A0A5K4F422_SCHMA Loading...

SANT domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F422, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 588 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	43.2	Very low	53	Low	235 Å²	235	163.8 Å²	163.8	100%	1.158	85%	0.853	S	S	*	*				0	122.7	0	-68.9	161.5	114.7	0	0	108.5
2	I	49.8	Very low	52.4	Low	169 Å²	169	166.7 Å²	166.7	87%	0.867	85%	0.853	S	S	*	*			trans	-134.2	106.3	171	-59.3	177.7	0	0	0	107.1
3	K	53.2	Low	52.1	Low	199 Å²	199	163.5 Å²	163.5	87%	0.865	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-83.7	125.4	176.6	-72.6	-180	176.1	177.8	0	108.9
4	R	51.9	Low	51.4	Low	232 Å²	232	167.6 Å²	167.6	88%	0.875	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-76.3	142.1	167.2	-76.3	-177.4	174.4	171.2	-1.5	109.8
5	P	59.6	Low	50.9	Low	120 Å²	120	169.5 Å²	169.5	78%	0.779	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-72.7	137.8	179.7	29.7	-34.5	0	0	0	111.6	V7	P5-V7 PolarHBondContact O-N 3.3Å
6	T	60.5	Low	50.1	Low	132 Å²	132	163.3 Å²	163.3	81%	0.81	84%	0.84	S	S	*	*			trans	-81.3	110.7	174.2	46.4	0	0	0	0	110.5	V8	T6-V8 PolarHBondContact O-N 3.12Å
7	V	57.5	Low	49.6	Very low	140 Å²	140	166.8 Å²	166.8	85%	0.848	84%	0.84	S	S	*	*			trans	-73.2	109.7	171.1	177.9	0	0	0	0	109.1	P5 R9	P5-V7 PolarHBondContact O-N 3.3Å; V7-R9 PolarHBondContact O-N 3.08Å
8	V	56.9	Low	49.3	Very low	133 Å²	133	167.8 Å²	167.8	81%	0.806	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-67.3	123.7	174.1	178.2	0	0	0	0	109	T6	T6-V8 PolarHBondContact O-N 3.12Å
9	R	46.2	Very low	49.1	Very low	237 Å²	237	165.5 Å²	165.5	89%	0.894	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-91.4	121.2	179.2	-147.6	176.3	-165.8	172.9	5.5	109	V7	V7-R9 PolarHBondContact O-N 3.08Å
10	A	54	Low	49	Very low	81 Å²	81	165.5 Å²	165.5	67%	0.669	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-56.2	146.1	-179.3	0	0	0	0	0	112.4	K12	A10-K12 PolarHBondContact O-N 3.38Å
11	P	50.3	Low	49.1	Very low	124 Å²	124	164.9 Å²	164.9	81%	0.805	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-65.7	133.6	-178.5	27.4	-34.3	0	0	0	110.9	T13	P11-T13 PolarHBondContact O-N 3.35Å
12	K	46.2	Very low	49.8	Very low	198 Å²	198	158.9 Å²	158.9	86%	0.861	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-69.9	124.8	172.3	-71.3	-179.7	178.3	178	0	109.1	A10 Y14	A10-K12 PolarHBondContact O-N 3.38Å; K12-Y14 PolarHBondContact O-N 2.91Å
13	T	48.5	Very low	50.4	Low	126 Å²	126	154.3 Å²	154.3	77%	0.773	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-59.3	127.9	174.4	44.1	0	0	0	0	111	P11 K15	P11-T13 PolarHBondContact O-N 3.35Å; T13-K15 PolarHBondContact O-N 3.33Å
14	Y	41.6	Very low	51	Low	220 Å²	220	148.7 Å²	148.7	86%	0.863	77%	0.773	S	S	*	*			trans	-63.2	112.6	172.6	-99.4	-101.8	0	0	0	109.7	K12	K12-Y14 PolarHBondContact O-N 2.91Å
15	K	44.2	Very low	52.2	Low	197 Å²	197	143.1 Å²	143.1	86%	0.857	77%	0.77	S	S	*	*			trans	-100.1	118.2	163.4	-80.1	-163.7	173.4	-170.1	0	109.7	T13	T13-K15 PolarHBondContact O-N 3.33Å
16	G	37.4	Very low	53.2	Low	69 Å²	69	143.7 Å²	143.7	71%	0.711	76%	0.756	S	S	*	*			trans	71.6	95.1	157.5	0	0	0	0	0	117.4	K18	G16-K18 PolarHBondContact O-N 3.25Å
17	R	42.5	Very low	54.1	Low	223 Å²	223	143 Å²	143	84%	0.842	75%	0.752	S	S	*	*			trans	-75.8	71.6	157.5	-73.7	-166.7	-175.7	-144.2	9.9	110.8
18	K	44.3	Very low	55.3	Low	186 Å²	186	137.8 Å²	137.8	81%	0.809	73%	0.726	S	S	*	*			trans	-131.6	141.6	157.9	-80.2	-170.9	172.2	-175.8	0	107.2	G16	G16-K18 PolarHBondContact O-N 3.25Å
19	N	44.2	Very low	56.5	Low	124 Å²	124	136.3 Å²	136.3	66%	0.663	72%	0.722	S	S	*	*			trans	74.1	52.3	-178.9	-57.3	42.7	0	0	0	115.8	D22	N19-D22 WeakPolarHBondContact CB-OD2 3.49Å; N19-D22 PolarHBondContact ND2-OD2 3.46Å
20	Q	47.3	Very low	58.3	Low	164 Å²	164	132.2 Å²	132.2	77%	0.766	72%	0.717	S	S	*	*			trans	-87.6	-10.4	165.3	-159.8	165.3	12.4	0	0	113.1
21	E	51.5	Low	59.7	Low	154 Å²	154	133.8 Å²	133.8	72%	0.72	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-78.7	-16.1	175.2	-66.1	-176.4	151.7	0	0	113.9	G23	E21-G23 PolarHBondContact O-N 2.9Å
22	D	58.5	Low	61.4	Low	108 Å²	108	134 Å²	134	58%	0.578	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-81.7	3	179.1	-63.9	-35.2	0	0	0	113.1	N19 R26	N19-D22 WeakPolarHBondContact CB-OD2 3.49Å; N19-D22 PolarHBondContact ND2-OD2 3.46Å; D22-R26 IonicContact OD1-NH2 3.41Å; D22-R26 PolarHBondContact OD1-NH2 3.11Å
23	G	61.6	Low	63.2	Low	74 Å²	74	128.8 Å²	128.8	76%	0.763	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-124.1	0.7	-174.5	0	0	0	0	0	115.9	E21	E21-G23 PolarHBondContact O-N 2.9Å
24	C	66.2	Low	64.9	Low	80 Å²	80	132 Å²	132	54%	0.541	70%	0.7	S	S	.	*	S	Bend	trans	-100.5	147.5	171	66.9	0	0	0	0	110.8	R26	C24-R26 PolarHBondContact O-N 3.43Å; C24-R26 VanDerWaalsContact O-N 3.12Å
25	S	76.1	Confident	66.8	Low	115 Å²	115	127.8 Å²	127.8	80%	0.804	70%	0.696	S	S	*	*			trans	-63	113.9	166.9	-55.3	0	0	0	0	108.2	V27	S25-V27 PolarHBondContact O-N 3.47Å
26	R	81.7	Confident	68.6	Low	133 Å²	133	123.5 Å²	123.5	50%	0.502	69%	0.691	S	S	.	*			trans	-69.5	129.2	177.9	-59.9	-174.8	-178.9	-174.5	0.6	108.8	D22 C24 F31	D22-R26 IonicContact OD1-NH2 3.41Å; D22-R26 PolarHBondContact OD1-NH2 3.11Å; C24-R26 PolarHBondContact O-N 3.43Å; C24-R26 VanDerWaalsContact O-N 3.12Å; R26-F31 HydrophobicContact CB-CB 3.94Å; R26-F31 HydrophobicContact CB-CD1 3.8Å; R26-F31 HydrophobicContact CB-CD2 3.78Å; R26-F31 HydrophobicContact CB-CE1 4.27Å; R26-F31 HydrophobicContact CB-CE2 4.24Å; R26-F31 HydrophobicContact CB-CG 3.54Å; R26-F31 HydrophobicContact CB-CZ 4.46Å; R26-F31 HydrophobicContact CG-CD1 4.48Å
27	V	80	Confident	70.8	Confident	118 Å²	118	129 Å²	129	72%	0.715	70%	0.698	S	S	*	*			trans	-123.3	128.5	-178.1	-178.2	0	0	0	0	108.5	S25	S25-V27 PolarHBondContact O-N 3.47Å
28	G	81.7	Confident	72.4	Confident	29 Å²	29	127.4 Å²	127.4	30%	0.299	69%	0.694	S	S	.	*	S	Bend	trans	155.8	163.4	-177.6	0	0	0	0	0	109.4	D30 F31 Q32	G28-D30 PolarHBondContact O-N 2.93Å; G28-F31 CarbonylContact O-C 3.54Å; G28-F31 PolarHBondContact O-N 3.46Å; G28-Q32 WeakPolarHBondContact O-CG 3.49Å; G28-Q32 PolarHBondContact O-N 3.21Å; G28-Q32 VanDerWaalsContact O-N 3.13Å
29	S	82.1	Confident	74	Confident	103 Å²	103	123.8 Å²	123.8	72%	0.72	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-56.6	-39.2	-178.7	-53.4	0	0	0	0	112.2	F31 Q32	S29-F31 PolarHBondContact O-N 2.97Å; S29-F31 VanDerWaalsContact O-N 3.12Å; S29-Q32 PolarHBondContact O-N 3.41Å
30	D	84.3	Confident	75.1	Confident	150 Å²	150	125.3 Å²	125.3	80%	0.802	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-67.3	-10.7	178.3	-45.3	-25.2	0	0	0	114.1	G28	G28-D30 PolarHBondContact O-N 2.93Å
31	F	84.2	Confident	75.5	Confident	115 Å²	115	125.9 Å²	125.9	50%	0.504	69%	0.69	S	S	.	*	G	3₁₀ helix	trans	-121.4	4.2	-178.4	-55	-66.5	0	0	0	113	R26 G28 S29	R26-F31 HydrophobicContact CB-CB 3.94Å; R26-F31 HydrophobicContact CB-CD1 3.8Å; R26-F31 HydrophobicContact CB-CD2 3.78Å; R26-F31 HydrophobicContact CB-CE1 4.27Å; R26-F31 HydrophobicContact CB-CE2 4.24Å; R26-F31 HydrophobicContact CB-CG 3.54Å; R26-F31 HydrophobicContact CB-CZ 4.46Å; R26-F31 HydrophobicContact CG-CD1 4.48Å; G28-F31 CarbonylContact O-C 3.54Å; G28-F31 PolarHBondContact O-N 3.46Å; S29-F31 PolarHBondContact O-N 2.97Å; S29-F31 VanDerWaalsContact O-N 3.12Å
32	Q	85.3	Confident	75.7	Confident	127 Å²	127	127.5 Å²	127.5	59%	0.593	70%	0.695	S	S	*	*	S	Bend	trans	-107.8	148.2	174.4	-71.8	175.8	3.2	0	0	109.2	G28 S29	G28-Q32 WeakPolarHBondContact O-CG 3.49Å; G28-Q32 PolarHBondContact O-N 3.21Å; G28-Q32 VanDerWaalsContact O-N 3.13Å; S29-Q32 PolarHBondContact O-N 3.41Å
33	A	83.1	Confident	75.5	Confident	89 Å²	89	125.5 Å²	125.5	74%	0.736	69%	0.689	S	S	*	*			trans	-76	128.9	172.3	0	0	0	0	0	109.3	V35	A33-V35 PolarHBondContact O-N 2.96Å
34	E	84.9	Confident	75.2	Confident	194 Å²	194	132.4 Å²	132.4	91%	0.907	69%	0.694	S	S	*	*			trans	-69.8	111	166.7	-172.3	170.5	-163.4	0	0	108.3
35	V	81.9	Confident	74.6	Confident	131 Å²	131	134.3 Å²	134.3	79%	0.794	70%	0.699	S	S	*	*			trans	-89.2	109.1	-179.6	-177.7	0	0	0	0	108.2	A33	A33-V35 PolarHBondContact O-N 2.96Å
36	S	82.2	Confident	73.6	Confident	107 Å²	107	132.7 Å²	132.7	75%	0.748	68%	0.681	S	S	*	*			trans	-54.7	146.5	175.1	-51.5	0	0	0	0	112
37	E	82.2	Confident	72.4	Confident	184 Å²	184	129.6 Å²	129.6	86%	0.86	68%	0.68	S	S	*	*			trans	-61.5	139.5	178.3	-168.1	168.1	-157.6	0	0	111.5	V39	E37-V39 PolarHBondContact O-N 3.09Å
38	Y	76.4	Confident	71.1	Confident	191 Å²	191	131.5 Å²	131.5	75%	0.749	68%	0.681	S	S	*	*			trans	-70.6	111.2	-175.3	173.6	-98	0	0	0	111.3	E40	Y38-E40 HydrophobicContact CD1-CB 4.41Å; Y38-E40 HydrophobicContact CE1-CB 3.74Å; Y38-E40 HydrophobicContact CE1-CG 4.04Å
39	V	78.1	Confident	69.9	Low	109 Å²	109	135.9 Å²	135.9	66%	0.661	70%	0.697	S	S	*	*			trans	-91.5	106.7	173.7	-175.7	0	0	0	0	109.3	E37 K41	E37-V39 PolarHBondContact O-N 3.09Å; V39-K41 PolarHBondContact O-N 3.32Å; V39-K41 VanDerWaalsContact O-N 3.08Å
40	E	67.2	Low	68.7	Low	157 Å²	157	135.2 Å²	135.2	73%	0.734	69%	0.685	S	S	*	*	S	Bend	trans	-64.5	-13.1	-176.9	-167.9	173.3	-146.1	0	0	114.2	Y38	Y38-E40 HydrophobicContact CD1-CB 4.41Å; Y38-E40 HydrophobicContact CE1-CB 3.74Å; Y38-E40 HydrophobicContact CE1-CG 4.04Å
41	K	56.7	Low	67.6	Low	175 Å²	175	130.2 Å²	130.2	76%	0.761	66%	0.662	S	S	*	*			trans	-114.6	99.9	-178.5	-65.5	178.8	-178.2	174.8	0	110.9	V39 S43	V39-K41 PolarHBondContact O-N 3.32Å; V39-K41 VanDerWaalsContact O-N 3.08Å; K41-S43 PolarHBondContact O-N 3.36Å
42	F	55.6	Low	66.7	Low	188 Å²	188	131.4 Å²	131.4	83%	0.825	68%	0.681	S	S	*	*			trans	-56.7	121.4	157.3	-78.8	-89.5	0	0	0	108.7
43	S	54.2	Low	65.9	Low	66 Å²	66	134 Å²	134	46%	0.462	69%	0.69	S	S	.	*			trans	-70.6	150.8	166.9	78.5	0	0	0	0	108.6	K41 D45 D46	K41-S43 PolarHBondContact O-N 3.36Å; S43-D45 PolarHBondContact O-N 3.05Å; S43-D46 PolarHBondContact O-N 3.47Å
44	Y	54.8	Low	65.5	Low	219 Å²	219	136 Å²	136	86%	0.859	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-64.4	-22.6	178.9	-116.4	-95.6	0	0	0	112.4	D46 S47	Y44-D46 PolarHBondContact O-N 3.19Å; Y44-S47 WeakPolarHBondContact O-CB 3.41Å; Y44-S47 PolarHBondContact O-N 3.2Å; Y44-S47 PolarHBondContact O-OG 3.22Å
45	D	54.7	Low	65.1	Low	120 Å²	120	133.4 Å²	133.4	64%	0.642	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-66.2	-31.2	-178.9	-85.8	-32.8	0	0	0	113.8	S43 S47 H48	S43-D45 PolarHBondContact O-N 3.05Å; D45-S47 PolarHBondContact O-N 3.24Å; D45-S47 VanDerWaalsContact O-N 3.11Å; D45-H48 WeakPolarHBondContact O-CB 3.33Å; D45-H48 PolarHBondContact O-N 3.38Å
46	D	55.1	Low	65.1	Low	82 Å²	82	129.6 Å²	129.6	44%	0.439	65%	0.649	S	S	.	*	G	3₁₀ helix	trans	-67.2	-14.4	179.5	-94.4	-28.4	0	0	0	113.3	S43 Y44 H48 N49	S43-D46 PolarHBondContact O-N 3.47Å; Y44-D46 PolarHBondContact O-N 3.19Å; D46-H48 PolarHBondContact O-N 3.29Å; D46-N49 PolarHBondContact O-N 3.13Å; D46-N49 VanDerWaalsContact O-N 3.1Å; D46-N49 PolarHBondContact OD1-ND2 3.06Å
47	S	55.8	Low	65.1	Low	67 Å²	67	128.4 Å²	128.4	47%	0.469	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-65.2	-17.2	169.8	71.2	0	0	0	0	113.6	Y44 D45 L50	Y44-S47 WeakPolarHBondContact O-CB 3.41Å; Y44-S47 PolarHBondContact O-N 3.2Å; Y44-S47 PolarHBondContact O-OG 3.22Å; D45-S47 PolarHBondContact O-N 3.24Å; D45-S47 VanDerWaalsContact O-N 3.11Å; S47-L50 WeakPolarHBondContact O-CD1 3.38Å
48	H	53.4	Low	65.4	Low	159 Å²	159	122.9 Å²	122.9	74%	0.736	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-94.4	-10	173.3	-66.8	-61	0	0	0	113.8	D45 D46	D45-H48 WeakPolarHBondContact O-CB 3.33Å; D45-H48 PolarHBondContact O-N 3.38Å; D46-H48 PolarHBondContact O-N 3.29Å
49	N	56.1	Low	65.9	Low	120 Å²	120	117.5 Å²	117.5	64%	0.642	59%	0.588	S	S	*	*			trans	-90.7	1.1	179.1	-74.6	-30.5	0	0	0	114	D46 S51	D46-N49 PolarHBondContact O-N 3.13Å; D46-N49 VanDerWaalsContact O-N 3.1Å; D46-N49 PolarHBondContact OD1-ND2 3.06Å; N49-S51 PolarHBondContact O-N 3.15Å
50	L	57.4	Low	66.2	Low	90 Å²	90	116.5 Å²	116.5	47%	0.471	58%	0.584	S	S	.	*			trans	-60.6	116.3	171.8	-76.6	94.3	0	0	0	109.7	S47 E54	S47-L50 WeakPolarHBondContact O-CD1 3.38Å; L50-E54 HydrophobicContact CD2-CB 4.47Å
51	S	59.7	Low	67.1	Low	45 Å²	45	117 Å²	117	32%	0.315	59%	0.592	S	S	.	*			trans	-48.6	137.6	165.7	172.6	0	0	0	0	109.1	N49 K53 E54	N49-S51 PolarHBondContact O-N 3.15Å; S51-K53 PolarHBondContact O-N 3.38Å; S51-E54 PolarHBondContact O-N 3.1Å
52	P	66.6	Low	68.5	Low	139 Å²	139	114.4 Å²	114.4	90%	0.903	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	7.9	-178.5	26.6	-35.8	0	0	0	114.6
53	K	68.4	Low	70	Confident	181 Å²	181	109.2 Å²	109.2	79%	0.787	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-14.4	172.4	-61.4	174.3	-178.1	169.3	0	113	S51	S51-K53 PolarHBondContact O-N 3.38Å
54	E	75.4	Confident	71.6	Confident	131 Å²	131	107.2 Å²	107.2	61%	0.612	54%	0.544	S	S	*	.			trans	-110.2	129.8	-172.7	-69.3	171.2	-154.8	0	0	109.9	L50 S51	L50-E54 HydrophobicContact CD2-CB 4.47Å; S51-E54 PolarHBondContact O-N 3.1Å
55	F	75.9	Confident	73.3	Confident	141 Å²	141	101.4 Å²	101.4	62%	0.618	53%	0.528	S	S	*	.			trans	-133.8	144.6	177.8	59.5	-85.5	0	0	0	109.5	I57	F55-I57 HydrophobicContact CD2-CG1 3.96Å; F55-I57 HydrophobicContact CE2-CD1 4.04Å; F55-I57 HydrophobicContact CE2-CG1 3.78Å; F55-I57 HydrophobicContact CZ-CD1 4.28Å; F55-I57 HydrophobicContact CZ-CG1 4.48Å; F55-I57 WeakPolarHBondContact O-CG1 3.36Å; F55-I57 PolarHBondContact O-N 3.25Å
56	S	81.8	Confident	75	Confident	50 Å²	50	100.6 Å²	100.6	35%	0.35	52%	0.523	S	S	.	.			trans	-60.4	128.9	172.3	164.6	0	0	0	0	109.6	H91	S56-H91 PolarHBondContact O-CD2 3.06Å; S56-H91 PolarHBondContact O-NE2 3.37Å; S56-H91 VanDerWaalsContact O-NE2 3.12Å; S56-H91 PolarHBondContact OG-CE1 2.93Å; S56-H91 PolarHBondContact OG-NE2 3.12Å
57	I	82.5	Confident	76.8	Confident	83 Å²	83	103.9 Å²	103.9	43%	0.426	54%	0.536	S	S	.	.			trans	-107.1	-27.2	178.5	-46.4	-169	0	0	0	110.7	F55 I88 H91	F55-I57 HydrophobicContact CD2-CG1 3.96Å; F55-I57 HydrophobicContact CE2-CD1 4.04Å; F55-I57 HydrophobicContact CE2-CG1 3.78Å; F55-I57 HydrophobicContact CZ-CD1 4.28Å; F55-I57 HydrophobicContact CZ-CG1 4.48Å; F55-I57 WeakPolarHBondContact O-CG1 3.36Å; F55-I57 PolarHBondContact O-N 3.25Å; I57-I88 HydrophobicContact CG2-CD1 4.05Å; I57-I88 HydrophobicContact CG2-CG1 3.44Å; I57-I88 VanDerWaalsContact CG2-CG1 3.44Å; I57-H91 WeakPolarHBondContact O-CB 3.27Å
58	W	88.3	Confident	78.6	Confident	68 Å²	68	106 Å²	106	26%	0.258	54%	0.538	S	S	.	.			trans	-157.2	143.5	179	-173.8	-106.3	0	0	0	111.7	Q63 L69 L87 L90 Y95	W58-Q63 HydrophobicContact CH2-CG 4.34Å; W58-Q63 HydrophobicContact CZ2-CB 4.08Å; W58-Q63 HydrophobicContact CZ2-CG 3.77Å; W58-L69 HydrophobicContact CH2-CD1 4.31Å; W58-L87 HydrophobicContact CE3-CB 3.83Å; W58-L87 HydrophobicContact CE3-CD2 4.07Å; W58-L87 HydrophobicContact CE3-CG 4.47Å; W58-L87 HydrophobicContact CH2-CD2 3.37Å; W58-L87 HydrophobicContact CZ2-CD2 3.88Å; W58-L87 HydrophobicContact CZ3-CB 3.87Å; W58-L87 HydrophobicContact CZ3-CD2 3.46Å; W58-L87 VanDerWaalsContact CZ3-CD2 3.46Å; W58-L87 HydrophobicContact CZ3-CG 4.24Å; W58-L90 HydrophobicContact CH2-CD2 4.03Å; W58-L90 HydrophobicContact CZ3-CD2 4.11Å; W58-L90 HydrophobicContact CZ3-CG 4.44Å; W58-Y95 HydrophobicContact CD2-CE1 4.19Å; W58-Y95 AromaticContact CE3-CE1 3.71Å; W58-Y95 HydrophobicContact CE3-CE1 3.71Å; W58-Y95 HydrophobicContact CH2-CD1 4.07Å; W58-Y95 AromaticContact CH2-CE1 3.61Å; W58-Y95 HydrophobicContact CH2-CE1 3.61Å; W58-Y95 HydrophobicContact CZ2-CE1 4.1Å; W58-Y95 HydrophobicContact CZ3-CD1 4.08Å; W58-Y95 AromaticContact CZ3-CE1 3.41Å; W58-Y95 HydrophobicContact CZ3-CE1 3.41Å; W58-Y95 VanDerWaalsContact CZ3-CE1 3.41Å
59	M	86.7	Confident	80.5	Confident	78 Å²	78	98.9 Å²	98.9	38%	0.384	51%	0.506	S	S	.	.			trans	-126	103.6	175.5	-71.5	-174.3	156.4	0	0	109.2	N61 K62 Y95	M59-N61 PolarHBondContact O-N 3.02Å; M59-N61 VanDerWaalsContact O-N 3.15Å; M59-K62 HydrophobicContact CB-CB 4.43Å; M59-K62 PolarHBondContact O-N 3.49Å; M59-K62 VanDerWaalsContact O-N 3.09Å; M59-K62 HydrophobicContact SD-CD 4.03Å; M59-Y95 HydrophobicContact CB-CE2 4.45Å; M59-Y95 PolarHBondContact N-OH 3.11Å
60	P	84.9	Confident	82.2	Confident	88 Å²	88	97.2 Å²	97.2	57%	0.571	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-54.6	-34.1	178.6	-27.4	35.5	0	0	0	113.5	K62 Q63	P60-K62 PolarHBondContact O-N 3.41Å; P60-Q63 VanDerWaalsContact O-CB 3.23Å; P60-Q63 WeakPolarHBondContact O-CB 3.24Å; P60-Q63 PolarHBondContact O-N 3.38Å; P60-Q63 VanDerWaalsContact O-N 3.15Å
61	N	84.6	Confident	84	Confident	168 Å²	168	96.5 Å²	96.5	90%	0.898	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-67.6	-14.1	-178.3	-58.8	-4.8	0	0	0	114.3	M59	M59-N61 PolarHBondContact O-N 3.02Å; M59-N61 VanDerWaalsContact O-N 3.15Å
62	K	86.4	Confident	85.6	Confident	120 Å²	120	94.5 Å²	94.5	52%	0.522	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-110.7	6.7	177.5	-66.1	-174.3	177.5	178.5	0	112.7	M59 P60 Y95	M59-K62 HydrophobicContact CB-CB 4.43Å; M59-K62 PolarHBondContact O-N 3.49Å; M59-K62 VanDerWaalsContact O-N 3.09Å; M59-K62 HydrophobicContact SD-CD 4.03Å; P60-K62 PolarHBondContact O-N 3.41Å; K62-Y95 HydrophobicContact CB-CD1 4.34Å; K62-Y95 HydrophobicContact CB-CD2 3.47Å; K62-Y95 VanDerWaalsContact CB-CD2 3.47Å; K62-Y95 HydrophobicContact CB-CE1 4.38Å; K62-Y95 HydrophobicContact CB-CE2 3.57Å; K62-Y95 HydrophobicContact CB-CG 3.92Å; K62-Y95 HydrophobicContact CD-CD2 4.06Å; K62-Y95 HydrophobicContact CD-CE2 3.97Å; K62-Y95 HydrophobicContact CG-CD2 4.43Å; K62-Y95 HydrophobicContact CG-CE2 4.41Å; K62-Y95 WeakPolarHBondContact O-CB 3.44Å; K62-Y95 WeakPolarHBondContact O-CD1 3.34Å
63	Q	88	Confident	86.9	Confident	79 Å²	79	89.2 Å²	89.2	37%	0.369	45%	0.448	S	S	.	.			trans	-59.7	133.3	-179.4	-173.6	179.6	-57.1	0	0	110.6	W58 P60 L69	W58-Q63 HydrophobicContact CH2-CG 4.34Å; W58-Q63 HydrophobicContact CZ2-CB 4.08Å; W58-Q63 HydrophobicContact CZ2-CG 3.77Å; P60-Q63 VanDerWaalsContact O-CB 3.23Å; P60-Q63 WeakPolarHBondContact O-CB 3.24Å; P60-Q63 PolarHBondContact O-N 3.38Å; P60-Q63 VanDerWaalsContact O-N 3.15Å; Q63-L69 HydrophobicContact CG-CD2 3.76Å
64	P	87.1	Confident	88.1	Confident	24 Å²	24	85.5 Å²	85.5	16%	0.156	43%	0.434	C	S	.	.			trans	-67.3	176.9	172	29.9	-35.5	0	0	0	111	L66 L69 L90 I97	P64-L66 PolarHBondContact O-N 3.11Å; P64-L69 HydrophobicContact CG-CB 4.34Å; P64-L69 HydrophobicContact CG-CD1 4.36Å; P64-L90 HydrophobicContact CG-CD2 4.17Å; P64-I97 HydrophobicContact CB-CD1 3.77Å; P64-I97 HydrophobicContact CB-CG1 4.33Å; P64-I97 HydrophobicContact CG-CD1 3.73Å; P64-I97 HydrophobicContact CG-CG1 4.08Å
65	D	91.2	Very high	88.9	Confident	96 Å²	96	82.1 Å²	82.1	51%	0.513	42%	0.417	S	S	.	.			trans	-57.4	145.1	179.6	179.4	63.9	0	0	0	111.8	Q67 E68 L69	D65-Q67 PolarHBondContact O-N 2.77Å; D65-Q67 VanDerWaalsContact OD2-CB 3.23Å; D65-Q67 WeakPolarHBondContact OD2-CB 3.38Å; D65-Q67 PolarHBondContact OD2-N 3.41Å; D65-E68 HydrophobicContact CB-CG 4.21Å; D65-E68 PolarHBondContact O-N 2.87Å; D65-L69 WeakPolarHBondContact O-CB 3.49Å; D65-L69 PolarHBondContact O-N 2.8Å
66	L	91	Very high	89.6	Confident	104 Å²	104	75.5 Å²	75.5	55%	0.545	39%	0.388	S	S	.	.	H	α-helix	trans	-61.8	-32	-174.1	-174.9	63.3	0	0	0	112.2	P64 N70	P64-L66 PolarHBondContact O-N 3.11Å; L66-N70 WeakPolarHBondContact O-CB 3.49Å; L66-N70 VanDerWaalsContact O-CG 3.27Å; L66-N70 PolarHBondContact O-N 3.34Å; L66-N70 VanDerWaalsContact O-N 3.07Å; L66-N70 PolarHBondContact O-ND2 3.38Å
67	Q	92.2	Very high	90	Very high	151 Å²	151	78.3 Å²	78.3	71%	0.706	39%	0.394	S	S	*	.	H	α-helix	trans	-72	-41.9	177.7	-171.4	176.3	-42.1	0	0	111.5	D65 S71	D65-Q67 PolarHBondContact O-N 2.77Å; D65-Q67 VanDerWaalsContact OD2-CB 3.23Å; D65-Q67 WeakPolarHBondContact OD2-CB 3.38Å; D65-Q67 PolarHBondContact OD2-N 3.41Å; Q67-S71 WeakPolarHBondContact O-CB 3.45Å; Q67-S71 PolarHBondContact O-N 3.28Å; Q67-S71 VanDerWaalsContact O-N 3.13Å; Q67-S71 PolarHBondContact O-OG 3.07Å
68	E	92.7	Very high	90.4	Very high	111 Å²	111	81.3 Å²	81.3	52%	0.519	41%	0.407	S	S	.	.	H	α-helix	trans	-66.4	-43.4	176.1	-55.2	-175.4	147.1	0	0	111	D65 N70 S71 Y72 I97	D65-E68 HydrophobicContact CB-CG 4.21Å; D65-E68 PolarHBondContact O-N 2.87Å; E68-N70 PolarHBondContact O-N 2.9Å; E68-S71 WeakPolarHBondContact O-CB 3.43Å; E68-S71 PolarHBondContact O-N 3.4Å; E68-Y72 PolarHBondContact O-N 2.75Å; E68-I97 HydrophobicContact CB-CD1 3.38Å
69	L	93	Very high	90.2	Very high	10 Å²	10	81.5 Å²	81.5	5%	0.052	41%	0.41	C	S	.	.	H	α-helix	trans	-61.1	-45.4	177.5	-177	63.2	0	0	0	112.3	W58 Q63 P64 D65 S71 Y72 L73 L87 L90	W58-L69 HydrophobicContact CH2-CD1 4.31Å; Q63-L69 HydrophobicContact CG-CD2 3.76Å; P64-L69 HydrophobicContact CG-CB 4.34Å; P64-L69 HydrophobicContact CG-CD1 4.36Å; D65-L69 WeakPolarHBondContact O-CB 3.49Å; D65-L69 PolarHBondContact O-N 2.8Å; L69-S71 VanDerWaalsContact C-N 3.29Å; L69-S71 PolarHBondContact O-N 3.15Å; L69-Y72 HydrophobicContact CD1-CD1 4.42Å; L69-Y72 WeakPolarHBondContact O-CB 3.4Å; L69-Y72 PolarHBondContact O-N 3.24Å; L69-L73 HydrophobicContact CD1-CG 4.49Å; L69-L73 HydrophobicContact CG-CD1 4.26Å; L69-L73 WeakPolarHBondContact O-CG 3.24Å; L69-L73 PolarHBondContact O-N 2.75Å; L69-L87 HydrophobicContact CD1-CD2 3.99Å; L69-L90 HydrophobicContact CD1-CD2 3.47Å; L69-L90 VanDerWaalsContact CD1-CD2 3.47Å
70	N	93.6	Very high	90.1	Very high	85 Å²	85	83.1 Å²	83.1	46%	0.455	42%	0.417	S	S	.	.	H	α-helix	trans	-64.3	-36.5	177.4	-76.4	-41.6	0	0	0	111.8	L66 E68 L73 E74	L66-N70 WeakPolarHBondContact O-CB 3.49Å; L66-N70 VanDerWaalsContact O-CG 3.27Å; L66-N70 PolarHBondContact O-N 3.34Å; L66-N70 VanDerWaalsContact O-N 3.07Å; L66-N70 PolarHBondContact O-ND2 3.38Å; E68-N70 PolarHBondContact O-N 2.9Å; N70-L73 PolarHBondContact O-N 2.65Å; N70-E74 PolarHBondContact O-N 3.04Å
71	S	93.4	Very high	90.2	Very high	74 Å²	74	80 Å²	80	52%	0.517	39%	0.394	S	S	.	.	H	α-helix	trans	-64.4	-43.3	175.2	-55.1	0	0	0	0	111.3	Q67 E68 L69 F75	Q67-S71 WeakPolarHBondContact O-CB 3.45Å; Q67-S71 PolarHBondContact O-N 3.28Å; Q67-S71 VanDerWaalsContact O-N 3.13Å; Q67-S71 PolarHBondContact O-OG 3.07Å; E68-S71 WeakPolarHBondContact O-CB 3.43Å; E68-S71 PolarHBondContact O-N 3.4Å; L69-S71 VanDerWaalsContact C-N 3.29Å; L69-S71 PolarHBondContact O-N 3.15Å; S71-F75 PolarHBondContact O-N 3.14Å; S71-F75 VanDerWaalsContact O-N 3.09Å
72	Y	94.1	Very high	90.3	Very high	4 Å²	4	74.3 Å²	74.3	2%	0.016	37%	0.365	C	S	.	.	H	α-helix	trans	-61.4	-43.4	173.3	171.6	-102.1	0	0	0	112.6	E68 L69 F75 A76 A86 L90 I97 A100 V101 I104	E68-Y72 PolarHBondContact O-N 2.75Å; L69-Y72 HydrophobicContact CD1-CD1 4.42Å; L69-Y72 WeakPolarHBondContact O-CB 3.4Å; L69-Y72 PolarHBondContact O-N 3.24Å; Y72-F75 PolarHBondContact O-N 3.05Å; Y72-A76 WeakPolarHBondContact O-CB 3.43Å; Y72-A76 PolarHBondContact O-N 3.11Å; Y72-A86 HydrophobicContact CE1-CB 3.87Å; Y72-A86 WeakPolarHBondContact CE1-O 3.34Å; Y72-A86 PolarHBondContact OH-O 3.36Å; Y72-A86 VanDerWaalsContact OH-O 3.07Å; Y72-L90 HydrophobicContact CD1-CD2 4.13Å; Y72-L90 HydrophobicContact CE1-CB 3.9Å; Y72-L90 HydrophobicContact CE1-CD2 4.17Å; Y72-L90 HydrophobicContact CE1-CG 4.49Å; Y72-I97 HydrophobicContact CD2-CG2 4.29Å; Y72-A100 HydrophobicContact CD2-CB 4.43Å; Y72-A100 HydrophobicContact CE2-CB 3.51Å; Y72-V101 HydrophobicContact CD2-CG2 3.84Å; Y72-V101 HydrophobicContact CE2-CG2 4.32Å; Y72-I104 HydrophobicContact CD2-CD1 4.15Å; Y72-I104 HydrophobicContact CE2-CD1 3.36Å; Y72-I104 HydrophobicContact CE2-CG1 4.44Å
73	L	93.5	Very high	90.5	Very high	27 Å²	27	75 Å²	75	14%	0.141	37%	0.37	C	S	.	.	H	α-helix	trans	-67.2	-39.6	180	-71.3	176.4	0	0	0	112.8	L69 N70 F75 K77 Q83 A86 L87	L69-L73 HydrophobicContact CD1-CG 4.49Å; L69-L73 HydrophobicContact CG-CD1 4.26Å; L69-L73 WeakPolarHBondContact O-CG 3.24Å; L69-L73 PolarHBondContact O-N 2.75Å; N70-L73 PolarHBondContact O-N 2.65Å; L73-F75 VanDerWaalsContact C-N 3.35Å; L73-K77 VanDerWaalsContact O-CB 3.23Å; L73-K77 WeakPolarHBondContact O-CB 3.47Å; L73-K77 PolarHBondContact O-N 2.99Å; L73-Q83 HydrophobicContact CD1-CG 4.25Å; L73-Q83 HydrophobicContact CD2-CG 4.11Å; L73-A86 HydrophobicContact CD2-CB 3.73Å; L73-L87 HydrophobicContact CD2-CD2 4.33Å; L73-L87 HydrophobicContact CD2-CG 4.33Å
74	E	93.1	Very high	90.6	Very high	103 Å²	103	78.2 Å²	78.2	48%	0.481	39%	0.385	S	S	.	.	H	α-helix	trans	-67.8	-33.9	173.3	-75.9	-65.2	157.7	0	0	112.1	N70 K77 Q78	N70-E74 PolarHBondContact O-N 3.04Å; E74-K77 IonicContact OE1-NZ 2.67Å; E74-K77 PolarHBondContact OE1-NZ 3.15Å; E74-K77 IonicContact OE2-NZ 2.64Å; E74-K77 PolarHBondContact OE2-NZ 3.35Å; E74-Q78 WeakPolarHBondContact O-CG 3.47Å; E74-Q78 PolarHBondContact O-N 3.44Å
75	F	92.4	Very high	90.7	Very high	61 Å²	61	80.3 Å²	80.3	27%	0.268	40%	0.395	S	S	.	.	H	α-helix	trans	-65.2	-50.1	171.5	179.9	-102.8	0	0	0	112	S71 Y72 L73 K77 Q78 H79 V101 I104	S71-F75 PolarHBondContact O-N 3.14Å; S71-F75 VanDerWaalsContact O-N 3.09Å; Y72-F75 PolarHBondContact O-N 3.05Å; L73-F75 VanDerWaalsContact C-N 3.35Å; F75-K77 PolarHBondContact O-N 2.68Å; F75-Q78 WeakPolarHBondContact O-CB 3.46Å; F75-Q78 PolarHBondContact O-N 2.95Å; F75-H79 AromaticContact CE2-NE2 3.92Å; F75-H79 AromaticContact CZ-NE2 3.61Å; F75-V101 HydrophobicContact CD1-CG1 4.21Å; F75-V101 HydrophobicContact CD1-CG2 4.19Å; F75-V101 HydrophobicContact CE1-CB 4.31Å; F75-V101 HydrophobicContact CE1-CG1 3.72Å; F75-V101 HydrophobicContact CE1-CG2 4.43Å; F75-V101 HydrophobicContact CZ-CG1 4.08Å; F75-I104 HydrophobicContact CD1-CD1 3.75Å; F75-I104 HydrophobicContact CD1-CG2 4.26Å; F75-I104 HydrophobicContact CE1-CB 4.01Å; F75-I104 HydrophobicContact CE1-CD1 4.02Å; F75-I104 HydrophobicContact CE1-CG2 3.73Å; F75-I104 HydrophobicContact CZ-CG2 4.49Å
76	A	91.7	Very high	90.7	Very high	1 Å²	1	75.8 Å²	75.8	1%	0.008	37%	0.371	C	S	.	.	H	α-helix	trans	-58.6	-36.7	178.6	0	0	0	0	0	112.8	Y72 Q78 H79 Q80 Y81 A86 I104	Y72-A76 WeakPolarHBondContact O-CB 3.43Å; Y72-A76 PolarHBondContact O-N 3.11Å; A76-Q78 VanDerWaalsContact C-N 3.31Å; A76-Q78 PolarHBondContact O-N 3.36Å; A76-H79 CarbonylContact O-C 3.41Å; A76-H79 WeakPolarHBondContact O-CA 3.44Å; A76-H79 PolarHBondContact O-N 3.23Å; A76-Q80 PolarHBondContact O-N 3.32Å; A76-Y81 HydrophobicContact CB-CG 4.4Å; A76-Y81 WeakPolarHBondContact O-CB 3.41Å; A76-Y81 PolarHBondContact O-N 3.2Å; A76-A86 HydrophobicContact CB-CB 3.63Å; A76-I104 HydrophobicContact CB-CD1 3.63Å; A76-I104 HydrophobicContact CB-CG1 4.46Å
