrophobicContact CG2-CG2 4.31Å; I162-V166 VanDerWaalsContact O-CG2 3.29Å; I162-V166 WeakPolarHBondContact O-CG2 3.38Å; I162-V166 PolarHBondContact O-N 2.84Å; K163-V166 PolarHBondContact O-N 2.99Å; V166-L169 PolarHBondContact O-N 3.34Å; V166-H170 WeakPolarHBondContact O-CB 3.22Å; V166-H170 PolarHBondContact O-N 3.33Å
167	L	72.8	Confident	66.4	Low	106 Å²	106	86.8 Å²	86.8	56%	0.555	44%	0.435	S	S	*	.	H	α-helix	trans	-64.1	-43.2	176.4	-71.2	171.7	0	0	0	112	K163 E164 V165 H170 N171	K163-L167 WeakPolarHBondContact O-CB 3.48Å; K163-L167 VanDerWaalsContact O-CG 3.29Å; K163-L167 WeakPolarHBondContact O-CG 3.22Å; K163-L167 PolarHBondContact O-N 2.94Å; E164-L167 PolarHBondContact O-N 3.42Å; V165-L167 VanDerWaalsContact C-N 3.33Å; V165-L167 PolarHBondContact O-N 3.41Å; L167-H170 PolarHBondContact O-N 3.35Å; L167-N171 WeakPolarHBondContact O-CB 3.33Å; L167-N171 VanDerWaalsContact O-CG 3.27Å; L167-N171 PolarHBondContact O-N 3.05Å; L167-N171 PolarHBondContact O-ND2 2.68Å
168	A	75.9	Confident	66.8	Low	19 Å²	19	88.4 Å²	88.4	16%	0.157	46%	0.456	C	S	.	.	H	α-helix	trans	-62.3	-44.9	177.5	0	0	0	0	0	111.8	E164 V165 N171 Q172 T190 Y194	E164-A168 VanDerWaalsContact O-CB 3.28Å; E164-A168 WeakPolarHBondContact O-CB 3.31Å; E164-A168 PolarHBondContact O-N 3.01Å; V165-A168 PolarHBondContact O-N 2.95Å; A168-N171 PolarHBondContact O-N 3.4Å; A168-Q172 VanDerWaalsContact O-CG 3.23Å; A168-Q172 WeakPolarHBondContact O-CG 3.39Å; A168-Q172 PolarHBondContact O-N 3.25Å; A168-Q172 VanDerWaalsContact O-N 3.08Å; A168-T190 HydrophobicContact CB-CG2 4.03Å; A168-Y194 HydrophobicContact CB-CE2 3.82Å
169	L	73.4	Confident	67.7	Low	20 Å²	20	84.6 Å²	84.6	11%	0.105	45%	0.449	C	S	.	.	H	α-helix	trans	-65.4	-41.3	176.9	-68.1	173.3	0	0	0	111.7	F106 V165 V166 Q172 S173 I187 T190 L191	F106-L169 HydrophobicContact CZ-CD1 4.26Å; V165-L169 HydrophobicContact CG1-CD1 3.65Å; V165-L169 HydrophobicContact CG1-CG 4.21Å; V165-L169 WeakPolarHBondContact O-CB 3.5Å; V165-L169 VanDerWaalsContact O-CG 3.22Å; V165-L169 WeakPolarHBondContact O-CG 3.33Å; V165-L169 PolarHBondContact O-N 2.97Å; V166-L169 PolarHBondContact O-N 3.34Å; L169-Q172 PolarHBondContact O-N 3.4Å; L169-S173 PolarHBondContact O-N 3.03Å; L169-I187 HydrophobicContact CD2-CB 4.2Å; L169-I187 HydrophobicContact CD2-CG1 3.97Å; L169-I187 HydrophobicContact CD2-CG2 3.93Å; L169-T190 HydrophobicContact CD2-CG2 4.05Å; L169-T190 HydrophobicContact CG-CG2 4.42Å; L169-L191 HydrophobicContact CD1-CD2 4.32Å
170	H	70.3	Confident	68.6	Low	118 Å²	118	82.9 Å²	82.9	55%	0.546	44%	0.444	S	S	.	.	H	α-helix	trans	-61.6	-47.9	176.1	-175.9	64.4	0	0	0	111.6	V166 L167 Q172 S173 S174	V166-H170 WeakPolarHBondContact O-CB 3.22Å; V166-H170 PolarHBondContact O-N 3.33Å; L167-H170 PolarHBondContact O-N 3.35Å; H170-Q172 PolarHBondContact O-N 3.27Å; H170-S173 PolarHBondContact O-N 3.25Å; H170-S173 VanDerWaalsContact O-N 3.13Å; H170-S173 PolarHBondContact O-OG 3.4Å; H170-S174 PolarHBondContact O-N 2.98Å
171	N	70.6	Confident	69.5	Low	94 Å²	94	83 Å²	83	50%	0.503	45%	0.449	S	S	.	.	H	α-helix	trans	-63.9	-22.3	176.7	-72.2	-20.9	0	0	0	113.7	L167 A168 S174	L167-N171 WeakPolarHBondContact O-CB 3.33Å; L167-N171 VanDerWaalsContact O-CG 3.27Å; L167-N171 PolarHBondContact O-N 3.05Å; L167-N171 PolarHBondContact O-ND2 2.68Å; A168-N171 PolarHBondContact O-N 3.4Å; N171-S174 PolarHBondContact O-OG 2.86Å
172	Q	70.1	Confident	70.1	Confident	43 Å²	43	86.5 Å²	86.5	20%	0.201	46%	0.464	C	S	.	.	H	α-helix	trans	-82.3	-37.9	173.8	-73.8	169.1	-3.6	0	0	111.8	A168 L169 H170 S174 R175 I186 T190	A168-Q172 VanDerWaalsContact O-CG 3.23Å; A168-Q172 WeakPolarHBondContact O-CG 3.39Å; A168-Q172 PolarHBondContact O-N 3.25Å; A168-Q172 VanDerWaalsContact O-N 3.08Å; L169-Q172 PolarHBondContact O-N 3.4Å; H170-Q172 PolarHBondContact O-N 3.27Å; Q172-S174 VanDerWaalsContact C-N 3.26Å; Q172-S174 PolarHBondContact O-N 2.84Å; Q172-R175 PolarHBondContact O-N 2.83Å; Q172-I186 HydrophobicContact CB-CG2 4.33Å; Q172-I186 VanDerWaalsContact CD-CG2 3.41Å; Q172-I186 HydrophobicContact CG-CG2 4.01Å; Q172-I186 VanDerWaalsContact OE1-CG2 3.29Å; Q172-T190 VanDerWaalsContact CD-OG1 3.27Å; Q172-T190 PolarHBondContact NE2-OG1 3.29Å; Q172-T190 PolarHBondContact OE1-OG1 3.21Å
173	S	66.4	Low	70.6	Confident	58 Å²	58	85 Å²	85	41%	0.406	45%	0.453	S	S	.	.	H	α-helix	trans	-65.1	-25.7	175.6	67	0	0	0	0	114.2	L169 H170 R175	L169-S173 PolarHBondContact O-N 3.03Å; H170-S173 PolarHBondContact O-N 3.25Å; H170-S173 VanDerWaalsContact O-N 3.13Å; H170-S173 PolarHBondContact O-OG 3.4Å; S173-R175 VanDerWaalsContact C-N 3.3Å
174	S	60.1	Low	71	Confident	85 Å²	85	80.3 Å²	80.3	59%	0.594	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-16.7	177.1	62.1	0	0	0	0	113.5	H170 N171 Q172	H170-S174 PolarHBondContact O-N 2.98Å; N171-S174 PolarHBondContact O-OG 2.86Å; Q172-S174 VanDerWaalsContact C-N 3.26Å; Q172-S174 PolarHBondContact O-N 2.84Å
175	R	61.1	Low	71.4	Confident	182 Å²	182	80.8 Å²	80.8	69%	0.687	44%	0.443	S	S	*	.	S	Bend	trans	-81.9	117.7	171.4	-61.5	179.6	-177	-172.2	-1.7	107	Q172 S173 L177	Q172-R175 PolarHBondContact O-N 2.83Å; S173-R175 VanDerWaalsContact C-N 3.3Å; R175-L177 VanDerWaalsContact C-N 3.3Å; R175-L177 WeakPolarHBondContact O-CG 3.19Å; R175-L177 PolarHBondContact O-N 3.41Å
176	L	55.3	Low	71.6	Confident	177 Å²	177	82.2 Å²	82.2	93%	0.927	45%	0.449	S	S	*	.			trans	-58.8	92.3	174.4	-69.4	167	0	0	0	109.2
177	L	62.9	Low	72	Confident	51 Å²	51	78 Å²	78	27%	0.267	42%	0.423	S	S	.	.			trans	-80.2	135.3	179.3	-74.6	157.7	0	0	0	109.4	R175 S179 E182 Y183 I186	R175-L177 VanDerWaalsContact C-N 3.3Å; R175-L177 WeakPolarHBondContact O-CG 3.19Å; R175-L177 PolarHBondContact O-N 3.41Å; L177-S179 VanDerWaalsContact C-N 3.26Å; L177-S179 PolarHBondContact O-N 3.25Å; L177-E182 HydrophobicContact CD2-CG 4.26Å; L177-Y183 HydrophobicContact CD1-CD2 3.52Å; L177-Y183 HydrophobicContact CD1-CG 4.21Å; L177-I186 HydrophobicContact CD1-CD1 3.95Å; L177-I186 HydrophobicContact CD2-CD1 3.45Å; L177-I186 VanDerWaalsContact CD2-CD1 3.45Å; L177-I186 HydrophobicContact CG-CD1 4.37Å
178	S	65.3	Low	72.5	Confident	117 Å²	117	78.7 Å²	78.7	82%	0.818	42%	0.422	S	S	*	.	S	Bend	trans	-72.2	-18.7	-167.6	-51.5	0	0	0	0	113.3
179	S	73.4	Confident	73	Confident	45 Å²	45	84.2 Å²	84.2	32%	0.315	44%	0.444	S	S	.	.			trans	-145.8	148.8	175.2	74.6	0	0	0	0	113.2	L177 N181 E182 Y183	L177-S179 VanDerWaalsContact C-N 3.26Å; L177-S179 PolarHBondContact O-N 3.25Å; S179-N181 VanDerWaalsContact C-N 3.26Å; S179-N181 PolarHBondContact O-N 3.46Å; S179-E182 PolarHBondContact O-N 2.87Å; S179-E182 VanDerWaalsContact OG-CB 3.28Å; S179-E182 WeakPolarHBondContact OG-CB 3.41Å; S179-E182 PolarHBondContact OG-N 2.78Å; S179-Y183 PolarHBondContact O-N 2.86Å
180	P	73	Confident	73.6	Confident	89 Å²	89	83.8 Å²	83.8	58%	0.578	44%	0.443	S	S	*	.	H	α-helix	trans	-57.3	-36.4	173.2	-25.8	34.4	0	0	0	113.5	Y183 Y184	P180-Y183 WeakPolarHBondContact O-CB 3.47Å; P180-Y183 PolarHBondContact O-N 3.43Å; P180-Y184 HydrophobicContact CB-CE2 4.13Å; P180-Y184 WeakPolarHBondContact O-CD2 3.45Å; P180-Y184 VanDerWaalsContact O-CG 3.3Å; P180-Y184 PolarHBondContact O-N 3.43Å
181	N	79.1	Confident	74.3	Confident	123 Å²	123	79.5 Å²	79.5	66%	0.658	42%	0.424	S	S	*	.	H	α-helix	trans	-66.9	-37.6	-179.6	-72.5	-17	0	0	0	112.7	S179 S185	S179-N181 VanDerWaalsContact C-N 3.26Å; S179-N181 PolarHBondContact O-N 3.46Å; N181-S185 WeakPolarHBondContact O-CB 3.43Å; N181-S185 PolarHBondContact O-N 2.93Å; N181-S185 PolarHBondContact O-OG 2.96Å
182	E	80	Confident	75.1	Confident	86 Å²	86	76.9 Å²	76.9	40%	0.402	41%	0.411	S	S	.	.	H	α-helix	trans	-66.6	-44.2	174.6	-174	179.5	-169	0	0	110.7	L177 S179 Y184 S185 I186	L177-E182 HydrophobicContact CD2-CG 4.26Å; S179-E182 PolarHBondContact O-N 2.87Å; S179-E182 VanDerWaalsContact OG-CB 3.28Å; S179-E182 WeakPolarHBondContact OG-CB 3.41Å; S179-E182 PolarHBondContact OG-N 2.78Å; E182-Y184 PolarHBondContact O-N 3.22Å; E182-S185 PolarHBondContact O-N 3.19Å; E182-I186 HydrophobicContact CG-CD1 4.09Å; E182-I186 WeakPolarHBondContact O-CG1 3.42Å; E182-I186 PolarHBondContact O-N 3.01Å
183	Y	78.3	Confident	76	Confident	61 Å²	61	78 Å²	78	24%	0.239	42%	0.423	C	S	.	.	H	α-helix	trans	-56.2	-48.8	174.2	175.7	-116.6	0	0	0	112.6	L177 S179 P180 S185 I186 I187	L177-Y183 HydrophobicContact CD1-CD2 3.52Å; L177-Y183 HydrophobicContact CD1-CG 4.21Å; S179-Y183 PolarHBondContact O-N 2.86Å; P180-Y183 WeakPolarHBondContact O-CB 3.47Å; P180-Y183 PolarHBondContact O-N 3.43Å; Y183-S185 VanDerWaalsContact C-N 3.33Å; Y183-S185 PolarHBondContact O-N 3.28Å; Y183-I186 PolarHBondContact O-N 3.47Å; Y183-I187 HydrophobicContact CD1-CD1 3.6Å; Y183-I187 HydrophobicContact CD2-CD1 4Å; Y183-I187 HydrophobicContact CD2-CG1 4.36Å; Y183-I187 HydrophobicContact CE1-CD1 3.25Å; Y183-I187 HydrophobicContact CE1-CG1 4.45Å; Y183-I187 HydrophobicContact CE2-CD1 3.7Å; Y183-I187 HydrophobicContact CE2-CG1 4.1Å; Y183-I187 HydrophobicContact CG-CD1 3.99Å; Y183-I187 VanDerWaalsContact O-CG1 3.3Å; Y183-I187 WeakPolarHBondContact O-CG1 3.35Å; Y183-I187 PolarHBondContact O-N 3.31Å
184	Y	77.8	Confident	77	Confident	37 Å²	37	77.5 Å²	77.5	15%	0.145	41%	0.413	C	S	.	.	H	α-helix	trans	-66.7	-34.2	178.8	-66.3	-42.7	0	0	0	113.4	K105 I109 P180 E182 I187 K188	K105-Y184 WeakPolarHBondContact CB-OH 3.32Å; I109-Y184 HydrophobicContact CD1-CD1 3.02Å; I109-Y184 HydrophobicContact CD1-CD2 4.18Å; I109-Y184 HydrophobicContact CD1-CE1 3.66Å; I109-Y184 HydrophobicContact CD1-CG 3.32Å; P180-Y184 HydrophobicContact CB-CE2 4.13Å; P180-Y184 WeakPolarHBondContact O-CD2 3.45Å; P180-Y184 VanDerWaalsContact O-CG 3.3Å; P180-Y184 PolarHBondContact O-N 3.43Å; E182-Y184 PolarHBondContact O-N 3.22Å; Y184-I187 HydrophobicContact CD1-CD1 4.03Å; Y184-I187 PolarHBondContact O-N 2.9Å; Y184-K188 WeakPolarHBondContact O-CB 3.01Å; Y184-K188 PolarHBondContact O-N 3.42Å
185	S	83.4	Confident	78.2	Confident	78 Å²	78	75.7 Å²	75.7	55%	0.545	40%	0.395	S	S	.	.	H	α-helix	trans	-66.9	-40.8	175.6	-62.4	0	0	0	0	111.5	N181 E182 Y183 K188 H189	N181-S185 WeakPolarHBondContact O-CB 3.43Å; N181-S185 PolarHBondContact O-N 2.93Å; N181-S185 PolarHBondContact O-OG 2.96Å; E182-S185 PolarHBondContact O-N 3.19Å; Y183-S185 VanDerWaalsContact C-N 3.33Å; Y183-S185 PolarHBondContact O-N 3.28Å; S185-K188 PolarHBondContact O-N 3.15Å; S185-H189 WeakPolarHBondContact O-CB 3.46Å; S185-H189 PolarHBondContact O-N 3.44Å
186	I	82.3	Confident	79.6	Confident	48 Å²	48	68.1 Å²	68.1	25%	0.246	37%	0.37	C	S	.	.	H	α-helix	trans	-63.8	-47.2	173.7	-70.2	166.9	0	0	0	110.6	Q172 L177 E182 Y183 K188 H189 T190	Q172-I186 HydrophobicContact CB-CG2 4.33Å; Q172-I186 VanDerWaalsContact CD-CG2 3.41Å; Q172-I186 HydrophobicContact CG-CG2 4.01Å; Q172-I186 VanDerWaalsContact OE1-CG2 3.29Å; L177-I186 HydrophobicContact CD1-CD1 3.95Å; L177-I186 HydrophobicContact CD2-CD1 3.45Å; L177-I186 VanDerWaalsContact CD2-CD1 3.45Å; L177-I186 HydrophobicContact CG-CD1 4.37Å; E182-I186 HydrophobicContact CG-CD1 4.09Å; E182-I186 WeakPolarHBondContact O-CG1 3.42Å; E182-I186 PolarHBondContact O-N 3.01Å; Y183-I186 PolarHBondContact O-N 3.47Å; I186-K188 VanDerWaalsContact C-N 3.33Å; I186-K188 PolarHBondContact O-N 3.45Å; I186-H189 PolarHBondContact O-N 2.93Å; I186-T190 WeakPolarHBondContact O-CB 3.48Å; I186-T190 PolarHBondContact O-N 3.46Å; I186-T190 PolarHBondContact O-OG1 2.94Å