77	K	90.1	Very high	90.7	Very high	110 Å²	110	72.2 Å²	72.2	48%	0.478	35%	0.352	S	S	.	.	H	α-helix	trans	-64.2	-30	175.9	177	177.4	160.1	-146.2	0	113.2	L73 E74 F75 H79 Q80	L73-K77 VanDerWaalsContact O-CB 3.23Å; L73-K77 WeakPolarHBondContact O-CB 3.47Å; L73-K77 PolarHBondContact O-N 2.99Å; E74-K77 IonicContact OE1-NZ 2.67Å; E74-K77 PolarHBondContact OE1-NZ 3.15Å; E74-K77 IonicContact OE2-NZ 2.64Å; E74-K77 PolarHBondContact OE2-NZ 3.35Å; F75-K77 PolarHBondContact O-N 2.68Å; K77-H79 PolarHBondContact O-N 3.16Å; K77-Q80 PolarHBondContact O-N 2.94Å
78	Q	89.3	Confident	90.6	Very high	146 Å²	146	67 Å²	67	68%	0.682	33%	0.329	S	S	*	.	H	α-helix	trans	-64.8	-31.3	170.9	-64.7	171.2	14.6	0	0	111.6	E74 F75 A76 Q80	E74-Q78 WeakPolarHBondContact O-CG 3.47Å; E74-Q78 PolarHBondContact O-N 3.44Å; F75-Q78 WeakPolarHBondContact O-CB 3.46Å; F75-Q78 PolarHBondContact O-N 2.95Å; A76-Q78 VanDerWaalsContact C-N 3.31Å; A76-Q78 PolarHBondContact O-N 3.36Å; Q78-Q80 VanDerWaalsContact C-N 3.31Å; Q78-Q80 PolarHBondContact O-N 3.23Å
79	H	85.1	Confident	90.5	Very high	71 Å²	71	62 Å²	62	33%	0.329	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	18.8	175.2	-70.1	-97.5	0	0	0	114	F75 A76 K77 Y81 I104	F75-H79 AromaticContact CE2-NE2 3.92Å; F75-H79 AromaticContact CZ-NE2 3.61Å; A76-H79 CarbonylContact O-C 3.41Å; A76-H79 WeakPolarHBondContact O-CA 3.44Å; A76-H79 PolarHBondContact O-N 3.23Å; K77-H79 PolarHBondContact O-N 3.16Å; H79-Y81 VanDerWaalsContact C-N 3.27Å; H79-Y81 HydrophobicContact CB-CD2 3.9Å; H79-Y81 HydrophobicContact CB-CE2 4.07Å; H79-Y81 WeakPolarHBondContact O-CD2 3.49Å; H79-Y81 PolarHBondContact O-N 3.41Å; H79-I104 HydrophobicContact CB-CG2 3.52Å; H79-I104 VanDerWaalsContact CD2-CG2 3.46Å; H79-I104 WeakPolarHBondContact CD2-CG2 3.5Å
80	Q	84.4	Confident	90.4	Very high	112 Å²	112	61.6 Å²	61.6	52%	0.523	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	19.8	177.2	-48.4	-179.6	11.6	0	0	115.7	A76 K77 Q78 Y111	A76-Q80 PolarHBondContact O-N 3.32Å; K77-Q80 PolarHBondContact O-N 2.94Å; Q78-Q80 VanDerWaalsContact C-N 3.31Å; Q78-Q80 PolarHBondContact O-N 3.23Å; Q80-Y111 PolarHBondContact O-OH 2.82Å
81	Y	86.7	Confident	90.4	Very high	22 Å²	22	59.1 Å²	59.1	9%	0.086	29%	0.289	C	S	.	.			trans	-73.2	144.6	170.8	-76.4	-112.7	0	0	0	111.4	A76 H79 L85 L89 I104 Y107 P109	A76-Y81 HydrophobicContact CB-CG 4.4Å; A76-Y81 WeakPolarHBondContact O-CB 3.41Å; A76-Y81 PolarHBondContact O-N 3.2Å; H79-Y81 VanDerWaalsContact C-N 3.27Å; H79-Y81 HydrophobicContact CB-CD2 3.9Å; H79-Y81 HydrophobicContact CB-CE2 4.07Å; H79-Y81 WeakPolarHBondContact O-CD2 3.49Å; H79-Y81 PolarHBondContact O-N 3.41Å; Y81-L85 HydrophobicContact CD1-CB 3.86Å; Y81-L89 HydrophobicContact CE1-CD2 3.96Å; Y81-I104 HydrophobicContact CE2-CB 4.47Å; Y81-I104 HydrophobicContact CE2-CG1 4.3Å; Y81-I104 HydrophobicContact CE2-CG2 4.08Å; Y81-I104 WeakPolarHBondContact CE2-O 3.45Å; Y81-I104 PolarHBondContact OH-O 3.29Å; Y81-I104 VanDerWaalsContact OH-O 3.14Å; Y81-Y107 WeakPolarHBondContact CE2-O 3.31Å; Y81-Y107 WeakPolarHBondContact OH-CB 3.21Å; Y81-Y107 PolarHBondContact OH-O 3.22Å; Y81-P109 HydrophobicContact CD1-CG 3.87Å; Y81-P109 HydrophobicContact CD2-CG 3.59Å; Y81-P109 HydrophobicContact CE1-CG 4.03Å; Y81-P109 HydrophobicContact CE2-CG 3.75Å; Y81-P109 HydrophobicContact CG-CG 3.66Å
82	T	87.3	Confident	90.2	Very high	49 Å²	49	64 Å²	64	30%	0.301	30%	0.296	S	S	.	.			trans	-76	156.4	161	68.2	0	0	0	0	109.5	E84 L85 A86 Y111	T82-E84 PolarHBondContact O-N 3.31Å; T82-L85 HydrophobicContact CG2-CD1 4.48Å; T82-L85 PolarHBondContact O-N 2.93Å; T82-L85 VanDerWaalsContact O-N 3.14Å; T82-L85 WeakPolarHBondContact OG1-CG 3.23Å; T82-L85 PolarHBondContact OG1-N 3.22Å; T82-A86 PolarHBondContact O-N 2.81Å; T82-Y111 HydrophobicContact CG2-CE1 4.46Å
83	Q	90.5	Very high	90.1	Very high	135 Å²	135	65.3 Å²	65.3	63%	0.631	30%	0.302	S	S	*	.	H	α-helix	trans	-53.8	-41.6	175.3	177.5	176.7	-21.3	0	0	111.5	L73 A86 L87	L73-Q83 HydrophobicContact CD1-CG 4.25Å; L73-Q83 HydrophobicContact CD2-CG 4.11Å; Q83-A86 PolarHBondContact O-N 2.86Å; Q83-L87 HydrophobicContact CG-CD1 3.89Å; Q83-L87 HydrophobicContact CG-CG 4.42Å; Q83-L87 WeakPolarHBondContact O-CB 3.33Å; Q83-L87 WeakPolarHBondContact O-CG 3.15Å; Q83-L87 PolarHBondContact O-N 3.47Å
84	E	89.3	Confident	89.9	Confident	147 Å²	147	70.3 Å²	70.3	69%	0.687	33%	0.329	S	S	*	.	H	α-helix	trans	-60.2	-47.8	177	-64.1	166.9	171.7	0	0	112.1	T82 A86 L87 I88	T82-E84 PolarHBondContact O-N 3.31Å; E84-A86 PolarHBondContact O-N 3.25Å; E84-L87 PolarHBondContact O-N 3.04Å; E84-I88 WeakPolarHBondContact O-CD1 3.47Å; E84-I88 VanDerWaalsContact O-CG1 3.22Å; E84-I88 WeakPolarHBondContact O-CG1 3.49Å; E84-I88 PolarHBondContact O-N 2.88Å
85	L	88.9	Confident	89.9	Confident	67 Å²	67	66.5 Å²	66.5	35%	0.351	31%	0.31	S	S	.	.	H	α-helix	trans	-65.4	-37	179.2	-70.3	173.4	0	0	0	112.5	Y81 T82 I88 L89 P109	Y81-L85 HydrophobicContact CD1-CB 3.86Å; T82-L85 HydrophobicContact CG2-CD1 4.48Å; T82-L85 PolarHBondContact O-N 2.93Å; T82-L85 VanDerWaalsContact O-N 3.14Å; T82-L85 WeakPolarHBondContact OG1-CG 3.23Å; T82-L85 PolarHBondContact OG1-N 3.22Å; L85-I88 HydrophobicContact CD2-CD1 4.32Å; L85-I88 PolarHBondContact O-N 3.42Å; L85-L89 WeakPolarHBondContact O-CB 3.47Å; L85-L89 PolarHBondContact O-N 3.43Å; L85-P109 HydrophobicContact CD1-CB 3.92Å; L85-P109 HydrophobicContact CD1-CG 4.35Å
86	A	91.3	Very high	89.8	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-65.3	-43.5	174	0	0	0	0	0	111.4	Y72 L73 A76 T82 Q83 E84 I88 L89 L90	Y72-A86 HydrophobicContact CE1-CB 3.87Å; Y72-A86 WeakPolarHBondContact CE1-O 3.34Å; Y72-A86 PolarHBondContact OH-O 3.36Å; Y72-A86 VanDerWaalsContact OH-O 3.07Å; L73-A86 HydrophobicContact CD2-CB 3.73Å; A76-A86 HydrophobicContact CB-CB 3.63Å; T82-A86 PolarHBondContact O-N 2.81Å; Q83-A86 PolarHBondContact O-N 2.86Å; E84-A86 PolarHBondContact O-N 3.25Å; A86-I88 VanDerWaalsContact C-N 3.34Å; A86-I88 PolarHBondContact O-N 2.94Å; A86-L89 PolarHBondContact O-N 3.03Å; A86-L90 WeakPolarHBondContact O-CB 3.48Å; A86-L90 PolarHBondContact O-N 2.89Å
87	L	92.1	Very high	89.9	Confident	30 Å²	30	66.7 Å²	66.7	16%	0.157	32%	0.317	C	S	.	.	H	α-helix	trans	-65.2	-35.6	176.2	-66.3	169.6	0	0	0	112.3	W58 L69 L73 Q83 E84 H91	W58-L87 HydrophobicContact CE3-CB 3.83Å; W58-L87 HydrophobicContact CE3-CD2 4.07Å; W58-L87 HydrophobicContact CE3-CG 4.47Å; W58-L87 HydrophobicContact CH2-CD2 3.37Å; W58-L87 HydrophobicContact CZ2-CD2 3.88Å; W58-L87 HydrophobicContact CZ3-CB 3.87Å; W58-L87 HydrophobicContact CZ3-CD2 3.46Å; W58-L87 VanDerWaalsContact CZ3-CD2 3.46Å; W58-L87 HydrophobicContact CZ3-CG 4.24Å; L69-L87 HydrophobicContact CD1-CD2 3.99Å; L73-L87 HydrophobicContact CD2-CD2 4.33Å; L73-L87 HydrophobicContact CD2-CG 4.33Å; Q83-L87 HydrophobicContact CG-CD1 3.89Å; Q83-L87 HydrophobicContact CG-CG 4.42Å; Q83-L87 WeakPolarHBondContact O-CB 3.33Å; Q83-L87 WeakPolarHBondContact O-CG 3.15Å; Q83-L87 PolarHBondContact O-N 3.47Å; E84-L87 PolarHBondContact O-N 3.04Å; L87-H91 WeakPolarHBondContact O-CB 3.48Å; L87-H91 PolarHBondContact O-N 3.4Å
88	I	89.2	Confident	90.1	Very high	42 Å²	42	65.4 Å²	65.4	22%	0.215	32%	0.32	C	S	.	.	H	α-helix	trans	-62.2	-49.6	172.7	-71.6	161.3	0	0	0	111.1	I57 E84 L85 A86 L90 H91 W92	I57-I88 HydrophobicContact CG2-CD1 4.05Å; I57-I88 HydrophobicContact CG2-CG1 3.44Å; I57-I88 VanDerWaalsContact CG2-CG1 3.44Å; E84-I88 WeakPolarHBondContact O-CD1 3.47Å; E84-I88 VanDerWaalsContact O-CG1 3.22Å; E84-I88 WeakPolarHBondContact O-CG1 3.49Å; E84-I88 PolarHBondContact O-N 2.88Å; L85-I88 HydrophobicContact CD2-CD1 4.32Å; L85-I88 PolarHBondContact O-N 3.42Å; A86-I88 VanDerWaalsContact C-N 3.34Å; A86-I88 PolarHBondContact O-N 2.94Å; I88-L90 VanDerWaalsContact C-N 3.34Å; I88-L90 PolarHBondContact O-N 3.27Å; I88-H91 WeakPolarHBondContact O-CB 3.38Å; I88-H91 PolarHBondContact O-N 3.18Å; I88-H91 VanDerWaalsContact O-N 3.15Å; I88-W92 HydrophobicContact CG2-CD2 4.14Å; I88-W92 HydrophobicContact CG2-CE3 4.31Å; I88-W92 HydrophobicContact CG2-CH2 4.06Å; I88-W92 HydrophobicContact CG2-CZ2 3.86Å; I88-W92 HydrophobicContact CG2-CZ3 4.27Å; I88-W92 PolarHBondContact O-N 2.88Å
89	L	90.5	Very high	90.2	Very high	6 Å²	6	64.4 Å²	64.4	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-61.7	-44.2	179	-176.4	60.5	0	0	0	110.8	Y81 L85 A86 H91 W92 H93 I104	Y81-L89 HydrophobicContact CE1-CD2 3.96Å; L85-L89 WeakPolarHBondContact O-CB 3.47Å; L85-L89 PolarHBondContact O-N 3.43Å; A86-L89 PolarHBondContact O-N 3.03Å; L89-H91 VanDerWaalsContact C-N 3.32Å; L89-H91 PolarHBondContact O-N 3.23Å; L89-W92 HydrophobicContact CD1-CE3 4.15Å; L89-W92 PolarHBondContact O-N 3.22Å; L89-H93 WeakPolarHBondContact CD1-NE2 3.04Å; L89-H93 PolarHBondContact O-CD2 3.16Å; L89-H93 PolarHBondContact O-N 3.05Å; L89-I104 HydrophobicContact CD2-CG1 3.7Å
90	L	92.4	Very high	90.6	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.1	-37.3	174.2	-175.8	61	0	0	0	112.7	W58 P64 L69 Y72 A86 I88 H93 Y95 I97 A100	W58-L90 HydrophobicContact CH2-CD2 4.03Å; W58-L90 HydrophobicContact CZ3-CD2 4.11Å; W58-L90 HydrophobicContact CZ3-CG 4.44Å; P64-L90 HydrophobicContact CG-CD2 4.17Å; L69-L90 HydrophobicContact CD1-CD2 3.47Å; L69-L90 VanDerWaalsContact CD1-CD2 3.47Å; Y72-L90 HydrophobicContact CD1-CD2 4.13Å; Y72-L90 HydrophobicContact CE1-CB 3.9Å; Y72-L90 HydrophobicContact CE1-CD2 4.17Å; Y72-L90 HydrophobicContact CE1-CG 4.49Å; A86-L90 WeakPolarHBondContact O-CB 3.48Å; A86-L90 PolarHBondContact O-N 2.89Å; I88-L90 VanDerWaalsContact C-N 3.34Å; I88-L90 PolarHBondContact O-N 3.27Å; L90-H93 PolarHBondContact O-N 3.47Å; L90-Y95 HydrophobicContact CG-CD1 4.43Å; L90-Y95 WeakPolarHBondContact O-CA 3.1Å; L90-Y95 PolarHBondContact O-N 3.38Å; L90-I97 HydrophobicContact CD1-CG1 3.94Å; L90-A100 HydrophobicContact CD1-CB 4.09Å
91	H	92.1	Very high	90.9	Very high	34 Å²	34	57.8 Å²	57.8	16%	0.157	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-44.9	172.9	-178	63.6	0	0	0	111.8	S56 I57 L87 I88 L89 H93 N94 Y95	S56-H91 PolarHBondContact O-CD2 3.06Å; S56-H91 PolarHBondContact O-NE2 3.37Å; S56-H91 VanDerWaalsContact O-NE2 3.12Å; S56-H91 PolarHBondContact OG-CE1 2.93Å; S56-H91 PolarHBondContact OG-NE2 3.12Å; I57-H91 WeakPolarHBondContact O-CB 3.27Å; L87-H91 WeakPolarHBondContact O-CB 3.48Å; L87-H91 PolarHBondContact O-N 3.4Å; I88-H91 WeakPolarHBondContact O-CB 3.38Å; I88-H91 PolarHBondContact O-N 3.18Å; I88-H91 VanDerWaalsContact O-N 3.15Å; L89-H91 VanDerWaalsContact C-N 3.32Å; L89-H91 PolarHBondContact O-N 3.23Å; H91-H93 VanDerWaalsContact C-N 3.29Å; H91-H93 PolarHBondContact O-N 3.16Å; H91-N94 WeakPolarHBondContact O-CA 3.37Å; H91-N94 PolarHBondContact O-N 2.82Å; H91-Y95 AromaticContact ND1-CE2 3.53Å; H91-Y95 AromaticContact ND1-CZ 3.48Å; H91-Y95 PolarHBondContact ND1-OH 2.99Å
92	W	90	Very high	91.2	Very high	176 Å²	176	62.2 Å²	62.2	67%	0.667	31%	0.31	S	S	*	.	H	α-helix	trans	-60.4	-35.2	175.6	-71.7	-22.2	0	0	0	113.2	I88 L89 N94	I88-W92 HydrophobicContact CG2-CD2 4.14Å; I88-W92 HydrophobicContact CG2-CE3 4.31Å; I88-W92 HydrophobicContact CG2-CH2 4.06Å; I88-W92 HydrophobicContact CG2-CZ2 3.86Å; I88-W92 HydrophobicContact CG2-CZ3 4.27Å; I88-W92 PolarHBondContact O-N 2.88Å; L89-W92 HydrophobicContact CD1-CE3 4.15Å; L89-W92 PolarHBondContact O-N 3.22Å; W92-N94 PolarHBondContact O-N 2.98Å
93	H	91.1	Very high	91.3	Very high	32 Å²	32	61.8 Å²	61.8	15%	0.148	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	15.6	173	-65.9	-65.6	0	0	0	114.4	L89 L90 H91 Y95 S96 K99 A100 D103	L89-H93 WeakPolarHBondContact CD1-NE2 3.04Å; L89-H93 PolarHBondContact O-CD2 3.16Å; L89-H93 PolarHBondContact O-N 3.05Å; L90-H93 PolarHBondContact O-N 3.47Å; H91-H93 VanDerWaalsContact C-N 3.29Å; H91-H93 PolarHBondContact O-N 3.16Å; H93-Y95 VanDerWaalsContact C-N 3.26Å; H93-Y95 PolarHBondContact O-N 3.1Å; H93-S96 WeakPolarHBondContact O-CB 3.44Å; H93-S96 PolarHBondContact O-N 2.97Å; H93-S96 VanDerWaalsContact O-N 3.11Å; H93-K99 HydrophobicContact CB-CB 4.11Å; H93-A100 HydrophobicContact CB-CB 4.32Å; H93-A100 VanDerWaalsContact CD2-CA 3.46Å; H93-A100 WeakPolarHBondContact CD2-CA 3.42Å; H93-D103 IonicContact CE1-OD2 2.66Å; H93-D103 PolarHBondContact CE1-OD2 2.95Å; H93-D103 IonicContact NE2-OD2 2.74Å
94	N	90.5	Very high	91.3	Very high	131 Å²	131	55.4 Å²	55.4	70%	0.701	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	43.5	-176.6	-67.1	-71.1	0	0	0	112.6	H91 W92 S96	H91-N94 WeakPolarHBondContact O-CA 3.37Å; H91-N94 PolarHBondContact O-N 2.82Å; W92-N94 PolarHBondContact O-N 2.98Å; N94-S96 PolarHBondContact O-N 3.2Å
95	Y	92.1	Very high	91.2	Very high	23 Å²	23	51.7 Å²	51.7	9%	0.09	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	12.3	179.9	-57.2	-89.1	0	0	0	115.1	W58 M59 K62 L90 H91 H93 I97	W58-Y95 HydrophobicContact CD2-CE1 4.19Å; W58-Y95 AromaticContact CE3-CE1 3.71Å; W58-Y95 HydrophobicContact CE3-CE1 3.71Å; W58-Y95 HydrophobicContact CH2-CD1 4.07Å; W58-Y95 AromaticContact CH2-CE1 3.61Å; W58-Y95 HydrophobicContact CH2-CE1 3.61Å; W58-Y95 HydrophobicContact CZ2-CE1 4.1Å; W58-Y95 HydrophobicContact CZ3-CD1 4.08Å; W58-Y95 AromaticContact CZ3-CE1 3.41Å; W58-Y95 HydrophobicContact CZ3-CE1 3.41Å; W58-Y95 VanDerWaalsContact CZ3-CE1 3.41Å; M59-Y95 HydrophobicContact CB-CE2 4.45Å; M59-Y95 PolarHBondContact N-OH 3.11Å; K62-Y95 HydrophobicContact CB-CD1 4.34Å; K62-Y95 HydrophobicContact CB-CD2 3.47Å; K62-Y95 VanDerWaalsContact CB-CD2 3.47Å; K62-Y95 HydrophobicContact CB-CE1 4.38Å; K62-Y95 HydrophobicContact CB-CE2 3.57Å; K62-Y95 HydrophobicContact CB-CG 3.92Å; K62-Y95 HydrophobicContact CD-CD2 4.06Å; K62-Y95 HydrophobicContact CD-CE2 3.97Å; K62-Y95 HydrophobicContact CG-CD2 4.43Å; K62-Y95 HydrophobicContact CG-CE2 4.41Å; K62-Y95 WeakPolarHBondContact O-CB 3.44Å; K62-Y95 WeakPolarHBondContact O-CD1 3.34Å; L90-Y95 HydrophobicContact CG-CD1 4.43Å; L90-Y95 WeakPolarHBondContact O-CA 3.1Å; L90-Y95 PolarHBondContact O-N 3.38Å; H91-Y95 AromaticContact ND1-CE2 3.53Å; H91-Y95 AromaticContact ND1-CZ 3.48Å; H91-Y95 PolarHBondContact ND1-OH 2.99Å; H93-Y95 VanDerWaalsContact C-N 3.26Å; H93-Y95 PolarHBondContact O-N 3.1Å; Y95-I97 PolarHBondContact O-N 3.44Å
96	S	91.9	Very high	90.9	Very high	36 Å²	36	53.8 Å²	53.8	25%	0.252	28%	0.277	S	S	.	.			trans	-79.9	97.6	174.3	-167.6	0	0	0	0	111	H93 N94 K99 A100	H93-S96 WeakPolarHBondContact O-CB 3.44Å; H93-S96 PolarHBondContact O-N 2.97Å; H93-S96 VanDerWaalsContact O-N 3.11Å; N94-S96 PolarHBondContact O-N 3.2Å; S96-K99 PolarHBondContact O-N 3.41Å; S96-A100 PolarHBondContact O-N 2.92Å
97	I	93.3	Very high	90.5	Very high	30 Å²	30	60.3 Å²	60.3	15%	0.154	30%	0.302	C	S	.	.	H	α-helix	trans	-51	-49.9	176.4	-66.2	176.1	0	0	0	113.8	P64 E68 Y72 L90 Y95 K99 A100 V101	P64-I97 HydrophobicContact CB-CD1 3.77Å; P64-I97 HydrophobicContact CB-CG1 4.33Å; P64-I97 HydrophobicContact CG-CD1 3.73Å; P64-I97 HydrophobicContact CG-CG1 4.08Å; E68-I97 HydrophobicContact CB-CD1 3.38Å; Y72-I97 HydrophobicContact CD2-CG2 4.29Å; L90-I97 HydrophobicContact CD1-CG1 3.94Å; Y95-I97 PolarHBondContact O-N 3.44Å; I97-K99 VanDerWaalsContact C-N 3.34Å; I97-K99 PolarHBondContact O-N 3.13Å; I97-A100 PolarHBondContact O-N 3.02Å; I97-A100 VanDerWaalsContact O-N 3.12Å; I97-V101 HydrophobicContact CG2-CG2 4.1Å; I97-V101 WeakPolarHBondContact O-CG2 3.37Å; I97-V101 PolarHBondContact O-N 3.39Å
98	P	93.2	Very high	89.4	Confident	84 Å²	84	64.2 Å²	64.2	55%	0.545	33%	0.327	S	S	.	.	H	α-helix	trans	-59.4	-43.7	-176.4	20.7	-32.7	0	0	0	112.4	A100 V101 D102	P98-A100 VanDerWaalsContact C-N 3.32Å; P98-A100 PolarHBondContact O-N 2.81Å; P98-V101 WeakPolarHBondContact O-CB 3.42Å; P98-V101 PolarHBondContact O-N 2.95Å; P98-V101 VanDerWaalsContact O-N 3.14Å; P98-D102 VanDerWaalsContact O-CG 3.3Å; P98-D102 PolarHBondContact O-N 3.05Å
99	K	92.1	Very high	88.3	Confident	124 Å²	124	63 Å²	63	54%	0.539	32%	0.322	S	S	.	.	H	α-helix	trans	-61.8	-40.6	176.8	-61.5	-177.8	-177.4	-179	0	112.3	H93 S96 I97 V101 D102 D103	H93-K99 HydrophobicContact CB-CB 4.11Å; S96-K99 PolarHBondContact O-N 3.41Å; I97-K99 VanDerWaalsContact C-N 3.34Å; I97-K99 PolarHBondContact O-N 3.13Å; K99-V101 VanDerWaalsContact C-N 3.32Å; K99-D102 PolarHBondContact O-N 3.3Å; K99-D103 PolarHBondContact O-N 3.25Å
100	A	92.8	Very high	86.8	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-70.2	-28.5	177.8	0	0	0	0	0	112.7	Y72 L90 H93 S96 I97 P98 I104	Y72-A100 HydrophobicContact CD2-CB 4.43Å; Y72-A100 HydrophobicContact CE2-CB 3.51Å; L90-A100 HydrophobicContact CD1-CB 4.09Å; H93-A100 HydrophobicContact CB-CB 4.32Å; H93-A100 VanDerWaalsContact CD2-CA 3.46Å; H93-A100 WeakPolarHBondContact CD2-CA 3.42Å; S96-A100 PolarHBondContact O-N 2.92Å; I97-A100 PolarHBondContact O-N 3.02Å; I97-A100 VanDerWaalsContact O-N 3.12Å; P98-A100 VanDerWaalsContact C-N 3.32Å; P98-A100 PolarHBondContact O-N 2.81Å; A100-I104 WeakPolarHBondContact O-CD1 3.41Å; A100-I104 VanDerWaalsContact O-CG1 3.23Å; A100-I104 WeakPolarHBondContact O-CG1 3.46Å; A100-I104 PolarHBondContact O-N 2.69Å
101	V	92.3	Very high	85.5	Confident	44 Å²	44	73.7 Å²	73.7	27%	0.267	38%	0.376	S	S	.	.	H	α-helix	trans	-70.6	-44.4	172.2	167.6	0	0	0	0	110.9	Y72 F75 I97 P98 K99 D103 I104 P105	Y72-V101 HydrophobicContact CD2-CG2 3.84Å; Y72-V101 HydrophobicContact CE2-CG2 4.32Å; F75-V101 HydrophobicContact CD1-CG1 4.21Å; F75-V101 HydrophobicContact CD1-CG2 4.19Å; F75-V101 HydrophobicContact CE1-CB 4.31Å; F75-V101 HydrophobicContact CE1-CG1 3.72Å; F75-V101 HydrophobicContact CE1-CG2 4.43Å; F75-V101 HydrophobicContact CZ-CG1 4.08Å; I97-V101 HydrophobicContact CG2-CG2 4.1Å; I97-V101 WeakPolarHBondContact O-CG2 3.37Å; I97-V101 PolarHBondContact O-N 3.39Å; P98-V101 WeakPolarHBondContact O-CB 3.42Å; P98-V101 PolarHBondContact O-N 2.95Å; P98-V101 VanDerWaalsContact O-N 3.14Å; K99-V101 VanDerWaalsContact C-N 3.32Å; V101-D103 VanDerWaalsContact C-N 3.27Å; V101-D103 PolarHBondContact O-N 3.2Å; V101-I104 PolarHBondContact O-N 3.18Å; V101-P105 VanDerWaalsContact O-CD 3.29Å; V101-P105 WeakPolarHBondContact O-CD 3.31Å
102	D	91.9	Very high	84.1	Confident	115 Å²	115	76.3 Å²	76.3	62%	0.615	39%	0.391	S	S	*	.	H	α-helix	trans	-62.1	-33.4	178.8	-65.4	-27.7	0	0	0	112.6	P98 K99 N106	P98-D102 VanDerWaalsContact O-CG 3.3Å; P98-D102 PolarHBondContact O-N 3.05Å; K99-D102 PolarHBondContact O-N 3.3Å; D102-N106 PolarHBondContact O-ND2 2.67Å
103	D	90.9	Very high	83.4	Confident	40 Å²	40	72.5 Å²	72.5	21%	0.214	38%	0.38	C	S	.	.	H	α-helix	trans	-91.8	-16.9	-178.4	-97.4	-28.3	0	0	0	115.3	H93 K99 V101 P105 N106 Y107	H93-D103 IonicContact CE1-OD2 2.66Å; H93-D103 PolarHBondContact CE1-OD2 2.95Å; H93-D103 IonicContact NE2-OD2 2.74Å; K99-D103 PolarHBondContact O-N 3.25Å; V101-D103 VanDerWaalsContact C-N 3.27Å; V101-D103 PolarHBondContact O-N 3.2Å; D103-P105 VanDerWaalsContact C-N 3.34Å; D103-N106 WeakPolarHBondContact O-CB 3.21Å; D103-N106 PolarHBondContact O-N 3.26Å; D103-N106 PolarHBondContact OD1-ND2 2.64Å; D103-Y107 HydrophobicContact CB-CD2 4.25Å; D103-Y107 HydrophobicContact CB-CE2 3.91Å; D103-Y107 VanDerWaalsContact O-CD2 3.31Å; D103-Y107 WeakPolarHBondContact O-CD2 3.15Å; D103-Y107 PolarHBondContact O-N 3.16Å
104	I	89.4	Confident	83	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.005	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-43.9	175.8	-90.1	163.1	0	0	0	113.2	Y72 F75 A76 H79 Y81 L89 A100 V101 N106	Y72-I104 HydrophobicContact CD2-CD1 4.15Å; Y72-I104 HydrophobicContact CE2-CD1 3.36Å; Y72-I104 HydrophobicContact CE2-CG1 4.44Å; F75-I104 HydrophobicContact CD1-CD1 3.75Å; F75-I104 HydrophobicContact CD1-CG2 4.26Å; F75-I104 HydrophobicContact CE1-CB 4.01Å; F75-I104 HydrophobicContact CE1-CD1 4.02Å; F75-I104 HydrophobicContact CE1-CG2 3.73Å; F75-I104 HydrophobicContact CZ-CG2 4.49Å; A76-I104 HydrophobicContact CB-CD1 3.63Å; A76-I104 HydrophobicContact CB-CG1 4.46Å; H79-I104 HydrophobicContact CB-CG2 3.52Å; H79-I104 VanDerWaalsContact CD2-CG2 3.46Å; H79-I104 WeakPolarHBondContact CD2-CG2 3.5Å; Y81-I104 HydrophobicContact CE2-CB 4.47Å; Y81-I104 HydrophobicContact CE2-CG1 4.3Å; Y81-I104 HydrophobicContact CE2-CG2 4.08Å; Y81-I104 WeakPolarHBondContact CE2-O 3.45Å; Y81-I104 PolarHBondContact OH-O 3.29Å; Y81-I104 VanDerWaalsContact OH-O 3.14Å; L89-I104 HydrophobicContact CD2-CG1 3.7Å; A100-I104 WeakPolarHBondContact O-CD1 3.41Å; A100-I104 VanDerWaalsContact O-CG1 3.23Å; A100-I104 WeakPolarHBondContact O-CG1 3.46Å; A100-I104 PolarHBondContact O-N 2.69Å; V101-I104 PolarHBondContact O-N 3.18Å; I104-N106 VanDerWaalsContact C-N 3.29Å; I104-N106 PolarHBondContact O-N 3.41Å
105	P	86.6	Confident	82.7	Confident	69 Å²	69	67.7 Å²	67.7	45%	0.448	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-25.6	176.6	-22.2	34.3	0	0	0	114.2	V101 D103	V101-P105 VanDerWaalsContact O-CD 3.29Å; V101-P105 WeakPolarHBondContact O-CD 3.31Å; D103-P105 VanDerWaalsContact C-N 3.34Å
106	N	84.2	Confident	82.3	Confident	112 Å²	112	72.6 Å²	72.6	60%	0.599	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-32.8	-174.1	-63.7	-29.7	0	0	0	112.3	D102 D103 I104	D102-N106 PolarHBondContact O-ND2 2.67Å; D103-N106 WeakPolarHBondContact O-CB 3.21Å; D103-N106 PolarHBondContact O-N 3.26Å; D103-N106 PolarHBondContact OD1-ND2 2.64Å; I104-N106 VanDerWaalsContact C-N 3.29Å; I104-N106 PolarHBondContact O-N 3.41Å
107	Y	82.3	Confident	82	Confident	137 Å²	137	72.8 Å²	72.8	54%	0.537	39%	0.386	S	S	.	.			trans	-105.7	124.1	177.4	-51.3	-81.3	0	0	0	110.4	Y81 D103	Y81-Y107 WeakPolarHBondContact CE2-O 3.31Å; Y81-Y107 WeakPolarHBondContact OH-CB 3.21Å; Y81-Y107 PolarHBondContact OH-O 3.22Å; D103-Y107 HydrophobicContact CB-CD2 4.25Å; D103-Y107 HydrophobicContact CB-CE2 3.91Å; D103-Y107 VanDerWaalsContact O-CD2 3.31Å; D103-Y107 WeakPolarHBondContact O-CD2 3.15Å; D103-Y107 PolarHBondContact O-N 3.16Å
108	V	69.4	Low	81.8	Confident	113 Å²	113	73.1 Å²	73.1	69%	0.685	39%	0.387	S	S	*	.			trans	-96.5	123.7	170	178.5	0	0	0	0	108.1	V110	V108-V110 PolarHBondContact O-N 3.02Å
109	P	65.4	Low	81.5	Confident	15 Å²	15	69.1 Å²	69.1	10%	0.097	36%	0.361	C	S	.	.			trans	-52.3	101.6	173.9	-31.5	38.1	0	0	0	112.4	Y81 L85 Y111	Y81-P109 HydrophobicContact CD1-CG 3.87Å; Y81-P109 HydrophobicContact CD2-CG 3.59Å; Y81-P109 HydrophobicContact CE1-CG 4.03Å; Y81-P109 HydrophobicContact CE2-CG 3.75Å; Y81-P109 HydrophobicContact CG-CG 3.66Å; L85-P109 HydrophobicContact CD1-CB 3.92Å; L85-P109 HydrophobicContact CD1-CG 4.35Å; P109-Y111 HydrophobicContact CB-CE2 4.09Å; P109-Y111 VanDerWaalsContact O-CD2 3.25Å; P109-Y111 WeakPolarHBondContact O-CD2 3.19Å; P109-Y111 PolarHBondContact O-N 2.92Å
110	V	59.7	Low	81.2	Confident	127 Å²	127	69 Å²	69	77%	0.77	36%	0.36	S	S	*	.			trans	-76.4	84	172.2	-173.9	0	0	0	0	107.6	V108	V108-V110 PolarHBondContact O-N 3.02Å
111	Y	64.2	Low	81	Confident	105 Å²	105	74.8 Å²	74.8	41%	0.412	39%	0.385	S	S	.	.			trans	-44.9	150.1	161.4	-68.6	-86.6	0	0	0	109.6	Q80 T82 P109 K113	Q80-Y111 PolarHBondContact O-OH 2.82Å; T82-Y111 HydrophobicContact CG2-CE1 4.46Å; P109-Y111 HydrophobicContact CB-CE2 4.09Å; P109-Y111 VanDerWaalsContact O-CD2 3.25Å; P109-Y111 WeakPolarHBondContact O-CD2 3.19Å; P109-Y111 PolarHBondContact O-N 2.92Å; Y111-K113 WeakPolarHBondContact O-CG 3.41Å; Y111-K113 PolarHBondContact O-N 3.42Å
112	N	63.8	Low	80.8	Confident	89 Å²	89	72.8 Å²	72.8	48%	0.476	37%	0.373	S	S	.	.			trans	-67.9	66.1	-179.2	-79.8	-20.6	0	0	0	112.5	W114 D148	N112-W114 PolarHBondContact O-NE1 3.33Å; N112-D148 PolarHBondContact ND2-OD1 3.16Å
113	K	74.6	Confident	80.6	Confident	96 Å²	96	67.4 Å²	67.4	42%	0.417	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-83.1	118.7	-179.8	-63.8	178.5	-177.8	179.8	0	108.2	Y111 R144 L185 T187	Y111-K113 WeakPolarHBondContact O-CG 3.41Å; Y111-K113 PolarHBondContact O-N 3.42Å; K113-R144 PolarHBondContact O-NH1 3.09Å; K113-R144 PolarHBondContact O-NH2 3.05Å; K113-L185 CarbonylContact C-O 3.54Å; K113-L185 WeakPolarHBondContact CA-O 3Å; K113-T187 HydrophobicContact CB-CG2 3.31Å; K113-T187 HydrophobicContact CD-CG2 3.97Å; K113-T187 HydrophobicContact CG-CG2 4.27Å
114	W	83	Confident	80.3	Confident	5 Å²	5	75 Å²	75	2%	0.019	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-84	135.6	-178.9	-67.5	74.7	0	0	0	111.2	N112 E118 V119 V141 R144 D148 I149 L152 L185 V186 T187	N112-W114 PolarHBondContact O-NE1 3.33Å; W114-E118 HydrophobicContact CE3-CB 3.81Å; W114-E118 HydrophobicContact CZ3-CB 4.38Å; W114-V119 HydrophobicContact CB-CG2 3.46Å; W114-V119 VanDerWaalsContact CB-CG2 3.46Å; W114-V119 HydrophobicContact CE3-CG2 4.49Å; W114-V119 HydrophobicContact CG-CG2 4.18Å; W114-V141 HydrophobicContact CH2-CG2 4.37Å; W114-V141 HydrophobicContact CZ3-CB 4.43Å; W114-V141 HydrophobicContact CZ3-CG1 4.34Å; W114-V141 HydrophobicContact CZ3-CG2 4.09Å; W114-R144 HydrophobicContact CE3-CG 4.21Å; W114-R144 HydrophobicContact CH2-CB 3.77Å; W114-R144 HydrophobicContact CH2-CG 3.59Å; W114-R144 HydrophobicContact CZ2-CB 4.25Å; W114-R144 HydrophobicContact CZ2-CG 4.05Å; W114-R144 HydrophobicContact CZ3-CB 4.29Å; W114-R144 HydrophobicContact CZ3-CG 3.69Å; W114-D148 HydrophobicContact CZ2-CB 3.77Å; W114-D148 WeakPolarHBondContact CZ2-O 3.49Å; W114-I149 HydrophobicContact CH2-CB 4.5Å; W114-I149 HydrophobicContact CH2-CG1 3.91Å; W114-L152 HydrophobicContact CD2-CD1 4.38Å; W114-L152 HydrophobicContact CD2-CD2 3.68Å; W114-L152 HydrophobicContact CD2-CG 4.41Å; W114-L152 HydrophobicContact CE3-CD2 3.59Å; W114-L152 HydrophobicContact CG-CD1 4.31Å; W114-L152 HydrophobicContact CG-CD2 4.36Å; W114-L152 HydrophobicContact CH2-CB 4.32Å; W114-L152 HydrophobicContact CH2-CD2 3.84Å; W114-L152 HydrophobicContact CZ2-CB 3.75Å; W114-L152 HydrophobicContact CZ2-CD2 3.92Å; W114-L152 HydrophobicContact CZ2-CG 4.4Å; W114-L152 HydrophobicContact CZ3-CD2 3.66Å; W114-L185 WeakPolarHBondContact CB-O 3.22Å; W114-L185 PolarHBondContact N-O 3.08Å; W114-V186 CarbonylContact O-C 3.54Å; W114-V186 WeakPolarHBondContact O-CA 3.34Å; W114-V186 WeakPolarHBondContact O-CG1 3.41Å; W114-T187 PolarHBondContact O-N 3.4Å; W114-T187 PolarHBondContact O-OG1 2.91Å
115	T	83.9	Confident	80.1	Confident	56 Å²	56	75.1 Å²	75.1	34%	0.344	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-69	152.7	172	61.7	0	0	0	0	111.5	G117 E118 V119 T187	T115-G117 PolarHBondContact O-N 3.4Å; T115-G117 VanDerWaalsContact O-N 3.11Å; T115-E118 WeakPolarHBondContact CB-OE2 3.06Å; T115-E118 WeakPolarHBondContact CG2-OE2 2.96Å; T115-E118 PolarHBondContact N-OE2 3.25Å; T115-E118 PolarHBondContact O-N 3.17Å; T115-E118 WeakPolarHBondContact OG1-CB 3.48Å; T115-E118 WeakPolarHBondContact OG1-CG 3.3Å; T115-E118 PolarHBondContact OG1-N 3.47Å; T115-E118 VanDerWaalsContact OG1-N 3.09Å; T115-E118 PolarHBondContact OG1-OE2 3.15Å; T115-V119 PolarHBondContact O-N 3.1Å; T115-T187 WeakPolarHBondContact CA-OG1 3.35Å; T115-T187 PolarHBondContact N-OG1 2.83Å
116	K	83.4	Confident	80.1	Confident	127 Å²	127	71.9 Å²	71.9	55%	0.552	35%	0.35	S	S	*	.	H	α-helix	trans	-51.4	-33.3	170.9	179.5	168.6	-176.1	179.1	0	112.1	K120 F177	K116-K120 WeakPolarHBondContact O-CB 3.29Å; K116-K120 VanDerWaalsContact O-CG 3.31Å; K116-K120 WeakPolarHBondContact O-CG 3.46Å; K116-K120 PolarHBondContact O-N 3.23Å; K116-F177 HydrophobicContact CB-CE2 4.36Å; K116-F177 HydrophobicContact CB-CZ 4.24Å; K116-F177 HydrophobicContact CD-CZ 4.12Å; K116-F177 HydrophobicContact CG-CE2 3.94Å; K116-F177 HydrophobicContact CG-CZ 3.68Å
117	G	85.5	Confident	79.8	Confident	39 Å²	39	67.4 Å²	67.4	40%	0.402	33%	0.326	S	S	.	.	H	α-helix	trans	-69.5	-48.6	174	0	0	0	0	0	113.5	T115 K120 K121	T115-G117 PolarHBondContact O-N 3.4Å; T115-G117 VanDerWaalsContact O-N 3.11Å; G117-K120 PolarHBondContact O-N 2.93Å; G117-K121 WeakPolarHBondContact O-CG 3.18Å; G117-K121 PolarHBondContact O-N 2.98Å
118	E	89.5	Confident	79.7	Confident	38 Å²	38	62.4 Å²	62.4	18%	0.178	31%	0.311	C	S	.	.	H	α-helix	trans	-61	-45.9	177.5	-72.2	166.6	112.9	0	0	112.2	W114 T115 K120 K121 F122 V141 R144	W114-E118 HydrophobicContact CE3-CB 3.81Å; W114-E118 HydrophobicContact CZ3-CB 4.38Å; T115-E118 WeakPolarHBondContact CB-OE2 3.06Å; T115-E118 WeakPolarHBondContact CG2-OE2 2.96Å; T115-E118 PolarHBondContact N-OE2 3.25Å; T115-E118 PolarHBondContact O-N 3.17Å; T115-E118 WeakPolarHBondContact OG1-CB 3.48Å; T115-E118 WeakPolarHBondContact OG1-CG 3.3Å; T115-E118 PolarHBondContact OG1-N 3.47Å; T115-E118 VanDerWaalsContact OG1-N 3.09Å; T115-E118 PolarHBondContact OG1-OE2 3.15Å; E118-K120 VanDerWaalsContact C-N 3.32Å; E118-K120 PolarHBondContact O-N 2.71Å; E118-K121 PolarHBondContact O-N 2.58Å; E118-F122 WeakPolarHBondContact O-CB 3.25Å; E118-F122 PolarHBondContact O-N 3.34Å; E118-V141 HydrophobicContact CB-CG1 3.93Å; E118-V141 HydrophobicContact CG-CG1 3.99Å; E118-R144 IonicContact OE1-CZ 3.44Å; E118-R144 IonicContact OE1-NE 3.68Å; E118-R144 PolarHBondContact OE1-NE 3.44Å; E118-R144 IonicContact OE1-NH2 3.98Å; E118-R144 PolarHBondContact OE1-NH2 3.23Å; E118-R144 IonicContact OE2-CZ 2.72Å; E118-R144 IonicContact OE2-NE 3.14Å; E118-R144 IonicContact OE2-NH2 2.71Å; E118-R144 PolarHBondContact OE2-NH2 3.27Å
119	V	87.8	Confident	80	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.5	-38.5	178.6	-178	0	0	0	0	111.4	W114 T115 F122 L123 L152 I156 F177 A180 V186	W114-V119 HydrophobicContact CB-CG2 3.46Å; W114-V119 VanDerWaalsContact CB-CG2 3.46Å; W114-V119 HydrophobicContact CE3-CG2 4.49Å; W114-V119 HydrophobicContact CG-CG2 4.18Å; T115-V119 PolarHBondContact O-N 3.1Å; V119-F122 PolarHBondContact O-N 3.11Å; V119-L123 HydrophobicContact CG1-CD1 3.84Å; V119-L123 HydrophobicContact CG1-CG 4.19Å; V119-L123 WeakPolarHBondContact O-CB 3.4Å; V119-L123 VanDerWaalsContact O-CG 3.27Å; V119-L123 WeakPolarHBondContact O-CG 3.1Å; V119-L123 PolarHBondContact O-N 3.04Å; V119-L152 HydrophobicContact CG2-CD1 4.43Å; V119-L152 HydrophobicContact CG2-CD2 4.32Å; V119-I156 HydrophobicContact CG1-CD1 4.26Å; V119-F177 HydrophobicContact CB-CD2 4.25Å; V119-F177 HydrophobicContact CB-CE2 4.32Å; V119-F177 HydrophobicContact CG1-CD2 3.87Å; V119-F177 HydrophobicContact CG1-CE2 4.4Å; V119-A180 HydrophobicContact CG1-CB 4.13Å; V119-V186 HydrophobicContact CG2-CG2 3.99Å
120	K	85.8	Confident	80.6	Confident	121 Å²	121	69.7 Å²	69.7	53%	0.526	34%	0.34	S	S	.	.	H	α-helix	trans	-64.3	-41.7	174.2	-78.8	-176.7	174.6	-165	0	112.6	K116 G117 E118 R124	K116-K120 WeakPolarHBondContact O-CB 3.29Å; K116-K120 VanDerWaalsContact O-CG 3.31Å; K116-K120 WeakPolarHBondContact O-CG 3.46Å; K116-K120 PolarHBondContact O-N 3.23Å; G117-K120 PolarHBondContact O-N 2.93Å; E118-K120 VanDerWaalsContact C-N 3.32Å; E118-K120 PolarHBondContact O-N 2.71Å; K120-R124 WeakPolarHBondContact O-CB 3.42Å; K120-R124 PolarHBondContact O-N 2.89Å; K120-R124 VanDerWaalsContact O-N 3.13Å
121	K	87.4	Confident	81.4	Confident	122 Å²	122	68.3 Å²	68.3	53%	0.53	32%	0.321	S	S	.	.	H	α-helix	trans	-62.2	-49.3	174.5	-73.2	177.1	179.1	-175.9	0	111.1	G117 E118 L123 R124 C125 V141	G117-K121 WeakPolarHBondContact O-CG 3.18Å; G117-K121 PolarHBondContact O-N 2.98Å; E118-K121 PolarHBondContact O-N 2.58Å; K121-L123 PolarHBondContact O-N 2.9Å; K121-R124 PolarHBondContact O-N 2.77Å; K121-C125 PolarHBondContact O-N 3.07Å; K121-V141 HydrophobicContact CB-CG1 4.49Å
122	F	89.2	Confident	82.1	Confident	1 Å²	1	67.4 Å²	67.4	0%	0.004	32%	0.319	C	S	.	.	H	α-helix	trans	-57.4	-49.1	177.1	167.2	-94.5	0	0	0	112.3	E118 V119 R124 C125 I126 A137 I149 L152 Y153 I156	E118-F122 WeakPolarHBondContact O-CB 3.25Å; E118-F122 PolarHBondContact O-N 3.34Å; V119-F122 PolarHBondContact O-N 3.11Å; F122-R124 VanDerWaalsContact C-N 3.33Å; F122-R124 PolarHBondContact O-N 3.11Å; F122-C125 PolarHBondContact O-N 3.17Å; F122-C125 VanDerWaalsContact O-N 3.17Å; F122-I126 HydrophobicContact CD1-CG1 4.45Å; F122-I126 HydrophobicContact CD2-CG1 3.98Å; F122-I126 HydrophobicContact CE1-CG1 4.04Å; F122-I126 HydrophobicContact CE2-CD1 3.92Å; F122-I126 HydrophobicContact CE2-CG1 3.52Å; F122-I126 HydrophobicContact CG-CG1 4.42Å; F122-I126 HydrophobicContact CZ-CD1 4.21Å; F122-I126 HydrophobicContact CZ-CG1 3.56Å; F122-I126 WeakPolarHBondContact O-CG1 3.16Å; F122-I126 PolarHBondContact O-N 3.08Å; F122-A137 HydrophobicContact CD2-CB 4.27Å; F122-I149 HydrophobicContact CD2-CG2 4.02Å; F122-I149 HydrophobicContact CE2-CG2 3.71Å; F122-L152 HydrophobicContact CB-CD2 4.19Å; F122-L152 HydrophobicContact CD1-CD2 3.39Å; F122-L152 HydrophobicContact CD1-CG 4.13Å; F122-L152 HydrophobicContact CD2-CD2 4.09Å; F122-L152 HydrophobicContact CE1-CD2 3.68Å; F122-L152 HydrophobicContact CE1-CG 3.92Å; F122-L152 HydrophobicContact CE2-CD2 4.34Å; F122-L152 HydrophobicContact CG-CD2 3.61Å; F122-L152 HydrophobicContact CZ-CD2 4.14Å; F122-L152 HydrophobicContact CZ-CG 4.27Å; F122-Y153 HydrophobicContact CZ-CD2 4.36Å; F122-I156 HydrophobicContact CD1-CD1 4.39Å; F122-I156 HydrophobicContact CE1-CD1 4.01Å
123	L	87.2	Confident	83.1	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.01	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-38.1	179.5	-73.9	172.5	0	0	0	112.4	V119 K121 C125 D127 I156 F160 I173 C176 F177	V119-L123 HydrophobicContact CG1-CD1 3.84Å; V119-L123 HydrophobicContact CG1-CG 4.19Å; V119-L123 WeakPolarHBondContact O-CB 3.4Å; V119-L123 VanDerWaalsContact O-CG 3.27Å; V119-L123 WeakPolarHBondContact O-CG 3.1Å; V119-L123 PolarHBondContact O-N 3.04Å; K121-L123 PolarHBondContact O-N 2.9Å; L123-C125 VanDerWaalsContact C-N 3.34Å; L123-D127 WeakPolarHBondContact O-CB 3.38Å; L123-D127 PolarHBondContact O-N 3.46Å; L123-I156 HydrophobicContact CD2-CD1 3.83Å; L123-I156 HydrophobicContact CD2-CG1 4.5Å; L123-I156 HydrophobicContact CG-CD1 4.37Å; L123-F160 HydrophobicContact CD2-CE2 3.69Å; L123-F160 HydrophobicContact CD2-CZ 4.07Å; L123-I173 HydrophobicContact CB-CG2 4.21Å; L123-I173 HydrophobicContact CD1-CG2 4.06Å; L123-C176 HydrophobicContact CD1-CB 4.04Å; L123-C176 HydrophobicContact CD2-CB 3.57Å; L123-C176 HydrophobicContact CG-CB 4.49Å; L123-F177 HydrophobicContact CD1-CB 4.16Å
124	R	84.1	Confident	83.8	Confident	200 Å²	200	62.8 Å²	62.8	76%	0.755	30%	0.297	S	S	*	.	H	α-helix	trans	-63	-39.9	174.5	-171.7	-172	-62.4	-175.4	-1.8	111.8	K120 K121 F122 S128	K120-R124 WeakPolarHBondContact O-CB 3.42Å; K120-R124 PolarHBondContact O-N 2.89Å; K120-R124 VanDerWaalsContact O-N 3.13Å; K121-R124 PolarHBondContact O-N 2.77Å; F122-R124 VanDerWaalsContact C-N 3.33Å; F122-R124 PolarHBondContact O-N 3.11Å; R124-S128 PolarHBondContact O-N 2.86Å
125	C	86.3	Confident	84.1	Confident	4 Å²	4	67 Å²	67	3%	0.027	32%	0.323	C	S	.	.	H	α-helix	trans	-74	-43.7	178.9	-178.6	0	0	0	0	112.7	K121 F122 L123 D127 S128 E136 A137 T140	K121-C125 PolarHBondContact O-N 3.07Å; F122-C125 PolarHBondContact O-N 3.17Å; F122-C125 VanDerWaalsContact O-N 3.17Å; L123-C125 VanDerWaalsContact C-N 3.34Å; C125-D127 PolarHBondContact O-N 3.4Å; C125-S128 WeakPolarHBondContact O-CB 3.36Å; C125-S128 PolarHBondContact O-N 3.35Å; C125-S128 PolarHBondContact O-OG 3.23Å; C125-E136 VanDerWaalsContact SG-CD 3.59Å; C125-E136 WeakPolarHBondContact SG-CG 3.32Å; C125-E136 PolarHBondContact SG-OE1 3.4Å; C125-E136 VanDerWaalsContact SG-OE1 3.35Å; C125-A137 HydrophobicContact CB-CB 4.49Å; C125-A137 WeakPolarHBondContact SG-CA 3.15Å; C125-A137 PolarHBondContact SG-N 3.47Å; C125-T140 HydrophobicContact CB-CG2 4.13Å
126	I	84.6	Confident	84.2	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64.5	-26.8	177.9	-66.5	-64.9	0	0	0	112.4	F122 K132 F134 A137 Y153 F160	F122-I126 HydrophobicContact CD1-CG1 4.45Å; F122-I126 HydrophobicContact CD2-CG1 3.98Å; F122-I126 HydrophobicContact CE1-CG1 4.04Å; F122-I126 HydrophobicContact CE2-CD1 3.92Å; F122-I126 HydrophobicContact CE2-CG1 3.52Å; F122-I126 HydrophobicContact CG-CG1 4.42Å; F122-I126 HydrophobicContact CZ-CD1 4.21Å; F122-I126 HydrophobicContact CZ-CG1 3.56Å; F122-I126 WeakPolarHBondContact O-CG1 3.16Å; F122-I126 PolarHBondContact O-N 3.08Å; I126-K132 PolarHBondContact O-N 3.01Å; I126-F134 HydrophobicContact CD1-CD1 4.12Å; I126-F134 HydrophobicContact CD1-CE1 4.01Å; I126-A137 HydrophobicContact CD1-CB 4.22Å; I126-Y153 HydrophobicContact CD1-CD2 4.45Å; I126-Y153 HydrophobicContact CG2-CD2 4.06Å; I126-Y153 HydrophobicContact CG2-CE2 3.98Å; I126-F160 HydrophobicContact CG2-CD1 4.2Å; I126-F160 HydrophobicContact CG2-CD2 4.12Å; I126-F160 HydrophobicContact CG2-CE1 4.32Å; I126-F160 HydrophobicContact CG2-CE2 4.23Å; I126-F160 HydrophobicContact CG2-CG 4.1Å; I126-F160 HydrophobicContact CG2-CZ 4.33Å
127	D	79.5	Confident	84.5	Confident	19 Å²	19	61.2 Å²	61.2	10%	0.102	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-13.4	171.7	-169.6	51.4	0	0	0	114.9	L123 C125 R131 F160 R165 H169	L123-D127 WeakPolarHBondContact O-CB 3.38Å; L123-D127 PolarHBondContact O-N 3.46Å; C125-D127 PolarHBondContact O-N 3.4Å; D127-R131 IonicContact OD1-CZ 3.53Å; D127-R131 IonicContact OD1-NE 3.72Å; D127-R131 IonicContact OD1-NH2 3.03Å; D127-R131 PolarHBondContact OD1-NH2 3.17Å; D127-R131 VanDerWaalsContact OD1-NH2 3.1Å; D127-F160 HydrophobicContact CB-CE1 3.82Å; D127-F160 HydrophobicContact CB-CZ 4.37Å; D127-R165 IonicContact OD2-NH2 3.1Å; D127-H169 VanDerWaalsContact CG-CE1 3.47Å; D127-H169 IonicContact OD1-CE1 2.66Å; D127-H169 PolarHBondContact OD1-CE1 3.19Å; D127-H169 IonicContact OD1-NE2 2.65Å; D127-H169 PolarHBondContact OD1-NE2 3.32Å; D127-H169 VanDerWaalsContact OD1-NE2 3.16Å; D127-H169 IonicContact OD2-CD2 3.75Å; D127-H169 IonicContact OD2-CE1 3.12Å; D127-H169 PolarHBondContact OD2-CE1 3.2Å; D127-H169 IonicContact OD2-NE2 2.75Å; D127-H169 PolarHBondContact OD2-NE2 3.4Å
128	S	78.6	Confident	84.7	Confident	31 Å²	31	62.6 Å²	62.6	22%	0.217	29%	0.289	C	S	.	.	S	Bend	trans	-62.2	167.1	176	87.8	0	0	0	0	110.5	R124 C125 P130 R131 E136	R124-S128 PolarHBondContact O-N 2.86Å; C125-S128 WeakPolarHBondContact O-CB 3.36Å; C125-S128 PolarHBondContact O-N 3.35Å; C125-S128 PolarHBondContact O-OG 3.23Å; S128-P130 CarbonylContact O-C 2.96Å; S128-R131 VanDerWaalsContact O-CA 3.26Å; S128-R131 WeakPolarHBondContact O-CA 3.45Å; S128-R131 WeakPolarHBondContact O-CG 3.47Å; S128-R131 PolarHBondContact O-N 3.22Å; S128-R131 VanDerWaalsContact O-N 3.08Å; S128-E136 PolarHBondContact OG-OE1 3.17Å
129	K	77.4	Confident	84.8	Confident	199 Å²	199	68.6 Å²	68.6	87%	0.865	32%	0.315	S	S	*	.	S	Bend	trans	-98	123.2	169.1	-69.5	-178.8	179.5	178.5	0	107
130	P	77.1	Confident	84.9	Confident	83 Å²	83	70.9 Å²	70.9	54%	0.539	33%	0.328	S	S	.	.	S	Bend	cis	-79.3	137.4	3.6	30.3	-32.1	0	0	0	113.8	S128 N133	S128-P130 CarbonylContact O-C 2.96Å; P130-N133 HydrophobicContact CG-CB 4.24Å; P130-N133 WeakPolarHBondContact O-CB 3.32Å; P130-N133 PolarHBondContact O-N 2.88Å
131	R	76	Confident	85	Confident	97 Å²	97	65.3 Å²	65.3	37%	0.366	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	143.6	-179.7	-79.5	-178.1	162.5	-172.9	-10.5	111.5	D127 S128 N133 R163	D127-R131 IonicContact OD1-CZ 3.53Å; D127-R131 IonicContact OD1-NE 3.72Å; D127-R131 IonicContact OD1-NH2 3.03Å; D127-R131 PolarHBondContact OD1-NH2 3.17Å; D127-R131 VanDerWaalsContact OD1-NH2 3.1Å; S128-R131 VanDerWaalsContact O-CA 3.26Å; S128-R131 WeakPolarHBondContact O-CA 3.45Å; S128-R131 WeakPolarHBondContact O-CG 3.47Å; S128-R131 PolarHBondContact O-N 3.22Å; S128-R131 VanDerWaalsContact O-N 3.08Å; R131-N133 VanDerWaalsContact C-N 3.3Å; R131-R163 PolarHBondContact NH1-O 3.35Å; R131-R163 VanDerWaalsContact NH1-O 3.16Å
132	K	79.4	Confident	84.9	Confident	86 Å²	86	64.2 Å²	64.2	37%	0.374	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	30.9	-179.4	-46.1	168.9	-172.3	171	0	113.7	I126 F134 Y153	I126-K132 PolarHBondContact O-N 3.01Å; K132-F134 VanDerWaalsContact C-N 3.35Å; K132-F134 HydrophobicContact CB-CE2 4.18Å; K132-F134 HydrophobicContact CB-CZ 4.49Å; K132-F134 WeakPolarHBondContact O-CD2 2.99Å; K132-F134 PolarHBondContact O-N 3.35Å; K132-Y153 HydrophobicContact CD-CE2 4.46Å; K132-Y153 WeakPolarHBondContact CD-OH 3.13Å; K132-Y153 WeakPolarHBondContact CE-OH 3.24Å; K132-Y153 HydrophobicContact CG-CE2 4.06Å
133	N	85.1	Confident	84.6	Confident	43 Å²	43	67.2 Å²	67.2	23%	0.23	34%	0.341	C	S	.	.			trans	-72.7	85.7	173.3	-169.1	-6.5	0	0	0	111.3	P130 R131 V135 E136 A137	P130-N133 HydrophobicContact CG-CB 4.24Å; P130-N133 WeakPolarHBondContact O-CB 3.32Å; P130-N133 PolarHBondContact O-N 2.88Å; R131-N133 VanDerWaalsContact C-N 3.3Å; N133-V135 PolarHBondContact O-N 3.17Å; N133-V135 PolarHBondContact OD1-N 3.5Å; N133-E136 HydrophobicContact CB-CB 3.95Å; N133-E136 VanDerWaalsContact CG-CB 3.43Å; N133-E136 VanDerWaalsContact ND2-CB 3.32Å; N133-E136 WeakPolarHBondContact ND2-CB 3.15Å; N133-E136 PolarHBondContact ND2-OE2 3.34Å; N133-E136 PolarHBondContact O-N 2.93Å; N133-E136 PolarHBondContact OD1-N 3.48Å; N133-A137 PolarHBondContact O-N 2.75Å
134	F	88.6	Confident	84.6	Confident	46 Å²	46	68.7 Å²	68.7	20%	0.202	35%	0.346	C	S	.	.	H	α-helix	trans	-63	-27.1	180	-65.8	-72.1	0	0	0	113.5	I126 K132 A137 K138 M146 I149 Y153	I126-F134 HydrophobicContact CD1-CD1 4.12Å; I126-F134 HydrophobicContact CD1-CE1 4.01Å; K132-F134 VanDerWaalsContact C-N 3.35Å; K132-F134 HydrophobicContact CB-CE2 4.18Å; K132-F134 HydrophobicContact CB-CZ 4.49Å; K132-F134 WeakPolarHBondContact O-CD2 2.99Å; K132-F134 PolarHBondContact O-N 3.35Å; F134-A137 PolarHBondContact O-N 3.21Å; F134-K138 WeakPolarHBondContact O-CB 3.36Å; F134-K138 PolarHBondContact O-N 3.05Å; F134-M146 HydrophobicContact CB-CE 4.49Å; F134-M146 HydrophobicContact CB-SD 3.99Å; F134-I149 HydrophobicContact CD1-CG2 4.01Å; F134-Y153 HydrophobicContact CE1-CD1 4.19Å; F134-Y153 HydrophobicContact CE1-CD2 4.05Å; F134-Y153 AromaticContact CE1-CG 3.72Å; F134-Y153 HydrophobicContact CE1-CG 3.72Å; F134-Y153 AromaticContact CZ-CD1 3.73Å; F134-Y153 HydrophobicContact CZ-CD1 3.73Å; F134-Y153 AromaticContact CZ-CD2 3.97Å; F134-Y153 HydrophobicContact CZ-CD2 3.97Å; F134-Y153 HydrophobicContact CZ-CE1 4.09Å; F134-Y153 HydrophobicContact CZ-CE2 4.32Å; F134-Y153 AromaticContact CZ-CG 3.67Å; F134-Y153 HydrophobicContact CZ-CG 3.67Å
135	V	89.1	Confident	84.8	Confident	92 Å²	92	65.6 Å²	65.6	56%	0.558	34%	0.34	S	S	*	.	H	α-helix	trans	-68.3	-43.3	176.4	-177.2	0	0	0	0	110.6	N133 K139	N133-V135 PolarHBondContact O-N 3.17Å; N133-V135 PolarHBondContact OD1-N 3.5Å; V135-K139 PolarHBondContact O-N 2.88Å
136	E	87.5	Confident	84.9	Confident	62 Å²	62	69.3 Å²	69.3	29%	0.29	36%	0.358	S	S	.	.	H	α-helix	trans	-68.2	-40.4	173.3	-170.9	-169.5	134.4	0	0	111.2	C125 S128 N133 K138 K139 T140	C125-E136 VanDerWaalsContact SG-CD 3.59Å; C125-E136 WeakPolarHBondContact SG-CG 3.32Å; C125-E136 PolarHBondContact SG-OE1 3.4Å; C125-E136 VanDerWaalsContact SG-OE1 3.35Å; S128-E136 PolarHBondContact OG-OE1 3.17Å; N133-E136 HydrophobicContact CB-CB 3.95Å; N133-E136 VanDerWaalsContact CG-CB 3.43Å; N133-E136 VanDerWaalsContact ND2-CB 3.32Å; N133-E136 WeakPolarHBondContact ND2-CB 3.15Å; N133-E136 PolarHBondContact ND2-OE2 3.34Å; N133-E136 PolarHBondContact O-N 2.93Å; N133-E136 PolarHBondContact OD1-N 3.48Å; E136-K138 VanDerWaalsContact C-N 3.32Å; E136-K138 PolarHBondContact O-N 2.85Å; E136-K139 WeakPolarHBondContact O-CA 3.26Å; E136-K139 WeakPolarHBondContact O-CB 3.45Å; E136-K139 PolarHBondContact O-N 3.21Å; E136-T140 PolarHBondContact O-N 2.98Å
137	A	88.6	Confident	85.1	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-58.7	-44.8	176.6	0	0	0	0	0	111.1	F122 C125 I126 N133 F134 K139 T140 V141 I149	F122-A137 HydrophobicContact CD2-CB 4.27Å; C125-A137 HydrophobicContact CB-CB 4.49Å; C125-A137 WeakPolarHBondContact SG-CA 3.15Å; C125-A137 PolarHBondContact SG-N 3.47Å; I126-A137 HydrophobicContact CD1-CB 4.22Å; N133-A137 PolarHBondContact O-N 2.75Å; F134-A137 PolarHBondContact O-N 3.21Å; A137-K139 VanDerWaalsContact C-N 3.28Å; A137-K139 PolarHBondContact O-N 3.26Å; A137-T140 PolarHBondContact O-N 2.76Å; A137-T140 PolarHBondContact O-OG1 2.78Å; A137-V141 VanDerWaalsContact O-CG2 3.28Å; A137-V141 WeakPolarHBondContact O-CG2 3.44Å; A137-V141 PolarHBondContact O-N 3.28Å; A137-I149 HydrophobicContact CB-CG2 4.01Å
138	K	91.1	Very high	85.6	Confident	69 Å²	69	72.1 Å²	72.1	30%	0.3	39%	0.386	S	S	.	.	H	α-helix	trans	-58.8	-33.6	174.2	176.2	57.6	177.3	168.9	0	113.2	F134 E136 V141 P142 R144 M146 I149	F134-K138 WeakPolarHBondContact O-CB 3.36Å; F134-K138 PolarHBondContact O-N 3.05Å; E136-K138 VanDerWaalsContact C-N 3.32Å; E136-K138 PolarHBondContact O-N 2.85Å; K138-V141 CarbonylContact O-C 3.54Å; K138-P142 PolarHBondContact NZ-O 3.29Å; K138-R144 WeakPolarHBondContact CD-O 3.31Å; K138-R144 PolarHBondContact NZ-O 3.31Å; K138-M146 HydrophobicContact CB-CE 4.05Å; K138-M146 HydrophobicContact CG-CE 4.38Å; K138-I149 HydrophobicContact CB-CD1 3.65Å; K138-I149 HydrophobicContact CD-CD1 3.68Å; K138-I149 HydrophobicContact CG-CD1 4.21Å
139	K	91.4	Very high	86.1	Confident	164 Å²	164	70.7 Å²	70.7	71%	0.713	38%	0.375	S	S	*	.	H	α-helix	trans	-67.1	-34.1	172.2	-64.8	176	-178	-175.8	0	112.4	V135 E136 A137	V135-K139 PolarHBondContact O-N 2.88Å; E136-K139 WeakPolarHBondContact O-CA 3.26Å; E136-K139 WeakPolarHBondContact O-CB 3.45Å; E136-K139 PolarHBondContact O-N 3.21Å; A137-K139 VanDerWaalsContact C-N 3.28Å; A137-K139 PolarHBondContact O-N 3.26Å
140	T	88.8	Confident	86.6	Confident	47 Å²	47	63 Å²	63	29%	0.288	35%	0.346	S	S	.	.	H	α-helix	trans	-77.1	-22.9	179.2	70.6	0	0	0	0	114.8	C125 E136 A137	C125-T140 HydrophobicContact CB-CG2 4.13Å; E136-T140 PolarHBondContact O-N 2.98Å; A137-T140 PolarHBondContact O-N 2.76Å; A137-T140 PolarHBondContact O-OG1 2.78Å
141	V	88.4	Confident	87.1	Confident	5 Å²	5	61.5 Å²	61.5	3%	0.03	34%	0.341	C	S	.	.	S	Bend	trans	-130.6	67.2	179.4	-70	0	0	0	0	111	W114 E118 K121 A137 K138 G143 R144 I149	W114-V141 HydrophobicContact CH2-CG2 4.37Å; W114-V141 HydrophobicContact CZ3-CB 4.43Å; W114-V141 HydrophobicContact CZ3-CG1 4.34Å; W114-V141 HydrophobicContact CZ3-CG2 4.09Å; E118-V141 HydrophobicContact CB-CG1 3.93Å; E118-V141 HydrophobicContact CG-CG1 3.99Å; K121-V141 HydrophobicContact CB-CG1 4.49Å; A137-V141 VanDerWaalsContact O-CG2 3.28Å; A137-V141 WeakPolarHBondContact O-CG2 3.44Å; A137-V141 PolarHBondContact O-N 3.28Å; K138-V141 CarbonylContact O-C 3.54Å; V141-G143 VanDerWaalsContact C-N 3.27Å; V141-G143 PolarHBondContact O-N 2.99Å; V141-G143 VanDerWaalsContact O-N 3.11Å; V141-R144 HydrophobicContact CB-CB 4.42Å; V141-R144 HydrophobicContact CB-CG 4.18Å; V141-R144 HydrophobicContact CG2-CB 4.21Å; V141-R144 HydrophobicContact CG2-CG 4.38Å; V141-R144 PolarHBondContact O-N 3.05Å; V141-I149 HydrophobicContact CG2-CD1 4.1Å; V141-I149 HydrophobicContact CG2-CG1 4.12Å
142	P	85.1	Confident	87.7	Confident	99 Å²	99	57 Å²	57	64%	0.643	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-31	-167	21.2	-33.2	0	0	0	114.5	K138 R144	K138-P142 PolarHBondContact NZ-O 3.29Å; P142-R144 VanDerWaalsContact C-N 3.33Å; P142-R144 PolarHBondContact O-N 2.91Å
143	G	83.9	Confident	88.1	Confident	63 Å²	63	53.1 Å²	53.1	65%	0.649	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-17	178	0	0	0	0	0	115.7	V141	V141-G143 VanDerWaalsContact C-N 3.27Å; V141-G143 PolarHBondContact O-N 2.99Å; V141-G143 VanDerWaalsContact O-N 3.11Å
144	R	87.2	Confident	88.2	Confident	33 Å²	33	58.2 Å²	58.2	13%	0.125	32%	0.324	C	S	.	.	S	Bend	trans	-87.6	134.9	-176.7	-63.1	-69.5	173.8	178.4	1.4	111.2	K113 W114 E118 K138 V141 P142 D148 I149	K113-R144 PolarHBondContact O-NH1 3.09Å; K113-R144 PolarHBondContact O-NH2 3.05Å; W114-R144 HydrophobicContact CE3-CG 4.21Å; W114-R144 HydrophobicContact CH2-CB 3.77Å; W114-R144 HydrophobicContact CH2-CG 3.59Å; W114-R144 HydrophobicContact CZ2-CB 4.25Å; W114-R144 HydrophobicContact CZ2-CG 4.05Å; W114-R144 HydrophobicContact CZ3-CB 4.29Å; W114-R144 HydrophobicContact CZ3-CG 3.69Å; E118-R144 IonicContact OE1-CZ 3.44Å; E118-R144 IonicContact OE1-NE 3.68Å; E118-R144 PolarHBondContact OE1-NE 3.44Å; E118-R144 IonicContact OE1-NH2 3.98Å; E118-R144 PolarHBondContact OE1-NH2 3.23Å; E118-R144 IonicContact OE2-CZ 2.72Å; E118-R144 IonicContact OE2-NE 3.14Å; E118-R144 IonicContact OE2-NH2 2.71Å; E118-R144 PolarHBondContact OE2-NH2 3.27Å; K138-R144 WeakPolarHBondContact CD-O 3.31Å; K138-R144 PolarHBondContact NZ-O 3.31Å; V141-R144 HydrophobicContact CB-CB 4.42Å; V141-R144 HydrophobicContact CB-CG 4.18Å; V141-R144 HydrophobicContact CG2-CB 4.21Å; V141-R144 HydrophobicContact CG2-CG 4.38Å; V141-R144 PolarHBondContact O-N 3.05Å; P142-R144 VanDerWaalsContact C-N 3.33Å; P142-R144 PolarHBondContact O-N 2.91Å; R144-D148 HydrophobicContact CB-CB 4.37Å; R144-I149 HydrophobicContact CB-CD1 4.41Å; R144-I149 HydrophobicContact CB-CG1 4.01Å
145	H	87.8	Confident	87.9	Confident	136 Å²	136	57.8 Å²	57.8	63%	0.63	33%	0.327	S	S	*	.			trans	-73.7	157.7	-180	-67.4	36.6	0	0	0	109.8	G147 D148 I149	H145-G147 PolarHBondContact O-N 3.11Å; H145-D148 WeakPolarHBondContact CB-OD2 3.5Å; H145-D148 IonicContact CG-OD2 3.12Å; H145-D148 PolarHBondContact N-OD2 3.07Å; H145-D148 WeakPolarHBondContact O-CB 3.36Å; H145-D148 PolarHBondContact O-N 2.77Å; H145-I149 WeakPolarHBondContact O-CG1 3.48Å; H145-I149 PolarHBondContact O-N 2.82Å; H145-I149 VanDerWaalsContact O-N 3.12Å
146	M	89	Confident	87.7	Confident	81 Å²	81	53.4 Å²	53.4	40%	0.399	30%	0.3	S	S	.	.	H	α-helix	trans	-60.1	-36.4	-178.9	-174.5	59.8	76.3	0	0	111.4	F134 K138 D148 I149 C150	F134-M146 HydrophobicContact CB-CE 4.49Å; F134-M146 HydrophobicContact CB-SD 3.99Å; K138-M146 HydrophobicContact CB-CE 4.05Å; K138-M146 HydrophobicContact CG-CE 4.38Å; M146-D148 PolarHBondContact O-N 2.85Å; M146-I149 PolarHBondContact O-N 3.29Å; M146-C150 WeakPolarHBondContact O-CB 3.37Å; M146-C150 PolarHBondContact O-N 3.05Å; M146-C150 PolarHBondContact O-SG 3.44Å; M146-C150 VanDerWaalsContact O-SG 3.39Å
147	G	88.5	Confident	86.7	Confident	52 Å²	52	50.6 Å²	50.6	54%	0.536	29%	0.288	S	S	.	.	H	α-helix	trans	-55.1	-46.6	171	0	0	0	0	0	112.8	H145 I149 C150 A151	H145-G147 PolarHBondContact O-N 3.11Å; G147-I149 PolarHBondContact O-N 3.45Å; G147-C150 PolarHBondContact O-N 3.48Å; G147-A151 VanDerWaalsContact O-CB 3.31Å; G147-A151 WeakPolarHBondContact O-CB 3.32Å; G147-A151 PolarHBondContact O-N 3.03Å
148	D	88.3	Confident	85.3	Confident	27 Å²	27	53.3 Å²	53.3	14%	0.144	31%	0.31	C	S	.	.	H	α-helix	trans	-62.6	-45.2	178.6	-53.3	-38.2	0	0	0	111.9	N112 W114 R144 H145 M146 C150 A151 L152	N112-D148 PolarHBondContact ND2-OD1 3.16Å; W114-D148 HydrophobicContact CZ2-CB 3.77Å; W114-D148 WeakPolarHBondContact CZ2-O 3.49Å; R144-D148 HydrophobicContact CB-CB 4.37Å; H145-D148 WeakPolarHBondContact CB-OD2 3.5Å; H145-D148 IonicContact CG-OD2 3.12Å; H145-D148 PolarHBondContact N-OD2 3.07Å; H145-D148 WeakPolarHBondContact O-CB 3.36Å; H145-D148 PolarHBondContact O-N 2.77Å; M146-D148 PolarHBondContact O-N 2.85Å; D148-C150 VanDerWaalsContact C-N 3.31Å; D148-C150 PolarHBondContact O-N 3.21Å; D148-A151 PolarHBondContact O-N 2.9Å; D148-L152 WeakPolarHBondContact O-CB 3.41Å; D148-L152 PolarHBondContact O-N 2.93Å
149	I	89.6	Confident	83.8	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.5	-43.2	-178.5	-62.3	165.1	0	0	0	109.7	W114 F122 F134 A137 K138 V141 R144 H145 M146 G147 Y153	W114-I149 HydrophobicContact CH2-CB 4.5Å; W114-I149 HydrophobicContact CH2-CG1 3.91Å; F122-I149 HydrophobicContact CD2-CG2 4.02Å; F122-I149 HydrophobicContact CE2-CG2 3.71Å; F134-I149 HydrophobicContact CD1-CG2 4.01Å; A137-I149 HydrophobicContact CB-CG2 4.01Å; K138-I149 HydrophobicContact CB-CD1 3.65Å; K138-I149 HydrophobicContact CD-CD1 3.68Å; K138-I149 HydrophobicContact CG-CD1 4.21Å; V141-I149 HydrophobicContact CG2-CD1 4.1Å; V141-I149 HydrophobicContact CG2-CG1 4.12Å; R144-I149 HydrophobicContact CB-CD1 4.41Å; R144-I149 HydrophobicContact CB-CG1 4.01Å; H145-I149 WeakPolarHBondContact O-CG1 3.48Å; H145-I149 PolarHBondContact O-N 2.82Å; H145-I149 VanDerWaalsContact O-N 3.12Å; M146-I149 PolarHBondContact O-N 3.29Å; G147-I149 PolarHBondContact O-N 3.45Å; I149-Y153 WeakPolarHBondContact O-CB 3.46Å; I149-Y153 PolarHBondContact O-N 2.87Å