187	I	80.5	Confident	81.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-56.9	-48.2	176.5	-69.4	161.7	0	0	0	110.8	F106 I109 L169 Y183 Y184 H189 T190 L191	F106-I187 HydrophobicContact CD2-CD1 3.56Å; F106-I187 HydrophobicContact CD2-CG2 4.4Å; F106-I187 HydrophobicContact CE2-CD1 3.61Å; F106-I187 HydrophobicContact CE2-CG1 4.16Å; F106-I187 HydrophobicContact CE2-CG2 3.9Å; I109-I187 HydrophobicContact CG2-CG2 4.2Å; L169-I187 HydrophobicContact CD2-CB 4.2Å; L169-I187 HydrophobicContact CD2-CG1 3.97Å; L169-I187 HydrophobicContact CD2-CG2 3.93Å; Y183-I187 HydrophobicContact CD1-CD1 3.6Å; Y183-I187 HydrophobicContact CD2-CD1 4Å; Y183-I187 HydrophobicContact CD2-CG1 4.36Å; Y183-I187 HydrophobicContact CE1-CD1 3.25Å; Y183-I187 HydrophobicContact CE1-CG1 4.45Å; Y183-I187 HydrophobicContact CE2-CD1 3.7Å; Y183-I187 HydrophobicContact CE2-CG1 4.1Å; Y183-I187 HydrophobicContact CG-CD1 3.99Å; Y183-I187 VanDerWaalsContact O-CG1 3.3Å; Y183-I187 WeakPolarHBondContact O-CG1 3.35Å; Y183-I187 PolarHBondContact O-N 3.31Å; Y184-I187 HydrophobicContact CD1-CD1 4.03Å; Y184-I187 PolarHBondContact O-N 2.9Å; I187-H189 PolarHBondContact O-N 2.74Å; I187-T190 PolarHBondContact O-N 3.36Å; I187-L191 HydrophobicContact CG2-CD1 3.74Å; I187-L191 HydrophobicContact CG2-CG 4.31Å; I187-L191 WeakPolarHBondContact O-CB 3.38Å; I187-L191 WeakPolarHBondContact O-CG 3.34Å; I187-L191 PolarHBondContact O-N 3.29Å
188	K	83.8	Confident	82.4	Confident	121 Å²	121	63.7 Å²	63.7	53%	0.526	35%	0.346	S	S	.	.	H	α-helix	trans	-58.7	-48.3	178.8	-178.6	175.2	-177.3	-178.9	0	111	I113 Y184 S185 I186 T190 L191 T192	I113-K188 HydrophobicContact CD1-CB 4.22Å; I113-K188 HydrophobicContact CD1-CG 3.91Å; I113-K188 HydrophobicContact CG1-CG 4.43Å; Y184-K188 WeakPolarHBondContact O-CB 3.01Å; Y184-K188 PolarHBondContact O-N 3.42Å; S185-K188 PolarHBondContact O-N 3.15Å; I186-K188 VanDerWaalsContact C-N 3.33Å; I186-K188 PolarHBondContact O-N 3.45Å; K188-T190 PolarHBondContact O-N 2.77Å; K188-L191 PolarHBondContact O-N 3.29Å; K188-T192 WeakPolarHBondContact O-CB 3.47Å; K188-T192 PolarHBondContact O-N 3.49Å; K188-T192 PolarHBondContact O-OG1 2.78Å
189	H	86.9	Confident	83.6	Confident	135 Å²	135	59.6 Å²	59.6	63%	0.625	32%	0.315	S	S	*	.	H	α-helix	trans	-59.7	-45.5	176.5	-174.5	-31	0	0	0	111.7	S185 I186 I187 T192 S193	S185-H189 WeakPolarHBondContact O-CB 3.46Å; S185-H189 PolarHBondContact O-N 3.44Å; I186-H189 PolarHBondContact O-N 2.93Å; I187-H189 PolarHBondContact O-N 2.74Å; H189-T192 PolarHBondContact O-N 3.21Å; H189-S193 WeakPolarHBondContact O-CB 3.26Å; H189-S193 PolarHBondContact O-N 3.37Å
190	T	85.6	Confident	84.5	Confident	12 Å²	12	63 Å²	63	7%	0.074	32%	0.321	C	S	.	.	H	α-helix	trans	-58	-52.4	178.1	-61.7	0	0	0	0	110.3	A168 L169 Q172 I186 I187 K188 T192 S193 Y194	A168-T190 HydrophobicContact CB-CG2 4.03Å; L169-T190 HydrophobicContact CD2-CG2 4.05Å; L169-T190 HydrophobicContact CG-CG2 4.42Å; Q172-T190 VanDerWaalsContact CD-OG1 3.27Å; Q172-T190 PolarHBondContact NE2-OG1 3.29Å; Q172-T190 PolarHBondContact OE1-OG1 3.21Å; I186-T190 WeakPolarHBondContact O-CB 3.48Å; I186-T190 PolarHBondContact O-N 3.46Å; I186-T190 PolarHBondContact O-OG1 2.94Å; I187-T190 PolarHBondContact O-N 3.36Å; K188-T190 PolarHBondContact O-N 2.77Å; T190-T192 PolarHBondContact O-N 2.97Å; T190-S193 WeakPolarHBondContact O-CB 3.28Å; T190-S193 PolarHBondContact O-N 2.89Å; T190-S193 VanDerWaalsContact O-N 3.16Å; T190-Y194 HydrophobicContact CG2-CD2 3.84Å; T190-Y194 HydrophobicContact CG2-CE2 3.81Å; T190-Y194 VanDerWaalsContact O-CD2 3.26Å; T190-Y194 WeakPolarHBondContact O-CD2 3.39Å; T190-Y194 PolarHBondContact O-N 3.47Å
191	L	84.7	Confident	85.3	Confident	28 Å²	28	61.9 Å²	61.9	15%	0.147	31%	0.312	C	S	.	.	H	α-helix	trans	-59.2	-45.3	179.4	-70.9	171.8	0	0	0	112.2	I110 I113 V165 L169 I187 K188 S193 Y194 E195	I110-L191 HydrophobicContact CG1-CD1 3.98Å; I113-L191 HydrophobicContact CD1-CB 3.88Å; I113-L191 HydrophobicContact CD1-CD1 3.62Å; I113-L191 HydrophobicContact CD1-CG 4.4Å; V165-L191 HydrophobicContact CG1-CD2 3.73Å; L169-L191 HydrophobicContact CD1-CD2 4.32Å; I187-L191 HydrophobicContact CG2-CD1 3.74Å; I187-L191 HydrophobicContact CG2-CG 4.31Å; I187-L191 WeakPolarHBondContact O-CB 3.38Å; I187-L191 WeakPolarHBondContact O-CG 3.34Å; I187-L191 PolarHBondContact O-N 3.29Å; K188-L191 PolarHBondContact O-N 3.29Å; L191-S193 VanDerWaalsContact C-N 3.33Å; L191-S193 PolarHBondContact O-N 3.18Å; L191-Y194 PolarHBondContact O-N 3.34Å; L191-E195 WeakPolarHBondContact O-CB 3.36Å; L191-E195 PolarHBondContact O-N 3.2Å
192	T	87.5	Confident	85.9	Confident	39 Å²	39	57.3 Å²	57.3	24%	0.239	29%	0.287	C	S	.	.	H	α-helix	trans	-62	-38.6	176.4	-62.5	0	0	0	0	112.4	K188 H189 T190 E195 C196 P231	K188-T192 WeakPolarHBondContact O-CB 3.47Å; K188-T192 PolarHBondContact O-N 3.49Å; K188-T192 PolarHBondContact O-OG1 2.78Å; H189-T192 PolarHBondContact O-N 3.21Å; T190-T192 PolarHBondContact O-N 2.97Å; T192-E195 PolarHBondContact O-N 3.34Å; T192-C196 WeakPolarHBondContact O-CB 3.48Å; T192-C196 PolarHBondContact O-N 3.5Å; T192-P231 HydrophobicContact CG2-CB 3.57Å; T192-P231 HydrophobicContact CG2-CG 3.96Å
193	S	88.9	Confident	86.5	Confident	65 Å²	65	53.3 Å²	53.3	46%	0.455	27%	0.268	S	S	.	.	H	α-helix	trans	-64.2	-44.5	176.7	-178.9	0	0	0	0	111.8	H189 T190 L191 C196 K197	H189-S193 WeakPolarHBondContact O-CB 3.26Å; H189-S193 PolarHBondContact O-N 3.37Å; T190-S193 WeakPolarHBondContact O-CB 3.28Å; T190-S193 PolarHBondContact O-N 2.89Å; T190-S193 VanDerWaalsContact O-N 3.16Å; L191-S193 VanDerWaalsContact C-N 3.33Å; L191-S193 PolarHBondContact O-N 3.18Å; S193-C196 WeakPolarHBondContact O-CB 3.4Å; S193-C196 PolarHBondContact O-N 2.88Å; S193-K197 PolarHBondContact O-N 3.06Å
194	Y	87.1	Confident	87.3	Confident	48 Å²	48	52.8 Å²	52.8	19%	0.188	27%	0.269	C	S	.	.	H	α-helix	trans	-70.4	-35.1	177.6	-83	-80.3	0	0	0	113	T161 E164 V165 A168 T190 L191 K197 S198	T161-Y194 HydrophobicContact CG2-CD1 3.94Å; E164-Y194 HydrophobicContact CB-CD1 4.45Å; E164-Y194 HydrophobicContact CB-CE1 3.48Å; E164-Y194 VanDerWaalsContact CB-CE1 3.48Å; E164-Y194 PolarHBondContact O-OH 2.93Å; E164-Y194 WeakPolarHBondContact OE2-CE1 3.35Å; V165-Y194 HydrophobicContact CB-CD2 4.45Å; V165-Y194 HydrophobicContact CB-CG 4.45Å; V165-Y194 HydrophobicContact CG2-CD1 3.56Å; V165-Y194 HydrophobicContact CG2-CD2 3.55Å; V165-Y194 HydrophobicContact CG2-CE1 4.17Å; V165-Y194 HydrophobicContact CG2-CE2 4.18Å; V165-Y194 HydrophobicContact CG2-CG 3.21Å; A168-Y194 HydrophobicContact CB-CE2 3.82Å; T190-Y194 HydrophobicContact CG2-CD2 3.84Å; T190-Y194 HydrophobicContact CG2-CE2 3.81Å; T190-Y194 VanDerWaalsContact O-CD2 3.26Å; T190-Y194 WeakPolarHBondContact O-CD2 3.39Å; T190-Y194 PolarHBondContact O-N 3.47Å; L191-Y194 PolarHBondContact O-N 3.34Å; Y194-K197 PolarHBondContact O-N 2.98Å; Y194-S198 WeakPolarHBondContact O-CB 3.42Å; Y194-S198 PolarHBondContact O-N 3.49Å
195	E	85.8	Confident	88	Confident	47 Å²	47	53 Å²	53	22%	0.22	28%	0.276	C	S	.	.	H	α-helix	trans	-60.1	-47.7	170.3	178.7	172.2	-151.4	0	0	111.1	K119 L191 T192 K197 S198 L199	K119-E195 IonicContact NZ-OE1 2.98Å; K119-E195 PolarHBondContact NZ-OE1 3.47Å; K119-E195 IonicContact NZ-OE2 3.46Å; L191-E195 WeakPolarHBondContact O-CB 3.36Å; L191-E195 PolarHBondContact O-N 3.2Å; T192-E195 PolarHBondContact O-N 3.34Å; E195-K197 PolarHBondContact O-N 3.38Å; E195-S198 PolarHBondContact O-N 2.88Å; E195-L199 HydrophobicContact CG-CD1 3.93Å; E195-L199 HydrophobicContact CG-CG 4.49Å; E195-L199 WeakPolarHBondContact O-CG 3.35Å; E195-L199 PolarHBondContact O-N 3.47Å
196	C	90.5	Very high	88.6	Confident	23 Å²	23	49.3 Å²	49.3	16%	0.155	25%	0.25	C	C	.	.	H	α-helix	trans	-56.9	-47.4	174.6	176.3	0	0	0	0	111.6	T192 S193 S198 L199 R200 P231 C234	T192-C196 WeakPolarHBondContact O-CB 3.48Å; T192-C196 PolarHBondContact O-N 3.5Å; S193-C196 WeakPolarHBondContact O-CB 3.4Å; S193-C196 PolarHBondContact O-N 2.88Å; C196-S198 PolarHBondContact O-N 3.24Å; C196-L199 PolarHBondContact O-N 3.35Å; C196-R200 WeakPolarHBondContact O-CB 3.31Å; C196-R200 VanDerWaalsContact O-CG 3.26Å; C196-R200 WeakPolarHBondContact O-CG 3.3Å; C196-R200 PolarHBondContact O-N 3.07Å; C196-P231 HydrophobicContact CB-CG 3.88Å; C196-C234 VanDerWaalsContact CA-SG 3.57Å; C196-C234 HydrophobicContact CB-CB 3.72Å; C196-C234 WeakPolarHBondContact CB-SG 3.39Å; C196-C234 WeakPolarHBondContact SG-CB 3.2Å; C196-C234 CovalentContact SG-SG 2.03Å; C196-C234 PolarHBondContact SG-SG 3.35Å
197	K	89.7	Confident	89.2	Confident	97 Å²	97	47.5 Å²	47.5	42%	0.422	24%	0.24	S	C	.	.	H	α-helix	trans	-56.4	-49.4	176.2	-177.4	-179.2	174	-174.7	0	111.1	E164 S193 Y194 E195 R200 T201	E164-K197 IonicContact OE1-NZ 2.78Å; E164-K197 PolarHBondContact OE1-NZ 2.04Å; E164-K197 IonicContact OE2-NZ 3.88Å; E164-K197 PolarHBondContact OE2-NZ 3.33Å; S193-K197 PolarHBondContact O-N 3.06Å; Y194-K197 PolarHBondContact O-N 2.98Å; E195-K197 PolarHBondContact O-N 3.38Å; K197-R200 PolarHBondContact O-N 3.42Å; K197-T201 PolarHBondContact O-N 3.34Å; K197-T201 VanDerWaalsContact O-N 3.08Å; K197-T201 PolarHBondContact O-OG1 2.91Å
198	S	87.3	Confident	89.9	Confident	38 Å²	38	52.2 Å²	52.2	27%	0.266	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-45.9	-179.2	-173.5	0	0	0	0	112.6	Y194 E195 C196 R200 T201 K202	Y194-S198 WeakPolarHBondContact O-CB 3.42Å; Y194-S198 PolarHBondContact O-N 3.49Å; E195-S198 PolarHBondContact O-N 2.88Å; C196-S198 PolarHBondContact O-N 3.24Å; S198-R200 PolarHBondContact O-N 2.92Å; S198-T201 PolarHBondContact O-N 3.47Å; S198-K202 PolarHBondContact O-N 2.93Å
199	L	89.2	Confident	90.4	Very high	31 Å²	31	47.8 Å²	47.8	16%	0.162	25%	0.247	C	C	.	.	H	α-helix	trans	-67.2	-36.2	179.3	-72.2	171.2	0	0	0	112.5	E195 C196 K202 L203 T229 L230	E195-L199 HydrophobicContact CG-CD1 3.93Å; E195-L199 HydrophobicContact CG-CG 4.49Å; E195-L199 WeakPolarHBondContact O-CG 3.35Å; E195-L199 PolarHBondContact O-N 3.47Å; C196-L199 PolarHBondContact O-N 3.35Å; L199-K202 PolarHBondContact O-N 3.29Å; L199-L203 WeakPolarHBondContact O-CB 3.19Å; L199-L203 WeakPolarHBondContact O-CG 3.38Å; L199-L203 PolarHBondContact O-N 2.85Å; L199-T229 WeakPolarHBondContact CD1-O 3Å; L199-L230 HydrophobicContact CB-CD2 3.62Å; L199-L230 HydrophobicContact CD1-CD2 4.13Å
200	R	92.6	Very high	90.9	Very high	117 Å²	117	41.3 Å²	41.3	44%	0.442	22%	0.217	S	C	.	.	H	α-helix	trans	-63.3	-44.7	173.6	-74.5	179.9	63.2	164.2	1.6	111.7	C196 K197 S198 K202 L203 D204 F236	C196-R200 WeakPolarHBondContact O-CB 3.31Å; C196-R200 VanDerWaalsContact O-CG 3.26Å; C196-R200 WeakPolarHBondContact O-CG 3.3Å; C196-R200 PolarHBondContact O-N 3.07Å; K197-R200 PolarHBondContact O-N 3.42Å; S198-R200 PolarHBondContact O-N 2.92Å; R200-K202 VanDerWaalsContact C-N 3.32Å; R200-K202 PolarHBondContact O-N 2.97Å; R200-L203 PolarHBondContact O-N 3.42Å; R200-D204 PolarHBondContact O-N 3.5Å; R200-F236 HydrophobicContact CB-CD2 4.36Å; R200-F236 HydrophobicContact CG-CD2 4.13Å