150	C	88.5	Confident	82.3	Confident	37 Å²	37	44.5 Å²	44.5	25%	0.25	28%	0.275	C	S	.	.	H	α-helix	trans	-64.2	-42.7	172.6	-72.1	0	0	0	0	112	M146 G147 D148 Y153 Y154	M146-C150 WeakPolarHBondContact O-CB 3.37Å; M146-C150 PolarHBondContact O-N 3.05Å; M146-C150 PolarHBondContact O-SG 3.44Å; M146-C150 VanDerWaalsContact O-SG 3.39Å; G147-C150 PolarHBondContact O-N 3.48Å; D148-C150 VanDerWaalsContact C-N 3.31Å; D148-C150 PolarHBondContact O-N 3.21Å; C150-Y153 WeakPolarHBondContact O-CB 3.33Å; C150-Y153 PolarHBondContact O-N 3.46Å; C150-Y154 WeakPolarHBondContact O-CD2 3.27Å; C150-Y154 PolarHBondContact O-N 2.89Å
151	A	87.2	Confident	80.8	Confident	52 Å²	52	48.7 Å²	48.7	43%	0.43	29%	0.289	S	S	.	.	H	α-helix	trans	-64.1	-43.5	178.6	0	0	0	0	0	112.4	G147 D148 Y154 S155	G147-A151 VanDerWaalsContact O-CB 3.31Å; G147-A151 WeakPolarHBondContact O-CB 3.32Å; G147-A151 PolarHBondContact O-N 3.03Å; D148-A151 PolarHBondContact O-N 2.9Å; A151-Y154 PolarHBondContact O-N 3.01Å; A151-S155 WeakPolarHBondContact O-CB 3.48Å; A151-S155 PolarHBondContact O-N 2.81Å; A151-S155 PolarHBondContact O-OG 3.23Å
152	L	88.5	Confident	79.1	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-59.7	-48	172.7	-179.9	68.9	0	0	0	110.3	W114 V119 F122 D148 S155 I156 L185	W114-L152 HydrophobicContact CD2-CD1 4.38Å; W114-L152 HydrophobicContact CD2-CD2 3.68Å; W114-L152 HydrophobicContact CD2-CG 4.41Å; W114-L152 HydrophobicContact CE3-CD2 3.59Å; W114-L152 HydrophobicContact CG-CD1 4.31Å; W114-L152 HydrophobicContact CG-CD2 4.36Å; W114-L152 HydrophobicContact CH2-CB 4.32Å; W114-L152 HydrophobicContact CH2-CD2 3.84Å; W114-L152 HydrophobicContact CZ2-CB 3.75Å; W114-L152 HydrophobicContact CZ2-CD2 3.92Å; W114-L152 HydrophobicContact CZ2-CG 4.4Å; W114-L152 HydrophobicContact CZ3-CD2 3.66Å; V119-L152 HydrophobicContact CG2-CD1 4.43Å; V119-L152 HydrophobicContact CG2-CD2 4.32Å; F122-L152 HydrophobicContact CB-CD2 4.19Å; F122-L152 HydrophobicContact CD1-CD2 3.39Å; F122-L152 HydrophobicContact CD1-CG 4.13Å; F122-L152 HydrophobicContact CD2-CD2 4.09Å; F122-L152 HydrophobicContact CE1-CD2 3.68Å; F122-L152 HydrophobicContact CE1-CG 3.92Å; F122-L152 HydrophobicContact CE2-CD2 4.34Å; F122-L152 HydrophobicContact CG-CD2 3.61Å; F122-L152 HydrophobicContact CZ-CD2 4.14Å; F122-L152 HydrophobicContact CZ-CG 4.27Å; D148-L152 WeakPolarHBondContact O-CB 3.41Å; D148-L152 PolarHBondContact O-N 2.93Å; L152-S155 PolarHBondContact O-N 3.41Å; L152-I156 HydrophobicContact CD1-CD1 3.99Å; L152-I156 HydrophobicContact CD1-CG2 4.18Å; L152-I156 HydrophobicContact CG-CD1 4.03Å; L152-I156 WeakPolarHBondContact O-CG1 3.28Å; L152-I156 PolarHBondContact O-N 2.87Å; L152-L185 HydrophobicContact CD1-CD1 4.17Å
153	Y	87.9	Confident	77.6	Confident	5 Å²	5	55.5 Å²	55.5	2%	0.02	32%	0.321	C	S	.	.	H	α-helix	trans	-53.7	-57.7	175.1	177.5	-97.8	0	0	0	111.3	F122 I126 K132 F134 I149 C150 S155 I156 A157	F122-Y153 HydrophobicContact CZ-CD2 4.36Å; I126-Y153 HydrophobicContact CD1-CD2 4.45Å; I126-Y153 HydrophobicContact CG2-CD2 4.06Å; I126-Y153 HydrophobicContact CG2-CE2 3.98Å; K132-Y153 HydrophobicContact CD-CE2 4.46Å; K132-Y153 WeakPolarHBondContact CD-OH 3.13Å; K132-Y153 WeakPolarHBondContact CE-OH 3.24Å; K132-Y153 HydrophobicContact CG-CE2 4.06Å; F134-Y153 HydrophobicContact CE1-CD1 4.19Å; F134-Y153 HydrophobicContact CE1-CD2 4.05Å; F134-Y153 AromaticContact CE1-CG 3.72Å; F134-Y153 HydrophobicContact CE1-CG 3.72Å; F134-Y153 AromaticContact CZ-CD1 3.73Å; F134-Y153 HydrophobicContact CZ-CD1 3.73Å; F134-Y153 AromaticContact CZ-CD2 3.97Å; F134-Y153 HydrophobicContact CZ-CD2 3.97Å; F134-Y153 HydrophobicContact CZ-CE1 4.09Å; F134-Y153 HydrophobicContact CZ-CE2 4.32Å; F134-Y153 AromaticContact CZ-CG 3.67Å; F134-Y153 HydrophobicContact CZ-CG 3.67Å; I149-Y153 WeakPolarHBondContact O-CB 3.46Å; I149-Y153 PolarHBondContact O-N 2.87Å; C150-Y153 WeakPolarHBondContact O-CB 3.33Å; C150-Y153 PolarHBondContact O-N 3.46Å; Y153-S155 PolarHBondContact O-N 3.09Å; Y153-I156 PolarHBondContact O-N 3.38Å; Y153-A157 HydrophobicContact CD1-CB 4.28Å; Y153-A157 HydrophobicContact CD2-CB 3.36Å; Y153-A157 HydrophobicContact CE1-CB 4.25Å; Y153-A157 HydrophobicContact CE2-CB 3.31Å; Y153-A157 HydrophobicContact CG-CB 3.85Å; Y153-A157 WeakPolarHBondContact O-CA 2.97Å; Y153-A157 WeakPolarHBondContact O-CB 3.39Å; Y153-A157 PolarHBondContact O-N 3.5Å
154	Y	86.3	Confident	76.3	Confident	151 Å²	151	57.5 Å²	57.5	59%	0.592	32%	0.321	S	S	*	.	H	α-helix	trans	-65.7	-27.1	-176.5	-71.9	-63.9	0	0	0	113.3	C150 A151	C150-Y154 WeakPolarHBondContact O-CD2 3.27Å; C150-Y154 PolarHBondContact O-N 2.89Å; A151-Y154 PolarHBondContact O-N 3.01Å
155	S	83.2	Confident	74.9	Confident	37 Å²	37	64.5 Å²	64.5	26%	0.259	35%	0.347	S	S	.	.	H	α-helix	trans	-70.8	-35	175.6	-70.7	0	0	0	0	113.9	A151 L152 Y153 R179 N183	A151-S155 WeakPolarHBondContact O-CB 3.48Å; A151-S155 PolarHBondContact O-N 2.81Å; A151-S155 PolarHBondContact O-OG 3.23Å; L152-S155 PolarHBondContact O-N 3.41Å; Y153-S155 PolarHBondContact O-N 3.09Å; S155-R179 PolarHBondContact O-NE 3.08Å; S155-N183 PolarHBondContact O-ND2 3.37Å
156	I	84.1	Confident	73.6	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-117.7	-24.1	-171.3	81.3	-175.8	0	0	0	114.8	V119 F122 L123 L152 Y153 A158 P159 C176 R179 A180 L185	V119-I156 HydrophobicContact CG1-CD1 4.26Å; F122-I156 HydrophobicContact CD1-CD1 4.39Å; F122-I156 HydrophobicContact CE1-CD1 4.01Å; L123-I156 HydrophobicContact CD2-CD1 3.83Å; L123-I156 HydrophobicContact CD2-CG1 4.5Å; L123-I156 HydrophobicContact CG-CD1 4.37Å; L152-I156 HydrophobicContact CD1-CD1 3.99Å; L152-I156 HydrophobicContact CD1-CG2 4.18Å; L152-I156 HydrophobicContact CG-CD1 4.03Å; L152-I156 WeakPolarHBondContact O-CG1 3.28Å; L152-I156 PolarHBondContact O-N 2.87Å; Y153-I156 PolarHBondContact O-N 3.38Å; I156-A158 PolarHBondContact O-N 3.21Å; I156-P159 VanDerWaalsContact O-CD 3.31Å; I156-P159 WeakPolarHBondContact O-CD 2.94Å; I156-C176 HydrophobicContact CD1-CB 4.32Å; I156-C176 HydrophobicContact CG1-CB 4.29Å; I156-R179 HydrophobicContact CB-CG 4.46Å; I156-R179 HydrophobicContact CG2-CG 4.47Å; I156-A180 HydrophobicContact CD1-CB 4.37Å; I156-A180 HydrophobicContact CG2-CB 3.8Å; I156-L185 HydrophobicContact CG2-CD1 4.35Å
157	A	66.8	Low	72.4	Confident	3 Å²	3	66.5 Å²	66.5	3%	0.025	36%	0.355	C	S	.	.			trans	-83	27.4	-165.3	0	0	0	0	0	115.8	Y153 F160	Y153-A157 HydrophobicContact CD1-CB 4.28Å; Y153-A157 HydrophobicContact CD2-CB 3.36Å; Y153-A157 HydrophobicContact CE1-CB 4.25Å; Y153-A157 HydrophobicContact CE2-CB 3.31Å; Y153-A157 HydrophobicContact CG-CB 3.85Å; Y153-A157 WeakPolarHBondContact O-CA 2.97Å; Y153-A157 WeakPolarHBondContact O-CB 3.39Å; Y153-A157 PolarHBondContact O-N 3.5Å; A157-F160 HydrophobicContact CB-CB 4.37Å; A157-F160 HydrophobicContact CB-CD2 3.83Å; A157-F160 PolarHBondContact O-N 3.02Å
158	A	59.2	Low	71.5	Confident	56 Å²	56	70.3 Å²	70.3	46%	0.463	35%	0.354	S	S	.	.	S	Bend	trans	-51.3	-37.6	167.7	0	0	0	0	0	112.9	I156	I156-A158 PolarHBondContact O-N 3.21Å
159	P	60.3	Low	70.6	Confident	31 Å²	31	70.4 Å²	70.4	20%	0.201	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-67.7	-34.2	176.8	-27.6	40.5	0	0	0	115.7	I156 K161 L172 C176	I156-P159 VanDerWaalsContact O-CD 3.31Å; I156-P159 WeakPolarHBondContact O-CD 2.94Å; P159-K161 PolarHBondContact O-N 3.01Å; P159-L172 HydrophobicContact CB-CB 4.27Å; P159-L172 HydrophobicContact CB-CD2 4.24Å; P159-C176 WeakPolarHBondContact CG-SG 3.35Å
160	F	59.4	Low	69.8	Low	18 Å²	18	73.8 Å²	73.8	8%	0.079	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-74.1	-7.5	-173.4	-70.8	-74.8	0	0	0	114.5	L123 I126 D127 A157	L123-F160 HydrophobicContact CD2-CE2 3.69Å; L123-F160 HydrophobicContact CD2-CZ 4.07Å; I126-F160 HydrophobicContact CG2-CD1 4.2Å; I126-F160 HydrophobicContact CG2-CD2 4.12Å; I126-F160 HydrophobicContact CG2-CE1 4.32Å; I126-F160 HydrophobicContact CG2-CE2 4.23Å; I126-F160 HydrophobicContact CG2-CG 4.1Å; I126-F160 HydrophobicContact CG2-CZ 4.33Å; D127-F160 HydrophobicContact CB-CE1 3.82Å; D127-F160 HydrophobicContact CB-CZ 4.37Å; A157-F160 HydrophobicContact CB-CB 4.37Å; A157-F160 HydrophobicContact CB-CD2 3.83Å; A157-F160 PolarHBondContact O-N 3.02Å
161	K	58	Low	69.4	Low	135 Å²	135	76.2 Å²	76.2	59%	0.587	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-84.8	-17.9	-177	-71.6	-173.8	177.8	-178.7	0	114.8	P159	P159-K161 PolarHBondContact O-N 3.01Å
162	A	51.9	Low	68.9	Low	91 Å²	91	75.6 Å²	75.6	75%	0.752	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.9	0.4	-158.4	0	0	0	0	0	119.5
163	R	55.1	Low	68.6	Low	156 Å²	156	77.8 Å²	77.8	59%	0.589	39%	0.385	S	S	*	.			trans	-132.8	140.6	179.8	-99.3	-175.8	179.9	-171.9	-0.9	116	R131	R131-R163 PolarHBondContact NH1-O 3.35Å; R131-R163 VanDerWaalsContact NH1-O 3.16Å
164	T	56.2	Low	68.3	Low	105 Å²	105	83.6 Å²	83.6	64%	0.644	41%	0.413	S	S	*	.			trans	-55.6	154.5	155.9	45.2	0	0	0	0	110.1	N166	T164-N166 PolarHBondContact O-N 3.17Å; T164-N166 PolarHBondContact O-OD1 2.8Å; T164-N166 PolarHBondContact OG1-OD1 3.49Å; T164-N166 VanDerWaalsContact OG1-OD1 3.11Å
165	R	57.5	Low	68.1	Low	179 Å²	179	81.6 Å²	81.6	68%	0.675	41%	0.408	S	S	*	.			trans	-60.2	108.9	171.1	-103.5	-176.2	167.4	-172.2	-2.5	108.8	D127	D127-R165 IonicContact OD2-NH2 3.1Å
166	N	60.5	Low	68.2	Low	63 Å²	63	79.8 Å²	79.8	34%	0.337	40%	0.396	S	S	.	.			trans	-103.6	168.3	169.4	-67.8	11.9	0	0	0	108.6	T164 Y168 H169	T164-N166 PolarHBondContact O-N 3.17Å; T164-N166 PolarHBondContact O-OD1 2.8Å; T164-N166 PolarHBondContact OG1-OD1 3.49Å; T164-N166 VanDerWaalsContact OG1-OD1 3.11Å; N166-Y168 PolarHBondContact O-N 2.89Å; N166-H169 WeakPolarHBondContact O-CB 3.29Å; N166-H169 PolarHBondContact O-N 2.95Å; N166-H169 VanDerWaalsContact O-N 3.15Å
167	K	63.7	Low	68.3	Low	196 Å²	196	81.7 Å²	81.7	85%	0.852	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-28.1	179.7	-164.3	174	-178.4	179.8	0	114.2	H169	K167-H169 VanDerWaalsContact C-N 3.29Å; K167-H169 PolarHBondContact O-N 2.92Å
168	Y	68.7	Low	69.1	Low	133 Å²	133	84.5 Å²	84.5	52%	0.522	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	29.3	-178.9	-54.2	-74.3	0	0	0	114.4	N166 E171 L172	N166-Y168 PolarHBondContact O-N 2.89Å; Y168-E171 WeakPolarHBondContact CD1-OE1 3.3Å; Y168-E171 WeakPolarHBondContact CD1-OE2 3.46Å; Y168-E171 PolarHBondContact O-N 2.87Å; Y168-L172 WeakPolarHBondContact O-CG 3.48Å; Y168-L172 PolarHBondContact O-N 3.02Å
169	H	70	Confident	70.2	Confident	28 Å²	28	86.5 Å²	86.5	13%	0.13	42%	0.419	C	S	.	.	H	α-helix	trans	-70.8	-36.1	-173.4	-173.1	70.5	0	0	0	113.5	D127 N166 K167 L172 I173	D127-H169 VanDerWaalsContact CG-CE1 3.47Å; D127-H169 IonicContact OD1-CE1 2.66Å; D127-H169 PolarHBondContact OD1-CE1 3.19Å; D127-H169 IonicContact OD1-NE2 2.65Å; D127-H169 PolarHBondContact OD1-NE2 3.32Å; D127-H169 VanDerWaalsContact OD1-NE2 3.16Å; D127-H169 IonicContact OD2-CD2 3.75Å; D127-H169 IonicContact OD2-CE1 3.12Å; D127-H169 PolarHBondContact OD2-CE1 3.2Å; D127-H169 IonicContact OD2-NE2 2.75Å; D127-H169 PolarHBondContact OD2-NE2 3.4Å; N166-H169 WeakPolarHBondContact O-CB 3.29Å; N166-H169 PolarHBondContact O-N 2.95Å; N166-H169 VanDerWaalsContact O-N 3.15Å; K167-H169 VanDerWaalsContact C-N 3.29Å; K167-H169 PolarHBondContact O-N 2.92Å; H169-L172 PolarHBondContact O-N 3.23Å; H169-I173 PolarHBondContact O-N 3.24Å
170	S	73.8	Confident	71.4	Confident	72 Å²	72	85 Å²	85	50%	0.503	41%	0.41	S	S	.	.	H	α-helix	trans	-58	-47.6	171.5	42.6	0	0	0	0	111.7	L172 I173 E174	S170-L172 VanDerWaalsContact C-N 3.26Å; S170-L172 PolarHBondContact O-N 3.28Å; S170-I173 WeakPolarHBondContact O-CB 3.48Å; S170-I173 PolarHBondContact O-N 2.94Å; S170-E174 PolarHBondContact O-N 3.2Å
171	E	79.2	Confident	72.4	Confident	88 Å²	88	86.9 Å²	86.9	41%	0.411	42%	0.422	S	S	.	.	H	α-helix	trans	-59.6	-33.9	178.7	-62.6	176.7	-172	0	0	112.5	Y168 E174 Q175	Y168-E171 WeakPolarHBondContact CD1-OE1 3.3Å; Y168-E171 WeakPolarHBondContact CD1-OE2 3.46Å; Y168-E171 PolarHBondContact O-N 2.87Å; E171-E174 PolarHBondContact O-N 3.02Å; E171-Q175 WeakPolarHBondContact O-CB 3.38Å; E171-Q175 WeakPolarHBondContact O-CG 3.49Å; E171-Q175 PolarHBondContact O-N 2.98Å
172	L	77.3	Confident	73.5	Confident	39 Å²	39	89.1 Å²	89.1	20%	0.204	43%	0.427	C	S	.	.	H	α-helix	trans	-68.4	-35.5	175.7	-63.8	173.5	0	0	0	112.2	P159 Y168 H169 S170 C176	P159-L172 HydrophobicContact CB-CB 4.27Å; P159-L172 HydrophobicContact CB-CD2 4.24Å; Y168-L172 WeakPolarHBondContact O-CG 3.48Å; Y168-L172 PolarHBondContact O-N 3.02Å; H169-L172 PolarHBondContact O-N 3.23Å; S170-L172 VanDerWaalsContact C-N 3.26Å; S170-L172 PolarHBondContact O-N 3.28Å; L172-C176 PolarHBondContact O-N 3.44Å; L172-C176 PolarHBondContact O-SG 2.95Å
173	I	81.3	Confident	74.9	Confident	48 Å²	48	88.2 Å²	88.2	25%	0.246	41%	0.41	C	S	.	.	H	α-helix	trans	-68.7	-42.4	174	-66.1	175	0	0	0	109.8	L123 H169 S170 C176 F177	L123-I173 HydrophobicContact CB-CG2 4.21Å; L123-I173 HydrophobicContact CD1-CG2 4.06Å; H169-I173 PolarHBondContact O-N 3.24Å; S170-I173 WeakPolarHBondContact O-CB 3.48Å; S170-I173 PolarHBondContact O-N 2.94Å; I173-C176 WeakPolarHBondContact O-CB 3.42Å; I173-C176 PolarHBondContact O-N 2.77Å; I173-F177 PolarHBondContact O-N 3.22Å
174	E	81.7	Confident	75.9	Confident	127 Å²	127	83.1 Å²	83.1	59%	0.593	41%	0.405	S	S	*	.	H	α-helix	trans	-65.5	-38	175.4	-69.8	-179	169.1	0	0	112.7	S170 E171 F177 S178	S170-E174 PolarHBondContact O-N 3.2Å; E171-E174 PolarHBondContact O-N 3.02Å; E174-F177 PolarHBondContact O-N 3.28Å; E174-S178 WeakPolarHBondContact O-CB 3.45Å; E174-S178 PolarHBondContact O-N 3.32Å; E174-S178 PolarHBondContact O-OG 3.11Å
175	Q	83	Confident	77	Confident	108 Å²	108	80 Å²	80	51%	0.505	39%	0.385	S	S	.	.	H	α-helix	trans	-63.9	-39.6	171.8	-75.6	172.2	21.2	0	0	111.9	E171 R179	E171-Q175 WeakPolarHBondContact O-CB 3.38Å; E171-Q175 WeakPolarHBondContact O-CG 3.49Å; E171-Q175 PolarHBondContact O-N 2.98Å; Q175-R179 VanDerWaalsContact O-CB 3.32Å; Q175-R179 WeakPolarHBondContact O-CB 3.4Å; Q175-R179 PolarHBondContact O-N 3.32Å
176	C	85.2	Confident	78	Confident	0 Å²	0	72 Å²	72	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-61.9	-46.1	172.1	-69.1	0	0	0	0	111.4	L123 I156 P159 L172 I173 R179 A180	L123-C176 HydrophobicContact CD1-CB 4.04Å; L123-C176 HydrophobicContact CD2-CB 3.57Å; L123-C176 HydrophobicContact CG-CB 4.49Å; I156-C176 HydrophobicContact CD1-CB 4.32Å; I156-C176 HydrophobicContact CG1-CB 4.29Å; P159-C176 WeakPolarHBondContact CG-SG 3.35Å; L172-C176 PolarHBondContact O-N 3.44Å; L172-C176 PolarHBondContact O-SG 2.95Å; I173-C176 WeakPolarHBondContact O-CB 3.42Å; I173-C176 PolarHBondContact O-N 2.77Å; C176-R179 PolarHBondContact O-N 3.04Å; C176-A180 PolarHBondContact O-N 3.19Å
177	F	84.5	Confident	78.2	Confident	40 Å²	40	71.4 Å²	71.4	18%	0.175	35%	0.354	C	S	.	.	H	α-helix	trans	-62.9	-45.6	177.6	-175.9	-95.5	0	0	0	111.8	K116 V119 L123 I173 E174 R179 A180 V181	K116-F177 HydrophobicContact CB-CE2 4.36Å; K116-F177 HydrophobicContact CB-CZ 4.24Å; K116-F177 HydrophobicContact CD-CZ 4.12Å; K116-F177 HydrophobicContact CG-CE2 3.94Å; K116-F177 HydrophobicContact CG-CZ 3.68Å; V119-F177 HydrophobicContact CB-CD2 4.25Å; V119-F177 HydrophobicContact CB-CE2 4.32Å; V119-F177 HydrophobicContact CG1-CD2 3.87Å; V119-F177 HydrophobicContact CG1-CE2 4.4Å; L123-F177 HydrophobicContact CD1-CB 4.16Å; I173-F177 PolarHBondContact O-N 3.22Å; E174-F177 PolarHBondContact O-N 3.28Å; F177-R179 PolarHBondContact O-N 3.01Å; F177-A180 WeakPolarHBondContact O-CA 3.41Å; F177-A180 VanDerWaalsContact O-CB 3.28Å; F177-A180 WeakPolarHBondContact O-CB 3.35Å; F177-A180 PolarHBondContact O-N 3.06Å; F177-V181 HydrophobicContact CD1-CG2 4.24Å; F177-V181 HydrophobicContact CE1-CG2 3.71Å; F177-V181 HydrophobicContact CZ-CG2 3.94Å; F177-V181 PolarHBondContact O-N 2.77Å
178	S	83.7	Confident	77.7	Confident	61 Å²	61	65 Å²	65	43%	0.427	33%	0.333	S	S	.	.	H	α-helix	trans	-61.2	-33.5	175.7	-55.6	0	0	0	0	112.1	E174 R182	E174-S178 WeakPolarHBondContact O-CB 3.45Å; E174-S178 PolarHBondContact O-N 3.32Å; E174-S178 PolarHBondContact O-OG 3.11Å; S178-R182 WeakPolarHBondContact O-CB 3.17Å; S178-R182 PolarHBondContact O-N 2.77Å
179	R	83.9	Confident	76.7	Confident	98 Å²	98	68.6 Å²	68.6	37%	0.37	35%	0.346	S	S	.	.	H	α-helix	trans	-71.9	-36.9	172.8	-175.4	168.2	171.6	140.8	3.8	112.1	S155 I156 Q175 C176 F177 V181 R182 N183	S155-R179 PolarHBondContact O-NE 3.08Å; I156-R179 HydrophobicContact CB-CG 4.46Å; I156-R179 HydrophobicContact CG2-CG 4.47Å; Q175-R179 VanDerWaalsContact O-CB 3.32Å; Q175-R179 WeakPolarHBondContact O-CB 3.4Å; Q175-R179 PolarHBondContact O-N 3.32Å; C176-R179 PolarHBondContact O-N 3.04Å; F177-R179 PolarHBondContact O-N 3.01Å; R179-V181 VanDerWaalsContact C-N 3.34Å; R179-R182 PolarHBondContact O-N 3.23Å; R179-N183 WeakPolarHBondContact O-CB 3.45Å; R179-N183 PolarHBondContact O-N 3.44Å; R179-N183 PolarHBondContact O-OD1 2.93Å; R179-N183 VanDerWaalsContact O-OD1 3.1Å
180	A	84.5	Confident	75.1	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-59.5	-45.6	172	0	0	0	0	0	111.5	V119 I156 C176 F177 L185 V186	V119-A180 HydrophobicContact CG1-CB 4.13Å; I156-A180 HydrophobicContact CD1-CB 4.37Å; I156-A180 HydrophobicContact CG2-CB 3.8Å; C176-A180 PolarHBondContact O-N 3.19Å; F177-A180 WeakPolarHBondContact O-CA 3.41Å; F177-A180 VanDerWaalsContact O-CB 3.28Å; F177-A180 WeakPolarHBondContact O-CB 3.35Å; F177-A180 PolarHBondContact O-N 3.06Å; A180-L185 WeakPolarHBondContact O-CB 3.34Å; A180-L185 PolarHBondContact O-N 3.1Å; A180-L185 VanDerWaalsContact O-N 3.08Å; A180-V186 HydrophobicContact CB-CG2 3.58Å
181	V	81.7	Confident	73.4	Confident	57 Å²	57	70.4 Å²	70.4	35%	0.345	36%	0.356	S	S	.	.	H	α-helix	trans	-64.7	-49.1	176.3	176.1	0	0	0	0	111.2	F177 R179 N183 G184 V186	F177-V181 HydrophobicContact CD1-CG2 4.24Å; F177-V181 HydrophobicContact CE1-CG2 3.71Å; F177-V181 HydrophobicContact CZ-CG2 3.94Å; F177-V181 PolarHBondContact O-N 2.77Å; R179-V181 VanDerWaalsContact C-N 3.34Å; V181-N183 PolarHBondContact O-N 2.78Å; V181-G184 PolarHBondContact O-N 3.01Å; V181-V186 HydrophobicContact CG2-CB 4.08Å; V181-V186 HydrophobicContact CG2-CG1 4.42Å; V181-V186 HydrophobicContact CG2-CG2 3.95Å
182	R	80.3	Confident	71.5	Confident	183 Å²	183	68.4 Å²	68.4	69%	0.691	35%	0.346	S	S	*	.	H	α-helix	trans	-57.9	-35.6	178.9	-169.3	-169.5	-58.8	106.7	1.7	112.9	S178 R179 G184	S178-R182 WeakPolarHBondContact O-CB 3.17Å; S178-R182 PolarHBondContact O-N 2.77Å; R179-R182 PolarHBondContact O-N 3.23Å; R182-G184 PolarHBondContact O-N 2.83Å
183	N	80.8	Confident	69.2	Low	72 Å²	72	70 Å²	70	39%	0.385	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	5	179.5	-67.6	16.9	0	0	0	113.3	S155 R179 V181 L185	S155-N183 PolarHBondContact O-ND2 3.37Å; R179-N183 WeakPolarHBondContact O-CB 3.45Å; R179-N183 PolarHBondContact O-N 3.44Å; R179-N183 PolarHBondContact O-OD1 2.93Å; R179-N183 VanDerWaalsContact O-OD1 3.1Å; V181-N183 PolarHBondContact O-N 2.78Å; N183-L185 HydrophobicContact CB-CD1 4Å; N183-L185 HydrophobicContact CB-CG 3.92Å; N183-L185 PolarHBondContact O-N 2.89Å; N183-L185 VanDerWaalsContact O-N 3.14Å
184	G	76.2	Confident	67.1	Low	48 Å²	48	71.7 Å²	71.7	50%	0.495	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	7.9	-176.4	0	0	0	0	0	114.5	V181 R182 V186	V181-G184 PolarHBondContact O-N 3.01Å; R182-G184 PolarHBondContact O-N 2.83Å; G184-V186 VanDerWaalsContact C-N 3.3Å; G184-V186 PolarHBondContact O-N 3.49Å
185	L	80.3	Confident	64.9	Low	40 Å²	40	70.9 Å²	70.9	21%	0.209	39%	0.385	C	S	.	.			trans	-77.4	-15.9	-175.9	-65.6	175.2	0	0	0	112.9	K113 W114 L152 I156 A180 N183	K113-L185 CarbonylContact C-O 3.54Å; K113-L185 WeakPolarHBondContact CA-O 3Å; W114-L185 WeakPolarHBondContact CB-O 3.22Å; W114-L185 PolarHBondContact N-O 3.08Å; L152-L185 HydrophobicContact CD1-CD1 4.17Å; I156-L185 HydrophobicContact CG2-CD1 4.35Å; A180-L185 WeakPolarHBondContact O-CB 3.34Å; A180-L185 PolarHBondContact O-N 3.1Å; A180-L185 VanDerWaalsContact O-N 3.08Å; N183-L185 HydrophobicContact CB-CD1 4Å; N183-L185 HydrophobicContact CB-CG 3.92Å; N183-L185 PolarHBondContact O-N 2.89Å; N183-L185 VanDerWaalsContact O-N 3.14Å
186	V	77.2	Confident	62.6	Low	11 Å²	11	70.5 Å²	70.5	7%	0.067	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-95.5	133.5	177.6	-179.3	0	0	0	0	109.5	W114 V119 A180 V181 G184 C188	W114-V186 CarbonylContact O-C 3.54Å; W114-V186 WeakPolarHBondContact O-CA 3.34Å; W114-V186 WeakPolarHBondContact O-CG1 3.41Å; V119-V186 HydrophobicContact CG2-CG2 3.99Å; A180-V186 HydrophobicContact CB-CG2 3.58Å; V181-V186 HydrophobicContact CG2-CB 4.08Å; V181-V186 HydrophobicContact CG2-CG1 4.42Å; V181-V186 HydrophobicContact CG2-CG2 3.95Å; G184-V186 VanDerWaalsContact C-N 3.3Å; G184-V186 PolarHBondContact O-N 3.49Å; V186-C188 PolarHBondContact O-N 3.19Å
187	T	65.4	Low	60.1	Low	51 Å²	51	73.5 Å²	73.5	31%	0.313	42%	0.423	S	S	.	.			trans	-65.6	80.2	158.9	38.9	0	0	0	0	109	K113 W114 T115 R189	K113-T187 HydrophobicContact CB-CG2 3.31Å; K113-T187 HydrophobicContact CD-CG2 3.97Å; K113-T187 HydrophobicContact CG-CG2 4.27Å; W114-T187 PolarHBondContact O-N 3.4Å; W114-T187 PolarHBondContact O-OG1 2.91Å; T115-T187 WeakPolarHBondContact CA-OG1 3.35Å; T115-T187 PolarHBondContact N-OG1 2.83Å; T187-R189 VanDerWaalsContact C-N 3.33Å; T187-R189 PolarHBondContact O-N 3Å
188	C	53.8	Low	57.5	Low	60 Å²	60	78.9 Å²	78.9	41%	0.405	45%	0.454	S	S	.	.			trans	-61.1	107.7	141.1	-60.9	0	0	0	0	104.5	V186 W190 A191	V186-C188 PolarHBondContact O-N 3.19Å; C188-W190 PolarHBondContact O-N 2.78Å; C188-A191 HydrophobicContact CB-CB 3.91Å
189	R	46.6	Very low	55.2	Low	210 Å²	210	84.5 Å²	84.5	79%	0.792	48%	0.475	S	S	*	.	S	Bend	trans	-72.2	24	-179.6	-162.8	-171.3	-82.1	-120	1.2	111.7	T187	T187-R189 VanDerWaalsContact C-N 3.33Å; T187-R189 PolarHBondContact O-N 3Å
190	W	37.2	Very low	52.6	Low	64 Å²	64	87.2 Å²	87.2	24%	0.242	49%	0.492	C	S	.	.			trans	-167.9	44.2	-149.8	-63.2	113.1	0	0	0	110.2	C188 E214 L234 L238	C188-W190 PolarHBondContact O-N 2.78Å; W190-E214 WeakPolarHBondContact CA-OE1 3.35Å; W190-E214 VanDerWaalsContact CE3-CD 3.46Å; W190-E214 HydrophobicContact CE3-CG 4.04Å; W190-E214 HydrophobicContact CZ3-CB 4.19Å; W190-E214 HydrophobicContact CZ3-CG 3.75Å; W190-L234 HydrophobicContact CH2-CB 3.91Å; W190-L234 HydrophobicContact CH2-CD1 4Å; W190-L234 HydrophobicContact CH2-CD2 3.77Å; W190-L234 HydrophobicContact CH2-CG 4.09Å; W190-L234 HydrophobicContact CZ2-CB 4.09Å; W190-L234 HydrophobicContact CZ2-CD2 4Å; W190-L238 HydrophobicContact CB-CD2 3.5Å; W190-L238 VanDerWaalsContact CD1-CD1 3.46Å; W190-L238 HydrophobicContact CD2-CB 3.6Å; W190-L238 HydrophobicContact CD2-CD1 4.11Å; W190-L238 HydrophobicContact CD2-CD2 3.77Å; W190-L238 HydrophobicContact CD2-CG 3.94Å; W190-L238 HydrophobicContact CE3-CB 3.75Å; W190-L238 HydrophobicContact CE3-CD2 4.38Å; W190-L238 HydrophobicContact CG-CB 4.14Å; W190-L238 HydrophobicContact CG-CD1 3.97Å; W190-L238 HydrophobicContact CG-CD2 3.32Å; W190-L238 HydrophobicContact CG-CG 3.93Å; W190-L238 HydrophobicContact CH2-CB 4.02Å; W190-L238 WeakPolarHBondContact CH2-O 3.4Å; W190-L238 HydrophobicContact CZ2-CB 3.87Å; W190-L238 HydrophobicContact CZ2-CD1 4.4Å; W190-L238 HydrophobicContact CZ3-CB 3.95Å; W190-L238 WeakPolarHBondContact CZ3-O 3.09Å; W190-L238 VanDerWaalsContact NE1-CD1 3.32Å
191	A	38	Very low	50.1	Low	73 Å²	73	90.2 Å²	90.2	60%	0.603	51%	0.507	S	S	*	.			trans	-132.8	65.4	-177.8	0	0	0	0	0	109.6	C188	C188-A191 HydrophobicContact CB-CB 3.91Å
192	K	38.7	Very low	47.5	Very low	47 Å²	47	93.1 Å²	93.1	20%	0.204	52%	0.521	C	S	.	.			trans	18.7	108.3	150.8	-163.7	-175.5	-173.9	120.2	0	115.7	S194 L208 T209 E210	K192-S194 PolarHBondContact O-N 3.18Å; K192-S194 VanDerWaalsContact O-N 3.16Å; K192-L208 WeakPolarHBondContact CD-O 3.2Å; K192-L208 VanDerWaalsContact NZ-C 3.26Å; K192-L208 PolarHBondContact NZ-O 3.42Å; K192-T209 HydrophobicContact CB-CG2 4.05Å; K192-E210 VanDerWaalsContact CE-OE1 3.27Å; K192-E210 WeakPolarHBondContact CE-OE1 3.33Å; K192-E210 IonicContact NZ-OE1 3.12Å; K192-E210 PolarHBondContact NZ-OE1 3.45Å
193	S	29.5	Very low	45	Very low	71 Å²	71	87 Å²	87	50%	0.497	52%	0.515	S	S	.	.			trans	-64.2	108.2	161.4	-173.4	0	0	0	0	110.4
194	S	37.5	Very low	42.4	Very low	85 Å²	85	91.2 Å²	91.2	59%	0.594	53%	0.525	S	S	*	.			trans	-152.1	148.2	156.1	62.2	0	0	0	0	112.1	K192	K192-S194 PolarHBondContact O-N 3.18Å; K192-S194 VanDerWaalsContact O-N 3.16Å
195	S	34.2	Very low	40.2	Very low	109 Å²	109	94.9 Å²	94.9	76%	0.762	52%	0.524	S	S	*	.			trans	-64.1	148.7	-160.1	-167.6	0	0	0	0	115.3	G197	S195-G197 VanDerWaalsContact C-N 3.34Å; S195-G197 PolarHBondContact O-N 3.05Å
196	P	35.5	Very low	37.7	Very low	101 Å²	101	101.3 Å²	101.3	66%	0.656	55%	0.551	S	S	*	*			trans	-73	80.8	179.9	30.9	-36.9	0	0	0	112.7
197	G	33.7	Very low	35.7	Very low	63 Å²	63	104.1 Å²	104.1	65%	0.649	58%	0.582	S	S	*	*			trans	-130.6	80.5	-177.6	0	0	0	0	0	114.1	S195	S195-G197 VanDerWaalsContact C-N 3.34Å; S195-G197 PolarHBondContact O-N 3.05Å
198	N	30	Very low	34.3	Very low	153 Å²	153	108.1 Å²	108.1	82%	0.818	60%	0.6	S	S	*	*			trans	49.6	72.1	153.1	-169.1	34.6	0	0	0	118
199	M	33.4	Very low	33.8	Very low	179 Å²	179	106.6 Å²	106.6	88%	0.882	59%	0.589	S	S	*	*			trans	-128.6	107.2	149.5	-85.1	-153.1	122.6	0	0	112.9
200	Q	30.7	Very low	33.8	Very low	155 Å²	155	102.3 Å²	102.3	72%	0.724	58%	0.578	S	S	*	*			trans	-50.7	153.4	139.5	-63.8	-177.1	-40.6	0	0	110
201	I	31.5	Very low	34.8	Very low	62 Å²	62	101.3 Å²	101.3	32%	0.318	58%	0.578	S	S	.	*			trans	100	100.1	165.4	-66.6	159.1	0	0	0	115.1	T317 L318 N320	I201-T317 HydrophobicContact CD1-CG2 3.35Å; I201-L318 WeakPolarHBondContact CD1-O 3.47Å; I201-N320 VanDerWaalsContact CA-OD1 3.22Å; I201-N320 WeakPolarHBondContact CA-OD1 3.49Å; I201-N320 HydrophobicContact CG1-CB 4.3Å
202	N	28.1	Very low	35.9	Very low	119 Å²	119	102.6 Å²	102.6	64%	0.636	58%	0.58	S	S	*	*			trans	-61.3	-174.3	179.3	-64.1	-33.6	0	0	0	113.6	N320 G321	N202-N320 HydrophobicContact CB-CB 4.11Å; N202-N320 WeakPolarHBondContact CB-OD1 3.27Å; N202-N320 PolarHBondContact N-OD1 2.66Å; N202-N320 PolarHBondContact ND2-OD1 2.9Å; N202-N320 PolarHBondContact OD1-OD1 3.37Å; N202-G321 WeakPolarHBondContact O-CA 3.31Å; N202-G321 PolarHBondContact O-N 3.28Å
203	G	25.9	Very low	37	Very low	54 Å²	54	105.3 Å²	105.3	56%	0.557	60%	0.596	S	S	*	*				72.7	159.2	129.6	0	0	0	0	0	117.8	G321	G203-G321 WeakPolarHBondContact O-CA 3.25Å
204	R	27	Very low	38.5	Very low	161 Å²	161	102.7 Å²	102.7	61%	0.608	58%	0.576	S	S	*	*			trans	52.4	119.2	-172.1	-86.3	-178.9	-175	-165.4	2	115.4	G321 Y323	R204-G321 WeakPolarHBondContact CB-O 3.38Å; R204-G321 WeakPolarHBondContact CD-O 3.39Å; R204-G321 WeakPolarHBondContact CG-O 3.42Å; R204-Y323 VanDerWaalsContact CD-N 3.32Å; R204-Y323 PolarHBondContact NH1-O 2.74Å
205	R	30.2	Very low	39.9	Very low	125 Å²	125	105.6 Å²	105.6	47%	0.472	57%	0.574	S	S	.	*			trans	76.4	99.1	154.4	-57.4	-176.7	-173.5	-165.5	3.5	117.6	Y323 E328	R205-Y323 VanDerWaalsContact CZ-CD1 3.47Å; R205-Y323 VanDerWaalsContact NH1-CD1 3.34Å; R205-E328 IonicContact CZ-OE1 3.86Å; R205-E328 IonicContact CZ-OE2 3.75Å; R205-E328 VanDerWaalsContact NH1-CD 3.28Å; R205-E328 IonicContact NH1-OE1 3.36Å; R205-E328 PolarHBondContact NH1-OE1 3.32Å; R205-E328 VanDerWaalsContact NH1-OE1 3.16Å; R205-E328 IonicContact NH1-OE2 2.99Å; R205-E328 PolarHBondContact NH1-OE2 2.87Å; R205-E328 IonicContact NH2-OE1 3.44Å; R205-E328 PolarHBondContact NH2-OE1 3.17Å; R205-E328 IonicContact NH2-OE2 3.1Å; R205-E328 PolarHBondContact NH2-OE2 2.89Å
206	F	28.8	Very low	41.6	Very low	175 Å²	175	107 Å²	107	77%	0.768	57%	0.568	S	S	*	*				23.1	131.5	123.1	-72.5	-86.5	0	0	0	119	E237	F206-E237 HydrophobicContact CE1-CG 4.24Å
207	G	33.2	Very low	43.2	Very low	69 Å²	69	105.8 Å²	105.8	71%	0.711	56%	0.556	S	S	*	*			trans	103	43.4	137.1	0	0	0	0	0	118.3
208	L	37.7	Very low	44.9	Very low	135 Å²	135	102.8 Å²	102.8	71%	0.707	53%	0.525	S	S	*	.			trans	-144.5	106.2	153.8	-72.6	180	0	0	0	110.7	K192	K192-L208 WeakPolarHBondContact CD-O 3.2Å; K192-L208 VanDerWaalsContact NZ-C 3.26Å; K192-L208 PolarHBondContact NZ-O 3.42Å
209	T	42.4	Very low	46.9	Very low	28 Å²	28	97.7 Å²	97.7	17%	0.172	50%	0.501	C	S	.	.			trans	-108	146.4	157.4	57.2	0	0	0	0	110.2	K192 E214 S240	K192-T209 HydrophobicContact CB-CG2 4.05Å; T209-E214 PolarHBondContact OG1-OE2 3.41Å; T209-S240 VanDerWaalsContact O-CB 3.31Å; T209-S240 WeakPolarHBondContact O-CB 3.45Å; T209-S240 WeakPolarHBondContact OG1-CB 2.94Å
210	E	47.4	Very low	48.9	Very low	121 Å²	121	96.1 Å²	96.1	57%	0.565	49%	0.486	S	S	*	.			trans	-134.9	40.3	-174.3	-70.2	153.8	-126	0	0	109.5	K192 P212	K192-E210 VanDerWaalsContact CE-OE1 3.27Å; K192-E210 WeakPolarHBondContact CE-OE1 3.33Å; K192-E210 IonicContact NZ-OE1 3.12Å; K192-E210 PolarHBondContact NZ-OE1 3.45Å; E210-P212 WeakPolarHBondContact O-CD 3.28Å
211	D	58.1	Low	50.8	Low	42 Å²	42	89.7 Å²	89.7	23%	0.225	46%	0.457	C	S	.	.			trans	-81.3	119.4	166.1	-169.2	-33.9	0	0	0	108	L213 E214 R215	D211-L213 PolarHBondContact O-N 3.17Å; D211-L213 VanDerWaalsContact OD1-CB 3.3Å; D211-L213 WeakPolarHBondContact OD1-CB 3.32Å; D211-L213 PolarHBondContact OD1-N 3.14Å; D211-E214 HydrophobicContact CB-CB 3.9Å; D211-E214 HydrophobicContact CB-CG 3.69Å; D211-E214 PolarHBondContact O-N 2.77Å; D211-R215 PolarHBondContact O-N 2.89Å
212	P	61.4	Low	52.8	Low	100 Å²	100	87.7 Å²	87.7	65%	0.649	45%	0.447	S	S	*	.	H	α-helix	trans	-58.2	-32.4	178.2	-23.4	34.5	0	0	0	112.7	E210 R215 E216	E210-P212 WeakPolarHBondContact O-CD 3.28Å; P212-R215 PolarHBondContact O-N 3.46Å; P212-E216 WeakPolarHBondContact O-CB 3.41Å; P212-E216 PolarHBondContact O-N 2.67Å
213	L	60.8	Low	54.9	Low	104 Å²	104	88.3 Å²	88.3	55%	0.545	45%	0.451	S	S	.	.	H	α-helix	trans	-72.6	-40.9	178.3	-177.6	67.2	0	0	0	111.3	D211 R215 E216 I217	D211-L213 PolarHBondContact O-N 3.17Å; D211-L213 VanDerWaalsContact OD1-CB 3.3Å; D211-L213 WeakPolarHBondContact OD1-CB 3.32Å; D211-L213 PolarHBondContact OD1-N 3.14Å; L213-R215 VanDerWaalsContact C-N 3.32Å; L213-R215 PolarHBondContact O-N 3.23Å; L213-E216 PolarHBondContact O-N 2.76Å; L213-I217 HydrophobicContact CD1-CD1 4.16Å; L213-I217 HydrophobicContact CD1-CG1 4.41Å; L213-I217 HydrophobicContact CG-CD1 3.86Å; L213-I217 HydrophobicContact CG-CG1 4.49Å; L213-I217 WeakPolarHBondContact O-CB 3.4Å; L213-I217 VanDerWaalsContact O-CG1 3.25Å; L213-I217 WeakPolarHBondContact O-CG1 3.35Å; L213-I217 PolarHBondContact O-N 2.58Å
214	E	61.7	Low	57.2	Low	17 Å²	17	90.8 Å²	90.8	8%	0.079	45%	0.451	C	S	.	.	H	α-helix	trans	-58.9	-46.2	172	-69.1	176.5	179	0	0	109.5	W190 T209 D211 E216 I217 E218	W190-E214 WeakPolarHBondContact CA-OE1 3.35Å; W190-E214 VanDerWaalsContact CE3-CD 3.46Å; W190-E214 HydrophobicContact CE3-CG 4.04Å; W190-E214 HydrophobicContact CZ3-CB 4.19Å; W190-E214 HydrophobicContact CZ3-CG 3.75Å; T209-E214 PolarHBondContact OG1-OE2 3.41Å; D211-E214 HydrophobicContact CB-CB 3.9Å; D211-E214 HydrophobicContact CB-CG 3.69Å; D211-E214 PolarHBondContact O-N 2.77Å; E214-E216 PolarHBondContact O-N 3.11Å; E214-I217 PolarHBondContact O-N 2.92Å; E214-E218 VanDerWaalsContact O-CB 3.27Å; E214-E218 WeakPolarHBondContact O-CB 3.35Å; E214-E218 WeakPolarHBondContact O-CG 3.46Å; E214-E218 PolarHBondContact O-N 3.28Å
215	R	65.9	Low	59.4	Low	145 Å²	145	85.3 Å²	85.3	55%	0.547	43%	0.433	S	S	.	.	H	α-helix	trans	-62.5	-37.3	176.4	176.6	175.1	-79.2	179.7	-3.5	113.6	D211 P212 L213 S219	D211-R215 PolarHBondContact O-N 2.89Å; P212-R215 PolarHBondContact O-N 3.46Å; L213-R215 VanDerWaalsContact C-N 3.32Å; L213-R215 PolarHBondContact O-N 3.23Å; R215-S219 VanDerWaalsContact O-CB 3.26Å; R215-S219 WeakPolarHBondContact O-CB 3.44Å; R215-S219 PolarHBondContact O-N 3.17Å
216	E	69.7	Low	61.4	Low	139 Å²	139	80.7 Å²	80.7	65%	0.65	42%	0.424	S	S	*	.	H	α-helix	trans	-72.1	-42	177.9	-172.1	170	-162	0	0	111.7	P212 L213 E214 E218 S219 Y220	P212-E216 WeakPolarHBondContact O-CB 3.41Å; P212-E216 PolarHBondContact O-N 2.67Å; L213-E216 PolarHBondContact O-N 2.76Å; E214-E216 PolarHBondContact O-N 3.11Å; E216-E218 VanDerWaalsContact C-N 3.34Å; E216-S219 PolarHBondContact O-N 3.33Å; E216-Y220 VanDerWaalsContact O-CB 3.28Å; E216-Y220 WeakPolarHBondContact O-CB 3.44Å; E216-Y220 PolarHBondContact O-N 2.82Å
217	I	69.1	Low	63.3	Low	75 Å²	75	72.3 Å²	72.3	39%	0.385	39%	0.387	S	S	.	.	H	α-helix	trans	-62	-42.9	172.2	-69	168.1	0	0	0	110.4	L213 E214 Y220 L221 L234	L213-I217 HydrophobicContact CD1-CD1 4.16Å; L213-I217 HydrophobicContact CD1-CG1 4.41Å; L213-I217 HydrophobicContact CG-CD1 3.86Å; L213-I217 HydrophobicContact CG-CG1 4.49Å; L213-I217 WeakPolarHBondContact O-CB 3.4Å; L213-I217 VanDerWaalsContact O-CG1 3.25Å; L213-I217 WeakPolarHBondContact O-CG1 3.35Å; L213-I217 PolarHBondContact O-N 2.58Å; E214-I217 PolarHBondContact O-N 2.92Å; I217-Y220 PolarHBondContact O-N 2.77Å; I217-L221 HydrophobicContact CG2-CD1 3.8Å; I217-L221 HydrophobicContact CG2-CG 4.41Å; I217-L221 WeakPolarHBondContact O-CB 3.48Å; I217-L221 VanDerWaalsContact O-CG 3.23Å; I217-L221 WeakPolarHBondContact O-CG 3.37Å; I217-L221 PolarHBondContact O-N 2.94Å; I217-L234 HydrophobicContact CG2-CD2 4.46Å
218	E	70	Confident	64.8	Low	0 Å²	0	70.4 Å²	70.4	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-57.9	-55.7	173.1	-78.9	176.6	-125.9	0	0	110.8	E214 E216 Y220 L221 V222 L234 M239 S240 T241	E214-E218 VanDerWaalsContact O-CB 3.27Å; E214-E218 WeakPolarHBondContact O-CB 3.35Å; E214-E218 WeakPolarHBondContact O-CG 3.46Å; E214-E218 PolarHBondContact O-N 3.28Å; E216-E218 VanDerWaalsContact C-N 3.34Å; E218-Y220 VanDerWaalsContact C-N 3.32Å; E218-Y220 PolarHBondContact O-N 3.02Å; E218-L221 CarbonylContact O-C 3.55Å; E218-L221 PolarHBondContact O-N 3.36Å; E218-V222 WeakPolarHBondContact O-CB 3.36Å; E218-V222 WeakPolarHBondContact O-CG2 3.18Å; E218-V222 PolarHBondContact O-N 3.19Å; E218-L234 HydrophobicContact CB-CD1 4.36Å; E218-L234 HydrophobicContact CG-CD1 3.31Å; E218-M239 HydrophobicContact CB-CE 3.98Å; E218-M239 HydrophobicContact CG-CE 3.72Å; E218-M239 WeakPolarHBondContact OE2-CA 3.45Å; E218-M239 WeakPolarHBondContact OE2-CE 3.33Å; E218-S240 WeakPolarHBondContact OE1-CB 3.46Å; E218-S240 PolarHBondContact OE1-N 3.34Å; E218-S240 PolarHBondContact OE1-OG 3.5Å; E218-S240 PolarHBondContact OE2-N 2.8Å; E218-S240 PolarHBondContact OE2-OG 2.73Å; E218-S240 VanDerWaalsContact OE2-OG 3.11Å; E218-T241 PolarHBondContact OE2-N 2.71Å; E218-T241 PolarHBondContact OE2-OG1 2.79Å
219	S	71.3	Confident	66.3	Low	46 Å²	46	69 Å²	69	32%	0.322	35%	0.351	S	S	.	.	H	α-helix	trans	-55.8	-45.3	178.2	-178.3	0	0	0	0	111.9	R215 E216 V222 N223	R215-S219 VanDerWaalsContact O-CB 3.26Å; R215-S219 WeakPolarHBondContact O-CB 3.44Å; R215-S219 PolarHBondContact O-N 3.17Å; E216-S219 PolarHBondContact O-N 3.33Å; S219-V222 WeakPolarHBondContact O-CB 3.22Å; S219-V222 PolarHBondContact O-N 2.72Å; S219-N223 WeakPolarHBondContact O-CB 3.33Å; S219-N223 PolarHBondContact O-N 2.89Å; S219-N223 PolarHBondContact O-ND2 3.37Å
220	Y	77.1	Confident	67.4	Low	146 Å²	146	67.6 Å²	67.6	57%	0.573	34%	0.343	S	S	*	.	H	α-helix	trans	-60.5	-47.4	176.3	178.9	-98.9	0	0	0	111.9	E216 I217 E218 N223 L224	E216-Y220 VanDerWaalsContact O-CB 3.28Å; E216-Y220 WeakPolarHBondContact O-CB 3.44Å; E216-Y220 PolarHBondContact O-N 2.82Å; I217-Y220 PolarHBondContact O-N 2.77Å; E218-Y220 VanDerWaalsContact C-N 3.32Å; E218-Y220 PolarHBondContact O-N 3.02Å; Y220-N223 PolarHBondContact O-N 2.9Å; Y220-L224 HydrophobicContact CE1-CD2 3.85Å; Y220-L224 VanDerWaalsContact O-CB 3.24Å; Y220-L224 WeakPolarHBondContact O-CB 3.14Å; Y220-L224 PolarHBondContact O-N 2.87Å
221	L	68.9	Low	68.1	Low	20 Å²	20	62.9 Å²	62.9	11%	0.105	33%	0.325	C	S	.	.	H	α-helix	trans	-66.4	-39.4	175.8	-70.1	170.1	0	0	0	111.4	I217 E218 N223 L224 I225 G226 T230 L233 L234	I217-L221 HydrophobicContact CG2-CD1 3.8Å; I217-L221 HydrophobicContact CG2-CG 4.41Å; I217-L221 WeakPolarHBondContact O-CB 3.48Å; I217-L221 VanDerWaalsContact O-CG 3.23Å; I217-L221 WeakPolarHBondContact O-CG 3.37Å; I217-L221 PolarHBondContact O-N 2.94Å; E218-L221 CarbonylContact O-C 3.55Å; E218-L221 PolarHBondContact O-N 3.36Å; L221-N223 VanDerWaalsContact C-N 3.26Å; L221-N223 PolarHBondContact O-N 2.86Å; L221-L224 PolarHBondContact O-N 2.56Å; L221-L224 VanDerWaalsContact O-N 3.17Å; L221-I225 HydrophobicContact CB-CD1 4.37Å; L221-I225 HydrophobicContact CB-CG1 4.3Å; L221-I225 HydrophobicContact CD2-CD1 4.05Å; L221-I225 HydrophobicContact CD2-CG1 4.49Å; L221-I225 WeakPolarHBondContact O-CG1 3.33Å; L221-I225 PolarHBondContact O-N 2.89Å; L221-G226 PolarHBondContact O-N 2.71Å; L221-T230 HydrophobicContact CB-CG2 3.48Å; L221-T230 VanDerWaalsContact CB-CG2 3.48Å; L221-T230 WeakPolarHBondContact CB-OG1 3.34Å; L221-T230 HydrophobicContact CD1-CG2 4.09Å; L221-T230 HydrophobicContact CG-CG2 4.45Å; L221-T230 PolarHBondContact O-OG1 3.01Å; L221-L233 HydrophobicContact CD1-CD2 4.11Å; L221-L233 HydrophobicContact CD2-CD2 4.22Å; L221-L234 HydrophobicContact CD1-CD1 4.19Å; L221-L234 HydrophobicContact CD1-CD2 3.52Å; L221-L234 HydrophobicContact CD1-CG 3.93Å
222	V	74.1	Confident	68.3	Low	20 Å²	20	61.2 Å²	61.2	12%	0.121	32%	0.315	C	S	.	.	H	α-helix	trans	-57.4	-44.6	175	176.1	0	0	0	0	110	E218 S219 G226 A227 T230 M239 Y243	E218-V222 WeakPolarHBondContact O-CB 3.36Å; E218-V222 WeakPolarHBondContact O-CG2 3.18Å; E218-V222 PolarHBondContact O-N 3.19Å; S219-V222 WeakPolarHBondContact O-CB 3.22Å; S219-V222 PolarHBondContact O-N 2.72Å; V222-G226 WeakPolarHBondContact O-CA 3.5Å; V222-G226 PolarHBondContact O-N 3.39Å; V222-A227 HydrophobicContact CB-CB 4.07Å; V222-A227 HydrophobicContact CG1-CB 3.94Å; V222-A227 HydrophobicContact CG2-CB 3.37Å; V222-T230 WeakPolarHBondContact CA-OG1 3.04Å; V222-T230 HydrophobicContact CG2-CG2 4.29Å; V222-T230 PolarHBondContact N-OG1 3.33Å; V222-M239 HydrophobicContact CG2-CE 4.42Å; V222-Y243 HydrophobicContact CB-CE1 4.5Å; V222-Y243 HydrophobicContact CB-CE2 4.3Å; V222-Y243 HydrophobicContact CG1-CD1 4.17Å; V222-Y243 HydrophobicContact CG1-CE1 3.75Å; V222-Y243 HydrophobicContact CG1-CE2 4.32Å; V222-Y243 HydrophobicContact CG2-CD2 3.81Å; V222-Y243 HydrophobicContact CG2-CE1 4.17Å; V222-Y243 HydrophobicContact CG2-CE2 3.2Å; V222-Y243 HydrophobicContact CG2-CG 4.47Å; V222-Y243 VanDerWaalsContact CG2-CZ 3.42Å
223	N	71.9	Confident	68.5	Low	132 Å²	132	60.8 Å²	60.8	71%	0.706	31%	0.307	S	S	*	.	H	α-helix	trans	-70.9	-34.4	178.6	-65.3	-30	0	0	0	112.4	S219 Y220 L221	S219-N223 WeakPolarHBondContact O-CB 3.33Å; S219-N223 PolarHBondContact O-N 2.89Å; S219-N223 PolarHBondContact O-ND2 3.37Å; Y220-N223 PolarHBondContact O-N 2.9Å; L221-N223 VanDerWaalsContact C-N 3.26Å; L221-N223 PolarHBondContact O-N 2.86Å
224	L	73.6	Confident	68.6	Low	107 Å²	107	56.9 Å²	56.9	56%	0.56	29%	0.287	S	S	*	.	H	α-helix	trans	-82.3	-39.7	-175.9	-174.6	67.2	0	0	0	113.7	Y220 L221	Y220-L224 HydrophobicContact CE1-CD2 3.85Å; Y220-L224 VanDerWaalsContact O-CB 3.24Å; Y220-L224 WeakPolarHBondContact O-CB 3.14Å; Y220-L224 PolarHBondContact O-N 2.87Å; L221-L224 PolarHBondContact O-N 2.56Å; L221-L224 VanDerWaalsContact O-N 3.17Å
225	I	75	Confident	68.4	Low	46 Å²	46	56.6 Å²	56.6	24%	0.236	29%	0.289	C	S	.	.	H	α-helix	trans	-127.7	-8.9	-170.8	56.6	172.4	0	0	0	113.7	L221 K229 L233	L221-I225 HydrophobicContact CB-CD1 4.37Å; L221-I225 HydrophobicContact CB-CG1 4.3Å; L221-I225 HydrophobicContact CD2-CD1 4.05Å; L221-I225 HydrophobicContact CD2-CG1 4.49Å; L221-I225 WeakPolarHBondContact O-CG1 3.33Å; L221-I225 PolarHBondContact O-N 2.89Å; I225-K229 HydrophobicContact CB-CB 3.69Å; I225-K229 HydrophobicContact CB-CD 4.08Å; I225-K229 HydrophobicContact CB-CG 4.41Å; I225-K229 HydrophobicContact CD1-CB 3.73Å; I225-K229 WeakPolarHBondContact CD1-O 3.15Å; I225-K229 HydrophobicContact CG1-CB 3.77Å; I225-K229 WeakPolarHBondContact O-CB 3.3Å; I225-K229 WeakPolarHBondContact O-CD 3.23Å; I225-K229 WeakPolarHBondContact O-CG 3.43Å; I225-L233 HydrophobicContact CD1-CB 4.07Å; I225-L233 HydrophobicContact CD1-CD1 3.76Å
226	G	71.7	Confident	67.8	Low	27 Å²	27	54 Å²	54	28%	0.278	28%	0.281	S	S	.	.			trans	79.1	138.4	-172.7	0	0	0	0	0	110.8	L221 V222 S228 K229 T230	L221-G226 PolarHBondContact O-N 2.71Å; V222-G226 WeakPolarHBondContact O-CA 3.5Å; V222-G226 PolarHBondContact O-N 3.39Å; G226-S228 VanDerWaalsContact C-N 3.26Å; G226-S228 PolarHBondContact O-N 3.29Å; G226-S228 VanDerWaalsContact O-N 3.11Å; G226-K229 CarbonylContact O-C 3.58Å; G226-K229 WeakPolarHBondContact O-CA 3.39Å; G226-K229 WeakPolarHBondContact O-CB 3.43Å; G226-K229 PolarHBondContact O-N 2.89Å; G226-T230 PolarHBondContact O-N 3.46Å; G226-T230 PolarHBondContact O-OG1 3.27Å
227	A	69.1	Low	66.9	Low	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-72	-2.7	-171.6	0	0	0	0	0	117.4	V222 K229 A231 M239 Y243 F245	V222-A227 HydrophobicContact CB-CB 4.07Å; V222-A227 HydrophobicContact CG1-CB 3.94Å; V222-A227 HydrophobicContact CG2-CB 3.37Å; A227-K229 VanDerWaalsContact C-N 3.31Å; A227-A231 WeakPolarHBondContact O-CB 3.17Å; A227-A231 PolarHBondContact O-N 3.02Å; A227-M239 HydrophobicContact CB-CE 4.41Å; A227-M239 HydrophobicContact CB-SD 4.32Å; A227-Y243 HydrophobicContact CB-CD2 3.69Å; A227-Y243 HydrophobicContact CB-CE2 4.33Å; A227-Y243 HydrophobicContact CB-CG 3.8Å; A227-F245 VanDerWaalsContact C-CZ 3.41Å; A227-F245 VanDerWaalsContact CA-CE2 3.42Å; A227-F245 HydrophobicContact CB-CD2 4.49Å; A227-F245 HydrophobicContact CB-CE1 4.36Å; A227-F245 HydrophobicContact CB-CE2 3.28Å; A227-F245 HydrophobicContact CB-CZ 3.22Å
228	S	63.6	Low	66	Low	29 Å²	29	52.6 Å²	52.6	20%	0.203	27%	0.274	C	S	.	.	H	α-helix	trans	-57.9	-51	154.8	-60.5	0	0	0	0	109.6	G226 T230 H232 F245	G226-S228 VanDerWaalsContact C-N 3.26Å; G226-S228 PolarHBondContact O-N 3.29Å; G226-S228 VanDerWaalsContact O-N 3.11Å; S228-T230 VanDerWaalsContact C-N 3.35Å; S228-H232 PolarHBondContact O-N 3.17Å; S228-H232 VanDerWaalsContact O-N 3.11Å; S228-H232 PolarHBondContact O-ND1 3.03Å; S228-F245 VanDerWaalsContact N-CD2 3.3Å; S228-F245 VanDerWaalsContact N-CE2 3.25Å; S228-F245 WeakPolarHBondContact OG-CB 3.48Å; S228-F245 VanDerWaalsContact OG-CD1 3.24Å; S228-F245 WeakPolarHBondContact OG-CD1 3.46Å; S228-F245 WeakPolarHBondContact OG-CG 3.4Å
229	K	69.1	Low	65.2	Low	104 Å²	104	54.1 Å²	54.1	45%	0.452	28%	0.282	S	S	.	.	H	α-helix	trans	-73.9	-24.6	179.7	-50	-164.9	-164.8	161.6	0	112.1	I225 G226 A227 H232 L233 K361	I225-K229 HydrophobicContact CB-CB 3.69Å; I225-K229 HydrophobicContact CB-CD 4.08Å; I225-K229 HydrophobicContact CB-CG 4.41Å; I225-K229 HydrophobicContact CD1-CB 3.73Å; I225-K229 WeakPolarHBondContact CD1-O 3.15Å; I225-K229 HydrophobicContact CG1-CB 3.77Å; I225-K229 WeakPolarHBondContact O-CB 3.3Å; I225-K229 WeakPolarHBondContact O-CD 3.23Å; I225-K229 WeakPolarHBondContact O-CG 3.43Å; G226-K229 CarbonylContact O-C 3.58Å; G226-K229 WeakPolarHBondContact O-CA 3.39Å; G226-K229 WeakPolarHBondContact O-CB 3.43Å; G226-K229 PolarHBondContact O-N 2.89Å; A227-K229 VanDerWaalsContact C-N 3.31Å; K229-H232 WeakPolarHBondContact O-CB 3.27Å; K229-L233 VanDerWaalsContact O-CB 3.25Å; K229-L233 WeakPolarHBondContact O-CB 3.45Å; K229-L233 PolarHBondContact O-N 3.43Å; K229-K361 HydrophobicContact CB-CD 4.38Å
230	T	66.4	Low	64.5	Low	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-75.1	-47.4	170.5	-48.1	0	0	0	0	112.9	L221 V222 G226 S228 H232 L233 L234 M239	L221-T230 HydrophobicContact CB-CG2 3.48Å; L221-T230 VanDerWaalsContact CB-CG2 3.48Å; L221-T230 WeakPolarHBondContact CB-OG1 3.34Å; L221-T230 HydrophobicContact CD1-CG2 4.09Å; L221-T230 HydrophobicContact CG-CG2 4.45Å; L221-T230 PolarHBondContact O-OG1 3.01Å; V222-T230 WeakPolarHBondContact CA-OG1 3.04Å; V222-T230 HydrophobicContact CG2-CG2 4.29Å; V222-T230 PolarHBondContact N-OG1 3.33Å; G226-T230 PolarHBondContact O-N 3.46Å; G226-T230 PolarHBondContact O-OG1 3.27Å; S228-T230 VanDerWaalsContact C-N 3.35Å; T230-H232 CarbonylContact O-C 3.15Å; T230-H232 PolarHBondContact O-N 2.81Å; T230-L233 PolarHBondContact O-N 2.81Å; T230-L234 HydrophobicContact CG2-CD1 3.59Å; T230-L234 HydrophobicContact CG2-CG 3.98Å; T230-L234 WeakPolarHBondContact O-CB 3.48Å; T230-L234 WeakPolarHBondContact O-CG 3.24Å; T230-L234 PolarHBondContact O-N 2.84Å; T230-M239 HydrophobicContact CG2-CE 3.73Å; T230-M239 HydrophobicContact CG2-SD 4.08Å
231	A	62	Low	63.4	Low	22 Å²	22	46.7 Å²	46.7	18%	0.182	25%	0.25	C	S	.	.	H	α-helix	trans	-58.5	-20.7	172.9	0	0	0	0	0	111.8	A227 G235 K236 M239	A227-A231 WeakPolarHBondContact O-CB 3.17Å; A227-A231 PolarHBondContact O-N 3.02Å; A231-G235 CarbonylContact O-C 3.41Å; A231-G235 WeakPolarHBondContact O-CA 3.41Å; A231-G235 PolarHBondContact O-N 2.93Å; A231-K236 PolarHBondContact O-N 2.74Å; A231-K236 VanDerWaalsContact O-N 3.15Å; A231-M239 WeakPolarHBondContact CA-SD 3.18Å; A231-M239 HydrophobicContact CB-CG 4.09Å; A231-M239 HydrophobicContact CB-SD 3.59Å; A231-M239 VanDerWaalsContact CB-SD 3.59Å; A231-M239 PolarHBondContact N-SD 3.12Å; A231-M239 VanDerWaalsContact N-SD 3.37Å
232	H	61.7	Low	62.6	Low	7 Å²	7	52.1 Å²	52.1	3%	0.032	29%	0.286	C	S	.	.	H	α-helix	trans	-76.7	-58.5	164	-99.2	52.9	0	0	0	116.2	S228 K229 T230 L234 G235 E357 L358 K361	S228-H232 PolarHBondContact O-N 3.17Å; S228-H232 VanDerWaalsContact O-N 3.11Å; S228-H232 PolarHBondContact O-ND1 3.03Å; K229-H232 WeakPolarHBondContact O-CB 3.27Å; T230-H232 CarbonylContact O-C 3.15Å; T230-H232 PolarHBondContact O-N 2.81Å; H232-L234 PolarHBondContact O-N 3.46Å; H232-G235 PolarHBondContact O-N 3.38Å; H232-E357 PolarHBondContact CD2-O 3.24Å; H232-E357 VanDerWaalsContact CE1-CB 3.48Å; H232-E357 WeakPolarHBondContact CE1-CB 3.34Å; H232-E357 IonicContact CE1-OE1 3.16Å; H232-E357 IonicContact CE1-OE2 3.19Å; H232-E357 PolarHBondContact CE1-OE2 3.27Å; H232-E357 IonicContact ND1-OE2 2.72Å; H232-E357 WeakPolarHBondContact NE2-CA 3.4Å; H232-E357 WeakPolarHBondContact NE2-CB 3.4Å; H232-E357 WeakPolarHBondContact NE2-CG 3.22Å; H232-E357 PolarHBondContact NE2-O 3.09Å; H232-E357 IonicContact NE2-OE1 2.68Å; H232-E357 IonicContact NE2-OE2 2.71Å; H232-L358 HydrophobicContact CB-CD2 4.15Å; H232-L358 VanDerWaalsContact CD2-CA 3.45Å; H232-L358 WeakPolarHBondContact CD2-CA 3.49Å; H232-L358 VanDerWaalsContact NE2-CA 3.31Å; H232-L358 WeakPolarHBondContact NE2-CA 3.2Å; H232-L358 PolarHBondContact NE2-N 3.27Å; H232-L358 WeakPolarHBondContact O-CD2 3.42Å; H232-K361 HydrophobicContact CB-CD 3.88Å; H232-K361 PolarHBondContact CD2-NZ 2.91Å; H232-K361 VanDerWaalsContact CG-NZ 3.32Å; H232-K361 PolarHBondContact NE2-NZ 3.49Å
233	L	64.8	Low	61.4	Low	90 Å²	90	55.2 Å²	55.2	47%	0.471	30%	0.297	S	S	.	.	H	α-helix	trans	-68.7	-25.7	-167	-157.7	141.5	0	0	0	110.5	L221 I225 K229 T230	L221-L233 HydrophobicContact CD1-CD2 4.11Å; L221-L233 HydrophobicContact CD2-CD2 4.22Å; I225-L233 HydrophobicContact CD1-CB 4.07Å; I225-L233 HydrophobicContact CD1-CD1 3.76Å; K229-L233 VanDerWaalsContact O-CB 3.25Å; K229-L233 WeakPolarHBondContact O-CB 3.45Å; K229-L233 PolarHBondContact O-N 3.43Å; T230-L233 PolarHBondContact O-N 2.81Å
234	L	63.9	Low	60	Low	22 Å²	22	54.6 Å²	54.6	12%	0.115	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-43.6	169.1	-51.8	-176.1	0	0	0	111.4	W190 I217 E218 L221 T230 H232 L238	W190-L234 HydrophobicContact CH2-CB 3.91Å; W190-L234 HydrophobicContact CH2-CD1 4Å; W190-L234 HydrophobicContact CH2-CD2 3.77Å; W190-L234 HydrophobicContact CH2-CG 4.09Å; W190-L234 HydrophobicContact CZ2-CB 4.09Å; W190-L234 HydrophobicContact CZ2-CD2 4Å; I217-L234 HydrophobicContact CG2-CD2 4.46Å; E218-L234 HydrophobicContact CB-CD1 4.36Å; E218-L234 HydrophobicContact CG-CD1 3.31Å; L221-L234 HydrophobicContact CD1-CD1 4.19Å; L221-L234 HydrophobicContact CD1-CD2 3.52Å; L221-L234 HydrophobicContact CD1-CG 3.93Å; T230-L234 HydrophobicContact CG2-CD1 3.59Å; T230-L234 HydrophobicContact CG2-CG 3.98Å; T230-L234 WeakPolarHBondContact O-CB 3.48Å; T230-L234 WeakPolarHBondContact O-CG 3.24Å; T230-L234 PolarHBondContact O-N 2.84Å; H232-L234 PolarHBondContact O-N 3.46Å; L234-L238 HydrophobicContact CB-CB 4.21Å; L234-L238 WeakPolarHBondContact O-CB 3.43Å; L234-L238 WeakPolarHBondContact O-CD1 3.11Å
235	G	57.4	Low	58.6	Low	12 Å²	12	54 Å²	54	12%	0.124	29%	0.293	C	S	.	.			trans	105.1	147.1	-172.8	0	0	0	0	0	111.8	A231 H232 E237 L238	A231-G235 CarbonylContact O-C 3.41Å; A231-G235 WeakPolarHBondContact O-CA 3.41Å; A231-G235 PolarHBondContact O-N 2.93Å; H232-G235 PolarHBondContact O-N 3.38Å; G235-E237 PolarHBondContact O-N 2.72Å; G235-E237 VanDerWaalsContact O-N 3.09Å; G235-L238 CarbonylContact O-C 3.45Å; G235-L238 WeakPolarHBondContact O-CA 2.94Å; G235-L238 WeakPolarHBondContact O-CB 3.37Å; G235-L238 PolarHBondContact O-N 3.46Å
236	K	54	Low	56.8	Low	90 Å²	90	60.4 Å²	60.4	39%	0.391	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-53.3	-31.7	-176.8	-84.2	179.3	156.8	174.7	0	114.7	A231 L238 D350 L351 I354	A231-K236 PolarHBondContact O-N 2.74Å; A231-K236 VanDerWaalsContact O-N 3.15Å; K236-L238 PolarHBondContact O-N 3.14Å; K236-D350 PolarHBondContact NZ-O 3.43Å; K236-L351 HydrophobicContact CD-CD2 4.41Å; K236-I354 HydrophobicContact CD-CB 4.45Å; K236-I354 HydrophobicContact CD-CG2 3.92Å; K236-I354 HydrophobicContact CG-CG2 4.12Å
237	E	49.4	Very low	55	Low	146 Å²	146	64.6 Å²	64.6	68%	0.682	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-77.2	-8	178.9	-62.5	-173.6	130.9	0	0	113.4	F206 G235	F206-E237 HydrophobicContact CE1-CG 4.24Å; G235-E237 PolarHBondContact O-N 2.72Å; G235-E237 VanDerWaalsContact O-N 3.09Å
238	L	51.5	Low	53.4	Low	38 Å²	38	69.7 Å²	69.7	20%	0.199	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-129.1	20.4	-157.1	-46.4	176.8	0	0	0	111.2	W190 L234 G235 K236	W190-L238 HydrophobicContact CB-CD2 3.5Å; W190-L238 VanDerWaalsContact CD1-CD1 3.46Å; W190-L238 HydrophobicContact CD2-CB 3.6Å; W190-L238 HydrophobicContact CD2-CD1 4.11Å; W190-L238 HydrophobicContact CD2-CD2 3.77Å; W190-L238 HydrophobicContact CD2-CG 3.94Å; W190-L238 HydrophobicContact CE3-CB 3.75Å; W190-L238 HydrophobicContact CE3-CD2 4.38Å; W190-L238 HydrophobicContact CG-CB 4.14Å; W190-L238 HydrophobicContact CG-CD1 3.97Å; W190-L238 HydrophobicContact CG-CD2 3.32Å; W190-L238 HydrophobicContact CG-CG 3.93Å; W190-L238 HydrophobicContact CH2-CB 4.02Å; W190-L238 WeakPolarHBondContact CH2-O 3.4Å; W190-L238 HydrophobicContact CZ2-CB 3.87Å; W190-L238 HydrophobicContact CZ2-CD1 4.4Å; W190-L238 HydrophobicContact CZ3-CB 3.95Å; W190-L238 WeakPolarHBondContact CZ3-O 3.09Å; W190-L238 VanDerWaalsContact NE1-CD1 3.32Å; L234-L238 HydrophobicContact CB-CB 4.21Å; L234-L238 WeakPolarHBondContact O-CB 3.43Å; L234-L238 WeakPolarHBondContact O-CD1 3.11Å; G235-L238 CarbonylContact O-C 3.45Å; G235-L238 WeakPolarHBondContact O-CA 2.94Å; G235-L238 WeakPolarHBondContact O-CB 3.37Å; G235-L238 PolarHBondContact O-N 3.46Å; K236-L238 PolarHBondContact O-N 3.14Å
239	M	52.2	Low	52	Low	33 Å²	33	75.3 Å²	75.3	16%	0.163	41%	0.405	C	S	.	.			trans	-105.5	112.1	165	-69.4	-132.4	62.5	0	0	109.1	E218 V222 A227 T230 A231 T241 Y243	E218-M239 HydrophobicContact CB-CE 3.98Å; E218-M239 HydrophobicContact CG-CE 3.72Å; E218-M239 WeakPolarHBondContact OE2-CA 3.45Å; E218-M239 WeakPolarHBondContact OE2-CE 3.33Å; V222-M239 HydrophobicContact CG2-CE 4.42Å; A227-M239 HydrophobicContact CB-CE 4.41Å; A227-M239 HydrophobicContact CB-SD 4.32Å; T230-M239 HydrophobicContact CG2-CE 3.73Å; T230-M239 HydrophobicContact CG2-SD 4.08Å; A231-M239 WeakPolarHBondContact CA-SD 3.18Å; A231-M239 HydrophobicContact CB-CG 4.09Å; A231-M239 HydrophobicContact CB-SD 3.59Å; A231-M239 VanDerWaalsContact CB-SD 3.59Å; A231-M239 PolarHBondContact N-SD 3.12Å; A231-M239 VanDerWaalsContact N-SD 3.37Å; M239-T241 PolarHBondContact O-N 3.24Å; M239-Y243 HydrophobicContact CE-CD2 3.85Å; M239-Y243 HydrophobicContact CE-CE2 4.01Å
240	S	56	Low	50.5	Low	13 Å²	13	76.1 Å²	76.1	9%	0.091	42%	0.415	C	S	.	.	S	Bend	trans	-67.8	-13.4	166.9	67.4	0	0	0	0	113	T209 E218	T209-S240 VanDerWaalsContact O-CB 3.31Å; T209-S240 WeakPolarHBondContact O-CB 3.45Å; T209-S240 WeakPolarHBondContact OG1-CB 2.94Å; E218-S240 WeakPolarHBondContact OE1-CB 3.46Å; E218-S240 PolarHBondContact OE1-N 3.34Å; E218-S240 PolarHBondContact OE1-OG 3.5Å; E218-S240 PolarHBondContact OE2-N 2.8Å; E218-S240 PolarHBondContact OE2-OG 2.73Å; E218-S240 VanDerWaalsContact OE2-OG 3.11Å
241	T	54.1	Low	49.3	Very low	23 Å²	23	83.4 Å²	83.4	14%	0.141	45%	0.449	C	S	.	.	S	Bend	trans	-123.9	118.5	-178.4	41.3	0	0	0	0	113.7	E218 M239 Y243	E218-T241 PolarHBondContact OE2-N 2.71Å; E218-T241 PolarHBondContact OE2-OG1 2.79Å; M239-T241 PolarHBondContact O-N 3.24Å; T241-Y243 WeakPolarHBondContact O-CD2 3.45Å; T241-Y243 PolarHBondContact O-N 2.63Å; T241-Y243 WeakPolarHBondContact OG1-CE2 3.41Å