201	T	91.1	Very high	91.4	Very high	66 Å²	66	42.4 Å²	42.4	41%	0.405	22%	0.221	S	C	.	.	H	α-helix	trans	-60.2	-42.5	174.6	-58.3	0	0	0	0	111.6	K197 S198 D204 C205	K197-T201 PolarHBondContact O-N 3.34Å; K197-T201 VanDerWaalsContact O-N 3.08Å; K197-T201 PolarHBondContact O-OG1 2.91Å; S198-T201 PolarHBondContact O-N 3.47Å; T201-D204 PolarHBondContact O-N 3.39Å; T201-C205 WeakPolarHBondContact O-CB 3.35Å; T201-C205 PolarHBondContact O-N 3.26Å
202	K	90.3	Very high	91.8	Very high	27 Å²	27	45.7 Å²	45.7	12%	0.117	24%	0.239	C	C	.	.	H	α-helix	trans	-59.6	-47.1	174.1	177.1	173.2	177.9	174	0	111.3	Y64 C154 S198 L199 R200 C205 L206	Y64-K202 PolarHBondContact O-NZ 3.25Å; C154-K202 HydrophobicContact CB-CG 4.2Å; S198-K202 PolarHBondContact O-N 2.93Å; L199-K202 PolarHBondContact O-N 3.29Å; R200-K202 VanDerWaalsContact C-N 3.32Å; R200-K202 PolarHBondContact O-N 2.97Å; K202-C205 WeakPolarHBondContact O-CB 3.48Å; K202-C205 PolarHBondContact O-N 3.34Å; K202-L206 HydrophobicContact CG-CD1 4Å; K202-L206 HydrophobicContact CG-CG 4.36Å; K202-L206 WeakPolarHBondContact O-CG 3.05Å; K202-L206 PolarHBondContact O-N 3.08Å
203	L	94	Very high	92.1	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-61.8	-44.1	179	-80.2	163.4	0	0	0	112.2	L199 R200 C205 L206 Y207 M223 F226 K227 L230 F236	L199-L203 WeakPolarHBondContact O-CB 3.19Å; L199-L203 WeakPolarHBondContact O-CG 3.38Å; L199-L203 PolarHBondContact O-N 2.85Å; R200-L203 PolarHBondContact O-N 3.42Å; L203-C205 VanDerWaalsContact C-N 3.35Å; L203-C205 PolarHBondContact O-N 3.29Å; L203-L206 PolarHBondContact O-N 3.42Å; L203-Y207 WeakPolarHBondContact O-CB 3.3Å; L203-Y207 PolarHBondContact O-N 2.95Å; L203-M223 HydrophobicContact CB-CE 4.14Å; L203-M223 HydrophobicContact CD2-CE 3.64Å; L203-M223 HydrophobicContact CD2-SD 4.25Å; L203-M223 WeakPolarHBondContact O-CE 3.48Å; L203-F226 HydrophobicContact CD2-CB 3.51Å; L203-F226 HydrophobicContact CG-CB 4.16Å; L203-K227 HydrophobicContact CD1-CG 4.42Å; L203-K227 HydrophobicContact CD2-CG 4.49Å; L203-L230 HydrophobicContact CD1-CD1 4.16Å; L203-L230 HydrophobicContact CD1-CD2 3.93Å; L203-L230 HydrophobicContact CD1-CG 4.3Å; L203-F236 HydrophobicContact CB-CD1 3.94Å; L203-F236 HydrophobicContact CB-CD2 4.08Å; L203-F236 HydrophobicContact CB-CE1 3.63Å; L203-F236 HydrophobicContact CB-CE2 3.78Å; L203-F236 HydrophobicContact CB-CG 4.15Å; L203-F236 HydrophobicContact CB-CZ 3.53Å; L203-F236 HydrophobicContact CD1-CB 3.86Å; L203-F236 HydrophobicContact CD1-CD1 3.83Å; L203-F236 HydrophobicContact CD1-CD2 4.17Å; L203-F236 HydrophobicContact CD1-CE1 4.39Å; L203-F236 HydrophobicContact CD1-CG 3.69Å; L203-F236 HydrophobicContact CD2-CD1 4.33Å; L203-F236 HydrophobicContact CD2-CE1 4.39Å; L203-F236 HydrophobicContact CG-CD1 4.28Å; L203-F236 HydrophobicContact CG-CE1 4.37Å; L203-F236 HydrophobicContact CG-CG 4.48Å
204	D	94.3	Very high	92.5	Very high	51 Å²	51	46.7 Å²	46.7	27%	0.273	24%	0.235	S	C	.	.	H	α-helix	trans	-62.7	-41.6	175.8	-80.7	-42.7	0	0	0	112	R200 T201 Y207 N208 F236 R241	R200-D204 PolarHBondContact O-N 3.5Å; T201-D204 PolarHBondContact O-N 3.39Å; D204-Y207 PolarHBondContact O-N 3.2Å; D204-N208 VanDerWaalsContact O-CG 3.28Å; D204-N208 PolarHBondContact O-N 3.29Å; D204-N208 PolarHBondContact O-ND2 3.48Å; D204-F236 VanDerWaalsContact OD1-CE2 3.28Å; D204-F236 WeakPolarHBondContact OD1-CE2 3.35Å; D204-F236 VanDerWaalsContact OD1-CZ 3.24Å; D204-F236 WeakPolarHBondContact OD1-CZ 3.4Å; D204-R241 IonicContact OD1-CZ 2.74Å; D204-R241 VanDerWaalsContact OD1-CZ 3.31Å; D204-R241 IonicContact OD1-NH1 2.88Å; D204-R241 PolarHBondContact OD1-NH1 3.08Å; D204-R241 IonicContact OD1-NH2 3.56Å; D204-R241 PolarHBondContact OD1-NH2 2.8Å
205	C	93.5	Very high	92.9	Very high	42 Å²	42	47 Å²	47	28%	0.284	24%	0.243	S	C	.	.	H	α-helix	trans	-60.6	-48.9	174.4	177.3	0	0	0	0	112	C154 T201 K202 L203 Y207 N208 I209	C154-C205 WeakPolarHBondContact CA-SG 3.14Å; C154-C205 HydrophobicContact CB-CB 3.64Å; C154-C205 WeakPolarHBondContact CB-SG 3.31Å; C154-C205 WeakPolarHBondContact SG-CB 3.48Å; C154-C205 CovalentContact SG-SG 2.04Å; C154-C205 PolarHBondContact SG-SG 2.87Å; T201-C205 WeakPolarHBondContact O-CB 3.35Å; T201-C205 PolarHBondContact O-N 3.26Å; K202-C205 WeakPolarHBondContact O-CB 3.48Å; K202-C205 PolarHBondContact O-N 3.34Å; L203-C205 VanDerWaalsContact C-N 3.35Å; L203-C205 PolarHBondContact O-N 3.29Å; C205-Y207 VanDerWaalsContact C-N 3.35Å; C205-Y207 PolarHBondContact O-N 3.46Å; C205-N208 PolarHBondContact O-N 2.87Å; C205-I209 WeakPolarHBondContact O-CG1 3.32Å; C205-I209 PolarHBondContact O-N 2.82Å; C205-I209 VanDerWaalsContact O-N 3.14Å
206	L	94.3	Very high	93.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-42.4	178.3	-73	174.6	0	0	0	112	Y64 A151 C154 K202 L203 N208 I209 L210 M223 F226	Y64-L206 HydrophobicContact CD1-CD2 4.08Å; Y64-L206 HydrophobicContact CE1-CD2 4.37Å; A151-L206 HydrophobicContact CB-CD2 3.71Å; C154-L206 HydrophobicContact CB-CD2 4.15Å; C154-L206 HydrophobicContact CB-CG 4.14Å; K202-L206 HydrophobicContact CG-CD1 4Å; K202-L206 HydrophobicContact CG-CG 4.36Å; K202-L206 WeakPolarHBondContact O-CG 3.05Å; K202-L206 PolarHBondContact O-N 3.08Å; L203-L206 PolarHBondContact O-N 3.42Å; L206-N208 VanDerWaalsContact C-N 3.33Å; L206-N208 PolarHBondContact O-N 3.13Å; L206-I209 PolarHBondContact O-N 3.45Å; L206-L210 HydrophobicContact CB-CD1 4.5Å; L206-L210 WeakPolarHBondContact O-CB 3.39Å; L206-L210 VanDerWaalsContact O-CG 3.23Å; L206-L210 WeakPolarHBondContact O-CG 3.5Å; L206-L210 PolarHBondContact O-N 3.34Å; L206-M223 HydrophobicContact CB-SD 4.08Å; L206-F226 HydrophobicContact CD1-CD2 3.42Å; L206-F226 VanDerWaalsContact CD1-CD2 3.42Å; L206-F226 HydrophobicContact CD1-CE2 3.54Å; L206-F226 HydrophobicContact CD1-CG 4.22Å; L206-F226 HydrophobicContact CD1-CZ 4.42Å
207	Y	96.5	Very high	93.8	Very high	10 Å²	10	47.6 Å²	47.6	4%	0.039	25%	0.249	C	C	.	.	H	α-helix	trans	-57.3	-48.3	175.9	179.4	-94.3	0	0	0	111	L203 D204 C205 I209 L210 H211 M223 Y238 R241 L242	L203-Y207 WeakPolarHBondContact O-CB 3.3Å; L203-Y207 PolarHBondContact O-N 2.95Å; D204-Y207 PolarHBondContact O-N 3.2Å; C205-Y207 VanDerWaalsContact C-N 3.35Å; C205-Y207 PolarHBondContact O-N 3.46Å; Y207-I209 VanDerWaalsContact C-N 3.26Å; Y207-I209 PolarHBondContact O-N 2.88Å; Y207-L210 PolarHBondContact O-N 3.43Å; Y207-L210 VanDerWaalsContact O-N 3.16Å; Y207-H211 HydrophobicContact CD2-CB 4.43Å; Y207-H211 HydrophobicContact CE1-CB 4.11Å; Y207-H211 AromaticContact CE1-CG 3.9Å; Y207-H211 HydrophobicContact CE2-CB 3.98Å; Y207-H211 WeakPolarHBondContact O-CB 3.29Å; Y207-H211 PolarHBondContact O-N 3.19Å; Y207-H211 PolarHBondContact O-ND1 3.48Å; Y207-M223 HydrophobicContact CD2-CE 4.48Å; Y207-Y238 HydrophobicContact CD2-CD2 4.27Å; Y207-Y238 HydrophobicContact CD2-CG 4.43Å; Y207-Y238 HydrophobicContact CE2-CD2 4.32Å; Y207-R241 HydrophobicContact CE1-CB 4.16Å; Y207-R241 HydrophobicContact CE2-CB 4.38Å; Y207-R241 WeakPolarHBondContact OH-CB 3.45Å; Y207-R241 PolarHBondContact OH-O 3.17Å; Y207-L242 HydrophobicContact CE2-CB 4.2Å; Y207-L242 WeakPolarHBondContact OH-CA 3.39Å; Y207-L242 PolarHBondContact OH-N 3.42Å
208	N	95.1	Very high	94.1	Very high	99 Å²	99	43 Å²	43	53%	0.529	23%	0.228	S	C	.	.	H	α-helix	trans	-62.3	-31.9	-178.9	-71.4	-18.2	0	0	0	113.2	D204 C205 L206 H211	D204-N208 VanDerWaalsContact O-CG 3.28Å; D204-N208 PolarHBondContact O-N 3.29Å; D204-N208 PolarHBondContact O-ND2 3.48Å; C205-N208 PolarHBondContact O-N 2.87Å; L206-N208 VanDerWaalsContact C-N 3.33Å; L206-N208 PolarHBondContact O-N 3.13Å; N208-H211 WeakPolarHBondContact CA-ND1 3.48Å; N208-H211 PolarHBondContact O-CE1 2.98Å; N208-H211 VanDerWaalsContact O-CE1 3.26Å; N208-H211 PolarHBondContact O-ND1 3.3Å
209	I	94.5	Very high	94.6	Very high	27 Å²	27	41.2 Å²	41.2	14%	0.138	22%	0.216	C	C	.	.	H	α-helix	trans	-73.9	-42.6	174.9	-67.9	166.9	0	0	0	111.3	Q147 L150 C154 C205 L206 Y207	Q147-I209 HydrophobicContact CB-CG2 3.8Å; Q147-I209 HydrophobicContact CG-CG2 4.15Å; L150-I209 HydrophobicContact CB-CD1 3.8Å; L150-I209 HydrophobicContact CB-CG1 4.25Å; L150-I209 HydrophobicContact CB-CG2 4.13Å; L150-I209 HydrophobicContact CD1-CG2 4.49Å; L150-I209 WeakPolarHBondContact O-CD1 3.41Å; C154-I209 WeakPolarHBondContact SG-CD1 3.46Å; C205-I209 WeakPolarHBondContact O-CG1 3.32Å; C205-I209 PolarHBondContact O-N 2.82Å; C205-I209 VanDerWaalsContact O-N 3.14Å; L206-I209 PolarHBondContact O-N 3.45Å; Y207-I209 VanDerWaalsContact C-N 3.26Å; Y207-I209 PolarHBondContact O-N 2.88Å
210	L	96.5	Very high	95	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-90.8	-33.5	-165	-64.2	171.2	0	0	0	114.1	Y64 L144 Q147 L206 Y207 N212 E213 C214 V219 I222	Y64-L210 HydrophobicContact CE1-CD1 4.24Å; Y64-L210 HydrophobicContact CE1-CD2 4.12Å; L144-L210 HydrophobicContact CD2-CD2 4.35Å; Q147-L210 HydrophobicContact CB-CD2 4.06Å; Q147-L210 HydrophobicContact CG-CD2 4.29Å; L206-L210 HydrophobicContact CB-CD1 4.5Å; L206-L210 WeakPolarHBondContact O-CB 3.39Å; L206-L210 VanDerWaalsContact O-CG 3.23Å; L206-L210 WeakPolarHBondContact O-CG 3.5Å; L206-L210 PolarHBondContact O-N 3.34Å; Y207-L210 PolarHBondContact O-N 3.43Å; Y207-L210 VanDerWaalsContact O-N 3.16Å; L210-N212 VanDerWaalsContact C-N 3.3Å; L210-N212 PolarHBondContact O-N 3.33Å; L210-E213 PolarHBondContact O-N 3.17Å; L210-E213 VanDerWaalsContact O-N 3.17Å; L210-C214 WeakPolarHBondContact O-CB 3.5Å; L210-C214 PolarHBondContact O-N 3.3Å; L210-V219 HydrophobicContact CB-CG2 4.11Å; L210-I222 HydrophobicContact CD1-CB 3.88Å; L210-I222 HydrophobicContact CD1-CG1 4.06Å; L210-I222 HydrophobicContact CD1-CG2 3.82Å
211	H	95.7	Very high	95.3	Very high	34 Å²	34	38.3 Å²	38.3	16%	0.157	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-32.5	-166.7	70.9	-71.9	0	0	0	114.6	Y207 N208 H245	Y207-H211 HydrophobicContact CD2-CB 4.43Å; Y207-H211 HydrophobicContact CE1-CB 4.11Å; Y207-H211 AromaticContact CE1-CG 3.9Å; Y207-H211 HydrophobicContact CE2-CB 3.98Å; Y207-H211 WeakPolarHBondContact O-CB 3.29Å; Y207-H211 PolarHBondContact O-N 3.19Å; Y207-H211 PolarHBondContact O-ND1 3.48Å; N208-H211 WeakPolarHBondContact CA-ND1 3.48Å; N208-H211 PolarHBondContact O-CE1 2.98Å; N208-H211 VanDerWaalsContact O-CE1 3.26Å; N208-H211 PolarHBondContact O-ND1 3.3Å; H211-H245 AromaticContact CD2-ND1 3.94Å; H211-H245 PolarHBondContact O-NE2 3.03Å
212	N	93.1	Very high	95.5	Very high	97 Å²	97	35.2 Å²	35.2	52%	0.519	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-25.2	177.8	-66.2	-34	0	0	0	113.1	L210 H245	L210-N212 VanDerWaalsContact C-N 3.3Å; L210-N212 PolarHBondContact O-N 3.33Å; N212-H245 PolarHBondContact OD1-CE1 3.2Å; N212-H245 PolarHBondContact OD1-NE2 3.13Å