242	P	52.3	Low	48.3	Very low	133 Å²	133	88.9 Å²	88.9	86%	0.864	47%	0.474	S	S	*	.			trans	-76.4	107.8	175.6	29.8	-32.6	0	0	0	110.6
243	Y	49.8	Very low	47	Very low	86 Å²	86	93.3 Å²	93.3	34%	0.337	51%	0.505	S	S	.	.			trans	-106.4	136.4	176.7	-75.1	-83.8	0	0	0	111.3	V222 A227 M239 T241 F245	V222-Y243 HydrophobicContact CB-CE1 4.5Å; V222-Y243 HydrophobicContact CB-CE2 4.3Å; V222-Y243 HydrophobicContact CG1-CD1 4.17Å; V222-Y243 HydrophobicContact CG1-CE1 3.75Å; V222-Y243 HydrophobicContact CG1-CE2 4.32Å; V222-Y243 HydrophobicContact CG2-CD2 3.81Å; V222-Y243 HydrophobicContact CG2-CE1 4.17Å; V222-Y243 HydrophobicContact CG2-CE2 3.2Å; V222-Y243 HydrophobicContact CG2-CG 4.47Å; V222-Y243 VanDerWaalsContact CG2-CZ 3.42Å; A227-Y243 HydrophobicContact CB-CD2 3.69Å; A227-Y243 HydrophobicContact CB-CE2 4.33Å; A227-Y243 HydrophobicContact CB-CG 3.8Å; M239-Y243 HydrophobicContact CE-CD2 3.85Å; M239-Y243 HydrophobicContact CE-CE2 4.01Å; T241-Y243 WeakPolarHBondContact O-CD2 3.45Å; T241-Y243 PolarHBondContact O-N 2.63Å; T241-Y243 WeakPolarHBondContact OG1-CE2 3.41Å; Y243-F245 HydrophobicContact CG-CE2 4.43Å; Y243-F245 HydrophobicContact CG-CZ 4.46Å; Y243-F245 WeakPolarHBondContact O-CD2 3.17Å; Y243-F245 WeakPolarHBondContact O-CE2 3.41Å
244	P	42.3	Very low	45.7	Very low	119 Å²	119	94.2 Å²	94.2	77%	0.773	52%	0.517	S	S	*	.			trans	-83.9	126.2	-178.8	31.9	-33.1	0	0	0	112.3
245	F	44.4	Very low	44.4	Very low	95 Å²	95	98 Å²	98	42%	0.417	55%	0.545	S	S	.	.			trans	-124.6	126.1	172.6	-64.5	-74.3	0	0	0	113.5	A227 S228 Y243	A227-F245 VanDerWaalsContact C-CZ 3.41Å; A227-F245 VanDerWaalsContact CA-CE2 3.42Å; A227-F245 HydrophobicContact CB-CD2 4.49Å; A227-F245 HydrophobicContact CB-CE1 4.36Å; A227-F245 HydrophobicContact CB-CE2 3.28Å; A227-F245 HydrophobicContact CB-CZ 3.22Å; S228-F245 VanDerWaalsContact N-CD2 3.3Å; S228-F245 VanDerWaalsContact N-CE2 3.25Å; S228-F245 WeakPolarHBondContact OG-CB 3.48Å; S228-F245 VanDerWaalsContact OG-CD1 3.24Å; S228-F245 WeakPolarHBondContact OG-CD1 3.46Å; S228-F245 WeakPolarHBondContact OG-CG 3.4Å; Y243-F245 HydrophobicContact CG-CE2 4.43Å; Y243-F245 HydrophobicContact CG-CZ 4.46Å; Y243-F245 WeakPolarHBondContact O-CD2 3.17Å; Y243-F245 WeakPolarHBondContact O-CE2 3.41Å
246	Q	36.7	Very low	43.5	Very low	179 Å²	179	106.8 Å²	106.8	84%	0.836	58%	0.58	S	S	*	*			trans	-104.8	125.7	171.9	-63.5	173.3	-24.9	0	0	107.9
247	T	34.8	Very low	42.7	Very low	115 Å²	115	107.8 Å²	107.8	71%	0.706	60%	0.598	S	S	*	*			trans	-137.9	113.8	163.4	47.3	0	0	0	0	109.2
248	S	35	Very low	42.1	Very low	107 Å²	107	105 Å²	105	75%	0.748	60%	0.599	S	S	*	*			trans	-156.6	120.1	172.9	61.5	0	0	0	0	109.1
249	D	35.1	Very low	41.6	Very low	147 Å²	147	111.5 Å²	111.5	79%	0.786	63%	0.629	S	S	*	*			trans	-176.5	134.3	151.2	-106.9	-18.2	0	0	0	107.5
250	N	36.9	Very low	40.8	Very low	122 Å²	122	115.6 Å²	115.6	65%	0.652	65%	0.652	S	S	*	*				-162.9	150.4	50	-95.3	-64.9	0	0	0	111.8
251	Q	40.2	Very low	40	Very low	153 Å²	153	120.9 Å²	120.9	72%	0.715	68%	0.683	S	S	*	*				174.8	118.3	105.4	-92.5	-176.2	81.7	0	0	112.8
252	I	41.2	Very low	39	Very low	137 Å²	137	124.7 Å²	124.7	70%	0.703	71%	0.71	S	S	*	*				37.1	126.4	111.9	-57.2	172.4	0	0	0	115.1
253	S	35.2	Very low	38.1	Very low	100 Å²	100	123.5 Å²	123.5	70%	0.699	71%	0.705	S	S	*	*			cis	178.9	-158.6	5	60	0	0	0	0	107.8
254	P	36.4	Very low	37.4	Very low	109 Å²	109	124.9 Å²	124.9	71%	0.708	73%	0.728	S	S	*	*			cis	-127.4	171	-42.5	34.1	-17.4	0	0	0	114.4
255	S	37.6	Very low	37.1	Very low	101 Å²	101	124.8 Å²	124.8	71%	0.706	73%	0.73	S	S	*	*				139.9	132	123.4	71.4	0	0	0	0	117.1
256	K	39.3	Very low	37.1	Very low	197 Å²	197	125.9 Å²	125.9	86%	0.857	75%	0.747	S	S	*	*			trans	60.6	151.3	161.9	-60.6	172.6	-176.9	177.9	0	117.2
257	S	36.2	Very low	37.1	Very low	110 Å²	110	125 Å²	125	77%	0.769	75%	0.747	S	S	*	*			cis	179.3	144.4	-26.7	49.2	0	0	0	0	107.6
258	A	37.3	Very low	37	Very low	87 Å²	87	130.1 Å²	130.1	72%	0.719	75%	0.753	S	S	*	*			cis	-169.8	175.7	-14.2	0	0	0	0	0	108.3
259	Q	40.9	Very low	37	Very low	175 Å²	175	131 Å²	131	82%	0.818	75%	0.754	S	S	*	*			trans	66.8	153.2	169.1	-56.7	-169.4	-92.1	0	0	117.4
260	D	34.9	Very low	37.1	Very low	120 Å²	120	130 Å²	130	64%	0.642	75%	0.753	S	S	*	*			cis	-160.9	164.3	-23.5	-108.6	-35.4	0	0	0	110.6
261	V	39.1	Very low	37.6	Very low	124 Å²	124	129.2 Å²	129.2	75%	0.752	76%	0.755	S	S	*	*			trans	52.4	107.1	156	-62.3	0	0	0	0	123.7
262	S	32.5	Very low	37.3	Very low	102 Å²	102	131.1 Å²	131.1	71%	0.713	76%	0.757	S	S	*	*				69.2	110.6	110.3	-53.2	0	0	0	0	123.7
263	S	33.4	Very low	37.1	Very low	108 Å²	108	129.6 Å²	129.6	76%	0.755	76%	0.758	S	S	*	*				86.9	153.9	113	78.9	0	0	0	0	122.8
264	S	35.8	Very low	37.1	Very low	115 Å²	115	130.7 Å²	130.7	80%	0.804	76%	0.76	S	S	*	*			trans	93.9	125.2	157.9	76.3	0	0	0	0	119.4
265	S	36.4	Very low	37.2	Very low	117 Å²	117	128.9 Å²	128.9	82%	0.818	76%	0.762	S	S	*	*			trans	-104.9	-156.1	-163.2	-40.7	0	0	0	0	110.6
266	P	44	Very low	37.4	Very low	119 Å²	119	134.6 Å²	134.6	77%	0.773	77%	0.767	S	S	*	*				-127	171.7	-128.5	34.7	-12.4	0	0	0	116.3
267	L	36.6	Very low	37.2	Very low	160 Å²	160	131.5 Å²	131.5	84%	0.838	76%	0.756	S	S	*	*			trans	-147.4	120.9	162.9	-81.1	171.8	0	0	0	108.5
268	R	33.2	Very low	37.5	Very low	223 Å²	223	134 Å²	134	84%	0.842	76%	0.761	S	S	*	*				83.1	119.2	75.1	-164.9	-170.7	-157.2	-157.5	7.9	113.2
269	T	35.4	Very low	37.4	Very low	125 Å²	125	138.1 Å²	138.1	77%	0.767	77%	0.765	S	S	*	*				164.1	154.2	125	-64	0	0	0	0	111.9
270	V	35.9	Very low	37.2	Very low	127 Å²	127	134.8 Å²	134.8	77%	0.77	76%	0.761	S	S	*	*			trans	-130	-155.9	-172.5	-132.5	0	0	0	0	107.6
271	P	47.3	Very low	37.3	Very low	105 Å²	105	134.6 Å²	134.6	68%	0.682	77%	0.769	S	S	*	*			cis	-131.1	-170.1	-44.2	31.5	-10.1	0	0	0	113.9
272	Y	34.4	Very low	37.1	Very low	193 Å²	193	134.2 Å²	134.2	76%	0.757	77%	0.772	S	S	*	*				119.5	146	124.2	-144	-105	0	0	0	121.7	V274	Y272-V274 HydrophobicContact CD1-CG2 4.35Å; Y272-V274 HydrophobicContact CE1-CG2 3.61Å
273	S	36.4	Very low	37.4	Very low	105 Å²	105	135.2 Å²	135.2	73%	0.734	78%	0.776	S	S	*	*			trans	105.1	142.5	161.1	-45.4	0	0	0	0	118.3
274	V	37.1	Very low	37.3	Very low	123 Å²	123	136.1 Å²	136.1	75%	0.745	78%	0.778	S	S	*	*			cis	-175.9	149.1	-39.6	134.8	0	0	0	0	109.7	Y272	Y272-V274 HydrophobicContact CD1-CG2 4.35Å; Y272-V274 HydrophobicContact CE1-CG2 3.61Å
275	G	38.1	Very low	37.4	Very low	71 Å²	71	137.3 Å²	137.3	73%	0.732	78%	0.779	S	S	*	*			trans	99.5	148.9	156.1	0	0	0	0	0	118
276	R	40.9	Very low	37.3	Very low	220 Å²	220	137 Å²	137	83%	0.83	78%	0.775	S	S	*	*			cis	-158.9	159.3	-4.1	-159.8	-178.8	-179.4	179.1	6.9	112.7
277	E	36.1	Very low	36.5	Very low	133 Å²	133	139.6 Å²	139.6	62%	0.621	78%	0.781	S	S	*	*			trans	-50.2	155	179.7	-46	85.7	-113.7	0	0	119
278	N	42	Very low	36.4	Very low	162 Å²	162	137 Å²	137	87%	0.866	78%	0.776	S	S	*	*				-170.5	166.4	104.2	-117.6	-11.5	0	0	0	115.6
279	E	34.9	Very low	36.2	Very low	173 Å²	173	132.5 Å²	132.5	81%	0.808	77%	0.774	S	S	*	*			trans	-105.3	167.7	-156	-52.9	-169.1	124.5	0	0	118.6
280	S	36.1	Very low	36.2	Very low	106 Å²	106	133.8 Å²	133.8	74%	0.741	78%	0.776	S	S	*	*				115.3	144	127.7	78.8	0	0	0	0	120.7
281	S	38	Very low	36.1	Very low	115 Å²	115	132.3 Å²	132.3	80%	0.804	77%	0.768	S	S	*	*			trans	89.3	108	156.1	-50.2	0	0	0	0	120.2
282	S	34.9	Very low	35.5	Very low	117 Å²	117	136.6 Å²	136.6	82%	0.818	77%	0.771	S	S	*	*			trans	-92.4	165.4	158.5	-57.8	0	0	0	0	110.8
283	P	37.8	Very low	35.7	Very low	122 Å²	122	135.5 Å²	135.5	79%	0.792	77%	0.773	S	S	*	*				-151.5	146.7	106	35.5	-17.2	0	0	0	118.3
284	T	32.6	Very low	35.5	Very low	128 Å²	128	136.9 Å²	136.9	79%	0.785	78%	0.778	S	S	*	*			trans	11.9	129	137.1	-43.9	0	0	0	0	121.6
285	V	37.9	Very low	35.4	Very low	139 Å²	139	136.2 Å²	136.2	84%	0.842	78%	0.778	S	S	*	*				-162.9	175.7	122.8	-130.6	0	0	0	0	111.3
286	P	33.6	Very low	35.3	Very low	111 Å²	111	138 Å²	138	72%	0.721	78%	0.779	S	S	*	*				-112.2	166.8	-117.6	41.7	-26.1	0	0	0	116.4
287	L	27.6	Very low	35.2	Very low	174 Å²	174	132.8 Å²	132.8	91%	0.911	78%	0.777	S	S	*	*			trans	-86.3	135	170.5	-171.2	65.7	0	0	0	110.9
288	S	34.4	Very low	35.1	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	79%	0.794	S	S	*	*			trans	-123.1	141.1	172.3	-70.5	0	0	0	0	111.3
289	T	28.3	Very low	35.1	Very low	129 Å²	129	133.1 Å²	133.1	79%	0.791	79%	0.789	S	S	*	*			trans	-76.8	154.6	-173.5	42.3	0	0	0	0	113.2
290	N	35.8	Very low	35.2	Very low	152 Å²	152	130.9 Å²	130.9	81%	0.813	79%	0.792	S	S	*	*			trans	-163.6	107.4	138.7	-106	-31.4	0	0	0	114.5
291	T	34	Very low	35.4	Very low	96 Å²	96	130.3 Å²	130.3	59%	0.589	79%	0.788	S	S	*	*			trans	-0.8	124.6	143.1	-46.7	0	0	0	0	118.9	Q293	T291-Q293 HydrophobicContact CG2-CG 4.03Å
292	Y	35.2	Very low	35.5	Very low	194 Å²	194	133.1 Å²	133.1	76%	0.761	79%	0.789	S	S	*	*			trans	-86.2	109	156.4	-72.6	-82.3	0	0	0	110
293	Q	38.4	Very low	35.8	Very low	171 Å²	171	135.6 Å²	135.6	80%	0.799	79%	0.791	S	S	*	*			trans	-89.9	115.8	161.1	-74.1	-178	-0.7	0	0	109.1	T291 S295	T291-Q293 HydrophobicContact CG2-CG 4.03Å; Q293-S295 PolarHBondContact O-N 3.45Å
294	T	31.2	Very low	35.8	Very low	134 Å²	134	132.7 Å²	132.7	82%	0.822	78%	0.783	S	S	*	*			trans	-75.3	113.6	162.3	47.4	0	0	0	0	108.8
295	S	35.7	Very low	36.1	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	78%	0.782	S	S	*	*			trans	-150.8	135.5	166.7	-81.2	0	0	0	0	111.3	Q293	Q293-S295 PolarHBondContact O-N 3.45Å
296	S	36.3	Very low	36.1	Very low	108 Å²	108	133.8 Å²	133.8	76%	0.755	78%	0.782	S	S	*	*			trans	-61.5	142	-179.8	48.3	0	0	0	0	113.7
297	S	38.7	Very low	36.3	Very low	111 Å²	111	133.6 Å²	133.6	78%	0.776	78%	0.784	S	S	*	*				168.2	106.7	119.3	-75.2	0	0	0	0	112.2
298	E	34.3	Very low	37	Very low	210 Å²	210	132.2 Å²	132.2	98%	0.981	78%	0.782	S	S	*	*			trans	-94.1	87.4	161.7	-77.7	-164.9	125.4	0	0	110.1
299	A	40.9	Very low	37	Very low	92 Å²	92	132.2 Å²	132.2	76%	0.76	78%	0.782	S	S	*	*			trans	-160.4	100.7	162.3	0	0	0	0	0	111.6
300	S	37.9	Very low	37.6	Very low	126 Å²	126	138 Å²	138	88%	0.881	79%	0.789	S	S	*	*				159.7	165.7	123.6	-160.3	0	0	0	0	111
301	S	39.4	Very low	37.6	Very low	93 Å²	93	134.6 Å²	134.6	65%	0.65	79%	0.79	S	S	*	*			trans	-116.2	148.7	-162.2	54.3	0	0	0	0	113.8
302	Q	40.1	Very low	38.2	Very low	175 Å²	175	139 Å²	139	82%	0.818	80%	0.802	S	S	*	*			trans	81.7	150	144.5	-156.5	171.5	-9.3	0	0	117.7
303	I	41.5	Very low	38.6	Very low	169 Å²	169	137.1 Å²	137.1	87%	0.867	81%	0.805	S	S	*	*			trans	72	129.2	-179.5	-37.7	161.3	0	0	0	112.4
304	G	37.3	Very low	38.8	Very low	61 Å²	61	135.8 Å²	135.8	63%	0.629	80%	0.803	S	S	*	*			cis	152.6	128.2	-4	0	0	0	0	0	109.7
305	S	40.4	Very low	39.7	Very low	108 Å²	108	140 Å²	140	76%	0.755	80%	0.803	S	S	*	*			trans	62.8	152.5	-178.3	-72.8	0	0	0	0	115.5
306	E	37.9	Very low	40.8	Very low	181 Å²	181	143.6 Å²	143.6	85%	0.846	81%	0.808	S	S	*	*			cis	-150.3	172.7	3	-129	144.1	-117.1	0	0	111.3
307	S	36.7	Very low	42.2	Very low	108 Å²	108	142.7 Å²	142.7	76%	0.755	80%	0.798	S	S	*	*			trans	-96.8	134.3	-166.1	53.4	0	0	0	0	115.8
308	V	41.8	Very low	44	Very low	144 Å²	144	141.4 Å²	141.4	87%	0.873	78%	0.782	S	S	*	*			trans	-140.5	143.6	149.5	-173.7	0	0	0	0	110.9
309	S	35.4	Very low	46.3	Very low	106 Å²	106	135.8 Å²	135.8	74%	0.741	76%	0.764	S	S	*	*			trans	-65.9	149.3	-166.8	45.4	0	0	0	0	118.6
310	R	40.8	Very low	47.6	Very low	250 Å²	250	135.6 Å²	135.6	94%	0.943	75%	0.75	S	S	*	*			trans	-161.4	138.8	132	-105.3	165.8	-170.1	-161.7	1.7	110.6
311	G	35.9	Very low	49.4	Very low	81 Å²	81	130.3 Å²	130.3	84%	0.835	72%	0.716	S	S	*	*			trans	-73.5	148.8	-160.3	0	0	0	0	0	116
312	K	46	Very low	51.4	Low	189 Å²	189	127.6 Å²	127.6	82%	0.822	70%	0.699	S	S	*	*			trans	-114	124	169.7	-73.2	-179.2	176.5	177.5	0	109.7	N314	K312-N314 PolarHBondContact O-N 3.33Å
313	N	45	Very low	53.4	Low	154 Å²	154	124 Å²	124	82%	0.824	68%	0.678	S	S	*	*			trans	-73	111.2	169.9	-66.2	-8.2	0	0	0	108.6	R315	N313-R315 VanDerWaalsContact C-N 3.28Å; N313-R315 PolarHBondContact O-N 2.85Å
314	N	42.2	Very low	55.5	Low	142 Å²	142	121.7 Å²	121.7	76%	0.759	66%	0.659	S	S	*	*			trans	-69.4	80.9	175.6	-76.8	-13.4	0	0	0	110.7	K312 H316	K312-N314 PolarHBondContact O-N 3.33Å; N314-H316 PolarHBondContact O-N 2.86Å
315	R	50.4	Low	57.9	Low	222 Å²	222	121.8 Å²	121.8	84%	0.838	65%	0.645	S	S	*	*			trans	-74.2	111.6	160.6	-77.8	-168.8	-87.5	-174	-6.1	108	N313 T317	N313-R315 VanDerWaalsContact C-N 3.28Å; N313-R315 PolarHBondContact O-N 2.85Å; R315-T317 PolarHBondContact O-N 3.31Å
316	H	57.5	Low	60.2	Low	185 Å²	185	121.3 Å²	121.3	86%	0.856	63%	0.631	S	S	*	*			trans	-69.7	77.1	171.6	-82.7	-89.1	0	0	0	110	N314	N314-H316 PolarHBondContact O-N 2.86Å
317	T	67.2	Low	62.7	Low	89 Å²	89	118.4 Å²	118.4	55%	0.546	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-69.4	144.7	165.6	-42.3	0	0	0	0	108.8	I201 R315	I201-T317 HydrophobicContact CD1-CG2 3.35Å; R315-T317 PolarHBondContact O-N 3.31Å
318	L	76.6	Confident	65.1	Low	85 Å²	85	117.1 Å²	117.1	45%	0.445	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-50.4	153.3	173.6	-80.5	171.6	0	0	0	111.4	I201 N320 A322	I201-L318 WeakPolarHBondContact CD1-O 3.47Å; L318-N320 PolarHBondContact O-N 3.21Å; L318-A322 HydrophobicContact CB-CB 4.24Å; L318-A322 HydrophobicContact CD2-CB 4.44Å
319	P	81.8	Confident	67.4	Low	92 Å²	92	114.4 Å²	114.4	60%	0.597	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-48.2	138.1	171.5	-26.3	34.3	0	0	0	110.5	G321 A322	P319-G321 PolarHBondContact O-N 3.48Å; P319-A322 HydrophobicContact CB-CB 4.45Å; P319-A322 PolarHBondContact O-N 3.16Å
320	N	67.6	Low	70.1	Confident	87 Å²	87	113.6 Å²	113.6	47%	0.465	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-29.2	100	159.1	-109.9	-77.6	0	0	0	108.8	I201 N202 L318	I201-N320 VanDerWaalsContact CA-OD1 3.22Å; I201-N320 WeakPolarHBondContact CA-OD1 3.49Å; I201-N320 HydrophobicContact CG1-CB 4.3Å; N202-N320 HydrophobicContact CB-CB 4.11Å; N202-N320 WeakPolarHBondContact CB-OD1 3.27Å; N202-N320 PolarHBondContact N-OD1 2.66Å; N202-N320 PolarHBondContact ND2-OD1 2.9Å; N202-N320 PolarHBondContact OD1-OD1 3.37Å; L318-N320 PolarHBondContact O-N 3.21Å
321	G	76.3	Confident	72.3	Confident	16 Å²	16	104 Å²	104	17%	0.165	54%	0.539	C	S	.	.	T	Hydrogen-bonded Turn	trans	90	15.3	176.5	0	0	0	0	0	119.2	N202 G203 R204 P319	N202-G321 WeakPolarHBondContact O-CA 3.31Å; N202-G321 PolarHBondContact O-N 3.28Å; G203-G321 WeakPolarHBondContact O-CA 3.25Å; R204-G321 WeakPolarHBondContact CB-O 3.38Å; R204-G321 WeakPolarHBondContact CD-O 3.39Å; R204-G321 WeakPolarHBondContact CG-O 3.42Å; P319-G321 PolarHBondContact O-N 3.48Å
322	A	81.5	Confident	74.8	Confident	35 Å²	35	105.5 Å²	105.5	29%	0.289	52%	0.523	S	S	.	.			trans	-90.6	107.3	157.7	0	0	0	0	0	109.4	L318 P319	L318-A322 HydrophobicContact CB-CB 4.24Å; L318-A322 HydrophobicContact CD2-CB 4.44Å; P319-A322 HydrophobicContact CB-CB 4.45Å; P319-A322 PolarHBondContact O-N 3.16Å
323	Y	81.9	Confident	76.9	Confident	100 Å²	100	101.5 Å²	101.5	39%	0.392	51%	0.511	S	S	.	.			trans	-81.2	134.2	157	-179.5	-87.8	0	0	0	108.6	R204 R205 D325	R204-Y323 VanDerWaalsContact CD-N 3.32Å; R204-Y323 PolarHBondContact NH1-O 2.74Å; R205-Y323 VanDerWaalsContact CZ-CD1 3.47Å; R205-Y323 VanDerWaalsContact NH1-CD1 3.34Å; Y323-D325 HydrophobicContact CE1-CB 3.71Å
324	Y	85.4	Confident	79.1	Confident	120 Å²	120	99.8 Å²	99.8	47%	0.471	51%	0.506	S	S	.	.			trans	-138.9	118.2	174.2	174.2	-93.4	0	0	0	107.1	H326 F329	Y324-H326 HydrophobicContact CE1-CB 4.07Å; Y324-H326 PolarHBondContact OH-ND1 3.41Å; Y324-F329 HydrophobicContact CD2-CB 4.41Å; Y324-F329 HydrophobicContact CE2-CB 3.74Å; Y324-F329 AromaticContact CE2-CD1 3.93Å; Y324-F329 HydrophobicContact CE2-CD1 3.93Å; Y324-F329 HydrophobicContact CE2-CD2 4.07Å; Y324-F329 AromaticContact CE2-CG 3.63Å; Y324-F329 HydrophobicContact CE2-CG 3.63Å
325	D	87.5	Confident	81.3	Confident	63 Å²	63	95.8 Å²	95.8	34%	0.337	48%	0.483	S	S	.	.			trans	-107	136.9	161	-177.1	3	0	0	0	107.2	Y323 D327 E328 F329	Y323-D325 HydrophobicContact CE1-CB 3.71Å; D325-D327 PolarHBondContact OD1-N 2.93Å; D325-E328 HydrophobicContact CB-CB 3.98Å; D325-F329 WeakPolarHBondContact O-CB 3.26Å; D325-F329 PolarHBondContact O-N 3.04Å; D325-F329 VanDerWaalsContact O-N 3.1Å
326	H	88.1	Confident	83.2	Confident	99 Å²	99	87.6 Å²	87.6	46%	0.458	46%	0.46	S	S	.	.	H	α-helix	trans	-71	-41.6	-178.6	-174.7	56.8	0	0	0	111	Y324 F329 M330	Y324-H326 HydrophobicContact CE1-CB 4.07Å; Y324-H326 PolarHBondContact OH-ND1 3.41Å; H326-F329 PolarHBondContact O-N 3.45Å; H326-M330 WeakPolarHBondContact O-CB 3.41Å; H326-M330 VanDerWaalsContact O-CG 3.29Å; H326-M330 WeakPolarHBondContact O-CG 3.28Å; H326-M330 PolarHBondContact O-N 3.26Å
327	D	90.6	Very high	84.7	Confident	120 Å²	120	84.9 Å²	84.9	64%	0.642	45%	0.452	S	S	*	.	H	α-helix	trans	-69.6	-42.1	-175.6	-69.4	-13.2	0	0	0	110.7	D325 M330 A331	D325-D327 PolarHBondContact OD1-N 2.93Å; D327-M330 PolarHBondContact O-N 2.71Å; D327-A331 WeakPolarHBondContact O-CB 3.31Å; D327-A331 PolarHBondContact O-N 2.77Å
328	E	88.7	Confident	85.7	Confident	80 Å²	80	86 Å²	86	37%	0.374	45%	0.454	S	S	.	.	H	α-helix	trans	-62.1	-41.9	171.6	-171.9	-165.1	159.4	0	0	112.2	R205 D325 A331 F332	R205-E328 IonicContact CZ-OE1 3.86Å; R205-E328 IonicContact CZ-OE2 3.75Å; R205-E328 VanDerWaalsContact NH1-CD 3.28Å; R205-E328 IonicContact NH1-OE1 3.36Å; R205-E328 PolarHBondContact NH1-OE1 3.32Å; R205-E328 VanDerWaalsContact NH1-OE1 3.16Å; R205-E328 IonicContact NH1-OE2 2.99Å; R205-E328 PolarHBondContact NH1-OE2 2.87Å; R205-E328 IonicContact NH2-OE1 3.44Å; R205-E328 PolarHBondContact NH2-OE1 3.17Å; R205-E328 IonicContact NH2-OE2 3.1Å; R205-E328 PolarHBondContact NH2-OE2 2.89Å; D325-E328 HydrophobicContact CB-CB 3.98Å; E328-A331 PolarHBondContact O-N 3.22Å; E328-F332 WeakPolarHBondContact O-CB 3.3Å; E328-F332 PolarHBondContact O-N 3.44Å
329	F	89	Confident	86.4	Confident	87 Å²	87	87.2 Å²	87.2	38%	0.382	46%	0.458	S	S	.	.	H	α-helix	trans	-65.2	-41.6	178.3	177.9	-102.7	0	0	0	111.9	Y324 D325 H326 F332 L333	Y324-F329 HydrophobicContact CD2-CB 4.41Å; Y324-F329 HydrophobicContact CE2-CB 3.74Å; Y324-F329 AromaticContact CE2-CD1 3.93Å; Y324-F329 HydrophobicContact CE2-CD1 3.93Å; Y324-F329 HydrophobicContact CE2-CD2 4.07Å; Y324-F329 AromaticContact CE2-CG 3.63Å; Y324-F329 HydrophobicContact CE2-CG 3.63Å; D325-F329 WeakPolarHBondContact O-CB 3.26Å; D325-F329 PolarHBondContact O-N 3.04Å; D325-F329 VanDerWaalsContact O-N 3.1Å; H326-F329 PolarHBondContact O-N 3.45Å; F329-F332 PolarHBondContact O-N 3.33Å; F329-L333 HydrophobicContact CD1-CD1 4.09Å; F329-L333 HydrophobicContact CE1-CD1 3.52Å; F329-L333 HydrophobicContact CE1-CG 4.26Å; F329-L333 HydrophobicContact CZ-CD1 3.82Å; F329-L333 HydrophobicContact CZ-CD2 4.42Å; F329-L333 HydrophobicContact CZ-CG 4.22Å; F329-L333 WeakPolarHBondContact O-CG 3.4Å; F329-L333 PolarHBondContact O-N 2.83Å; F329-L333 VanDerWaalsContact O-N 3.07Å
330	M	91.4	Very high	86.7	Confident	90 Å²	90	85.1 Å²	85.1	44%	0.443	44%	0.441	S	S	.	.	H	α-helix	trans	-67.1	-38.9	175.2	-68.7	-58.6	-64.8	0	0	111.6	H326 D327 L333 T334	H326-M330 WeakPolarHBondContact O-CB 3.41Å; H326-M330 VanDerWaalsContact O-CG 3.29Å; H326-M330 WeakPolarHBondContact O-CG 3.28Å; H326-M330 PolarHBondContact O-N 3.26Å; D327-M330 PolarHBondContact O-N 2.71Å; M330-L333 PolarHBondContact O-N 2.75Å; M330-L333 HydrophobicContact SD-CD1 4.37Å; M330-T334 PolarHBondContact O-N 2.89Å; M330-T334 PolarHBondContact O-OG1 3.23Å
331	A	88.6	Confident	87.8	Confident	47 Å²	47	86.6 Å²	86.6	39%	0.388	45%	0.448	S	S	.	.	H	α-helix	trans	-60.2	-49.9	172.2	0	0	0	0	0	111.4	D327 E328 L333 T334 M335	D327-A331 WeakPolarHBondContact O-CB 3.31Å; D327-A331 PolarHBondContact O-N 2.77Å; E328-A331 PolarHBondContact O-N 3.22Å; A331-L333 VanDerWaalsContact C-N 3.28Å; A331-L333 PolarHBondContact O-N 3.26Å; A331-T334 WeakPolarHBondContact O-CA 3.5Å; A331-T334 PolarHBondContact O-N 3.39Å; A331-T334 PolarHBondContact O-OG1 3.04Å; A331-M335 WeakPolarHBondContact O-CG 3.04Å; A331-M335 PolarHBondContact O-N 3.33Å; A331-M335 VanDerWaalsContact O-N 3.15Å
332	F	88.7	Confident	88.5	Confident	113 Å²	113	91.6 Å²	91.6	50%	0.496	47%	0.467	S	S	.	.	H	α-helix	trans	-56.3	-38.6	177.7	177.6	-97.1	0	0	0	113	E328 F329 T334 M335 L340	E328-F332 WeakPolarHBondContact O-CB 3.3Å; E328-F332 PolarHBondContact O-N 3.44Å; F329-F332 PolarHBondContact O-N 3.33Å; F332-T334 PolarHBondContact O-N 2.84Å; F332-M335 PolarHBondContact O-N 2.92Å; F332-L340 HydrophobicContact CD2-CD1 4.39Å; F332-L340 HydrophobicContact CE2-CD1 4.15Å; F332-L340 HydrophobicContact CE2-CD2 3.87Å
333	L	89.2	Confident	88.8	Confident	106 Å²	106	94 Å²	94	56%	0.555	47%	0.472	S	S	*	.	H	α-helix	trans	-68	-19	174.9	-72.7	178.9	0	0	0	114.2	F329 M330 A331	F329-L333 HydrophobicContact CD1-CD1 4.09Å; F329-L333 HydrophobicContact CE1-CD1 3.52Å; F329-L333 HydrophobicContact CE1-CG 4.26Å; F329-L333 HydrophobicContact CZ-CD1 3.82Å; F329-L333 HydrophobicContact CZ-CD2 4.42Å; F329-L333 HydrophobicContact CZ-CG 4.22Å; F329-L333 WeakPolarHBondContact O-CG 3.4Å; F329-L333 PolarHBondContact O-N 2.83Å; F329-L333 VanDerWaalsContact O-N 3.07Å; M330-L333 PolarHBondContact O-N 2.75Å; M330-L333 HydrophobicContact SD-CD1 4.37Å; A331-L333 VanDerWaalsContact C-N 3.28Å; A331-L333 PolarHBondContact O-N 3.26Å
334	T	90.2	Very high	89.2	Confident	117 Å²	117	93.4 Å²	93.4	72%	0.718	47%	0.472	S	S	*	.	H	α-helix	trans	-99.1	-8.9	178.1	59.2	0	0	0	0	114.2	M330 A331 F332	M330-T334 PolarHBondContact O-N 2.89Å; M330-T334 PolarHBondContact O-OG1 3.23Å; A331-T334 WeakPolarHBondContact O-CA 3.5Å; A331-T334 PolarHBondContact O-N 3.39Å; A331-T334 PolarHBondContact O-OG1 3.04Å; F332-T334 PolarHBondContact O-N 2.84Å
335	M	88.4	Confident	89.6	Confident	59 Å²	59	93.9 Å²	93.9	29%	0.291	48%	0.478	S	S	.	.	S	Bend	trans	-78.9	146.4	177.7	-71.4	171.7	72.1	0	0	112	A331 F332 Q339 L340	A331-M335 WeakPolarHBondContact O-CG 3.04Å; A331-M335 PolarHBondContact O-N 3.33Å; A331-M335 VanDerWaalsContact O-N 3.15Å; F332-M335 PolarHBondContact O-N 2.92Å; M335-Q339 HydrophobicContact CE-CB 4.49Å; M335-L340 HydrophobicContact CE-CB 4.34Å; M335-L340 HydrophobicContact CE-CD1 4.18Å
336	S	90.6	Very high	89.8	Confident	50 Å²	50	94.9 Å²	94.9	35%	0.35	49%	0.487	S	S	.	.			trans	-80.9	158.3	166.2	77.2	0	0	0	0	111.6	D338 Q339 L340	S336-D338 PolarHBondContact O-N 3.12Å; S336-Q339 PolarHBondContact O-N 2.85Å; S336-Q339 WeakPolarHBondContact OG-CG 3.25Å; S336-Q339 PolarHBondContact OG-N 3.46Å; S336-L340 PolarHBondContact O-N 3.5Å
337	N	88.7	Confident	89.9	Confident	128 Å²	128	93.6 Å²	93.6	68%	0.684	48%	0.483	S	S	*	.	H	α-helix	trans	-58.9	-35.6	175	-70.9	-43.3	0	0	0	112.2	L340 L341	N337-L340 PolarHBondContact O-N 3.47Å; N337-L341 PolarHBondContact O-N 2.98Å
338	D	89.2	Confident	90	Very high	111 Å²	111	93 Å²	93	59%	0.594	48%	0.48	S	S	*	.	H	α-helix	trans	-70.1	-37.9	179.5	-51.1	-35.8	0	0	0	111.5	S336 L341 H342	S336-D338 PolarHBondContact O-N 3.12Å; D338-L341 PolarHBondContact O-N 2.87Å; D338-H342 PolarHBondContact O-CD2 2.77Å; D338-H342 VanDerWaalsContact O-CD2 3.32Å; D338-H342 PolarHBondContact O-N 3.46Å
339	Q	89.9	Confident	90.1	Very high	111 Å²	111	91.9 Å²	91.9	52%	0.519	48%	0.484	S	S	.	.	H	α-helix	trans	-63.4	-42.4	172.5	-73.7	168.3	-10.4	0	0	111.4	M335 S336 H342 E343	M335-Q339 HydrophobicContact CE-CB 4.49Å; S336-Q339 PolarHBondContact O-N 2.85Å; S336-Q339 WeakPolarHBondContact OG-CG 3.25Å; S336-Q339 PolarHBondContact OG-N 3.46Å; Q339-H342 PolarHBondContact O-N 3.23Å; Q339-E343 WeakPolarHBondContact O-CB 3.43Å; Q339-E343 PolarHBondContact O-N 3.4Å
340	L	88.6	Confident	90.2	Very high	48 Å²	48	91.4 Å²	91.4	25%	0.251	49%	0.485	S	S	.	.	H	α-helix	trans	-64	-40.6	176.9	-176.3	68.9	0	0	0	112	F332 M335 S336 N337 K344	F332-L340 HydrophobicContact CD2-CD1 4.39Å; F332-L340 HydrophobicContact CE2-CD1 4.15Å; F332-L340 HydrophobicContact CE2-CD2 3.87Å; M335-L340 HydrophobicContact CE-CB 4.34Å; M335-L340 HydrophobicContact CE-CD1 4.18Å; S336-L340 PolarHBondContact O-N 3.5Å; N337-L340 PolarHBondContact O-N 3.47Å; L340-K344 VanDerWaalsContact O-CG 3.24Å; L340-K344 WeakPolarHBondContact O-CG 3.5Å; L340-K344 PolarHBondContact O-N 3.12Å; L340-K344 VanDerWaalsContact O-N 3.09Å
341	L	90.3	Very high	90.2	Very high	118 Å²	118	91.6 Å²	91.6	62%	0.618	49%	0.488	S	S	*	.	H	α-helix	trans	-65.3	-47	175.7	-79.4	171.2	0	0	0	111.8	N337 D338 E343 K344 E345	N337-L341 PolarHBondContact O-N 2.98Å; D338-L341 PolarHBondContact O-N 2.87Å; L341-E343 PolarHBondContact O-N 3.28Å; L341-K344 PolarHBondContact O-N 2.74Å; L341-E345 WeakPolarHBondContact O-CB 3.45Å; L341-E345 PolarHBondContact O-N 3.22Å
342	H	91	Very high	90.2	Very high	122 Å²	122	95 Å²	95	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-61.9	-41.5	176.6	-79.2	-48.5	0	0	0	112.6	D338 Q339 K344 E345 T346	D338-H342 PolarHBondContact O-CD2 2.77Å; D338-H342 VanDerWaalsContact O-CD2 3.32Å; D338-H342 PolarHBondContact O-N 3.46Å; Q339-H342 PolarHBondContact O-N 3.23Å; H342-K344 VanDerWaalsContact C-N 3.33Å; H342-K344 PolarHBondContact O-N 3.14Å; H342-E345 IonicContact ND1-OE2 2.89Å; H342-E345 PolarHBondContact O-N 3.43Å; H342-T346 WeakPolarHBondContact O-CG2 3.33Å; H342-T346 PolarHBondContact O-N 3.02Å; H342-T346 PolarHBondContact O-OG1 3.01Å; H342-T346 VanDerWaalsContact O-OG1 3.11Å
343	E	89	Confident	90.3	Very high	84 Å²	84	95.2 Å²	95.2	39%	0.393	49%	0.493	S	S	.	.	H	α-helix	trans	-57.8	-46.4	174.3	-172.5	-165.4	-134.2	0	0	110.9	Q339 L341 E345 T346 D347	Q339-E343 WeakPolarHBondContact O-CB 3.43Å; Q339-E343 PolarHBondContact O-N 3.4Å; L341-E343 PolarHBondContact O-N 3.28Å; E343-E345 PolarHBondContact O-N 3.46Å; E343-T346 WeakPolarHBondContact CA-OG1 3.47Å; E343-T346 PolarHBondContact O-N 3.38Å; E343-T346 PolarHBondContact O-OG1 3.17Å; E343-D347 WeakPolarHBondContact O-CB 3.43Å; E343-D347 VanDerWaalsContact O-CG 3.27Å; E343-D347 PolarHBondContact O-N 3.44Å
344	K	90.4	Very high	90.3	Very high	89 Å²	89	91.9 Å²	91.9	39%	0.387	48%	0.476	S	S	.	.	H	α-helix	trans	-65.7	-35	178	-68	-70	141.1	-73.2	0	113.2	L340 L341 H342 D347 L348	L340-K344 VanDerWaalsContact O-CG 3.24Å; L340-K344 WeakPolarHBondContact O-CG 3.5Å; L340-K344 PolarHBondContact O-N 3.12Å; L340-K344 VanDerWaalsContact O-N 3.09Å; L341-K344 PolarHBondContact O-N 2.74Å; H342-K344 VanDerWaalsContact C-N 3.33Å; H342-K344 PolarHBondContact O-N 3.14Å; K344-D347 IonicContact NZ-OD2 3.78Å; K344-D347 PolarHBondContact NZ-OD2 3.03Å; K344-L348 VanDerWaalsContact O-CG 3.27Å; K344-L348 WeakPolarHBondContact O-CG 3.31Å; K344-L348 PolarHBondContact O-N 2.88Å; K344-L348 VanDerWaalsContact O-N 3.11Å
345	E	93.1	Very high	90.2	Very high	129 Å²	129	92.6 Å²	92.6	60%	0.603	47%	0.469	S	S	*	.	H	α-helix	trans	-69.3	-41	175.7	-169.2	167.7	-143.5	0	0	111.4	L341 H342 E343 L348 A349	L341-E345 WeakPolarHBondContact O-CB 3.45Å; L341-E345 PolarHBondContact O-N 3.22Å; H342-E345 IonicContact ND1-OE2 2.89Å; H342-E345 PolarHBondContact O-N 3.43Å; E343-E345 PolarHBondContact O-N 3.46Å; E345-L348 PolarHBondContact O-N 3.42Å; E345-A349 PolarHBondContact O-N 2.98Å; E345-A349 VanDerWaalsContact O-N 3.08Å
346	T	91.8	Very high	90.3	Very high	84 Å²	84	96.6 Å²	96.6	52%	0.515	49%	0.487	S	S	.	.	H	α-helix	trans	-65.9	-41.3	173.1	53	0	0	0	0	112.8	H342 E343 L348 A349 D350	H342-T346 WeakPolarHBondContact O-CG2 3.33Å; H342-T346 PolarHBondContact O-N 3.02Å; H342-T346 PolarHBondContact O-OG1 3.01Å; H342-T346 VanDerWaalsContact O-OG1 3.11Å; E343-T346 WeakPolarHBondContact CA-OG1 3.47Å; E343-T346 PolarHBondContact O-N 3.38Å; E343-T346 PolarHBondContact O-OG1 3.17Å; T346-L348 VanDerWaalsContact C-N 3.29Å; T346-L348 PolarHBondContact O-N 3.47Å; T346-A349 PolarHBondContact O-N 2.7Å; T346-D350 PolarHBondContact O-N 3.14Å
347	D	90.9	Very high	90.1	Very high	72 Å²	72	97.1 Å²	97.1	39%	0.385	48%	0.484	S	S	.	.	H	α-helix	trans	-56.7	-44	174.6	-77.2	-26.5	0	0	0	111.1	E343 K344 L351	E343-D347 WeakPolarHBondContact O-CB 3.43Å; E343-D347 VanDerWaalsContact O-CG 3.27Å; E343-D347 PolarHBondContact O-N 3.44Å; K344-D347 IonicContact NZ-OD2 3.78Å; K344-D347 PolarHBondContact NZ-OD2 3.03Å; D347-L351 WeakPolarHBondContact O-CB 3.42Å; D347-L351 WeakPolarHBondContact O-CD1 3.26Å; D347-L351 VanDerWaalsContact O-CG 3.24Å; D347-L351 WeakPolarHBondContact O-CG 3.42Å; D347-L351 PolarHBondContact O-N 2.87Å
348	L	92	Very high	90	Very high	109 Å²	109	92.7 Å²	92.7	57%	0.571	46%	0.46	S	S	*	.	H	α-helix	trans	-67.3	-45.7	-179.6	-74.2	170.9	0	0	0	111.8	K344 E345 T346 D350 L351 E352	K344-L348 VanDerWaalsContact O-CG 3.27Å; K344-L348 WeakPolarHBondContact O-CG 3.31Å; K344-L348 PolarHBondContact O-N 2.88Å; K344-L348 VanDerWaalsContact O-N 3.11Å; E345-L348 PolarHBondContact O-N 3.42Å; T346-L348 VanDerWaalsContact C-N 3.29Å; T346-L348 PolarHBondContact O-N 3.47Å; L348-D350 VanDerWaalsContact C-N 3.34Å; L348-D350 PolarHBondContact O-N 3.37Å; L348-L351 WeakPolarHBondContact O-CB 3.43Å; L348-L351 PolarHBondContact O-N 3.22Å; L348-L351 VanDerWaalsContact O-N 3.11Å; L348-E352 WeakPolarHBondContact O-CG 3.46Å; L348-E352 PolarHBondContact O-N 3.19Å
349	A	91.9	Very high	89.9	Confident	56 Å²	56	91.3 Å²	91.3	46%	0.463	46%	0.458	S	S	.	.	H	α-helix	trans	-60.6	-40.6	176.8	0	0	0	0	0	112.6	E345 T346 L351 E352 R353	E345-A349 PolarHBondContact O-N 2.98Å; E345-A349 VanDerWaalsContact O-N 3.08Å; T346-A349 PolarHBondContact O-N 2.7Å; A349-L351 VanDerWaalsContact C-N 3.32Å; A349-L351 PolarHBondContact O-N 3.01Å; A349-E352 PolarHBondContact O-N 3.29Å; A349-R353 PolarHBondContact O-N 3.43Å
350	D	90	Very high	89.9	Confident	76 Å²	76	91.3 Å²	91.3	41%	0.406	46%	0.458	S	S	.	.	H	α-helix	trans	-70.4	-25.6	175.3	-90.8	-11.2	0	0	0	113.5	K236 T346 L348 R353	K236-D350 PolarHBondContact NZ-O 3.43Å; T346-D350 PolarHBondContact O-N 3.14Å; L348-D350 VanDerWaalsContact C-N 3.34Å; L348-D350 PolarHBondContact O-N 3.37Å; D350-R353 IonicContact OD1-CZ 3.8Å; D350-R353 IonicContact OD1-NH1 2.56Å; D350-R353 PolarHBondContact OD1-NH1 3.42Å; D350-R353 IonicContact OD1-NH2 2.77Å; D350-R353 PolarHBondContact OD1-NH2 2.77Å
351	L	90.7	Very high	89.8	Confident	94 Å²	94	90.7 Å²	90.7	49%	0.492	45%	0.453	S	S	.	.	H	α-helix	trans	-73.7	-42.4	171.1	-77.7	163.2	0	0	0	111.6	K236 D347 L348 A349 K355	K236-L351 HydrophobicContact CD-CD2 4.41Å; D347-L351 WeakPolarHBondContact O-CB 3.42Å; D347-L351 WeakPolarHBondContact O-CD1 3.26Å; D347-L351 VanDerWaalsContact O-CG 3.24Å; D347-L351 WeakPolarHBondContact O-CG 3.42Å; D347-L351 PolarHBondContact O-N 2.87Å; L348-L351 WeakPolarHBondContact O-CB 3.43Å; L348-L351 PolarHBondContact O-N 3.22Å; L348-L351 VanDerWaalsContact O-N 3.11Å; A349-L351 VanDerWaalsContact C-N 3.32Å; A349-L351 PolarHBondContact O-N 3.01Å; L351-K355 WeakPolarHBondContact O-CB 3.45Å; L351-K355 PolarHBondContact O-N 3.36Å; L351-K355 VanDerWaalsContact O-N 3.12Å
352	E	90.4	Very high	89.4	Confident	119 Å²	119	89.4 Å²	89.4	56%	0.556	45%	0.447	S	S	*	.	H	α-helix	trans	-65.8	-47	178.6	-70.4	-170.5	149.1	0	0	112.5	L348 A349 I354 K355 E356	L348-E352 WeakPolarHBondContact O-CG 3.46Å; L348-E352 PolarHBondContact O-N 3.19Å; A349-E352 PolarHBondContact O-N 3.29Å; E352-I354 VanDerWaalsContact C-N 3.3Å; E352-I354 PolarHBondContact O-N 3.39Å; E352-K355 WeakPolarHBondContact O-CB 3.48Å; E352-K355 PolarHBondContact O-N 2.82Å; E352-K355 VanDerWaalsContact O-N 3.1Å; E352-E356 PolarHBondContact O-N 3.31Å
353	R	90.5	Very high	89.3	Confident	117 Å²	117	90.2 Å²	90.2	44%	0.442	45%	0.451	S	S	.	.	H	α-helix	trans	-52.3	-47.2	176.3	-178.3	-178.6	66.2	-116.4	-7.9	112.5	A349 D350 E356 E357	A349-R353 PolarHBondContact O-N 3.43Å; D350-R353 IonicContact OD1-CZ 3.8Å; D350-R353 IonicContact OD1-NH1 2.56Å; D350-R353 PolarHBondContact OD1-NH1 3.42Å; D350-R353 IonicContact OD1-NH2 2.77Å; D350-R353 PolarHBondContact OD1-NH2 2.77Å; R353-E356 PolarHBondContact O-N 3.05Å; R353-E357 PolarHBondContact O-N 2.99Å
354	I	89.2	Confident	89.3	Confident	37 Å²	37	90.9 Å²	90.9	19%	0.19	46%	0.456	C	S	.	.	H	α-helix	trans	-75.7	-27.4	-175.8	-66	171	0	0	0	111.3	K236 E352 L358	K236-I354 HydrophobicContact CD-CB 4.45Å; K236-I354 HydrophobicContact CD-CG2 3.92Å; K236-I354 HydrophobicContact CG-CG2 4.12Å; E352-I354 VanDerWaalsContact C-N 3.3Å; E352-I354 PolarHBondContact O-N 3.39Å; I354-L358 HydrophobicContact CG2-CD1 4.16Å; I354-L358 HydrophobicContact CG2-CG 4.45Å; I354-L358 WeakPolarHBondContact O-CB 3.5Å; I354-L358 WeakPolarHBondContact O-CD1 3.2Å; I354-L358 VanDerWaalsContact O-CG 3.23Å; I354-L358 WeakPolarHBondContact O-CG 3.34Å; I354-L358 PolarHBondContact O-N 3.13Å
355	K	88.2	Confident	88.9	Confident	132 Å²	132	90.1 Å²	90.1	57%	0.574	46%	0.459	S	S	*	.	H	α-helix	trans	-63.5	-42.9	170.2	170.8	-162.9	163.5	-153.3	0	111.7	L351 E352 L358 C359	L351-K355 WeakPolarHBondContact O-CB 3.45Å; L351-K355 PolarHBondContact O-N 3.36Å; L351-K355 VanDerWaalsContact O-N 3.12Å; E352-K355 WeakPolarHBondContact O-CB 3.48Å; E352-K355 PolarHBondContact O-N 2.82Å; E352-K355 VanDerWaalsContact O-N 3.1Å; K355-L358 WeakPolarHBondContact O-CB 3.42Å; K355-L358 PolarHBondContact O-N 3.12Å; K355-C359 PolarHBondContact O-N 3.26Å
356	E	90	Very high	88.4	Confident	143 Å²	143	88.5 Å²	88.5	67%	0.668	45%	0.452	S	S	*	.	H	α-helix	trans	-65.6	-51.9	-179.7	-69.8	-176.5	157.8	0	0	112	E352 R353 L358 C359 E360	E352-E356 PolarHBondContact O-N 3.31Å; R353-E356 PolarHBondContact O-N 3.05Å; E356-L358 PolarHBondContact O-N 2.96Å; E356-L358 VanDerWaalsContact O-N 3.15Å; E356-C359 WeakPolarHBondContact O-CB 3.23Å; E356-C359 PolarHBondContact O-N 3.31Å; E356-C359 VanDerWaalsContact O-N 3.13Å; E356-E360 PolarHBondContact O-N 3.4Å
357	E	87.1	Confident	88.2	Confident	60 Å²	60	87 Å²	87	28%	0.28	45%	0.448	S	S	.	.	H	α-helix	trans	-56.7	-34.2	175	-165.8	-155.1	161.2	0	0	109.4	H232 R353 C359 E360 K361	H232-E357 PolarHBondContact CD2-O 3.24Å; H232-E357 VanDerWaalsContact CE1-CB 3.48Å; H232-E357 WeakPolarHBondContact CE1-CB 3.34Å; H232-E357 IonicContact CE1-OE1 3.16Å; H232-E357 IonicContact CE1-OE2 3.19Å; H232-E357 PolarHBondContact CE1-OE2 3.27Å; H232-E357 IonicContact ND1-OE2 2.72Å; H232-E357 WeakPolarHBondContact NE2-CA 3.4Å; H232-E357 WeakPolarHBondContact NE2-CB 3.4Å; H232-E357 WeakPolarHBondContact NE2-CG 3.22Å; H232-E357 PolarHBondContact NE2-O 3.09Å; H232-E357 IonicContact NE2-OE1 2.68Å; H232-E357 IonicContact NE2-OE2 2.71Å; R353-E357 PolarHBondContact O-N 2.99Å; E357-C359 VanDerWaalsContact C-N 3.32Å; E357-E360 WeakPolarHBondContact O-CB 3.38Å; E357-E360 PolarHBondContact O-N 3.47Å; E357-K361 VanDerWaalsContact CD-NZ 3.35Å; E357-K361 PolarHBondContact O-N 3.44Å; E357-K361 IonicContact OE1-NZ 2.69Å; E357-K361 PolarHBondContact OE1-NZ 3.46Å
358	L	85.2	Confident	87.9	Confident	36 Å²	36	92.6 Å²	92.6	19%	0.188	46%	0.463	C	S	.	.	H	α-helix	trans	-66.2	-35.7	-177	-99.6	169.1	0	0	0	111.6	H232 I354 K355 E356 N362	H232-L358 HydrophobicContact CB-CD2 4.15Å; H232-L358 VanDerWaalsContact CD2-CA 3.45Å; H232-L358 WeakPolarHBondContact CD2-CA 3.49Å; H232-L358 VanDerWaalsContact NE2-CA 3.31Å; H232-L358 WeakPolarHBondContact NE2-CA 3.2Å; H232-L358 PolarHBondContact NE2-N 3.27Å; H232-L358 WeakPolarHBondContact O-CD2 3.42Å; I354-L358 HydrophobicContact CG2-CD1 4.16Å; I354-L358 HydrophobicContact CG2-CG 4.45Å; I354-L358 WeakPolarHBondContact O-CB 3.5Å; I354-L358 WeakPolarHBondContact O-CD1 3.2Å; I354-L358 VanDerWaalsContact O-CG 3.23Å; I354-L358 WeakPolarHBondContact O-CG 3.34Å; I354-L358 PolarHBondContact O-N 3.13Å; K355-L358 WeakPolarHBondContact O-CB 3.42Å; K355-L358 PolarHBondContact O-N 3.12Å; E356-L358 PolarHBondContact O-N 2.96Å; E356-L358 VanDerWaalsContact O-N 3.15Å; L358-N362 PolarHBondContact O-N 3.43Å; L358-N362 PolarHBondContact O-ND2 3.34Å
359	C	87.4	Confident	87.4	Confident	82 Å²	82	90.1 Å²	90.1	55%	0.554	46%	0.455	S	S	*	.	H	α-helix	trans	-63.5	-46.4	172.6	-70.4	0	0	0	0	111	K355 E356 E357 K361 N362 E363	K355-C359 PolarHBondContact O-N 3.26Å; E356-C359 WeakPolarHBondContact O-CB 3.23Å; E356-C359 PolarHBondContact O-N 3.31Å; E356-C359 VanDerWaalsContact O-N 3.13Å; E357-C359 VanDerWaalsContact C-N 3.32Å; C359-K361 PolarHBondContact O-N 2.97Å; C359-N362 PolarHBondContact O-N 3.15Å; C359-E363 PolarHBondContact O-N 2.96Å
360	E	90.2	Very high	86.9	Confident	110 Å²	110	94.7 Å²	94.7	51%	0.514	46%	0.46	S	S	.	.	H	α-helix	trans	-57.4	-48.3	-179	-169.4	-164.1	169.8	0	0	112.6	E356 E357 N362 E363 I364	E356-E360 PolarHBondContact O-N 3.4Å; E357-E360 WeakPolarHBondContact O-CB 3.38Å; E357-E360 PolarHBondContact O-N 3.47Å; E360-N362 VanDerWaalsContact C-N 3.35Å; E360-N362 PolarHBondContact O-N 3Å; E360-E363 WeakPolarHBondContact O-CB 3.41Å; E360-E363 PolarHBondContact O-N 3.4Å; E360-I364 HydrophobicContact CG-CD1 4.11Å; E360-I364 WeakPolarHBondContact O-CG1 3.23Å; E360-I364 PolarHBondContact O-N 2.71Å
361	K	85.6	Confident	86.6	Confident	36 Å²	36	95.2 Å²	95.2	16%	0.157	47%	0.47	C	S	.	.	H	α-helix	trans	-70.8	-29.4	179.9	-64.4	-162.9	-165.3	65.8	0	113.4	K229 H232 E357 C359 T365	K229-K361 HydrophobicContact CB-CD 4.38Å; H232-K361 HydrophobicContact CB-CD 3.88Å; H232-K361 PolarHBondContact CD2-NZ 2.91Å; H232-K361 VanDerWaalsContact CG-NZ 3.32Å; H232-K361 PolarHBondContact NE2-NZ 3.49Å; E357-K361 VanDerWaalsContact CD-NZ 3.35Å; E357-K361 PolarHBondContact O-N 3.44Å; E357-K361 IonicContact OE1-NZ 2.69Å; E357-K361 PolarHBondContact OE1-NZ 3.46Å; C359-K361 PolarHBondContact O-N 2.97Å; K361-T365 VanDerWaalsContact O-CB 3.3Å; K361-T365 WeakPolarHBondContact O-CB 3.47Å; K361-T365 PolarHBondContact O-N 3.37Å; K361-T365 PolarHBondContact O-OG1 3.1Å
362	N	83.2	Confident	86.1	Confident	90 Å²	90	95.2 Å²	95.2	48%	0.481	47%	0.474	S	S	.	.	H	α-helix	trans	-65	-45.5	170.7	-84.1	-69.9	0	0	0	110	L358 C359 E360 I364 T365 E366	L358-N362 PolarHBondContact O-N 3.43Å; L358-N362 PolarHBondContact O-ND2 3.34Å; C359-N362 PolarHBondContact O-N 3.15Å; E360-N362 VanDerWaalsContact C-N 3.35Å; E360-N362 PolarHBondContact O-N 3Å; N362-I364 PolarHBondContact O-N 3.26Å; N362-T365 PolarHBondContact O-N 3.46Å; N362-T365 VanDerWaalsContact O-N 3.17Å; N362-E366 WeakPolarHBondContact O-CG 3.44Å; N362-E366 PolarHBondContact O-N 3.05Å
363	E	88.2	Confident	85.4	Confident	140 Å²	140	94.5 Å²	94.5	65%	0.654	47%	0.473	S	S	*	.	H	α-helix	trans	-59.2	-46.8	176.6	-173.6	170.8	-171.8	0	0	112.3	C359 E360 T365 E366 A367	C359-E363 PolarHBondContact O-N 2.96Å; E360-E363 WeakPolarHBondContact O-CB 3.41Å; E360-E363 PolarHBondContact O-N 3.4Å; E363-T365 VanDerWaalsContact C-N 3.33Å; E363-T365 PolarHBondContact O-N 2.72Å; E363-E366 PolarHBondContact O-N 3.18Å; E363-A367 WeakPolarHBondContact O-CB 3.45Å; E363-A367 PolarHBondContact O-N 3.05Å
364	I	88.4	Confident	84.7	Confident	98 Å²	98	96.7 Å²	96.7	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-60.6	-40.9	174.8	-66.4	166.5	0	0	0	111.6	E360 N362 A367 R368	E360-I364 HydrophobicContact CG-CD1 4.11Å; E360-I364 WeakPolarHBondContact O-CG1 3.23Å; E360-I364 PolarHBondContact O-N 2.71Å; N362-I364 PolarHBondContact O-N 3.26Å; I364-A367 PolarHBondContact O-N 3.24Å; I364-R368 WeakPolarHBondContact O-CB 3.47Å; I364-R368 PolarHBondContact O-N 3.29Å
365	T	82.7	Confident	84	Confident	73 Å²	73	100.6 Å²	100.6	45%	0.448	50%	0.498	S	S	.	.	H	α-helix	trans	-69.7	-39.5	180	-57.8	0	0	0	0	111.5	K361 N362 E363 R368 S369	K361-T365 VanDerWaalsContact O-CB 3.3Å; K361-T365 WeakPolarHBondContact O-CB 3.47Å; K361-T365 PolarHBondContact O-N 3.37Å; K361-T365 PolarHBondContact O-OG1 3.1Å; N362-T365 PolarHBondContact O-N 3.46Å; N362-T365 VanDerWaalsContact O-N 3.17Å; E363-T365 VanDerWaalsContact C-N 3.33Å; E363-T365 PolarHBondContact O-N 2.72Å; T365-R368 PolarHBondContact O-N 2.87Å; T365-S369 WeakPolarHBondContact O-CB 3.31Å; T365-S369 PolarHBondContact O-N 3.09Å; T365-S369 PolarHBondContact O-OG 3.31Å
366	E	83.6	Confident	83.5	Confident	95 Å²	95	99.3 Å²	99.3	44%	0.444	50%	0.496	S	S	.	.	H	α-helix	trans	-68.8	-37	173.1	-67.6	-168.1	171.3	0	0	112.4	N362 E363 S369 R370	N362-E366 WeakPolarHBondContact O-CG 3.44Å; N362-E366 PolarHBondContact O-N 3.05Å; E363-E366 PolarHBondContact O-N 3.18Å; E366-S369 WeakPolarHBondContact CA-OG 3.13Å; E366-S369 PolarHBondContact O-N 3.33Å; E366-S369 PolarHBondContact O-OG 2.93Å; E366-S369 VanDerWaalsContact O-OG 3.08Å; E366-R370 WeakPolarHBondContact O-CB 3.47Å; E366-R370 WeakPolarHBondContact O-CG 3.38Å; E366-R370 PolarHBondContact O-N 3.07Å; E366-R370 IonicContact OE2-CZ 3.89Å; E366-R370 IonicContact OE2-NH1 3.64Å; E366-R370 PolarHBondContact OE2-NH1 3.15Å; E366-R370 IonicContact OE2-NH2 3.61Å; E366-R370 PolarHBondContact OE2-NH2 2.73Å
367	A	86.2	Confident	82.6	Confident	52 Å²	52	100.9 Å²	100.9	43%	0.43	50%	0.503	S	S	.	.	H	α-helix	trans	-62.3	-43.2	172.9	0	0	0	0	0	111.2	E363 I364 S371	E363-A367 WeakPolarHBondContact O-CB 3.45Å; E363-A367 PolarHBondContact O-N 3.05Å; I364-A367 PolarHBondContact O-N 3.24Å; A367-S371 WeakPolarHBondContact O-CB 3.45Å; A367-S371 PolarHBondContact O-N 2.88Å
368	R	85.6	Confident	82	Confident	189 Å²	189	104.3 Å²	104.3	71%	0.713	52%	0.522	S	S	*	.	H	α-helix	trans	-65.3	-42.6	174.7	-173.4	177.5	179.6	-176.9	0.1	112.3	I364 T365 S371 V372	I364-R368 WeakPolarHBondContact O-CB 3.47Å; I364-R368 PolarHBondContact O-N 3.29Å; T365-R368 PolarHBondContact O-N 2.87Å; R368-S371 PolarHBondContact O-N 2.78Å; R368-V372 HydrophobicContact CG-CG2 4.25Å; R368-V372 WeakPolarHBondContact O-CG2 3.44Å; R368-V372 PolarHBondContact O-N 2.68Å
369	S	81.5	Confident	81.5	Confident	57 Å²	57	109.5 Å²	109.5	40%	0.399	55%	0.55	S	S	.	.	H	α-helix	trans	-67.2	-39.9	179	71.6	0	0	0	0	111.6	T365 E366 S371 V372 L373	T365-S369 WeakPolarHBondContact O-CB 3.31Å; T365-S369 PolarHBondContact O-N 3.09Å; T365-S369 PolarHBondContact O-OG 3.31Å; E366-S369 WeakPolarHBondContact CA-OG 3.13Å; E366-S369 PolarHBondContact O-N 3.33Å; E366-S369 PolarHBondContact O-OG 2.93Å; E366-S369 VanDerWaalsContact O-OG 3.08Å; S369-S371 VanDerWaalsContact C-N 3.34Å; S369-S371 PolarHBondContact O-N 3.14Å; S369-V372 PolarHBondContact O-N 2.77Å; S369-L373 WeakPolarHBondContact O-CB 3.43Å; S369-L373 VanDerWaalsContact O-CG 3.29Å; S369-L373 WeakPolarHBondContact O-CG 3.23Å; S369-L373 PolarHBondContact O-N 2.8Å
370	R	81.8	Confident	80.6	Confident	152 Å²	152	113 Å²	113	57%	0.574	56%	0.555	S	S	*	*	H	α-helix	trans	-56.9	-46.4	168.6	-72.5	170.5	-172.7	115.1	12.4	111.2	E366 Y374	E366-R370 WeakPolarHBondContact O-CB 3.47Å; E366-R370 WeakPolarHBondContact O-CG 3.38Å; E366-R370 PolarHBondContact O-N 3.07Å; E366-R370 IonicContact OE2-CZ 3.89Å; E366-R370 IonicContact OE2-NH1 3.64Å; E366-R370 PolarHBondContact OE2-NH1 3.15Å; E366-R370 IonicContact OE2-NH2 3.61Å; E366-R370 PolarHBondContact OE2-NH2 2.73Å; R370-Y374 VanDerWaalsContact O-CB 3.3Å; R370-Y374 WeakPolarHBondContact O-CB 3.38Å; R370-Y374 PolarHBondContact O-N 3.12Å
371	S	82.9	Confident	79.5	Confident	87 Å²	87	111.4 Å²	111.4	61%	0.608	55%	0.554	S	S	*	*	H	α-helix	trans	-68.1	-36.6	-179.8	-177	0	0	0	0	114.4	A367 R368 S369 Y374	A367-S371 WeakPolarHBondContact O-CB 3.45Å; A367-S371 PolarHBondContact O-N 2.88Å; R368-S371 PolarHBondContact O-N 2.78Å; S369-S371 VanDerWaalsContact C-N 3.34Å; S369-S371 PolarHBondContact O-N 3.14Å; S371-Y374 WeakPolarHBondContact O-CB 3.3Å
372	V	80.8	Confident	78.6	Confident	95 Å²	95	116.8 Å²	116.8	58%	0.576	59%	0.59	S	S	*	*	H	α-helix	trans	-75.6	-35.3	-179.7	169.9	0	0	0	0	111.4	R368 S369	R368-V372 HydrophobicContact CG-CG2 4.25Å; R368-V372 WeakPolarHBondContact O-CG2 3.44Å; R368-V372 PolarHBondContact O-N 2.68Å; S369-V372 PolarHBondContact O-N 2.77Å
373	L	75.2	Confident	77.7	Confident	104 Å²	104	121.7 Å²	121.7	55%	0.545	61%	0.61	S	S	.	*	H	α-helix	trans	-85.1	-12.2	176.9	-59.6	174.3	0	0	0	112.6	S369 K375 M376	S369-L373 WeakPolarHBondContact O-CB 3.43Å; S369-L373 VanDerWaalsContact O-CG 3.29Å; S369-L373 WeakPolarHBondContact O-CG 3.23Å; S369-L373 PolarHBondContact O-N 2.8Å; L373-K375 PolarHBondContact O-N 3.45Å; L373-M376 HydrophobicContact CD2-CE 3.52Å; L373-M376 HydrophobicContact CD2-SD 4.32Å; L373-M376 WeakPolarHBondContact O-CB 3.47Å; L373-M376 PolarHBondContact O-N 2.56Å; L373-M376 VanDerWaalsContact O-N 3.16Å
374	Y	76	Confident	76.6	Confident	163 Å²	163	116.9 Å²	116.9	64%	0.639	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	126.7	178.7	-173.5	-118.5	0	0	0	110.7	R370 S371 M376	R370-Y374 VanDerWaalsContact O-CB 3.3Å; R370-Y374 WeakPolarHBondContact O-CB 3.38Å; R370-Y374 PolarHBondContact O-N 3.12Å; S371-Y374 WeakPolarHBondContact O-CB 3.3Å; Y374-M376 PolarHBondContact O-N 3.23Å
375	K	74.2	Confident	75.5	Confident	119 Å²	119	121.4 Å²	121.4	52%	0.517	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	58.2	11.4	-179	-65.8	178.6	171.4	-177.7	0	115.7	L373 E377 L378	L373-K375 PolarHBondContact O-N 3.45Å; K375-E377 PolarHBondContact O-N 3.42Å; K375-L378 HydrophobicContact CB-CB 4.48Å; K375-L378 HydrophobicContact CB-CD1 3.82Å; K375-L378 HydrophobicContact CB-CG 4.04Å; K375-L378 HydrophobicContact CD-CD1 3.83Å; K375-L378 HydrophobicContact CG-CD1 3.69Å; K375-L378 HydrophobicContact CG-CG 4.28Å; K375-L378 WeakPolarHBondContact O-CA 3.3Å; K375-L378 VanDerWaalsContact O-CB 3.3Å; K375-L378 WeakPolarHBondContact O-CB 3.19Å; K375-L378 PolarHBondContact O-N 2.9Å
376	M	77.1	Confident	75.2	Confident	105 Å²	105	121.2 Å²	121.2	52%	0.517	62%	0.615	S	S	.	*	G	3₁₀ helix	trans	-62	-26.1	174.9	-165.6	166.7	72.2	0	0	112.1	L373 Y374 L378 L379	L373-M376 HydrophobicContact CD2-CE 3.52Å; L373-M376 HydrophobicContact CD2-SD 4.32Å; L373-M376 WeakPolarHBondContact O-CB 3.47Å; L373-M376 PolarHBondContact O-N 2.56Å; L373-M376 VanDerWaalsContact O-N 3.16Å; Y374-M376 PolarHBondContact O-N 3.23Å; M376-L378 VanDerWaalsContact C-N 3.28Å; M376-L378 PolarHBondContact O-N 3.19Å; M376-L379 HydrophobicContact CG-CD1 4.49Å; M376-L379 WeakPolarHBondContact O-CB 3.29Å; M376-L379 PolarHBondContact O-N 3.3Å; M376-L379 VanDerWaalsContact O-N 3.14Å
377	E	72.7	Confident	75.1	Confident	175 Å²	175	125.2 Å²	125.2	82%	0.818	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-66	-25.6	171.9	-161.1	159.3	-139.7	0	0	113.2	K375 L379 K380	K375-E377 PolarHBondContact O-N 3.42Å; E377-L379 VanDerWaalsContact C-N 3.27Å; E377-L379 PolarHBondContact O-N 3.06Å; E377-K380 WeakPolarHBondContact O-CB 3.31Å; E377-K380 PolarHBondContact O-N 3.3Å
378	L	74.8	Confident	75.2	Confident	132 Å²	132	127.5 Å²	127.5	69%	0.691	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-76	-12.3	172.9	-53.7	-174.3	0	0	0	113.2	K375 M376 K380	K375-L378 HydrophobicContact CB-CB 4.48Å; K375-L378 HydrophobicContact CB-CD1 3.82Å; K375-L378 HydrophobicContact CB-CG 4.04Å; K375-L378 HydrophobicContact CD-CD1 3.83Å; K375-L378 HydrophobicContact CG-CD1 3.69Å; K375-L378 HydrophobicContact CG-CG 4.28Å; K375-L378 WeakPolarHBondContact O-CA 3.3Å; K375-L378 VanDerWaalsContact O-CB 3.3Å; K375-L378 WeakPolarHBondContact O-CB 3.19Å; K375-L378 PolarHBondContact O-N 2.9Å; M376-L378 VanDerWaalsContact C-N 3.28Å; M376-L378 PolarHBondContact O-N 3.19Å; L378-K380 VanDerWaalsContact C-N 3.33Å
379	L	73	Confident	75.2	Confident	145 Å²	145	120.7 Å²	120.7	76%	0.759	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-87.7	-4.6	175.3	-57.6	177.8	0	0	0	112.4	M376 E377	M376-L379 HydrophobicContact CG-CD1 4.49Å; M376-L379 WeakPolarHBondContact O-CB 3.29Å; M376-L379 PolarHBondContact O-N 3.3Å; M376-L379 VanDerWaalsContact O-N 3.14Å; E377-L379 VanDerWaalsContact C-N 3.27Å; E377-L379 PolarHBondContact O-N 3.06Å
380	K	70	Confident	75.5	Confident	156 Å²	156	126.7 Å²	126.7	68%	0.678	63%	0.634	S	S	*	*	S	Bend	trans	-76.9	132.3	176.4	-169.5	179.3	178.6	-174.1	0	109.7	E377 L378 V382	E377-K380 WeakPolarHBondContact O-CB 3.31Å; E377-K380 PolarHBondContact O-N 3.3Å; L378-K380 VanDerWaalsContact C-N 3.33Å; K380-V382 PolarHBondContact O-N 3.1Å
381	P	65.9	Low	75.8	Confident	76 Å²	76	129.4 Å²	129.4	49%	0.494	64%	0.644	S	S	.	*			trans	-56.7	128.9	175	-24.8	34	0	0	0	111.6	E383 G384	P381-E383 VanDerWaalsContact C-N 3.28Å; P381-E383 PolarHBondContact O-N 2.86Å; P381-G384 PolarHBondContact O-N 3.28Å
382	V	67	Low	76	Confident	149 Å²	149	129.4 Å²	129.4	90%	0.903	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-36.4	-175	179.3	0	0	0	0	112	K380	K380-V382 PolarHBondContact O-N 3.1Å
383	E	64.7	Low	76.4	Confident	193 Å²	193	127.9 Å²	127.9	90%	0.902	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	7.6	-172.2	-59.6	-176.8	156.2	0	0	113.8	P381	P381-E383 VanDerWaalsContact C-N 3.28Å; P381-E383 PolarHBondContact O-N 2.86Å
384	G	64.5	Low	76.8	Confident	40 Å²	40	132 Å²	132	41%	0.412	64%	0.635	S	S	.	*			trans	71.6	-157.4	-176	0	0	0	0	0	113.4	P381	P381-G384 PolarHBondContact O-N 3.28Å
385	F	65.7	Low	77.4	Confident	192 Å²	192	128.6 Å²	128.6	84%	0.842	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-98	128.9	174.5	-65	-75.1	0	0	0	109.6
386	P	75.9	Confident	78.2	Confident	70 Å²	70	123.5 Å²	123.5	46%	0.455	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-64.7	146.3	-179.7	27	-34.8	0	0	0	111.4	T420	P386-T420 HydrophobicContact CB-CG2 3.92Å; P386-T420 HydrophobicContact CG-CG2 4.35Å
387	Q	82.3	Confident	78.8	Confident	178 Å²	178	121 Å²	121	83%	0.832	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-70.5	148.3	177.3	-66	-171.2	5.4	0	0	111.6	S389	Q387-S389 PolarHBondContact O-N 3.36Å
388	I	87.1	Confident	79.5	Confident	101 Å²	101	115.1 Å²	115.1	52%	0.518	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-71.3	123.8	176.6	-58.9	171.7	0	0	0	109	T420 F425	I388-T420 WeakPolarHBondContact CA-O 3.48Å; I388-F425 HydrophobicContact CG2-CD2 4.21Å; I388-F425 HydrophobicContact CG2-CE2 3.75Å
389	S	87.1	Confident	80.2	Confident	45 Å²	45	114.7 Å²	114.7	32%	0.315	57%	0.572	S	S	.	*			trans	-115.1	130.2	-179.1	173.6	0	0	0	0	111.4	Q387 R391 T420 K421	Q387-S389 PolarHBondContact O-N 3.36Å; S389-R391 VanDerWaalsContact C-N 3.34Å; S389-R391 PolarHBondContact OG-N 2.72Å; S389-T420 PolarHBondContact N-O 2.97Å; S389-K421 WeakPolarHBondContact O-CD 3.25Å; S389-K421 VanDerWaalsContact O-CE 3.31Å; S389-K421 WeakPolarHBondContact O-CE 3.43Å; S389-K421 PolarHBondContact O-NZ 3.39Å
390	Y	87.8	Confident	81.1	Confident	184 Å²	184	107.8 Å²	107.8	72%	0.722	54%	0.536	S	S	*	.	S	Bend	trans	-72.7	-23.2	176.2	-63.4	-97.1	0	0	0	113.4	F425	Y390-F425 AromaticContact CD1-CE1 3.97Å; Y390-F425 HydrophobicContact CD1-CE1 3.97Å; Y390-F425 HydrophobicContact CD1-CE2 4.41Å; Y390-F425 AromaticContact CD1-CZ 3.46Å; Y390-F425 HydrophobicContact CD1-CZ 3.46Å; Y390-F425 VanDerWaalsContact CD1-CZ 3.46Å; Y390-F425 HydrophobicContact CE1-CE1 4.32Å; Y390-F425 AromaticContact CE1-CZ 3.57Å; Y390-F425 HydrophobicContact CE1-CZ 3.57Å; Y390-F425 HydrophobicContact CG-CZ 4.25Å
391	R	87.3	Confident	81.9	Confident	209 Å²	209	103.3 Å²	103.3	79%	0.789	52%	0.519	S	S	*	.	S	Bend	trans	-84.7	135.4	-178.1	-58.9	-176	90.4	-176.4	7.6	109.8	S389 K421	S389-R391 VanDerWaalsContact C-N 3.34Å; S389-R391 PolarHBondContact OG-N 2.72Å; R391-K421 PolarHBondContact O-NZ 3.33Å
392	W	87.6	Confident	83	Confident	86 Å²	86	104.2 Å²	104.2	33%	0.326	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-91.2	123.4	175.5	-74.7	95	0	0	0	111.2	E396 L397 V400 K421 F425 I426 F429	W392-E396 HydrophobicContact CE3-CB 4.18Å; W392-E396 HydrophobicContact CZ3-CB 4.4Å; W392-L397 HydrophobicContact CD2-CD2 4.14Å; W392-L397 HydrophobicContact CE3-CD2 3.61Å; W392-L397 HydrophobicContact CE3-CG 4.06Å; W392-L397 HydrophobicContact CZ3-CD2 4.11Å; W392-V400 HydrophobicContact CH2-CG2 3.94Å; W392-V400 HydrophobicContact CZ3-CG2 3.7Å; W392-K421 HydrophobicContact CD2-CD 4.35Å; W392-K421 VanDerWaalsContact CD2-CE 3.49Å; W392-K421 HydrophobicContact CE3-CD 4.4Å; W392-K421 HydrophobicContact CH2-CD 4.03Å; W392-K421 HydrophobicContact CH2-CG 4.04Å; W392-K421 HydrophobicContact CZ2-CD 3.93Å; W392-K421 HydrophobicContact CZ2-CG 4.43Å; W392-K421 HydrophobicContact CZ3-CD 4.25Å; W392-K421 HydrophobicContact CZ3-CG 4.12Å; W392-F425 HydrophobicContact CZ2-CB 4.2Å; W392-I426 HydrophobicContact CH2-CD1 3.84Å; W392-F429 HydrophobicContact CH2-CB 4.09Å; W392-F429 HydrophobicContact CH2-CD2 4.3Å; W392-F429 HydrophobicContact CH2-CG 4.15Å; W392-F429 HydrophobicContact CZ2-CB 3.78Å; W392-F429 HydrophobicContact CZ2-CD2 4.19Å; W392-F429 HydrophobicContact CZ2-CG 4.17Å