213	E	94.4	Very high	95.8	Very high	115 Å²	115	33.9 Å²	33.9	54%	0.537	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-17.7	-167.6	-60.8	-62.2	145.5	0	0	113.1	C143 Q147 L210	C143-E213 VanDerWaalsContact CB-O 3.26Å; C143-E213 WeakPolarHBondContact CB-O 2.83Å; Q147-E213 HydrophobicContact CG-CB 4.14Å; L210-E213 PolarHBondContact O-N 3.17Å; L210-E213 VanDerWaalsContact O-N 3.17Å
214	C	96.7	Very high	96	Very high	11 Å²	11	35.5 Å²	35.5	7%	0.074	19%	0.187	C	C	.	.	S	Bend	trans	-124.6	148.3	-176.6	-81.5	0	0	0	0	111.9	C143 L210 A218 V219	C143-C214 HydrophobicContact CB-CB 4.02Å; C143-C214 WeakPolarHBondContact CB-SG 3.21Å; C143-C214 WeakPolarHBondContact SG-CA 3.28Å; C143-C214 WeakPolarHBondContact SG-CB 3.4Å; C143-C214 CovalentContact SG-SG 2.05Å; C143-C214 PolarHBondContact SG-SG 3.18Å; L210-C214 WeakPolarHBondContact O-CB 3.5Å; L210-C214 PolarHBondContact O-N 3.3Å; C214-A218 HydrophobicContact CB-CB 4.25Å; C214-V219 HydrophobicContact CB-CG2 3.99Å
215	P	96.1	Very high	96.1	Very high	54 Å²	54	33.2 Å²	33.2	35%	0.351	17%	0.174	S	C	.	.			trans	-65	154.1	173.4	28	-33	0	0	0	111.4	H139 N217 A218 V219	H139-P215 VanDerWaalsContact CE1-CG 3.43Å; H139-P215 WeakPolarHBondContact CE1-CG 3.16Å; H139-P215 WeakPolarHBondContact ND1-CG 3.42Å; P215-N217 VanDerWaalsContact C-N 3.27Å; P215-N217 WeakPolarHBondContact CB-OD1 3.49Å; P215-N217 WeakPolarHBondContact CG-OD1 3.44Å; P215-N217 PolarHBondContact O-N 3.46Å; P215-N217 VanDerWaalsContact O-N 3.15Å; P215-A218 HydrophobicContact CG-CB 4.05Å; P215-A218 WeakPolarHBondContact O-CB 3.23Å; P215-A218 PolarHBondContact O-N 3.28Å; P215-V219 WeakPolarHBondContact O-CG2 3.22Å; P215-V219 PolarHBondContact O-N 3.49Å
216	S	96.6	Very high	96.1	Very high	33 Å²	33	31.7 Å²	31.7	23%	0.231	16%	0.163	C	C	.	.	H	α-helix	trans	-58.4	-32.6	-171.4	62.1	0	0	0	0	114.5	V219 R220	S216-V219 PolarHBondContact O-N 3.07Å; S216-R220 WeakPolarHBondContact O-CB 3.4Å; S216-R220 VanDerWaalsContact O-CG 3.28Å; S216-R220 WeakPolarHBondContact O-CG 3.13Å; S216-R220 PolarHBondContact O-N 3.35Å
217	N	97.4	Very high	96.2	Very high	50 Å²	50	35 Å²	35	27%	0.267	18%	0.177	S	C	.	.	H	α-helix	trans	-68	-39.5	175.4	60.6	-17.8	0	0	0	112.5	I135 H139 P215 L221	I135-N217 HydrophobicContact CD1-CB 4.49Å; I135-N217 HydrophobicContact CG2-CB 4.24Å; H139-N217 PolarHBondContact NE2-ND2 3.24Å; P215-N217 VanDerWaalsContact C-N 3.27Å; P215-N217 WeakPolarHBondContact CB-OD1 3.49Å; P215-N217 WeakPolarHBondContact CG-OD1 3.44Å; P215-N217 PolarHBondContact O-N 3.46Å; P215-N217 VanDerWaalsContact O-N 3.15Å; N217-L221 WeakPolarHBondContact O-CB 3.29Å; N217-L221 PolarHBondContact O-N 2.96Å
218	A	97.5	Very high	96.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66.6	-44.1	173.1	0	0	0	0	0	110.7	H139 L144 C214 P215 R220 L221 I222	H139-A218 HydrophobicContact CB-CB 3.97Å; L144-A218 HydrophobicContact CD2-CB 4.43Å; C214-A218 HydrophobicContact CB-CB 4.25Å; P215-A218 HydrophobicContact CG-CB 4.05Å; P215-A218 WeakPolarHBondContact O-CB 3.23Å; P215-A218 PolarHBondContact O-N 3.28Å; A218-R220 PolarHBondContact O-N 3.18Å; A218-L221 WeakPolarHBondContact O-CB 3.47Å; A218-L221 PolarHBondContact O-N 3.32Å; A218-I222 WeakPolarHBondContact O-CG1 3.36Å; A218-I222 PolarHBondContact O-N 2.04Å; A218-I222 VanDerWaalsContact O-N 3.12Å
219	V	97.7	Very high	96	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-56.8	-52.6	174.7	-179.9	0	0	0	0	110.2	L210 C214 P215 S216 L221 I222 M223 L242	L210-V219 HydrophobicContact CB-CG2 4.11Å; C214-V219 HydrophobicContact CB-CG2 3.99Å; P215-V219 WeakPolarHBondContact O-CG2 3.22Å; P215-V219 PolarHBondContact O-N 3.49Å; S216-V219 PolarHBondContact O-N 3.07Å; V219-L221 VanDerWaalsContact C-N 3.3Å; V219-L221 PolarHBondContact O-N 3.5Å; V219-I222 PolarHBondContact O-N 3.38Å; V219-M223 HydrophobicContact CG1-CG 3.96Å; V219-M223 VanDerWaalsContact O-CB 3.3Å; V219-M223 WeakPolarHBondContact O-CB 3.49Å; V219-M223 WeakPolarHBondContact O-CG 3Å; V219-M223 PolarHBondContact O-N 2.74Å; V219-L242 HydrophobicContact CB-CD2 4.4Å; V219-L242 HydrophobicContact CG1-CD1 4.27Å; V219-L242 HydrophobicContact CG1-CD2 4.15Å
220	R	98	Very high	95.9	Very high	86 Å²	86	33.3 Å²	33.3	33%	0.325	17%	0.167	S	C	.	.	H	α-helix	trans	-58.3	-40.2	178.8	-75.1	174.8	-179.3	143.1	-1.4	112.6	S216 A218 N224 Y238 E239 L242	S216-R220 WeakPolarHBondContact O-CB 3.4Å; S216-R220 VanDerWaalsContact O-CG 3.28Å; S216-R220 WeakPolarHBondContact O-CG 3.13Å; S216-R220 PolarHBondContact O-N 3.35Å; A218-R220 PolarHBondContact O-N 3.18Å; R220-N224 WeakPolarHBondContact O-CB 3.48Å; R220-N224 PolarHBondContact O-N 2.98Å; R220-N224 PolarHBondContact O-ND2 3.02Å; R220-N224 VanDerWaalsContact O-ND2 3.16Å; R220-Y238 WeakPolarHBondContact CA-OH 3.29Å; R220-Y238 HydrophobicContact CG-CE2 4.11Å; R220-Y238 PolarHBondContact O-OH 3.3Å; R220-E239 IonicContact CZ-OE1 3.22Å; R220-E239 IonicContact NE-OE1 3.27Å; R220-E239 PolarHBondContact NE-OE1 2.68Å; R220-E239 IonicContact NE-OE2 3.4Å; R220-E239 PolarHBondContact NE-OE2 3.13Å; R220-E239 IonicContact NH2-OE1 2.69Å; R220-E239 PolarHBondContact NH2-OE1 3.05Å; R220-L242 HydrophobicContact CG-CD2 3.86Å
221	L	97.7	Very high	95.6	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	17%	0.172	C	C	.	.	H	α-helix	trans	-57.8	-54.2	177.1	178.7	71.2	0	0	0	111.5	Y126 I127 N132 I135 L136 N217 A218 V219 Y225	Y126-L221 HydrophobicContact CE1-CD1 4.03Å; Y126-L221 WeakPolarHBondContact CE1-O 3.3Å; I127-L221 HydrophobicContact CG1-CD1 4.35Å; N132-L221 HydrophobicContact CB-CD1 3.56Å; I135-L221 HydrophobicContact CB-CD2 4.23Å; I135-L221 HydrophobicContact CG2-CB 4.32Å; I135-L221 HydrophobicContact CG2-CD2 3.94Å; L136-L221 HydrophobicContact CB-CD2 3.84Å; L136-L221 HydrophobicContact CD1-CD2 3.96Å; N217-L221 WeakPolarHBondContact O-CB 3.29Å; N217-L221 PolarHBondContact O-N 2.96Å; A218-L221 WeakPolarHBondContact O-CB 3.47Å; A218-L221 PolarHBondContact O-N 3.32Å; V219-L221 VanDerWaalsContact C-N 3.3Å; V219-L221 PolarHBondContact O-N 3.5Å; L221-Y225 PolarHBondContact O-N 3.41Å; L221-Y225 VanDerWaalsContact O-N 3.15Å
222	I	96.4	Very high	95.4	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.1	-45.3	-177.8	-52.3	-64.4	0	0	0	110.5	Y64 F66 L144 L210 A218 V219 Y225 F226	Y64-I222 HydrophobicContact CD1-CG2 3.82Å; Y64-I222 HydrophobicContact CE1-CD1 4.5Å; Y64-I222 HydrophobicContact CE1-CG2 4.11Å; F66-I222 HydrophobicContact CE1-CD1 4.38Å; F66-I222 HydrophobicContact CE2-CD1 4.3Å; F66-I222 HydrophobicContact CZ-CD1 3.51Å; F66-I222 HydrophobicContact CZ-CG2 4.46Å; L144-I222 HydrophobicContact CD1-CD1 4.19Å; L144-I222 HydrophobicContact CD2-CD1 3.76Å; L144-I222 HydrophobicContact CD2-CG1 3.73Å; L210-I222 HydrophobicContact CD1-CB 3.88Å; L210-I222 HydrophobicContact CD1-CG1 4.06Å; L210-I222 HydrophobicContact CD1-CG2 3.82Å; A218-I222 WeakPolarHBondContact O-CG1 3.36Å; A218-I222 PolarHBondContact O-N 2.04Å; A218-I222 VanDerWaalsContact O-N 3.12Å; V219-I222 PolarHBondContact O-N 3.38Å; I222-Y225 PolarHBondContact O-N 3.43Å; I222-F226 HydrophobicContact CG2-CD2 4.1Å; I222-F226 HydrophobicContact CG2-CE2 3.93Å; I222-F226 WeakPolarHBondContact O-CD2 3.04Å; I222-F226 PolarHBondContact O-N 3.44Å
223	M	96.8	Very high	95.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.1	-41.2	-176.2	-66.7	-56.1	-66.3	0	0	112.3	L203 L206 Y207 V219 F226 K227 F236 Y238	L203-M223 HydrophobicContact CB-CE 4.14Å; L203-M223 HydrophobicContact CD2-CE 3.64Å; L203-M223 HydrophobicContact CD2-SD 4.25Å; L203-M223 WeakPolarHBondContact O-CE 3.48Å; L206-M223 HydrophobicContact CB-SD 4.08Å; Y207-M223 HydrophobicContact CD2-CE 4.48Å; V219-M223 HydrophobicContact CG1-CG 3.96Å; V219-M223 VanDerWaalsContact O-CB 3.3Å; V219-M223 WeakPolarHBondContact O-CB 3.49Å; V219-M223 WeakPolarHBondContact O-CG 3Å; V219-M223 PolarHBondContact O-N 2.74Å; M223-F226 PolarHBondContact O-N 2.99Å; M223-K227 WeakPolarHBondContact O-CG 3.06Å; M223-K227 PolarHBondContact O-N 2.77Å; M223-F236 HydrophobicContact CE-CD1 4.31Å; M223-F236 HydrophobicContact CE-CE1 3.47Å; M223-F236 VanDerWaalsContact CE-CE1 3.47Å; M223-F236 HydrophobicContact CE-CZ 4.2Å; M223-Y238 HydrophobicContact CB-CD1 3.87Å; M223-Y238 HydrophobicContact CB-CD2 4.27Å; M223-Y238 HydrophobicContact CB-CE1 3.44Å; M223-Y238 VanDerWaalsContact CB-CE1 3.44Å; M223-Y238 HydrophobicContact CB-CE2 3.89Å; M223-Y238 HydrophobicContact CB-CG 4.27Å; M223-Y238 VanDerWaalsContact CB-CZ 3.46Å; M223-Y238 HydrophobicContact CE-CD1 4.05Å; M223-Y238 HydrophobicContact CE-CG 4.07Å; M223-Y238 HydrophobicContact CG-CD1 4.44Å; M223-Y238 HydrophobicContact CG-CD2 4.25Å; M223-Y238 HydrophobicContact CG-CE1 4.38Å; M223-Y238 HydrophobicContact CG-CE2 4.2Å; M223-Y238 HydrophobicContact CG-CG 4.38Å
224	N	97.1	Very high	95.3	Very high	35 Å²	35	32.8 Å²	32.8	19%	0.187	19%	0.191	C	C	.	.	H	α-helix	trans	-70.7	-36.2	177.8	-71.1	-25.3	0	0	0	112.3	Y126 R220 F226 K227 E228 Y238	Y126-N224 HydrophobicContact CD1-CB 4.39Å; Y126-N224 HydrophobicContact CE1-CB 3.64Å; Y126-N224 HydrophobicContact CE2-CB 3.91Å; Y126-N224 WeakPolarHBondContact OH-CB 3.43Å; Y126-N224 PolarHBondContact OH-ND2 3.24Å; R220-N224 WeakPolarHBondContact O-CB 3.48Å; R220-N224 PolarHBondContact O-N 2.98Å; R220-N224 PolarHBondContact O-ND2 3.02Å; R220-N224 VanDerWaalsContact O-ND2 3.16Å; N224-F226 VanDerWaalsContact C-N 3.31Å; N224-F226 PolarHBondContact O-N 3.34Å; N224-K227 WeakPolarHBondContact O-CB 3.39Å; N224-K227 PolarHBondContact O-N 2.91Å; N224-K227 VanDerWaalsContact O-N 3.13Å; N224-K227 PolarHBondContact OD1-NZ 3.46Å; N224-E228 WeakPolarHBondContact O-CG 3.37Å; N224-E228 PolarHBondContact O-N 3.32Å; N224-Y238 PolarHBondContact ND2-OH 2.79Å; N224-Y238 PolarHBondContact OD1-OH 3.24Å
225	Y	96.5	Very high	95.1	Very high	3 Å²	3	37.5 Å²	37.5	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-53.8	-48.7	172.5	170	-90.1	0	0	0	111.7	F66 G67 A123 I127 L221 I222 E228	F66-Y225 AromaticContact CD1-CD1 3.53Å; F66-Y225 HydrophobicContact CD1-CD1 3.53Å; F66-Y225 HydrophobicContact CD1-CD2 4.13Å; F66-Y225 AromaticContact CD1-CE1 3.43Å; F66-Y225 HydrophobicContact CD1-CE1 3.43Å; F66-Y225 VanDerWaalsContact CD1-CE1 3.43Å; F66-Y225 AromaticContact CD1-CE2 3.99Å; F66-Y225 HydrophobicContact CD1-CE2 3.99Å; F66-Y225 AromaticContact CD1-CG 3.9Å; F66-Y225 HydrophobicContact CD1-CG 3.9Å; F66-Y225 AromaticContact CD1-CZ 3.66Å; F66-Y225 AromaticContact CE1-CD1 3.57Å; F66-Y225 HydrophobicContact CE1-CD1 3.57Å; F66-Y225 HydrophobicContact CE1-CD2 4.49Å; F66-Y225 AromaticContact CE1-CE1 3.95Å; F66-Y225 HydrophobicContact CE1-CE1 3.95Å; F66-Y225 AromaticContact CE1-CG 3.89Å; F66-Y225 HydrophobicContact CE1-CG 3.89Å; G67-Y225 PolarHBondContact N-OH 2.89Å; A123-Y225 HydrophobicContact CB-CD2 3.77Å; A123-Y225 HydrophobicContact CB-CE2 3.54Å; A123-Y225 HydrophobicContact CB-CG 4.42Å; A123-Y225 WeakPolarHBondContact CB-O 3.06Å; A123-Y225 VanDerWaalsContact O-CD2 3.28Å; A123-Y225 WeakPolarHBondContact O-CD2 3.46Å; I127-Y225 HydrophobicContact CB-CD2 3.66Å; I127-Y225 HydrophobicContact CB-CE2 4.34Å; I127-Y225 HydrophobicContact CB-CG 4.47Å; I127-Y225 HydrophobicContact CD1-CD2 4.07Å; I127-Y225 HydrophobicContact CD1-CG 4.33Å; I127-Y225 HydrophobicContact CG1-CD2 4.47Å; I127-Y225 HydrophobicContact CG2-CD2 3.56Å; I127-Y225 HydrophobicContact CG2-CE2 3.72Å; L221-Y225 PolarHBondContact O-N 3.41Å; L221-Y225 VanDerWaalsContact O-N 3.15Å; I222-Y225 PolarHBondContact O-N 3.43Å; Y225-E228 PolarHBondContact O-N 2.89Å
226	F	94.5	Very high	95.1	Very high	9 Å²	9	35.7 Å²	35.7	4%	0.039	21%	0.206	C	C	.	.	H	α-helix	trans	-73.7	-27	179.3	-73.7	-64.5	0	0	0	113	Y64 F66 L203 L206 I222 M223 N224 E228 T229	Y64-F226 WeakPolarHBondContact O-CZ 3.33Å; F66-F226 HydrophobicContact CD1-CZ 4.46Å; F66-F226 HydrophobicContact CE1-CE2 4.1Å; F66-F226 HydrophobicContact CE1-CZ 4.2Å; L203-F226 HydrophobicContact CD2-CB 3.51Å; L203-F226 HydrophobicContact CG-CB 4.16Å; L206-F226 HydrophobicContact CD1-CD2 3.42Å; L206-F226 VanDerWaalsContact CD1-CD2 3.42Å; L206-F226 HydrophobicContact CD1-CE2 3.54Å; L206-F226 HydrophobicContact CD1-CG 4.22Å; L206-F226 HydrophobicContact CD1-CZ 4.42Å; I222-F226 HydrophobicContact CG2-CD2 4.1Å; I222-F226 HydrophobicContact CG2-CE2 3.93Å; I222-F226 WeakPolarHBondContact O-CD2 3.04Å; I222-F226 PolarHBondContact O-N 3.44Å; M223-F226 PolarHBondContact O-N 2.99Å; N224-F226 VanDerWaalsContact C-N 3.31Å; N224-F226 PolarHBondContact O-N 3.34Å; F226-E228 VanDerWaalsContact C-N 3.3Å; F226-E228 PolarHBondContact O-N 3.15Å; F226-T229 PolarHBondContact O-N 3.12Å; F226-T229 VanDerWaalsContact O-N 3.08Å; F226-T229 PolarHBondContact O-OG1 3.08Å
227	K	95.4	Very high	95	Very high	71 Å²	71	39 Å²	39	31%	0.309	22%	0.221	S	C	.	.	H	α-helix	trans	-62.3	-36.9	171	-78.4	171.3	63.9	-167.6	0	112.5	L203 M223 N224 T229 L230 Y238	L203-K227 HydrophobicContact CD1-CG 4.42Å; L203-K227 HydrophobicContact CD2-CG 4.49Å; M223-K227 WeakPolarHBondContact O-CG 3.06Å; M223-K227 PolarHBondContact O-N 2.77Å; N224-K227 WeakPolarHBondContact O-CB 3.39Å; N224-K227 PolarHBondContact O-N 2.91Å; N224-K227 VanDerWaalsContact O-N 3.13Å; N224-K227 PolarHBondContact OD1-NZ 3.46Å; K227-T229 PolarHBondContact O-N 2.98Å; K227-L230 HydrophobicContact CB-CD1 4.39Å; K227-L230 HydrophobicContact CG-CD1 4.29Å; K227-L230 WeakPolarHBondContact O-CB 3.19Å; K227-L230 WeakPolarHBondContact O-CG 3.28Å; K227-L230 PolarHBondContact O-N 2.6Å; K227-L230 VanDerWaalsContact O-N 3.12Å; K227-Y238 HydrophobicContact CD-CD1 3.96Å; K227-Y238 HydrophobicContact CD-CE1 3.55Å
228	E	95	Very high	94.9	Very high	75 Å²	75	36.7 Å²	36.7	35%	0.35	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.3	174.6	-65.4	-54	142.5	0	0	113.1	K122 A123 Y126 N224 Y225 F226	K122-E228 HydrophobicContact CB-CB 4.15Å; A123-E228 HydrophobicContact CB-CB 3.85Å; Y126-E228 HydrophobicContact CG-CG 4.44Å; N224-E228 WeakPolarHBondContact O-CG 3.37Å; N224-E228 PolarHBondContact O-N 3.32Å; Y225-E228 PolarHBondContact O-N 2.89Å; F226-E228 VanDerWaalsContact C-N 3.3Å; F226-E228 PolarHBondContact O-N 3.15Å
229	T	91.9	Very high	94.8	Very high	7 Å²	7	39.6 Å²	39.6	4%	0.043	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-7.4	176	70.9	0	0	0	0	114.1	F120 A123 L199 F226 K227	F120-T229 HydrophobicContact CD1-CG2 4.47Å; A123-T229 HydrophobicContact CB-CG2 3.54Å; L199-T229 WeakPolarHBondContact CD1-O 3Å; F226-T229 PolarHBondContact O-N 3.12Å; F226-T229 VanDerWaalsContact O-N 3.08Å; F226-T229 PolarHBondContact O-OG1 3.08Å; K227-T229 PolarHBondContact O-N 2.98Å
230	L	92.9	Very high	94.7	Very high	17 Å²	17	43.1 Å²	43.1	9%	0.089	24%	0.244	C	C	.	.	S	Bend	trans	-65	142.8	178.9	-66.7	172.2	0	0	0	110.4	L199 L203 K227 C234 F236	L199-L230 HydrophobicContact CB-CD2 3.62Å; L199-L230 HydrophobicContact CD1-CD2 4.13Å; L203-L230 HydrophobicContact CD1-CD1 4.16Å; L203-L230 HydrophobicContact CD1-CD2 3.93Å; L203-L230 HydrophobicContact CD1-CG 4.3Å; K227-L230 HydrophobicContact CB-CD1 4.39Å; K227-L230 HydrophobicContact CG-CD1 4.29Å; K227-L230 WeakPolarHBondContact O-CB 3.19Å; K227-L230 WeakPolarHBondContact O-CG 3.28Å; K227-L230 PolarHBondContact O-N 2.6Å; K227-L230 VanDerWaalsContact O-N 3.12Å; L230-C234 HydrophobicContact CB-CB 4.23Å; L230-F236 HydrophobicContact CD1-CB 3.87Å
231	P	91	Very high	94.6	Very high	17 Å²	17	43.5 Å²	43.5	11%	0.11	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-65.5	157.4	173.9	25.8	-31.7	0	0	0	111.1	T192 C196 G233 C234	T192-P231 HydrophobicContact CG2-CB 3.57Å; T192-P231 HydrophobicContact CG2-CG 3.96Å; C196-P231 HydrophobicContact CB-CG 3.88Å; P231-G233 PolarHBondContact O-N 3.22Å; P231-C234 HydrophobicContact CG-CB 3.72Å; P231-C234 VanDerWaalsContact O-CB 3.23Å; P231-C234 WeakPolarHBondContact O-CB 3.15Å; P231-C234 PolarHBondContact O-N 2.65Å
232	D	90	Very high	94.5	Very high	117 Å²	117	43.4 Å²	43.4	63%	0.626	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	133.8	178.4	-61.9	-35.9	0	0	0	110.8	K122 C234	K122-D232 IonicContact NZ-OD1 3.03Å; D232-C234 VanDerWaalsContact C-N 3.26Å; D232-C234 PolarHBondContact O-N 3.02Å
233	G	91.2	Very high	94.4	Very high	84 Å²	84	45.4 Å²	45.4	87%	0.866	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	-8.2	-175.6	0	0	0	0	0	115.4	P231	P231-G233 PolarHBondContact O-N 3.22Å
234	C	94.1	Very high	94.3	Very high	17 Å²	17	52.1 Å²	52.1	12%	0.115	29%	0.288	C	S	.	.			trans	-90	122.4	173.6	-174.4	0	0	0	0	110.9	C196 L230 P231 D232	C196-C234 VanDerWaalsContact CA-SG 3.57Å; C196-C234 HydrophobicContact CB-CB 3.72Å; C196-C234 WeakPolarHBondContact CB-SG 3.39Å; C196-C234 WeakPolarHBondContact SG-CB 3.2Å; C196-C234 CovalentContact SG-SG 2.03Å; C196-C234 PolarHBondContact SG-SG 3.35Å; L230-C234 HydrophobicContact CB-CB 4.23Å; P231-C234 HydrophobicContact CG-CB 3.72Å; P231-C234 VanDerWaalsContact O-CB 3.23Å; P231-C234 WeakPolarHBondContact O-CB 3.15Å; P231-C234 PolarHBondContact O-N 2.65Å; D232-C234 VanDerWaalsContact C-N 3.26Å; D232-C234 PolarHBondContact O-N 3.02Å
235	T	94.4	Very high	94.1	Very high	111 Å²	111	52.5 Å²	52.5	68%	0.681	29%	0.289	S	S	*	.			trans	-117.9	148.1	-178.7	61.3	0	0	0	0	111.9
236	F	95.3	Very high	94	Very high	15 Å²	15	54.9 Å²	54.9	7%	0.066	30%	0.301	C	S	.	.			trans	-139.3	126.9	174.2	-176	-96.5	0	0	0	110.8	R200 L203 D204 M223 L230 Y238	R200-F236 HydrophobicContact CB-CD2 4.36Å; R200-F236 HydrophobicContact CG-CD2 4.13Å; L203-F236 HydrophobicContact CB-CD1 3.94Å; L203-F236 HydrophobicContact CB-CD2 4.08Å; L203-F236 HydrophobicContact CB-CE1 3.63Å; L203-F236 HydrophobicContact CB-CE2 3.78Å; L203-F236 HydrophobicContact CB-CG 4.15Å; L203-F236 HydrophobicContact CB-CZ 3.53Å; L203-F236 HydrophobicContact CD1-CB 3.86Å; L203-F236 HydrophobicContact CD1-CD1 3.83Å; L203-F236 HydrophobicContact CD1-CD2 4.17Å; L203-F236 HydrophobicContact CD1-CE1 4.39Å; L203-F236 HydrophobicContact CD1-CG 3.69Å; L203-F236 HydrophobicContact CD2-CD1 4.33Å; L203-F236 HydrophobicContact CD2-CE1 4.39Å; L203-F236 HydrophobicContact CG-CD1 4.28Å; L203-F236 HydrophobicContact CG-CE1 4.37Å; L203-F236 HydrophobicContact CG-CG 4.48Å; D204-F236 VanDerWaalsContact OD1-CE2 3.28Å; D204-F236 WeakPolarHBondContact OD1-CE2 3.35Å; D204-F236 VanDerWaalsContact OD1-CZ 3.24Å; D204-F236 WeakPolarHBondContact OD1-CZ 3.4Å; M223-F236 HydrophobicContact CE-CD1 4.31Å; M223-F236 HydrophobicContact CE-CE1 3.47Å; M223-F236 VanDerWaalsContact CE-CE1 3.47Å; M223-F236 HydrophobicContact CE-CZ 4.2Å; L230-F236 HydrophobicContact CD1-CB 3.87Å; F236-Y238 HydrophobicContact CD1-CD1 4.19Å; F236-Y238 HydrophobicContact CE1-CD1 4.2Å; F236-Y238 HydrophobicContact CE1-CG 4.43Å
237	N	94.5	Very high	93.9	Very high	103 Å²	103	60 Å²	60	55%	0.551	33%	0.325	S	S	*	.			trans	-113.2	115.8	178.8	-172.5	-3.5	0	0	0	110.7	E239 T240 R241	N237-E239 PolarHBondContact OD1-N 3.46Å; N237-E239 VanDerWaalsContact OD1-N 3.09Å; N237-T240 PolarHBondContact ND2-OG1 3.2Å; N237-R241 PolarHBondContact O-NH2 2.95Å
238	Y	95.9	Very high	93.7	Very high	1 Å²	1	59.9 Å²	59.9	0%	0.004	33%	0.334	C	S	.	.			trans	-116.8	-15.7	169.7	70.8	-86.2	0	0	0	112.7	Y207 R220 M223 N224 K227 F236 T240 R241 L242	Y207-Y238 HydrophobicContact CD2-CD2 4.27Å; Y207-Y238 HydrophobicContact CD2-CG 4.43Å; Y207-Y238 HydrophobicContact CE2-CD2 4.32Å; R220-Y238 WeakPolarHBondContact CA-OH 3.29Å; R220-Y238 HydrophobicContact CG-CE2 4.11Å; R220-Y238 PolarHBondContact O-OH 3.3Å; M223-Y238 HydrophobicContact CB-CD1 3.87Å; M223-Y238 HydrophobicContact CB-CD2 4.27Å; M223-Y238 HydrophobicContact CB-CE1 3.44Å; M223-Y238 VanDerWaalsContact CB-CE1 3.44Å; M223-Y238 HydrophobicContact CB-CE2 3.89Å; M223-Y238 HydrophobicContact CB-CG 4.27Å; M223-Y238 VanDerWaalsContact CB-CZ 3.46Å; M223-Y238 HydrophobicContact CE-CD1 4.05Å; M223-Y238 HydrophobicContact CE-CG 4.07Å; M223-Y238 HydrophobicContact CG-CD1 4.44Å; M223-Y238 HydrophobicContact CG-CD2 4.25Å; M223-Y238 HydrophobicContact CG-CE1 4.38Å; M223-Y238 HydrophobicContact CG-CE2 4.2Å; M223-Y238 HydrophobicContact CG-CG 4.38Å; N224-Y238 PolarHBondContact ND2-OH 2.79Å; N224-Y238 PolarHBondContact OD1-OH 3.24Å; K227-Y238 HydrophobicContact CD-CD1 3.96Å; K227-Y238 HydrophobicContact CD-CE1 3.55Å; F236-Y238 HydrophobicContact CD1-CD1 4.19Å; F236-Y238 HydrophobicContact CE1-CD1 4.2Å; F236-Y238 HydrophobicContact CE1-CG 4.43Å; Y238-T240 VanDerWaalsContact C-N 3.34Å; Y238-T240 PolarHBondContact O-N 2.94Å; Y238-R241 WeakPolarHBondContact O-CB 3.32Å; Y238-R241 PolarHBondContact O-N 2.9Å; Y238-L242 HydrophobicContact CD2-CB 4.35Å; Y238-L242 HydrophobicContact CD2-CD2 4.33Å; Y238-L242 HydrophobicContact CE2-CD2 4.03Å; Y238-L242 PolarHBondContact O-N 3.38Å
239	E	95.7	Very high	93.5	Very high	61 Å²	61	58.6 Å²	58.6	29%	0.285	33%	0.331	S	S	.	.	H	α-helix	trans	-64	-42.7	-168.7	-169	61.7	-152.7	0	0	110.7	R220 N237 R241 L242 S243	R220-E239 IonicContact CZ-OE1 3.22Å; R220-E239 IonicContact NE-OE1 3.27Å; R220-E239 PolarHBondContact NE-OE1 2.68Å; R220-E239 IonicContact NE-OE2 3.4Å; R220-E239 PolarHBondContact NE-OE2 3.13Å; R220-E239 IonicContact NH2-OE1 2.69Å; R220-E239 PolarHBondContact NH2-OE1 3.05Å; N237-E239 PolarHBondContact OD1-N 3.46Å; N237-E239 VanDerWaalsContact OD1-N 3.09Å; E239-R241 VanDerWaalsContact C-N 3.27Å; E239-R241 PolarHBondContact O-N 2.95Å; E239-L242 PolarHBondContact O-N 3.37Å; E239-L242 VanDerWaalsContact O-N 3.15Å; E239-S243 PolarHBondContact O-N 3.21Å; E239-S243 PolarHBondContact O-OG 3.1Å
240	T	94.5	Very high	93.3	Very high	75 Å²	75	63.9 Å²	63.9	46%	0.46	36%	0.355	S	S	.	.	H	α-helix	trans	-60.7	-35.8	175.4	-49.5	0	0	0	0	112.6	N237 Y238 K244	N237-T240 PolarHBondContact ND2-OG1 3.2Å; Y238-T240 VanDerWaalsContact C-N 3.34Å; Y238-T240 PolarHBondContact O-N 2.94Å; T240-K244 WeakPolarHBondContact O-CG 3.41Å; T240-K244 PolarHBondContact O-N 3.21Å
241	R	95.5	Very high	93.2	Very high	93 Å²	93	68.3 Å²	68.3	35%	0.351	38%	0.377	S	S	.	.	H	α-helix	trans	-70.6	-41.6	176.5	-69.5	-174.8	-79.2	178.9	-7.4	110.7	D204 Y207 N237 Y238 E239 H245	D204-R241 IonicContact OD1-CZ 2.74Å; D204-R241 VanDerWaalsContact OD1-CZ 3.31Å; D204-R241 IonicContact OD1-NH1 2.88Å; D204-R241 PolarHBondContact OD1-NH1 3.08Å; D204-R241 IonicContact OD1-NH2 3.56Å; D204-R241 PolarHBondContact OD1-NH2 2.8Å; Y207-R241 HydrophobicContact CE1-CB 4.16Å; Y207-R241 HydrophobicContact CE2-CB 4.38Å; Y207-R241 WeakPolarHBondContact OH-CB 3.45Å; Y207-R241 PolarHBondContact OH-O 3.17Å; N237-R241 PolarHBondContact O-NH2 2.95Å; Y238-R241 WeakPolarHBondContact O-CB 3.32Å; Y238-R241 PolarHBondContact O-N 2.9Å; E239-R241 VanDerWaalsContact C-N 3.27Å; E239-R241 PolarHBondContact O-N 2.95Å; R241-H245 WeakPolarHBondContact O-CB 3.45Å; R241-H245 PolarHBondContact O-N 3.43Å
242	L	95.6	Very high	92.9	Very high	1 Å²	1	70.7 Å²	70.7	1%	0.005	39%	0.391	C	S	.	.	H	α-helix	trans	-64.9	-45.3	178.7	-174.4	58.7	0	0	0	111.4	Y207 V219 R220 Y238 E239 K244 H245 L246	Y207-L242 HydrophobicContact CE2-CB 4.2Å; Y207-L242 WeakPolarHBondContact OH-CA 3.39Å; Y207-L242 PolarHBondContact OH-N 3.42Å; V219-L242 HydrophobicContact CB-CD2 4.4Å; V219-L242 HydrophobicContact CG1-CD1 4.27Å; V219-L242 HydrophobicContact CG1-CD2 4.15Å; R220-L242 HydrophobicContact CG-CD2 3.86Å; Y238-L242 HydrophobicContact CD2-CB 4.35Å; Y238-L242 HydrophobicContact CD2-CD2 4.33Å; Y238-L242 HydrophobicContact CE2-CD2 4.03Å; Y238-L242 PolarHBondContact O-N 3.38Å; E239-L242 PolarHBondContact O-N 3.37Å; E239-L242 VanDerWaalsContact O-N 3.15Å; L242-K244 PolarHBondContact O-N 3.17Å; L242-H245 WeakPolarHBondContact O-CB 3.27Å; L242-H245 PolarHBondContact O-N 3.3Å; L242-L246 HydrophobicContact CD1-CD1 4.46Å; L242-L246 HydrophobicContact CD1-CG 4.42Å; L242-L246 HydrophobicContact CG-CD1 4.13Å; L242-L246 VanDerWaalsContact O-CG 3.29Å; L242-L246 WeakPolarHBondContact O-CG 3.48Å; L242-L246 PolarHBondContact O-N 3.39Å
243	S	95.1	Very high	92.7	Very high	42 Å²	42	70.5 Å²	70.5	29%	0.294	39%	0.386	S	S	.	.	H	α-helix	trans	-57.5	-49.1	176.7	-62.5	0	0	0	0	112.1	E239 H245 L246 E247	E239-S243 PolarHBondContact O-N 3.21Å; E239-S243 PolarHBondContact O-OG 3.1Å; S243-H245 VanDerWaalsContact C-N 3.29Å; S243-H245 PolarHBondContact O-N 2.77Å; S243-L246 PolarHBondContact O-N 2.86Å; S243-E247 WeakPolarHBondContact O-CG 3.42Å; S243-E247 PolarHBondContact O-N 3.29Å
244	K	94.5	Very high	92.3	Very high	140 Å²	140	71 Å²	71	61%	0.609	37%	0.369	S	S	*	.	H	α-helix	trans	-60.2	-39.6	177	-72.8	180	178.2	-170.8	0	112.6	T240 L242 S248	T240-K244 WeakPolarHBondContact O-CG 3.41Å; T240-K244 PolarHBondContact O-N 3.21Å; L242-K244 PolarHBondContact O-N 3.17Å; K244-S248 WeakPolarHBondContact O-CB 3.47Å; K244-S248 PolarHBondContact O-N 2.95Å
245	H	93.6	Very high	91.8	Very high	44 Å²	44	74 Å²	74	20%	0.204	38%	0.383	C	S	.	.	H	α-helix	trans	-64.1	-44.9	176.4	177.8	68.6	0	0	0	111.4	H211 N212 R241 L242 S243 E247 S248 V249	H211-H245 AromaticContact CD2-ND1 3.94Å; H211-H245 PolarHBondContact O-NE2 3.03Å; N212-H245 PolarHBondContact OD1-CE1 3.2Å; N212-H245 PolarHBondContact OD1-NE2 3.13Å; R241-H245 WeakPolarHBondContact O-CB 3.45Å; R241-H245 PolarHBondContact O-N 3.43Å; L242-H245 WeakPolarHBondContact O-CB 3.27Å; L242-H245 PolarHBondContact O-N 3.3Å; S243-H245 VanDerWaalsContact C-N 3.29Å; S243-H245 PolarHBondContact O-N 2.77Å; H245-E247 PolarHBondContact O-N 3.24Å; H245-S248 WeakPolarHBondContact O-CB 3Å; H245-S248 PolarHBondContact O-N 2.76Å; H245-V249 WeakPolarHBondContact O-CG2 3.24Å; H245-V249 PolarHBondContact O-N 3.21Å
246	L	93.1	Very high	90.9	Very high	52 Å²	52	72.3 Å²	72.3	27%	0.272	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-41.4	178.2	-66.8	169.5	0	0	0	112.4	L242 S243 V249 Q250	L242-L246 HydrophobicContact CD1-CD1 4.46Å; L242-L246 HydrophobicContact CD1-CG 4.42Å; L242-L246 HydrophobicContact CG-CD1 4.13Å; L242-L246 VanDerWaalsContact O-CG 3.29Å; L242-L246 WeakPolarHBondContact O-CG 3.48Å; L242-L246 PolarHBondContact O-N 3.39Å; S243-L246 PolarHBondContact O-N 2.86Å; L246-V249 PolarHBondContact O-N 3.5Å; L246-Q250 WeakPolarHBondContact O-CB 3.43Å; L246-Q250 VanDerWaalsContact O-CG 3.3Å; L246-Q250 WeakPolarHBondContact O-CG 3.42Å; L246-Q250 PolarHBondContact O-N 3.48Å
247	E	92.9	Very high	90	Very high	116 Å²	116	76.1 Å²	76.1	54%	0.542	39%	0.391	S	S	.	.	H	α-helix	trans	-60.1	-45.6	173.3	-72.6	166.7	-169	0	0	111.1	S243 H245 V249 Q250 M251	S243-E247 WeakPolarHBondContact O-CG 3.42Å; S243-E247 PolarHBondContact O-N 3.29Å; H245-E247 PolarHBondContact O-N 3.24Å; E247-V249 PolarHBondContact O-N 3.38Å; E247-Q250 PolarHBondContact O-N 2.74Å; E247-M251 VanDerWaalsContact O-CG 3.31Å; E247-M251 WeakPolarHBondContact O-CG 3.33Å; E247-M251 PolarHBondContact O-N 2.98Å
248	S	92	Very high	89	Confident	69 Å²	69	75.9 Å²	75.9	48%	0.483	39%	0.39	S	S	.	.	H	α-helix	trans	-60.4	-44.3	176.5	-176.4	0	0	0	0	112.1	K244 H245 M251 T252	K244-S248 WeakPolarHBondContact O-CB 3.47Å; K244-S248 PolarHBondContact O-N 2.95Å; H245-S248 WeakPolarHBondContact O-CB 3Å; H245-S248 PolarHBondContact O-N 2.76Å; S248-M251 PolarHBondContact O-N 2.88Å; S248-T252 PolarHBondContact O-N 3.2Å; S248-T252 PolarHBondContact O-OG1 3.44Å
249	V	89.6	Confident	87.6	Confident	49 Å²	49	81 Å²	81	30%	0.297	41%	0.413	S	S	.	.	H	α-helix	trans	-65.2	-41.4	178.9	171.2	0	0	0	0	111.1	H245 L246 E247 T252 Q253	H245-V249 WeakPolarHBondContact O-CG2 3.24Å; H245-V249 PolarHBondContact O-N 3.21Å; L246-V249 PolarHBondContact O-N 3.5Å; E247-V249 PolarHBondContact O-N 3.38Å; V249-T252 PolarHBondContact O-N 3.16Å; V249-Q253 WeakPolarHBondContact O-CB 3.44Å; V249-Q253 VanDerWaalsContact O-CG 3.28Å; V249-Q253 WeakPolarHBondContact O-CG 3.48Å; V249-Q253 PolarHBondContact O-N 3.49Å
250	Q	88.5	Confident	85.8	Confident	117 Å²	117	82.1 Å²	82.1	55%	0.547	42%	0.421	S	S	.	.	H	α-helix	trans	-63.3	-43.6	176.2	-74.9	174.7	-1.9	0	0	111.8	L246 E247 Q253 L254	L246-Q250 WeakPolarHBondContact O-CB 3.43Å; L246-Q250 VanDerWaalsContact O-CG 3.3Å; L246-Q250 WeakPolarHBondContact O-CG 3.42Å; L246-Q250 PolarHBondContact O-N 3.48Å; E247-Q250 PolarHBondContact O-N 2.74Å; Q250-Q253 PolarHBondContact O-N 2.69Å; Q250-L254 WeakPolarHBondContact O-CG 3.45Å; Q250-L254 PolarHBondContact O-N 3.35Å
251	M	89.4	Confident	84	Confident	110 Å²	110	83.2 Å²	83.2	54%	0.542	42%	0.424	S	S	.	.	H	α-helix	trans	-62.9	-43.6	176.2	-71	-58	-60.7	0	0	111.8	E247 S248 Q253 L254 I255	E247-M251 VanDerWaalsContact O-CG 3.31Å; E247-M251 WeakPolarHBondContact O-CG 3.33Å; E247-M251 PolarHBondContact O-N 2.98Å; S248-M251 PolarHBondContact O-N 2.88Å; M251-Q253 VanDerWaalsContact C-N 3.32Å; M251-Q253 PolarHBondContact O-N 2.63Å; M251-L254 PolarHBondContact O-N 2.96Å; M251-L254 HydrophobicContact SD-CD1 4.26Å; M251-I255 VanDerWaalsContact O-CG1 3.28Å; M251-I255 WeakPolarHBondContact O-CG1 3.3Å; M251-I255 PolarHBondContact O-N 3.48Å
252	T	86.4	Confident	82.2	Confident	68 Å²	68	83.1 Å²	83.1	42%	0.417	43%	0.43	S	S	.	.	H	α-helix	trans	-63	-38	175.6	-55.2	0	0	0	0	111.9	S248 V249 N256	S248-T252 PolarHBondContact O-N 3.2Å; S248-T252 PolarHBondContact O-OG1 3.44Å; V249-T252 PolarHBondContact O-N 3.16Å; T252-N256 WeakPolarHBondContact O-CB 3.26Å; T252-N256 PolarHBondContact O-N 3.41Å; T252-N256 PolarHBondContact O-OD1 2.92Å
253	Q	85	Confident	79.9	Confident	112 Å²	112	88 Å²	88	52%	0.523	45%	0.452	S	S	.	.	H	α-helix	trans	-67.5	-38.2	175.6	-73.9	172.7	-5.1	0	0	112.4	V249 Q250 M251 N257	V249-Q253 WeakPolarHBondContact O-CB 3.44Å; V249-Q253 VanDerWaalsContact O-CG 3.28Å; V249-Q253 WeakPolarHBondContact O-CG 3.48Å; V249-Q253 PolarHBondContact O-N 3.49Å; Q250-Q253 PolarHBondContact O-N 2.69Å; M251-Q253 VanDerWaalsContact C-N 3.32Å; M251-Q253 PolarHBondContact O-N 2.63Å; Q253-N257 VanDerWaalsContact O-CB 3.3Å; Q253-N257 WeakPolarHBondContact O-CB 3.15Å; Q253-N257 PolarHBondContact O-N 3.17Å; Q253-N257 PolarHBondContact O-ND2 2.87Å; Q253-N257 VanDerWaalsContact O-ND2 3.12Å
254	L	83.7	Confident	77.5	Confident	96 Å²	96	95.7 Å²	95.7	50%	0.503	48%	0.475	S	S	.	.	H	α-helix	trans	-64.4	-48.3	174.2	-71.8	169.8	0	0	0	111.1	Q250 M251 N256 N257 D258	Q250-L254 WeakPolarHBondContact O-CG 3.45Å; Q250-L254 PolarHBondContact O-N 3.35Å; M251-L254 PolarHBondContact O-N 2.96Å; M251-L254 HydrophobicContact SD-CD1 4.26Å; L254-N256 PolarHBondContact O-N 2.82Å; L254-N257 PolarHBondContact O-N 3.34Å; L254-N257 VanDerWaalsContact O-N 3.14Å; L254-D258 PolarHBondContact O-N 2.82Å
255	I	81.7	Confident	75.3	Confident	80 Å²	80	93.5 Å²	93.5	41%	0.41	47%	0.47	S	S	.	.	H	α-helix	trans	-59.7	-48.3	177.2	-66.6	164	0	0	0	110.5	M251 N257 D258 E259	M251-I255 VanDerWaalsContact O-CG1 3.28Å; M251-I255 WeakPolarHBondContact O-CG1 3.3Å; M251-I255 PolarHBondContact O-N 3.48Å; I255-N257 VanDerWaalsContact C-N 3.25Å; I255-N257 PolarHBondContact O-N 2.89Å; I255-D258 PolarHBondContact O-N 3.44Å; I255-E259 HydrophobicContact CG2-CG 4.21Å; I255-E259 WeakPolarHBondContact O-CB 3.43Å; I255-E259 WeakPolarHBondContact O-CG 3.21Å; I255-E259 PolarHBondContact O-N 2.96Å
256	N	77.2	Confident	72.9	Confident	74 Å²	74	95.7 Å²	95.7	40%	0.396	48%	0.482	S	S	.	.	H	α-helix	trans	-64.2	-31	178.2	-69.9	-6.5	0	0	0	112.3	T252 L254 N260	T252-N256 WeakPolarHBondContact O-CB 3.26Å; T252-N256 PolarHBondContact O-N 3.41Å; T252-N256 PolarHBondContact O-OD1 2.92Å; L254-N256 PolarHBondContact O-N 2.82Å; N256-N260 VanDerWaalsContact O-CB 3.24Å; N256-N260 WeakPolarHBondContact O-CB 3.03Å; N256-N260 VanDerWaalsContact O-CG 3.31Å; N256-N260 PolarHBondContact O-N 3.03Å; N256-N260 PolarHBondContact O-ND2 3.5Å
257	N	75.1	Confident	70.1	Confident	95 Å²	95	99.7 Å²	99.7	51%	0.508	50%	0.501	S	S	.	.	H	α-helix	trans	-73.4	-40.3	175.9	-73.8	-23.1	0	0	0	111.6	Q253 L254 I255 N260 I261	Q253-N257 VanDerWaalsContact O-CB 3.3Å; Q253-N257 WeakPolarHBondContact O-CB 3.15Å; Q253-N257 PolarHBondContact O-N 3.17Å; Q253-N257 PolarHBondContact O-ND2 2.87Å; Q253-N257 VanDerWaalsContact O-ND2 3.12Å; L254-N257 PolarHBondContact O-N 3.34Å; L254-N257 VanDerWaalsContact O-N 3.14Å; I255-N257 VanDerWaalsContact C-N 3.25Å; I255-N257 PolarHBondContact O-N 2.89Å; N257-N260 PolarHBondContact O-N 2.82Å; N257-I261 VanDerWaalsContact O-CG1 3.26Å; N257-I261 WeakPolarHBondContact O-CG1 3.46Å; N257-I261 PolarHBondContact O-N 3.46Å
258	D	73.7	Confident	67.7	Low	99 Å²	99	102.9 Å²	102.9	53%	0.529	51%	0.513	S	S	.	.	H	α-helix	trans	-66.1	-44.6	173.8	-74.7	-17.5	0	0	0	110.8	L254 I255 N260 I261 D262	L254-D258 PolarHBondContact O-N 2.82Å; I255-D258 PolarHBondContact O-N 3.44Å; D258-N260 VanDerWaalsContact C-N 3.31Å; D258-N260 PolarHBondContact O-N 2.97Å; D258-I261 CarbonylContact O-C 3.55Å; D258-I261 WeakPolarHBondContact O-CA 3.26Å; D258-I261 WeakPolarHBondContact O-CB 3.26Å; D258-I261 PolarHBondContact O-N 2.79Å; D258-D262 PolarHBondContact O-N 3Å
259	E	66.9	Low	65.3	Low	107 Å²	107	107.6 Å²	107.6	50%	0.5	53%	0.528	S	S	.	.	H	α-helix	trans	-64.4	-31.6	173.2	-74.5	-177.8	177.1	0	0	112.1	I255 D262 E263	I255-E259 HydrophobicContact CG2-CG 4.21Å; I255-E259 WeakPolarHBondContact O-CB 3.43Å; I255-E259 WeakPolarHBondContact O-CG 3.21Å; I255-E259 PolarHBondContact O-N 2.96Å; E259-D262 CarbonylContact O-C 3.4Å; E259-D262 PolarHBondContact O-N 3.42Å; E259-E263 WeakPolarHBondContact O-CA 3.28Å; E259-E263 WeakPolarHBondContact O-CB 3.32Å; E259-E263 WeakPolarHBondContact O-CG 3.22Å; E259-E263 PolarHBondContact O-N 3.47Å
260	N	57.4	Low	62.3	Low	86 Å²	86	110 Å²	110	46%	0.46	54%	0.543	S	S	.	.	H	α-helix	trans	-74.2	-26.8	171.6	-86.6	-66.2	0	0	0	112.8	N256 N257 D258 R264	N256-N260 VanDerWaalsContact O-CB 3.24Å; N256-N260 WeakPolarHBondContact O-CB 3.03Å; N256-N260 VanDerWaalsContact O-CG 3.31Å; N256-N260 PolarHBondContact O-N 3.03Å; N256-N260 PolarHBondContact O-ND2 3.5Å; N257-N260 PolarHBondContact O-N 2.82Å; D258-N260 VanDerWaalsContact C-N 3.31Å; D258-N260 PolarHBondContact O-N 2.97Å; N260-R264 WeakPolarHBondContact O-CB 3.4Å; N260-R264 WeakPolarHBondContact O-CG 3.14Å; N260-R264 PolarHBondContact O-N 2.83Å
261	I	57.1	Low	59.6	Low	98 Å²	98	110.5 Å²	110.5	50%	0.503	55%	0.553	S	S	.	*	H	α-helix	trans	-70.2	-43.9	170.8	-69.6	162.6	0	0	0	109	N257 D258 R264 N265	N257-I261 VanDerWaalsContact O-CG1 3.26Å; N257-I261 WeakPolarHBondContact O-CG1 3.46Å; N257-I261 PolarHBondContact O-N 3.46Å; D258-I261 CarbonylContact O-C 3.55Å; D258-I261 WeakPolarHBondContact O-CA 3.26Å; D258-I261 WeakPolarHBondContact O-CB 3.26Å; D258-I261 PolarHBondContact O-N 2.79Å; I261-R264 PolarHBondContact O-N 3.32Å; I261-N265 VanDerWaalsContact O-CG 3.3Å; I261-N265 PolarHBondContact O-N 2.75Å; I261-N265 PolarHBondContact O-ND2 2.97Å; I261-N265 VanDerWaalsContact O-ND2 3.12Å
262	D	57.1	Low	57	Low	91 Å²	91	112.1 Å²	112.1	49%	0.487	56%	0.563	S	S	.	*	H	α-helix	trans	-73.2	-37	177.1	-74.5	-19.9	0	0	0	112.4	D258 E259 N265 I266	D258-D262 PolarHBondContact O-N 3Å; E259-D262 CarbonylContact O-C 3.4Å; E259-D262 PolarHBondContact O-N 3.42Å; D262-N265 CarbonylContact O-C 3.6Å; D262-N265 WeakPolarHBondContact O-CA 3.47Å; D262-N265 VanDerWaalsContact O-CB 3.31Å; D262-N265 WeakPolarHBondContact O-CB 3.24Å; D262-N265 PolarHBondContact O-N 3.31Å; D262-I266 HydrophobicContact CB-CD1 4.41Å; D262-I266 WeakPolarHBondContact O-CB 3.21Å; D262-I266 WeakPolarHBondContact O-CD1 3.37Å; D262-I266 WeakPolarHBondContact O-CG1 3.25Å; D262-I266 PolarHBondContact O-N 3.48Å
263	E	48.1	Very low	54.3	Low	102 Å²	102	116.5 Å²	116.5	48%	0.477	58%	0.578	S	S	.	*	H	α-helix	trans	-70.2	-30.1	171.4	-83.6	-167.4	149.1	0	0	111.5	E259 N265 I266 M267	E259-E263 WeakPolarHBondContact O-CA 3.28Å; E259-E263 WeakPolarHBondContact O-CB 3.32Å; E259-E263 WeakPolarHBondContact O-CG 3.22Å; E259-E263 PolarHBondContact O-N 3.47Å; E263-N265 PolarHBondContact O-N 2.95Å; E263-I266 PolarHBondContact O-N 2.76Å; E263-M267 WeakPolarHBondContact O-CA 3.43Å; E263-M267 WeakPolarHBondContact O-CB 3.2Å; E263-M267 WeakPolarHBondContact O-CG 3.5Å; E263-M267 PolarHBondContact O-N 3.41Å
264	R	45.2	Very low	51.6	Low	204 Å²	204	117.1 Å²	117.1	77%	0.77	59%	0.585	S	S	*	*	H	α-helix	trans	-64.5	-29.1	165.5	-92.5	-173.9	-168.4	169.8	7.1	112.2	N260 I261	N260-R264 WeakPolarHBondContact O-CB 3.4Å; N260-R264 WeakPolarHBondContact O-CG 3.14Å; N260-R264 PolarHBondContact O-N 2.83Å; I261-R264 PolarHBondContact O-N 3.32Å
265	N	46.7	Very low	48.7	Very low	94 Å²	94	121.1 Å²	121.1	50%	0.503	60%	0.599	S	S	.	*	H	α-helix	trans	-81	-31.3	175	-65.8	-32.3	0	0	0	111.9	I261 D262 E263	I261-N265 VanDerWaalsContact O-CG 3.3Å; I261-N265 PolarHBondContact O-N 2.75Å; I261-N265 PolarHBondContact O-ND2 2.97Å; I261-N265 VanDerWaalsContact O-ND2 3.12Å; D262-N265 CarbonylContact O-C 3.6Å; D262-N265 WeakPolarHBondContact O-CA 3.47Å; D262-N265 VanDerWaalsContact O-CB 3.31Å; D262-N265 WeakPolarHBondContact O-CB 3.24Å; D262-N265 PolarHBondContact O-N 3.31Å; E263-N265 PolarHBondContact O-N 2.95Å
266	I	44.4	Very low	46	Very low	90 Å²	90	123.2 Å²	123.2	46%	0.462	61%	0.611	S	S	.	*	H	α-helix	trans	-93.2	-28.9	-177.3	-63.5	162.3	0	0	0	112.8	D262 E263 K268 Q269 T270	D262-I266 HydrophobicContact CB-CD1 4.41Å; D262-I266 WeakPolarHBondContact O-CB 3.21Å; D262-I266 WeakPolarHBondContact O-CD1 3.37Å; D262-I266 WeakPolarHBondContact O-CG1 3.25Å; D262-I266 PolarHBondContact O-N 3.48Å; E263-I266 PolarHBondContact O-N 2.76Å; I266-K268 PolarHBondContact O-N 3.31Å; I266-Q269 CarbonylContact O-C 3.52Å; I266-Q269 WeakPolarHBondContact O-CA 3.41Å; I266-Q269 PolarHBondContact O-N 2.83Å; I266-T270 PolarHBondContact O-N 3.33Å; I266-T270 VanDerWaalsContact O-N 3.08Å; I266-T270 PolarHBondContact O-OG1 3.32Å
267	M	34.8	Very low	43.7	Very low	136 Å²	136	126.3 Å²	126.3	67%	0.67	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-19.8	169.6	-89.7	-159.4	169.9	0	0	111.8	E263 Q269 V271	E263-M267 WeakPolarHBondContact O-CA 3.43Å; E263-M267 WeakPolarHBondContact O-CB 3.2Å; E263-M267 WeakPolarHBondContact O-CG 3.5Å; E263-M267 PolarHBondContact O-N 3.41Å; M267-Q269 PolarHBondContact O-N 3.48Å; M267-V271 WeakPolarHBondContact O-CG2 3.39Å
268	K	41.3	Very low	41.2	Very low	183 Å²	183	127 Å²	127	80%	0.796	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-15.1	166.3	-76.6	-175.8	178.7	176.6	0	113.3	I266	I266-K268 PolarHBondContact O-N 3.31Å
269	Q	41.4	Very low	38.8	Very low	168 Å²	168	130.8 Å²	130.8	79%	0.785	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	-12.8	-173.1	-83.1	-179.3	-21.7	0	0	115.9	I266 M267	I266-Q269 CarbonylContact O-C 3.52Å; I266-Q269 WeakPolarHBondContact O-CA 3.41Å; I266-Q269 PolarHBondContact O-N 2.83Å; M267-Q269 PolarHBondContact O-N 3.48Å
270	T	28.2	Very low	36.7	Very low	99 Å²	99	129.9 Å²	129.9	61%	0.607	66%	0.66	S	S	*	*			trans	-133.4	46.1	-173.5	-24.5	0	0	0	0	114.8	I266 I272	I266-T270 PolarHBondContact O-N 3.33Å; I266-T270 VanDerWaalsContact O-N 3.08Å; I266-T270 PolarHBondContact O-OG1 3.32Å; T270-I272 PolarHBondContact O-N 2.81Å
271	V	31.5	Very low	35.3	Very low	128 Å²	128	131.1 Å²	131.1	78%	0.776	68%	0.675	S	S	*	*			trans	-84.6	14.3	169.1	-179	0	0	0	0	112	M267	M267-V271 WeakPolarHBondContact O-CG2 3.39Å
272	I	34	Very low	34.5	Very low	145 Å²	145	131.7 Å²	131.7	74%	0.744	69%	0.686	S	S	*	*			trans	-122.4	75.5	178.3	-47.3	175.5	0	0	0	110	T270	T270-I272 PolarHBondContact O-N 2.81Å
273	H	29.5	Very low	33	Very low	159 Å²	159	132 Å²	132	74%	0.736	70%	0.695	S	S	*	*			trans	174	119.5	132.8	-111.1	-76	0	0	0	113.2
274	N	28.3	Very low	32.1	Very low	126 Å²	126	136 Å²	136	67%	0.674	71%	0.711	S	S	*	*			trans	39.1	121.2	140.9	-69	-2.6	0	0	0	121.4
275	F	22.8	Very low	31.1	Very low	179 Å²	179	131.9 Å²	131.9	79%	0.785	71%	0.713	S	S	*	*				82.6	122.9	71.8	-109.2	-94.4	0	0	0	114.4
276	N	26.1	Very low	30.4	Very low	124 Å²	124	133.6 Å²	133.6	66%	0.663	73%	0.727	S	S	*	*			trans	74.9	116.9	155.6	-69.4	-10.1	0	0	0	120.8
277	D	27.5	Very low	29.5	Very low	139 Å²	139	137.7 Å²	137.7	74%	0.743	74%	0.742	S	S	*	*				158.4	114.4	109.5	-83.9	-30.8	0	0	0	109
278	V	24.1	Very low	29.1	Very low	111 Å²	111	138.7 Å²	138.7	67%	0.673	75%	0.749	S	S	*	*				83.8	130.8	75.8	170.9	0	0	0	0	113.9
279	Q	23	Very low	28.7	Very low	178 Å²	178	137.5 Å²	137.5	83%	0.832	74%	0.741	S	S	*	*			trans	88.5	97.3	154	-85.2	160.4	19.1	0	0	122.2
280	A	23.3	Very low	28.1	Very low	87 Å²	87	133.5 Å²	133.5	72%	0.719	74%	0.737	S	S	*	*				37.9	135.6	106.7	0	0	0	0	0	123
281	S	27.5	Very low	28.3	Very low	112 Å²	112	133.5 Å²	133.5	78%	0.783	74%	0.739	S	S	*	*			trans	81.6	165.5	140	-69.1	0	0	0	0	119.2
282	P	40.4	Very low	28.2	Very low	111 Å²	111	132.2 Å²	132.2	72%	0.721	73%	0.728	S	S	*	*			cis	-138.3	-159.8	-43.2	38.5	-20.3	0	0	0	112
283	S	25	Very low	28.2	Very low	98 Å²	98	132 Å²	132	69%	0.685	73%	0.726	S	S	*	*			trans	98.2	139.9	147.9	99.4	0	0	0	0	115.5
284	K	28.5	Very low	28.4	Very low	185 Å²	185	129.5 Å²	129.5	80%	0.804	72%	0.719	S	S	*	*			cis	-148.6	142.6	18.1	-97.6	156.2	-174.6	171.3	0	109.7
285	S	25.5	Very low	28.5	Very low	117 Å²	117	130.3 Å²	130.3	82%	0.818	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-64.8	127.2	164.4	51.4	0	0	0	0	110.8
286	V	31.2	Very low	29.1	Very low	130 Å²	130	126.2 Å²	126.2	79%	0.788	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-93	128.4	170.9	-179.1	0	0	0	0	108.5
287	K	26.1	Very low	29.6	Very low	177 Å²	177	127.3 Å²	127.3	77%	0.77	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-65	144.4	-163.1	-67.6	167.6	174.1	176.3	0	113.4	Y289	K287-Y289 WeakPolarHBondContact O-CD2 3.36Å; K287-Y289 WeakPolarHBondContact O-CE2 3.46Å; K287-Y289 PolarHBondContact O-N 2.87Å
288	N	25.5	Very low	30.2	Very low	156 Å²	156	125.2 Å²	125.2	83%	0.834	69%	0.687	S	S	*	*			trans	-61.3	113.8	170.6	-91	-30.5	0	0	0	111.6	A290	N288-A290 PolarHBondContact O-N 3.23Å
289	Y	33.1	Very low	30.9	Very low	159 Å²	159	123.4 Å²	123.4	62%	0.624	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	17.9	174.8	-74.1	-82.5	0	0	0	114.3	K287 C291 L292	K287-Y289 WeakPolarHBondContact O-CD2 3.36Å; K287-Y289 WeakPolarHBondContact O-CE2 3.46Å; K287-Y289 PolarHBondContact O-N 2.87Å; Y289-C291 PolarHBondContact O-N 2.91Å; Y289-C291 VanDerWaalsContact O-N 3.08Å; Y289-L292 HydrophobicContact CD1-CD1 3.57Å; Y289-L292 HydrophobicContact CE1-CD1 3.87Å; Y289-L292 PolarHBondContact O-N 2.92Å; Y289-L292 VanDerWaalsContact O-N 3.17Å
290	A	29.8	Very low	31.9	Very low	84 Å²	84	119.9 Å²	119.9	69%	0.694	66%	0.659	S	S	*	*	H	α-helix	trans	-58.9	-18.6	168.6	0	0	0	0	0	112.4	N288	N288-A290 PolarHBondContact O-N 3.23Å
291	C	30.8	Very low	33	Very low	98 Å²	98	118.7 Å²	118.7	66%	0.662	64%	0.643	S	S	*	*	H	α-helix	trans	-79.9	-17.4	178.9	-142.1	0	0	0	0	114.4	Y289 Y295	Y289-C291 PolarHBondContact O-N 2.91Å; Y289-C291 VanDerWaalsContact O-N 3.08Å; C291-Y295 PolarHBondContact O-N 2.81Å
292	L	30.9	Very low	33.7	Very low	101 Å²	101	117.4 Å²	117.4	53%	0.529	63%	0.627	S	S	.	*	H	α-helix	trans	-87.2	-26.8	-172.3	-119.9	131.5	0	0	0	114.2	Y289 N294 Y295 N296	Y289-L292 HydrophobicContact CD1-CD1 3.57Å; Y289-L292 HydrophobicContact CE1-CD1 3.87Å; Y289-L292 PolarHBondContact O-N 2.92Å; Y289-L292 VanDerWaalsContact O-N 3.17Å; L292-N294 VanDerWaalsContact C-N 3.27Å; L292-Y295 PolarHBondContact O-N 3.15Å; L292-N296 PolarHBondContact O-N 2.96Å
293	I	33.4	Very low	33.9	Very low	140 Å²	140	116 Å²	116	72%	0.718	62%	0.616	S	S	*	*	H	α-helix	trans	-68.1	-34.6	170.4	-63.2	177.2	0	0	0	109.9	Y295 F297	I293-Y295 VanDerWaalsContact C-N 3.33Å; I293-Y295 PolarHBondContact O-N 3.38Å; I293-F297 PolarHBondContact O-N 2.85Å
294	N	33.5	Very low	34.9	Very low	108 Å²	108	117.5 Å²	117.5	58%	0.578	61%	0.613	S	S	*	*	H	α-helix	trans	-70.6	-30.1	175.1	-142.6	1.3	0	0	0	112	L292 F297 L298	L292-N294 VanDerWaalsContact C-N 3.27Å; N294-F297 PolarHBondContact O-N 3.31Å; N294-L298 VanDerWaalsContact O-CB 3.26Å; N294-L298 WeakPolarHBondContact O-CB 3.25Å; N294-L298 PolarHBondContact O-N 2.95Å
295	Y	30.9	Very low	35.8	Very low	142 Å²	142	114 Å²	114	56%	0.557	60%	0.603	S	S	*	*	H	α-helix	trans	-68.8	-35.7	178.6	-149.8	-95.8	0	0	0	113.3	C291 L292 I293 N299	C291-Y295 PolarHBondContact O-N 2.81Å; L292-Y295 PolarHBondContact O-N 3.15Å; I293-Y295 VanDerWaalsContact C-N 3.33Å; I293-Y295 PolarHBondContact O-N 3.38Å; Y295-N299 WeakPolarHBondContact CE1-ND2 3.27Å; Y295-N299 WeakPolarHBondContact O-CB 3.3Å; Y295-N299 PolarHBondContact O-N 3.37Å
296	N	34.9	Very low	37	Very low	94 Å²	94	113 Å²	113	50%	0.503	59%	0.587	S	S	.	*	H	α-helix	trans	-72	-36.9	174.6	-86.8	-10.9	0	0	0	112.3	L292 I300	L292-N296 PolarHBondContact O-N 2.96Å; N296-I300 WeakPolarHBondContact O-CG1 3.4Å; N296-I300 PolarHBondContact O-N 2.91Å
297	F	37.7	Very low	37.8	Very low	147 Å²	147	111.4 Å²	111.4	65%	0.645	57%	0.573	S	S	*	*	H	α-helix	trans	-69.6	-39.4	176	-132.1	-85.5	0	0	0	111.4	I293 N294 I300 T301	I293-F297 PolarHBondContact O-N 2.85Å; N294-F297 PolarHBondContact O-N 3.31Å; F297-I300 PolarHBondContact O-N 3.45Å; F297-T301 WeakPolarHBondContact O-CG2 3.23Å; F297-T301 PolarHBondContact O-N 3.39Å; F297-T301 VanDerWaalsContact O-N 3.16Å; F297-T301 PolarHBondContact O-OG1 2.8Å
298	L	40.2	Very low	38.8	Very low	95 Å²	95	105.9 Å²	105.9	50%	0.497	55%	0.554	S	S	.	*	H	α-helix	trans	-67.2	-37.8	176.5	-152.8	86.3	0	0	0	112.1	N294 T301 L302	N294-L298 VanDerWaalsContact O-CB 3.26Å; N294-L298 WeakPolarHBondContact O-CB 3.25Å; N294-L298 PolarHBondContact O-N 2.95Å; L298-T301 WeakPolarHBondContact CA-OG1 3.38Å; L298-T301 PolarHBondContact O-N 2.97Å; L298-T301 PolarHBondContact O-OG1 3.23Å; L298-L302 VanDerWaalsContact O-CB 3.3Å; L298-L302 WeakPolarHBondContact O-CB 3.36Å; L298-L302 PolarHBondContact O-N 3.49Å
299	N	37.9	Very low	39.3	Very low	73 Å²	73	106.2 Å²	106.2	39%	0.39	55%	0.545	S	S	.	.	H	α-helix	trans	-69.5	-37	177.7	-86.8	-19.5	0	0	0	112.6	Y295 T301 L302 T303	Y295-N299 WeakPolarHBondContact CE1-ND2 3.27Å; Y295-N299 WeakPolarHBondContact O-CB 3.3Å; Y295-N299 PolarHBondContact O-N 3.37Å; N299-T301 VanDerWaalsContact C-N 3.35Å; N299-L302 PolarHBondContact O-N 3.31Å; N299-T303 PolarHBondContact O-N 2.95Å; N299-T303 PolarHBondContact O-OG1 3.2Å
300	I	44.5	Very low	39.5	Very low	103 Å²	103	102.1 Å²	102.1	53%	0.528	54%	0.536	S	S	.	.	H	α-helix	trans	-63.1	-45	175.2	-67.2	167	0	0	0	109.7	N296 F297 T303 E304	N296-I300 WeakPolarHBondContact O-CG1 3.4Å; N296-I300 PolarHBondContact O-N 2.91Å; F297-I300 PolarHBondContact O-N 3.45Å; I300-T303 PolarHBondContact O-N 3.41Å; I300-T303 PolarHBondContact O-OG1 3.46Å; I300-E304 PolarHBondContact O-N 2.88Å
301	T	45.7	Very low	39.8	Very low	62 Å²	62	102.8 Å²	102.8	38%	0.38	53%	0.528	S	S	.	.	H	α-helix	trans	-69.4	-32.8	177.2	56.5	0	0	0	0	112.8	F297 L298 N299 L305	F297-T301 WeakPolarHBondContact O-CG2 3.23Å; F297-T301 PolarHBondContact O-N 3.39Å; F297-T301 VanDerWaalsContact O-N 3.16Å; F297-T301 PolarHBondContact O-OG1 2.8Å; L298-T301 WeakPolarHBondContact CA-OG1 3.38Å; L298-T301 PolarHBondContact O-N 2.97Å; L298-T301 PolarHBondContact O-OG1 3.23Å; N299-T301 VanDerWaalsContact C-N 3.35Å; T301-L305 WeakPolarHBondContact O-CB 3.47Å; T301-L305 PolarHBondContact O-N 3.45Å
302	L	43.2	Very low	40.3	Very low	86 Å²	86	101.6 Å²	101.6	45%	0.45	51%	0.514	S	S	.	.	H	α-helix	trans	-71.4	-39.9	176.1	-139	90	0	0	0	112.1	L298 N299 E304 L305 I306	L298-L302 VanDerWaalsContact O-CB 3.3Å; L298-L302 WeakPolarHBondContact O-CB 3.36Å; L298-L302 PolarHBondContact O-N 3.49Å; N299-L302 PolarHBondContact O-N 3.31Å; L302-E304 VanDerWaalsContact C-N 3.32Å; L302-E304 PolarHBondContact O-N 3.41Å; L302-L305 PolarHBondContact O-N 3.45Å; L302-I306 HydrophobicContact CD2-CD1 4.18Å; L302-I306 HydrophobicContact CG-CD1 4.47Å; L302-I306 WeakPolarHBondContact O-CB 3.34Å; L302-I306 VanDerWaalsContact O-CG1 3.26Å; L302-I306 WeakPolarHBondContact O-CG1 3.31Å; L302-I306 PolarHBondContact O-N 3.01Å
303	T	44.4	Very low	40.4	Very low	80 Å²	80	100.3 Å²	100.3	49%	0.491	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-39.3	174.7	35.4	0	0	0	0	111.7	N299 I300 I306 I307	N299-T303 PolarHBondContact O-N 2.95Å; N299-T303 PolarHBondContact O-OG1 3.2Å; I300-T303 PolarHBondContact O-N 3.41Å; I300-T303 PolarHBondContact O-OG1 3.46Å; T303-I306 PolarHBondContact O-N 2.86Å; T303-I307 WeakPolarHBondContact O-CB 3.45Å; T303-I307 WeakPolarHBondContact O-CD1 3.31Å; T303-I307 WeakPolarHBondContact O-CG1 3.44Å; T303-I307 PolarHBondContact O-N 2.7Å
304	E	45.3	Very low	40.8	Very low	131 Å²	131	99.8 Å²	99.8	61%	0.612	51%	0.51	S	S	*	.	H	α-helix	trans	-69	-39.2	175	-69.7	-159.8	171.1	0	0	112.2	I300 L302 I307 V308	I300-E304 PolarHBondContact O-N 2.88Å; L302-E304 VanDerWaalsContact C-N 3.32Å; L302-E304 PolarHBondContact O-N 3.41Å; E304-I307 PolarHBondContact O-N 3Å; E304-V308 WeakPolarHBondContact O-CB 3.16Å; E304-V308 VanDerWaalsContact O-CG2 3.24Å; E304-V308 WeakPolarHBondContact O-CG2 3.43Å; E304-V308 PolarHBondContact O-N 3.22Å
305	L	47.8	Very low	40.9	Very low	112 Å²	112	101.2 Å²	101.2	59%	0.586	52%	0.517	S	S	*	.	H	α-helix	trans	-64.1	-39.8	174	-90.7	160.4	0	0	0	112.6	T301 L302 V308 Y309	T301-L305 WeakPolarHBondContact O-CB 3.47Å; T301-L305 PolarHBondContact O-N 3.45Å; L302-L305 PolarHBondContact O-N 3.45Å; L305-V308 PolarHBondContact O-N 3.37Å; L305-Y309 WeakPolarHBondContact O-CB 3.3Å; L305-Y309 PolarHBondContact O-N 2.91Å
306	I	51	Low	41.1	Very low	95 Å²	95	105 Å²	105	49%	0.487	54%	0.54	S	S	.	.	H	α-helix	trans	-66.8	-44.5	176.9	-69.5	166.4	0	0	0	110.1	L302 T303 V308 Y309 T310	L302-I306 HydrophobicContact CD2-CD1 4.18Å; L302-I306 HydrophobicContact CG-CD1 4.47Å; L302-I306 WeakPolarHBondContact O-CB 3.34Å; L302-I306 VanDerWaalsContact O-CG1 3.26Å; L302-I306 WeakPolarHBondContact O-CG1 3.31Å; L302-I306 PolarHBondContact O-N 3.01Å; T303-I306 PolarHBondContact O-N 2.86Å; I306-V308 VanDerWaalsContact C-N 3.28Å; I306-V308 PolarHBondContact O-N 3.44Å; I306-Y309 PolarHBondContact O-N 3.3Å; I306-Y309 VanDerWaalsContact O-N 3.15Å; I306-T310 PolarHBondContact O-N 2.96Å; I306-T310 PolarHBondContact O-OG1 2.73Å
307	I	48.1	Very low	41.4	Very low	97 Å²	97	105.6 Å²	105.6	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-57.7	-45.3	175.9	-69.9	165	0	0	0	109.9	T303 E304 T310 L311	T303-I307 WeakPolarHBondContact O-CB 3.45Å; T303-I307 WeakPolarHBondContact O-CD1 3.31Å; T303-I307 WeakPolarHBondContact O-CG1 3.44Å; T303-I307 PolarHBondContact O-N 2.7Å; E304-I307 PolarHBondContact O-N 3Å; I307-T310 WeakPolarHBondContact CA-OG1 3.38Å; I307-T310 PolarHBondContact O-OG1 3.17Å; I307-L311 HydrophobicContact CG2-CD1 3.84Å; I307-L311 WeakPolarHBondContact O-CB 3.39Å; I307-L311 WeakPolarHBondContact O-CD1 3.36Å; I307-L311 VanDerWaalsContact O-CG 3.23Å; I307-L311 WeakPolarHBondContact O-CG 3.33Å; I307-L311 PolarHBondContact O-N 3.02Å
308	V	45.9	Very low	41.6	Very low	61 Å²	61	103.4 Å²	103.4	37%	0.37	54%	0.536	S	S	.	.	H	α-helix	trans	-65.2	-41.1	176.5	173.2	0	0	0	0	111.8	E304 L305 I306 L311 I312	E304-V308 WeakPolarHBondContact O-CB 3.16Å; E304-V308 VanDerWaalsContact O-CG2 3.24Å; E304-V308 WeakPolarHBondContact O-CG2 3.43Å; E304-V308 PolarHBondContact O-N 3.22Å; L305-V308 PolarHBondContact O-N 3.37Å; I306-V308 VanDerWaalsContact C-N 3.28Å; I306-V308 PolarHBondContact O-N 3.44Å; V308-L311 PolarHBondContact O-N 3.23Å; V308-I312 HydrophobicContact CG1-CD1 3.75Å; V308-I312 HydrophobicContact CG1-CG1 4.45Å; V308-I312 VanDerWaalsContact O-CG1 3.25Å; V308-I312 WeakPolarHBondContact O-CG1 3.41Å; V308-I312 PolarHBondContact O-N 3.46Å
309	Y	36.4	Very low	41.7	Very low	163 Å²	163	103.9 Å²	103.9	64%	0.639	54%	0.538	S	S	*	.	H	α-helix	trans	-68.3	-41.5	179.1	-148.5	-87.8	0	0	0	111.6	L305 I306 L311 I312 C313	L305-Y309 WeakPolarHBondContact O-CB 3.3Å; L305-Y309 PolarHBondContact O-N 2.91Å; I306-Y309 PolarHBondContact O-N 3.3Å; I306-Y309 VanDerWaalsContact O-N 3.15Å; Y309-L311 VanDerWaalsContact C-N 3.32Å; Y309-L311 PolarHBondContact O-N 2.9Å; Y309-I312 PolarHBondContact O-N 3.35Å; Y309-C313 VanDerWaalsContact CD1-SG 3.6Å; Y309-C313 VanDerWaalsContact CE1-SG 3.56Å; Y309-C313 WeakPolarHBondContact O-CB 3.3Å; Y309-C313 PolarHBondContact O-N 3.49Å; Y309-C313 PolarHBondContact O-SG 3.44Å; Y309-C313 VanDerWaalsContact O-SG 3.41Å
310	T	37.8	Very low	41.9	Very low	72 Å²	72	105.7 Å²	105.7	44%	0.442	55%	0.547	S	S	.	.	H	α-helix	trans	-62.6	-38.6	172.2	41.2	0	0	0	0	112	I306 I307 I312 C313 I314	I306-T310 PolarHBondContact O-N 2.96Å; I306-T310 PolarHBondContact O-OG1 2.73Å; I307-T310 WeakPolarHBondContact CA-OG1 3.38Å; I307-T310 PolarHBondContact O-OG1 3.17Å; T310-I312 VanDerWaalsContact C-N 3.31Å; T310-I312 PolarHBondContact O-N 3.02Å; T310-C313 PolarHBondContact O-N 3.33Å; T310-I314 WeakPolarHBondContact O-CB 3.12Å; T310-I314 WeakPolarHBondContact O-CD1 3.49Å; T310-I314 WeakPolarHBondContact O-CG1 3.42Å; T310-I314 PolarHBondContact O-N 3.11Å
311	L	36.4	Very low	41.8	Very low	99 Å²	99	105.9 Å²	105.9	52%	0.518	55%	0.548	S	S	.	.	H	α-helix	trans	-69	-28.9	176.3	-75.2	167	0	0	0	113	I307 V308 Y309 N315	I307-L311 HydrophobicContact CG2-CD1 3.84Å; I307-L311 WeakPolarHBondContact O-CB 3.39Å; I307-L311 WeakPolarHBondContact O-CD1 3.36Å; I307-L311 VanDerWaalsContact O-CG 3.23Å; I307-L311 WeakPolarHBondContact O-CG 3.33Å; I307-L311 PolarHBondContact O-N 3.02Å; V308-L311 PolarHBondContact O-N 3.23Å; Y309-L311 VanDerWaalsContact C-N 3.32Å; Y309-L311 PolarHBondContact O-N 2.9Å; L311-N315 PolarHBondContact O-ND2 2.97Å
312	I	40.5	Very low	41.5	Very low	73 Å²	73	108.8 Å²	108.8	37%	0.374	56%	0.56	S	S	.	*	H	α-helix	trans	-77.4	-41	174.1	-67.9	166.7	0	0	0	110.6	V308 Y309 T310 I314 N315	V308-I312 HydrophobicContact CG1-CD1 3.75Å; V308-I312 HydrophobicContact CG1-CG1 4.45Å; V308-I312 VanDerWaalsContact O-CG1 3.25Å; V308-I312 WeakPolarHBondContact O-CG1 3.41Å; V308-I312 PolarHBondContact O-N 3.46Å; Y309-I312 PolarHBondContact O-N 3.35Å; T310-I312 VanDerWaalsContact C-N 3.31Å; T310-I312 PolarHBondContact O-N 3.02Å; I312-I314 PolarHBondContact O-N 3.38Å; I312-N315 PolarHBondContact O-N 3.29Å
313	C	32.5	Very low	41.4	Very low	73 Å²	73	110.4 Å²	110.4	49%	0.493	57%	0.567	S	S	.	*	H	α-helix	trans	-72.2	-24.2	178	-70.2	0	0	0	0	113.9	Y309 T310	Y309-C313 VanDerWaalsContact CD1-SG 3.6Å; Y309-C313 VanDerWaalsContact CE1-SG 3.56Å; Y309-C313 WeakPolarHBondContact O-CB 3.3Å; Y309-C313 PolarHBondContact O-N 3.49Å; Y309-C313 PolarHBondContact O-SG 3.44Å; Y309-C313 VanDerWaalsContact O-SG 3.41Å; T310-C313 PolarHBondContact O-N 3.33Å
314	I	42.8	Very low	41.2	Very low	129 Å²	129	112.8 Å²	112.8	66%	0.662	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-19.3	172.5	-69.7	164.2	0	0	0	111.4	T310 I312	T310-I314 WeakPolarHBondContact O-CB 3.12Å; T310-I314 WeakPolarHBondContact O-CD1 3.49Å; T310-I314 WeakPolarHBondContact O-CG1 3.42Å; T310-I314 PolarHBondContact O-N 3.11Å; I312-I314 PolarHBondContact O-N 3.38Å
315	N	34.6	Very low	40.8	Very low	138 Å²	138	111.3 Å²	111.3	74%	0.738	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	20.2	-178	-83.4	-39.2	0	0	0	114.1	L311 I312	L311-N315 PolarHBondContact O-ND2 2.97Å; I312-N315 PolarHBondContact O-N 3.29Å
316	H	36	Very low	40.2	Very low	223 Å²	223	111.2 Å²	111.2	100%	1.032	57%	0.568	S	S	*	*			trans	-125.5	0	173.6	-122.5	-53.7	0	0	0	111.5

Retrieved 316 of 316 residues in 694.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).