393	T	88.6	Confident	84.1	Confident	63 Å²	63	97.5 Å²	97.5	39%	0.387	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-98	158.1	172.6	61.4	0	0	0	0	111.1	T395 E396 L397	T393-T395 PolarHBondContact O-N 2.91Å; T393-T395 PolarHBondContact OG1-OG1 2.97Å; T393-E396 WeakPolarHBondContact CB-OE2 3.45Å; T393-E396 PolarHBondContact N-OE2 3.01Å; T393-E396 PolarHBondContact O-N 3.36Å; T393-E396 WeakPolarHBondContact OG1-CB 3.39Å; T393-E396 WeakPolarHBondContact OG1-CG 3.49Å; T393-E396 PolarHBondContact OG1-N 3.36Å; T393-E396 PolarHBondContact OG1-OE2 2.83Å; T393-L397 WeakPolarHBondContact O-CG 3.33Å; T393-L397 PolarHBondContact O-N 3.5Å
394	K	84.5	Confident	85.2	Confident	191 Å²	191	88.4 Å²	88.4	83%	0.83	44%	0.441	S	S	*	.	H	α-helix	trans	-61.1	-32.8	178.7	-65.1	-177.3	-179.8	179.6	0	112.6	A398	K394-A398 PolarHBondContact O-N 3.36Å; K394-A398 VanDerWaalsContact O-N 3.1Å
395	T	87.9	Confident	86.3	Confident	91 Å²	91	93.4 Å²	93.4	56%	0.558	45%	0.451	S	S	*	.	H	α-helix	trans	-70.1	-46.1	176.5	43.1	0	0	0	0	111.9	T393 L397 A398 F399	T393-T395 PolarHBondContact O-N 2.91Å; T393-T395 PolarHBondContact OG1-OG1 2.97Å; T395-L397 VanDerWaalsContact C-N 3.33Å; T395-L397 PolarHBondContact O-N 3.06Å; T395-A398 PolarHBondContact O-N 3.43Å; T395-F399 WeakPolarHBondContact O-CD2 3.44Å; T395-F399 WeakPolarHBondContact O-CG 3.45Å; T395-F399 PolarHBondContact O-N 2.95Å
396	E	90.6	Very high	87.4	Confident	13 Å²	13	91 Å²	91	6%	0.061	44%	0.44	C	S	.	.	H	α-helix	trans	-60.1	-41.3	174.2	-71.1	165.4	135.8	0	0	112.3	W392 T393 F399 V400 V418 T420 K421	W392-E396 HydrophobicContact CE3-CB 4.18Å; W392-E396 HydrophobicContact CZ3-CB 4.4Å; T393-E396 WeakPolarHBondContact CB-OE2 3.45Å; T393-E396 PolarHBondContact N-OE2 3.01Å; T393-E396 PolarHBondContact O-N 3.36Å; T393-E396 WeakPolarHBondContact OG1-CB 3.39Å; T393-E396 WeakPolarHBondContact OG1-CG 3.49Å; T393-E396 PolarHBondContact OG1-N 3.36Å; T393-E396 PolarHBondContact OG1-OE2 2.83Å; E396-F399 PolarHBondContact O-N 2.91Å; E396-V400 WeakPolarHBondContact O-CG2 3.26Å; E396-V400 PolarHBondContact O-N 2.77Å; E396-V418 HydrophobicContact CB-CG1 4.42Å; E396-V418 HydrophobicContact CG-CG1 4.27Å; E396-T420 VanDerWaalsContact OE1-CB 3.26Å; E396-T420 WeakPolarHBondContact OE1-CB 3.48Å; E396-T420 PolarHBondContact OE1-OG1 3.42Å; E396-K421 IonicContact OE1-NZ 2.58Å; E396-K421 PolarHBondContact OE1-NZ 2.9Å; E396-K421 IonicContact OE2-NZ 3.16Å; E396-K421 PolarHBondContact OE2-NZ 3.14Å; E396-K421 VanDerWaalsContact OE2-NZ 3.14Å
397	L	89	Confident	88	Confident	53 Å²	53	91 Å²	91	28%	0.277	43%	0.432	S	S	.	.	H	α-helix	trans	-61.8	-43.1	175	-69.3	169.7	0	0	0	111.6	W392 T393 T395 V400 L401 F429	W392-L397 HydrophobicContact CD2-CD2 4.14Å; W392-L397 HydrophobicContact CE3-CD2 3.61Å; W392-L397 HydrophobicContact CE3-CG 4.06Å; W392-L397 HydrophobicContact CZ3-CD2 4.11Å; T393-L397 WeakPolarHBondContact O-CG 3.33Å; T393-L397 PolarHBondContact O-N 3.5Å; T395-L397 VanDerWaalsContact C-N 3.33Å; T395-L397 PolarHBondContact O-N 3.06Å; L397-V400 PolarHBondContact O-N 3.46Å; L397-L401 VanDerWaalsContact O-CG 3.3Å; L397-L401 WeakPolarHBondContact O-CG 3.5Å; L397-L401 PolarHBondContact O-N 3.23Å; L397-F429 HydrophobicContact CD2-CD2 4.02Å; L397-F429 HydrophobicContact CD2-CE2 3.29Å; L397-F429 HydrophobicContact CD2-CZ 3.8Å
398	A	88.3	Confident	88.2	Confident	51 Å²	51	83.5 Å²	83.5	42%	0.421	40%	0.403	S	S	.	.	H	α-helix	trans	-63.5	-40.2	174.9	0	0	0	0	0	112.3	K394 T395 T402	K394-A398 PolarHBondContact O-N 3.36Å; K394-A398 VanDerWaalsContact O-N 3.1Å; T395-A398 PolarHBondContact O-N 3.43Å; A398-T402 VanDerWaalsContact O-CB 3.31Å; A398-T402 WeakPolarHBondContact O-CB 3.34Å; A398-T402 PolarHBondContact O-N 3.19Å; A398-T402 PolarHBondContact O-OG1 3.41Å
399	F	90.3	Very high	88.2	Confident	123 Å²	123	84.1 Å²	84.1	54%	0.539	40%	0.403	S	S	.	.	H	α-helix	trans	-63.5	-45.3	173.6	-69	-48.9	0	0	0	112	T395 E396 T402 A403 V418	T395-F399 WeakPolarHBondContact O-CD2 3.44Å; T395-F399 WeakPolarHBondContact O-CG 3.45Å; T395-F399 PolarHBondContact O-N 2.95Å; E396-F399 PolarHBondContact O-N 2.91Å; F399-T402 PolarHBondContact O-N 2.78Å; F399-A403 WeakPolarHBondContact O-CB 3.43Å; F399-A403 PolarHBondContact O-N 2.78Å; F399-V418 HydrophobicContact CB-CG2 4.16Å
400	V	90.4	Very high	88.4	Confident	0 Å²	0	86.3 Å²	86.3	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-60.2	-49	176.7	168.3	0	0	0	0	111.7	W392 E396 L397 T402 A403 M404 I414 V418 I426 F429	W392-V400 HydrophobicContact CH2-CG2 3.94Å; W392-V400 HydrophobicContact CZ3-CG2 3.7Å; E396-V400 WeakPolarHBondContact O-CG2 3.26Å; E396-V400 PolarHBondContact O-N 2.77Å; L397-V400 PolarHBondContact O-N 3.46Å; V400-T402 VanDerWaalsContact C-N 3.32Å; V400-T402 PolarHBondContact O-N 3.22Å; V400-A403 PolarHBondContact O-N 2.9Å; V400-M404 HydrophobicContact CG1-CE 3.71Å; V400-M404 HydrophobicContact CG1-CG 4.23Å; V400-M404 HydrophobicContact CG1-SD 3.7Å; V400-M404 WeakPolarHBondContact O-CB 3.33Å; V400-M404 WeakPolarHBondContact O-CG 3.22Å; V400-M404 PolarHBondContact O-N 3.05Å; V400-I414 HydrophobicContact CG1-CG2 4.43Å; V400-I414 HydrophobicContact CG2-CG2 4.31Å; V400-V418 HydrophobicContact CG2-CG2 3.55Å; V400-I426 HydrophobicContact CG2-CD1 3.75Å; V400-F429 HydrophobicContact CG1-CD1 3.77Å; V400-F429 HydrophobicContact CG1-CE1 3.7Å
401	L	88.2	Confident	88.6	Confident	61 Å²	61	78.8 Å²	78.8	32%	0.319	38%	0.382	S	S	.	.	H	α-helix	trans	-63.5	-38.8	179.9	-67.1	172.4	0	0	0	112	L397 K405 L439	L397-L401 VanDerWaalsContact O-CG 3.3Å; L397-L401 WeakPolarHBondContact O-CG 3.5Å; L397-L401 PolarHBondContact O-N 3.23Å; L401-K405 WeakPolarHBondContact O-CB 3.5Å; L401-K405 PolarHBondContact O-N 2.76Å; L401-L439 HydrophobicContact CD2-CD2 3.43Å; L401-L439 VanDerWaalsContact CD2-CD2 3.43Å
402	T	87.6	Confident	88.9	Confident	96 Å²	96	71.2 Å²	71.2	59%	0.589	36%	0.361	S	S	*	.	H	α-helix	trans	-67.3	-40.3	175.6	-55.6	0	0	0	0	111.7	A398 F399 V400 K405 K406	A398-T402 VanDerWaalsContact O-CB 3.31Å; A398-T402 WeakPolarHBondContact O-CB 3.34Å; A398-T402 PolarHBondContact O-N 3.19Å; A398-T402 PolarHBondContact O-OG1 3.41Å; F399-T402 PolarHBondContact O-N 2.78Å; V400-T402 VanDerWaalsContact C-N 3.32Å; V400-T402 PolarHBondContact O-N 3.22Å; T402-K405 PolarHBondContact O-N 2.78Å; T402-K406 PolarHBondContact O-N 3.27Å
403	A	90.2	Very high	89.1	Confident	7 Å²	7	68.5 Å²	68.5	6%	0.058	35%	0.353	C	S	.	.	H	α-helix	trans	-70.4	-41	177.5	0	0	0	0	0	111.9	F399 V400 K405 K406 Y407 I414 T417	F399-A403 WeakPolarHBondContact O-CB 3.43Å; F399-A403 PolarHBondContact O-N 2.78Å; V400-A403 PolarHBondContact O-N 2.9Å; A403-K405 VanDerWaalsContact C-N 3.33Å; A403-K405 PolarHBondContact O-N 3.22Å; A403-K406 PolarHBondContact O-N 3.33Å; A403-Y407 HydrophobicContact CB-CD2 4.05Å; A403-Y407 HydrophobicContact CB-CE2 4.26Å; A403-Y407 VanDerWaalsContact O-CD2 3.23Å; A403-Y407 WeakPolarHBondContact O-CD2 3.47Å; A403-Y407 PolarHBondContact O-N 3.37Å; A403-I414 HydrophobicContact CB-CB 4.23Å; A403-I414 HydrophobicContact CB-CG1 3.91Å; A403-I414 HydrophobicContact CB-CG2 3.9Å; A403-T417 WeakPolarHBondContact CB-OG1 3.13Å
404	M	88.9	Confident	89.2	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.015	34%	0.335	C	S	.	.	H	α-helix	trans	-60.6	-40.8	172.8	-76.9	176.1	167.5	0	0	111.8	V400 K406 G408 I414 I426 F429 Y430 L439 M443	V400-M404 HydrophobicContact CG1-CE 3.71Å; V400-M404 HydrophobicContact CG1-CG 4.23Å; V400-M404 HydrophobicContact CG1-SD 3.7Å; V400-M404 WeakPolarHBondContact O-CB 3.33Å; V400-M404 WeakPolarHBondContact O-CG 3.22Å; V400-M404 PolarHBondContact O-N 3.05Å; M404-K406 PolarHBondContact O-N 2.81Å; M404-G408 VanDerWaalsContact O-CA 3.26Å; M404-G408 WeakPolarHBondContact O-CA 3.39Å; M404-G408 PolarHBondContact O-N 3.1Å; M404-I414 HydrophobicContact CB-CD1 4.5Å; M404-I414 HydrophobicContact CG-CD1 3.67Å; M404-I426 HydrophobicContact CE-CG2 3.89Å; M404-F429 HydrophobicContact CE-CD1 3.99Å; M404-F429 HydrophobicContact CE-CE1 4.38Å; M404-F429 HydrophobicContact SD-CE1 4.36Å; M404-Y430 HydrophobicContact CE-CD2 4.24Å; M404-Y430 HydrophobicContact CE-CG 4.41Å; M404-L439 HydrophobicContact SD-CD1 4.31Å; M404-M443 HydrophobicContact CB-CG 4.01Å; M404-M443 HydrophobicContact CB-SD 4.25Å; M404-M443 HydrophobicContact CG-SD 4.46Å; M404-M443 HydrophobicContact SD-SD 4.41Å
405	K	86.8	Confident	89.6	Confident	144 Å²	144	56.9 Å²	56.9	63%	0.626	30%	0.3	S	S	*	.	H	α-helix	trans	-63.1	-28.9	172.8	-174.2	177.3	178.3	-178.3	0	113.2	L401 T402 A403 I442	L401-K405 WeakPolarHBondContact O-CB 3.5Å; L401-K405 PolarHBondContact O-N 2.76Å; T402-K405 PolarHBondContact O-N 2.78Å; A403-K405 VanDerWaalsContact C-N 3.33Å; A403-K405 PolarHBondContact O-N 3.22Å; K405-I442 HydrophobicContact CB-CG2 4.1Å; K405-I442 HydrophobicContact CG-CG2 4.38Å
406	K	88.6	Confident	89.7	Confident	141 Å²	141	60.5 Å²	60.5	61%	0.613	30%	0.303	S	S	*	.	H	α-helix	trans	-92	-38.7	-176.8	-173.2	177.6	175.9	-165.6	0	113.9	T402 A403 M404	T402-K406 PolarHBondContact O-N 3.27Å; A403-K406 PolarHBondContact O-N 3.33Å; M404-K406 PolarHBondContact O-N 2.81Å
407	Y	89.3	Confident	89.7	Confident	71 Å²	71	63 Å²	63	28%	0.278	32%	0.319	S	S	.	.	H	α-helix	trans	-117.5	1.9	-171.6	-49.5	-71.1	0	0	0	113.5	A403 Q409 D410 T413 I414 T417	A403-Y407 HydrophobicContact CB-CD2 4.05Å; A403-Y407 HydrophobicContact CB-CE2 4.26Å; A403-Y407 VanDerWaalsContact O-CD2 3.23Å; A403-Y407 WeakPolarHBondContact O-CD2 3.47Å; A403-Y407 PolarHBondContact O-N 3.37Å; Y407-Q409 PolarHBondContact O-N 3.06Å; Y407-D410 WeakPolarHBondContact O-CB 3.48Å; Y407-D410 PolarHBondContact O-N 3.24Å; Y407-T413 HydrophobicContact CD1-CG2 3.77Å; Y407-T413 HydrophobicContact CD2-CG2 3.97Å; Y407-T413 HydrophobicContact CE1-CG2 3.84Å; Y407-T413 HydrophobicContact CE2-CG2 4.04Å; Y407-T413 HydrophobicContact CG-CG2 3.85Å; Y407-I414 HydrophobicContact CD2-CG1 4.45Å; Y407-T417 HydrophobicContact CE2-CG2 3.81Å
408	G	86	Confident	89.7	Confident	21 Å²	21	61.2 Å²	61.2	22%	0.216	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	-122.4	179.4	0	0	0	0	0	112.4	M404 I414	M404-G408 VanDerWaalsContact O-CA 3.26Å; M404-G408 WeakPolarHBondContact O-CA 3.39Å; M404-G408 PolarHBondContact O-N 3.1Å; G408-I414 WeakPolarHBondContact O-CD1 3.5Å
409	Q	86.8	Confident	89.6	Confident	114 Å²	114	60.3 Å²	60.3	53%	0.533	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	13.5	-179.1	-71	-179.9	-10.7	0	0	113.9	Y407 F411 Y430 M443	Y407-Q409 PolarHBondContact O-N 3.06Å; Q409-F411 HydrophobicContact CB-CE2 4.31Å; Q409-F411 HydrophobicContact CB-CZ 4.27Å; Q409-F411 HydrophobicContact CG-CZ 4.41Å; Q409-F411 WeakPolarHBondContact O-CD2 3.46Å; Q409-F411 WeakPolarHBondContact O-CE2 3.41Å; Q409-F411 WeakPolarHBondContact O-CG 3.03Å; Q409-F411 PolarHBondContact O-N 3.42Å; Q409-Y430 PolarHBondContact NE2-OH 2.88Å; Q409-M443 HydrophobicContact CB-CE 4.45Å; Q409-M443 HydrophobicContact CG-CE 3.35Å
410	D	91.2	Very high	89.7	Confident	90 Å²	90	55.9 Å²	55.9	48%	0.481	29%	0.289	S	S	.	.			trans	-73.2	67.8	176.2	-72.6	-12.6	0	0	0	112.2	Y407 P412 T413 I414	Y407-D410 WeakPolarHBondContact O-CB 3.48Å; Y407-D410 PolarHBondContact O-N 3.24Å; D410-P412 VanDerWaalsContact C-N 3.3Å; D410-T413 PolarHBondContact O-N 3.42Å; D410-I414 WeakPolarHBondContact O-CG1 3.2Å; D410-I414 PolarHBondContact O-N 2.92Å
411	F	92.9	Very high	89.6	Confident	26 Å²	26	56.1 Å²	56.1	11%	0.114	29%	0.29	C	S	.	.	H	α-helix	trans	-48.6	-40.2	177.6	-51.2	-64.9	0	0	0	114.1	Q409 T413 I414 A415 E423 I426 R427 Y430	Q409-F411 HydrophobicContact CB-CE2 4.31Å; Q409-F411 HydrophobicContact CB-CZ 4.27Å; Q409-F411 HydrophobicContact CG-CZ 4.41Å; Q409-F411 WeakPolarHBondContact O-CD2 3.46Å; Q409-F411 WeakPolarHBondContact O-CE2 3.41Å; Q409-F411 WeakPolarHBondContact O-CG 3.03Å; Q409-F411 PolarHBondContact O-N 3.42Å; F411-T413 VanDerWaalsContact C-N 3.29Å; F411-T413 PolarHBondContact O-N 2.83Å; F411-I414 PolarHBondContact O-N 3.39Å; F411-A415 VanDerWaalsContact O-CB 3.3Å; F411-A415 WeakPolarHBondContact O-CB 3.39Å; F411-A415 PolarHBondContact O-N 3.22Å; F411-E423 HydrophobicContact CB-CG 3.76Å; F411-I426 HydrophobicContact CD1-CB 4.47Å; F411-I426 HydrophobicContact CD1-CG2 3.86Å; F411-R427 HydrophobicContact CB-CG 4.21Å; F411-R427 HydrophobicContact CD1-CG 4Å; F411-R427 HydrophobicContact CD2-CG 3.52Å; F411-R427 HydrophobicContact CE1-CG 4.24Å; F411-R427 HydrophobicContact CE2-CG 3.78Å; F411-R427 HydrophobicContact CG-CG 3.63Å; F411-R427 HydrophobicContact CZ-CG 4.13Å; F411-Y430 AromaticContact CE1-CD1 3.92Å; F411-Y430 HydrophobicContact CE1-CD1 3.92Å; F411-Y430 AromaticContact CE1-CG 3.94Å; F411-Y430 HydrophobicContact CE1-CG 3.94Å; F411-Y430 AromaticContact CZ-CD1 3.62Å; F411-Y430 HydrophobicContact CZ-CD1 3.62Å; F411-Y430 HydrophobicContact CZ-CE1 4.15Å; F411-Y430 HydrophobicContact CZ-CG 4.13Å
412	P	92.6	Very high	89.8	Confident	51 Å²	51	54.7 Å²	54.7	33%	0.331	29%	0.285	S	S	.	.	H	α-helix	trans	-61.7	-35.4	175.7	-19.3	27.9	0	0	0	113.3	D410 R416 E423	D410-P412 VanDerWaalsContact C-N 3.3Å; P412-R416 PolarHBondContact O-N 3.33Å; P412-R416 PolarHBondContact O-NE 3.4Å; P412-R416 PolarHBondContact O-NH2 3.04Å; P412-E423 HydrophobicContact CG-CG 4.29Å; P412-E423 WeakPolarHBondContact CG-OE1 3.47Å
413	T	92.2	Very high	90	Very high	28 Å²	28	53.2 Å²	53.2	17%	0.172	27%	0.272	C	S	.	.	H	α-helix	trans	-79.9	-39.6	-179.1	-61.6	0	0	0	0	110.7	Y407 D410 F411 R416 T417	Y407-T413 HydrophobicContact CD1-CG2 3.77Å; Y407-T413 HydrophobicContact CD2-CG2 3.97Å; Y407-T413 HydrophobicContact CE1-CG2 3.84Å; Y407-T413 HydrophobicContact CE2-CG2 4.04Å; Y407-T413 HydrophobicContact CG-CG2 3.85Å; D410-T413 PolarHBondContact O-N 3.42Å; F411-T413 VanDerWaalsContact C-N 3.29Å; F411-T413 PolarHBondContact O-N 2.83Å; T413-R416 PolarHBondContact O-N 3.11Å; T413-R416 PolarHBondContact OG1-NH1 2.86Å; T413-R416 PolarHBondContact OG1-NH2 3.37Å; T413-T417 PolarHBondContact O-N 2.91Å; T413-T417 PolarHBondContact O-OG1 2.92Å
414	I	91.9	Very high	90.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.1	-49.3	172.5	-63.9	159.7	0	0	0	110.4	V400 A403 M404 Y407 G408 D410 F411 R416 T417 V418 I426	V400-I414 HydrophobicContact CG1-CG2 4.43Å; V400-I414 HydrophobicContact CG2-CG2 4.31Å; A403-I414 HydrophobicContact CB-CB 4.23Å; A403-I414 HydrophobicContact CB-CG1 3.91Å; A403-I414 HydrophobicContact CB-CG2 3.9Å; M404-I414 HydrophobicContact CB-CD1 4.5Å; M404-I414 HydrophobicContact CG-CD1 3.67Å; Y407-I414 HydrophobicContact CD2-CG1 4.45Å; G408-I414 WeakPolarHBondContact O-CD1 3.5Å; D410-I414 WeakPolarHBondContact O-CG1 3.2Å; D410-I414 PolarHBondContact O-N 2.92Å; F411-I414 PolarHBondContact O-N 3.39Å; I414-R416 VanDerWaalsContact C-N 3.35Å; I414-R416 PolarHBondContact O-N 3.36Å; I414-T417 WeakPolarHBondContact CA-OG1 3.47Å; I414-T417 PolarHBondContact O-N 3.29Å; I414-T417 PolarHBondContact O-OG1 3.44Å; I414-V418 HydrophobicContact CG2-CG2 4.44Å; I414-V418 WeakPolarHBondContact O-CG2 3.43Å; I414-V418 PolarHBondContact O-N 2.8Å; I414-I426 HydrophobicContact CB-CG2 4.07Å; I414-I426 HydrophobicContact CD1-CG2 4.42Å; I414-I426 HydrophobicContact CG2-CD1 4.38Å; I414-I426 HydrophobicContact CG2-CG1 4.2Å; I414-I426 HydrophobicContact CG2-CG2 3.54Å
415	A	92.4	Very high	90.3	Very high	11 Å²	11	57.4 Å²	57.4	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-56	-46.4	176	0	0	0	0	0	112	F411 T417 V418 G419 K421 E423 I426	F411-A415 VanDerWaalsContact O-CB 3.3Å; F411-A415 WeakPolarHBondContact O-CB 3.39Å; F411-A415 PolarHBondContact O-N 3.22Å; A415-T417 VanDerWaalsContact C-N 3.31Å; A415-T417 PolarHBondContact O-N 2.98Å; A415-V418 PolarHBondContact O-N 3.19Å; A415-G419 PolarHBondContact O-N 3.38Å; A415-K421 WeakPolarHBondContact CB-O 3.48Å; A415-E423 HydrophobicContact CB-CB 4.35Å; A415-I426 HydrophobicContact CB-CG1 4.06Å
416	R	89.8	Confident	90.6	Very high	167 Å²	167	50.6 Å²	50.6	63%	0.63	27%	0.266	S	S	*	.	H	α-helix	trans	-60.6	-34.3	174.2	-85.4	-179.6	-84.6	104.3	1.1	113.8	P412 T413 I414	P412-R416 PolarHBondContact O-N 3.33Å; P412-R416 PolarHBondContact O-NE 3.4Å; P412-R416 PolarHBondContact O-NH2 3.04Å; T413-R416 PolarHBondContact O-N 3.11Å; T413-R416 PolarHBondContact OG1-NH1 2.86Å; T413-R416 PolarHBondContact OG1-NH2 3.37Å; I414-R416 VanDerWaalsContact C-N 3.35Å; I414-R416 PolarHBondContact O-N 3.36Å
417	T	89.6	Confident	90.8	Very high	65 Å²	65	48.2 Å²	48.2	40%	0.399	25%	0.253	S	S	.	.	H	α-helix	trans	-77.4	-24.1	176.2	52.6	0	0	0	0	114.7	A403 Y407 T413 I414 A415	A403-T417 WeakPolarHBondContact CB-OG1 3.13Å; Y407-T417 HydrophobicContact CE2-CG2 3.81Å; T413-T417 PolarHBondContact O-N 2.91Å; T413-T417 PolarHBondContact O-OG1 2.92Å; I414-T417 WeakPolarHBondContact CA-OG1 3.47Å; I414-T417 PolarHBondContact O-N 3.29Å; I414-T417 PolarHBondContact O-OG1 3.44Å; A415-T417 VanDerWaalsContact C-N 3.31Å; A415-T417 PolarHBondContact O-N 2.98Å
418	V	89.4	Confident	90.8	Very high	16 Å²	16	49 Å²	49	10%	0.097	26%	0.262	C	S	.	.	H	α-helix	trans	-85.5	-35.2	175.6	177.6	0	0	0	0	111	E396 F399 V400 I414 A415 T420 K421	E396-V418 HydrophobicContact CB-CG1 4.42Å; E396-V418 HydrophobicContact CG-CG1 4.27Å; F399-V418 HydrophobicContact CB-CG2 4.16Å; V400-V418 HydrophobicContact CG2-CG2 3.55Å; I414-V418 HydrophobicContact CG2-CG2 4.44Å; I414-V418 WeakPolarHBondContact O-CG2 3.43Å; I414-V418 PolarHBondContact O-N 2.8Å; A415-V418 PolarHBondContact O-N 3.19Å; V418-T420 PolarHBondContact O-N 3.18Å; V418-K421 HydrophobicContact CG1-CB 3.94Å; V418-K421 HydrophobicContact CG1-CG 3.76Å
419	G	87.7	Confident	91	Very high	31 Å²	31	48.7 Å²	48.7	32%	0.32	26%	0.255	S	S	.	.	S	Bend	trans	75.1	-46.5	178.2	0	0	0	0	0	114.2	A415 K421	A415-G419 PolarHBondContact O-N 3.38Å; G419-K421 PolarHBondContact O-N 3.12Å
420	T	90.3	Very high	91.1	Very high	31 Å²	31	44.2 Å²	44.2	19%	0.19	23%	0.233	C	C	.	.	S	Bend	trans	-85.7	1.8	-175.2	55.5	0	0	0	0	114.7	P386 I388 S389 E396 V418	P386-T420 HydrophobicContact CB-CG2 3.92Å; P386-T420 HydrophobicContact CG-CG2 4.35Å; I388-T420 WeakPolarHBondContact CA-O 3.48Å; S389-T420 PolarHBondContact N-O 2.97Å; E396-T420 VanDerWaalsContact OE1-CB 3.26Å; E396-T420 WeakPolarHBondContact OE1-CB 3.48Å; E396-T420 PolarHBondContact OE1-OG1 3.42Å; V418-T420 PolarHBondContact O-N 3.18Å
421	K	89.7	Confident	90.9	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.017	23%	0.234	C	C	.	.	S	Bend	trans	-132.6	129.1	-175.4	-65.9	-72.5	-179.2	-79.3	0	110.1	S389 R391 W392 E396 A415 V418 G419 F425 I426	S389-K421 WeakPolarHBondContact O-CD 3.25Å; S389-K421 VanDerWaalsContact O-CE 3.31Å; S389-K421 WeakPolarHBondContact O-CE 3.43Å; S389-K421 PolarHBondContact O-NZ 3.39Å; R391-K421 PolarHBondContact O-NZ 3.33Å; W392-K421 HydrophobicContact CD2-CD 4.35Å; W392-K421 VanDerWaalsContact CD2-CE 3.49Å; W392-K421 HydrophobicContact CE3-CD 4.4Å; W392-K421 HydrophobicContact CH2-CD 4.03Å; W392-K421 HydrophobicContact CH2-CG 4.04Å; W392-K421 HydrophobicContact CZ2-CD 3.93Å; W392-K421 HydrophobicContact CZ2-CG 4.43Å; W392-K421 HydrophobicContact CZ3-CD 4.25Å; W392-K421 HydrophobicContact CZ3-CG 4.12Å; E396-K421 IonicContact OE1-NZ 2.58Å; E396-K421 PolarHBondContact OE1-NZ 2.9Å; E396-K421 IonicContact OE2-NZ 3.16Å; E396-K421 PolarHBondContact OE2-NZ 3.14Å; E396-K421 VanDerWaalsContact OE2-NZ 3.14Å; A415-K421 WeakPolarHBondContact CB-O 3.48Å; V418-K421 HydrophobicContact CG1-CB 3.94Å; V418-K421 HydrophobicContact CG1-CG 3.76Å; G419-K421 PolarHBondContact O-N 3.12Å; K421-F425 HydrophobicContact CB-CB 4.48Å; K421-F425 HydrophobicContact CD-CB 4.19Å; K421-F425 HydrophobicContact CD-CD2 4.35Å; K421-F425 HydrophobicContact CD-CG 4.48Å; K421-I426 HydrophobicContact CB-CD1 3.65Å; K421-I426 HydrophobicContact CG-CD1 4.36Å
422	S	91.9	Very high	90.6	Very high	31 Å²	31	46.5 Å²	46.5	22%	0.217	25%	0.249	C	C	.	.			trans	-69	159.9	171.2	62	0	0	0	0	111.7	S424 F425 I426	S422-S424 PolarHBondContact O-N 3.26Å; S422-S424 PolarHBondContact OG-OG 3.41Å; S422-F425 PolarHBondContact O-N 3.24Å; S422-F425 VanDerWaalsContact O-N 3.08Å; S422-F425 WeakPolarHBondContact OG-CD2 3.33Å; S422-F425 WeakPolarHBondContact OG-CE2 3.44Å; S422-I426 PolarHBondContact O-N 3.04Å
423	E	92.9	Very high	90.1	Very high	66 Å²	66	46.8 Å²	46.8	31%	0.308	25%	0.245	S	C	.	.	H	α-helix	trans	-55	-34.1	175.6	-165.2	-173.6	153.4	0	0	113.3	F411 P412 A415 I426 R427	F411-E423 HydrophobicContact CB-CG 3.76Å; P412-E423 HydrophobicContact CG-CG 4.29Å; P412-E423 WeakPolarHBondContact CG-OE1 3.47Å; A415-E423 HydrophobicContact CB-CB 4.35Å; E423-I426 PolarHBondContact O-N 3.08Å; E423-R427 PolarHBondContact O-N 2.74Å; E423-R427 IonicContact OE1-CZ 2.77Å; E423-R427 IonicContact OE1-NH1 3.23Å; E423-R427 PolarHBondContact OE1-NH1 2.79Å; E423-R427 IonicContact OE1-NH2 3.44Å; E423-R427 PolarHBondContact OE1-NH2 3Å; E423-R427 IonicContact OE2-NH2 3.75Å
424	S	92.1	Very high	89.5	Confident	56 Å²	56	47.8 Å²	47.8	39%	0.392	25%	0.248	S	C	.	.	H	α-helix	trans	-61.9	-49.4	173.3	52.4	0	0	0	0	112.1	S422 I426 R427 D428	S422-S424 PolarHBondContact O-N 3.26Å; S422-S424 PolarHBondContact OG-OG 3.41Å; S424-I426 VanDerWaalsContact C-N 3.25Å; S424-I426 PolarHBondContact O-N 3.08Å; S424-R427 WeakPolarHBondContact O-CB 3.34Å; S424-R427 PolarHBondContact O-N 2.93Å; S424-R427 VanDerWaalsContact O-N 3.08Å; S424-D428 PolarHBondContact O-N 3.37Å
425	F	92.2	Very high	88.5	Confident	42 Å²	42	53.7 Å²	53.7	18%	0.184	28%	0.28	C	S	.	.	H	α-helix	trans	-61.5	-33.3	177.9	-66.9	-53.2	0	0	0	112.8	I388 Y390 W392 K421 S422 F429	I388-F425 HydrophobicContact CG2-CD2 4.21Å; I388-F425 HydrophobicContact CG2-CE2 3.75Å; Y390-F425 AromaticContact CD1-CE1 3.97Å; Y390-F425 HydrophobicContact CD1-CE1 3.97Å; Y390-F425 HydrophobicContact CD1-CE2 4.41Å; Y390-F425 AromaticContact CD1-CZ 3.46Å; Y390-F425 HydrophobicContact CD1-CZ 3.46Å; Y390-F425 VanDerWaalsContact CD1-CZ 3.46Å; Y390-F425 HydrophobicContact CE1-CE1 4.32Å; Y390-F425 AromaticContact CE1-CZ 3.57Å; Y390-F425 HydrophobicContact CE1-CZ 3.57Å; Y390-F425 HydrophobicContact CG-CZ 4.25Å; W392-F425 HydrophobicContact CZ2-CB 4.2Å; K421-F425 HydrophobicContact CB-CB 4.48Å; K421-F425 HydrophobicContact CD-CB 4.19Å; K421-F425 HydrophobicContact CD-CD2 4.35Å; K421-F425 HydrophobicContact CD-CG 4.48Å; S422-F425 PolarHBondContact O-N 3.24Å; S422-F425 VanDerWaalsContact O-N 3.08Å; S422-F425 WeakPolarHBondContact OG-CD2 3.33Å; S422-F425 WeakPolarHBondContact OG-CE2 3.44Å; F425-F429 WeakPolarHBondContact O-CB 3.29Å; F425-F429 PolarHBondContact O-N 2.94Å
426	I	92.8	Very high	87.5	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-69.3	-41.2	175.3	-50.4	-48.8	0	0	0	110.9	W392 V400 M404 F411 I414 A415 K421 S422 E423 S424 F429 Y430	W392-I426 HydrophobicContact CH2-CD1 3.84Å; V400-I426 HydrophobicContact CG2-CD1 3.75Å; M404-I426 HydrophobicContact CE-CG2 3.89Å; F411-I426 HydrophobicContact CD1-CB 4.47Å; F411-I426 HydrophobicContact CD1-CG2 3.86Å; I414-I426 HydrophobicContact CB-CG2 4.07Å; I414-I426 HydrophobicContact CD1-CG2 4.42Å; I414-I426 HydrophobicContact CG2-CD1 4.38Å; I414-I426 HydrophobicContact CG2-CG1 4.2Å; I414-I426 HydrophobicContact CG2-CG2 3.54Å; A415-I426 HydrophobicContact CB-CG1 4.06Å; K421-I426 HydrophobicContact CB-CD1 3.65Å; K421-I426 HydrophobicContact CG-CD1 4.36Å; S422-I426 PolarHBondContact O-N 3.04Å; E423-I426 PolarHBondContact O-N 3.08Å; S424-I426 VanDerWaalsContact C-N 3.25Å; S424-I426 PolarHBondContact O-N 3.08Å; I426-F429 PolarHBondContact O-N 3.46Å; I426-Y430 WeakPolarHBondContact O-CB 3.22Å; I426-Y430 PolarHBondContact O-N 3.22Å
427	R	92.4	Very high	86.2	Confident	92 Å²	92	59.2 Å²	59.2	35%	0.347	30%	0.302	S	S	.	.	H	α-helix	trans	-62.5	-47.6	173.6	-88.7	-167	-85.3	-86.8	3.9	112.2	F411 E423 S424 F429 Y430 N431	F411-R427 HydrophobicContact CB-CG 4.21Å; F411-R427 HydrophobicContact CD1-CG 4Å; F411-R427 HydrophobicContact CD2-CG 3.52Å; F411-R427 HydrophobicContact CE1-CG 4.24Å; F411-R427 HydrophobicContact CE2-CG 3.78Å; F411-R427 HydrophobicContact CG-CG 3.63Å; F411-R427 HydrophobicContact CZ-CG 4.13Å; E423-R427 PolarHBondContact O-N 2.74Å; E423-R427 IonicContact OE1-CZ 2.77Å; E423-R427 IonicContact OE1-NH1 3.23Å; E423-R427 PolarHBondContact OE1-NH1 2.79Å; E423-R427 IonicContact OE1-NH2 3.44Å; E423-R427 PolarHBondContact OE1-NH2 3Å; E423-R427 IonicContact OE2-NH2 3.75Å; S424-R427 WeakPolarHBondContact O-CB 3.34Å; S424-R427 PolarHBondContact O-N 2.93Å; S424-R427 VanDerWaalsContact O-N 3.08Å; R427-F429 VanDerWaalsContact C-N 3.3Å; R427-F429 PolarHBondContact O-N 2.96Å; R427-Y430 PolarHBondContact O-N 3.34Å; R427-N431 WeakPolarHBondContact O-CB 3.44Å; R427-N431 VanDerWaalsContact O-CG 3.23Å; R427-N431 PolarHBondContact O-N 2.89Å; R427-N431 PolarHBondContact O-ND2 2.66Å
428	D	91.2	Very high	85.2	Confident	86 Å²	86	60.3 Å²	60.3	46%	0.46	31%	0.309	S	S	.	.	H	α-helix	trans	-62.4	-40.6	179.3	-62.1	-25.1	0	0	0	110.7	S424 T432	S424-D428 PolarHBondContact O-N 3.37Å; D428-T432 WeakPolarHBondContact O-CB 3.4Å; D428-T432 PolarHBondContact O-N 3.17Å; D428-T432 PolarHBondContact O-OG1 3.46Å
429	F	88.8	Confident	84.3	Confident	15 Å²	15	59.7 Å²	59.7	7%	0.066	30%	0.304	C	S	.	.	H	α-helix	trans	-60.1	-50.4	172.1	176.3	-93.2	0	0	0	111.7	W392 L397 V400 M404 F425 I426 R427 T432 F433 L439	W392-F429 HydrophobicContact CH2-CB 4.09Å; W392-F429 HydrophobicContact CH2-CD2 4.3Å; W392-F429 HydrophobicContact CH2-CG 4.15Å; W392-F429 HydrophobicContact CZ2-CB 3.78Å; W392-F429 HydrophobicContact CZ2-CD2 4.19Å; W392-F429 HydrophobicContact CZ2-CG 4.17Å; L397-F429 HydrophobicContact CD2-CD2 4.02Å; L397-F429 HydrophobicContact CD2-CE2 3.29Å; L397-F429 HydrophobicContact CD2-CZ 3.8Å; V400-F429 HydrophobicContact CG1-CD1 3.77Å; V400-F429 HydrophobicContact CG1-CE1 3.7Å; M404-F429 HydrophobicContact CE-CD1 3.99Å; M404-F429 HydrophobicContact CE-CE1 4.38Å; M404-F429 HydrophobicContact SD-CE1 4.36Å; F425-F429 WeakPolarHBondContact O-CB 3.29Å; F425-F429 PolarHBondContact O-N 2.94Å; I426-F429 PolarHBondContact O-N 3.46Å; R427-F429 VanDerWaalsContact C-N 3.3Å; R427-F429 PolarHBondContact O-N 2.96Å; F429-T432 PolarHBondContact O-N 3.11Å; F429-F433 AromaticContact CD2-CD2 3.34Å; F429-F433 HydrophobicContact CD2-CD2 3.34Å; F429-F433 AromaticContact CD2-CE2 3.7Å; F429-F433 HydrophobicContact CD2-CE2 3.7Å; F429-F433 HydrophobicContact CD2-CG 4.41Å; F429-F433 HydrophobicContact CE2-CB 4.49Å; F429-F433 AromaticContact CE2-CD2 3.39Å; F429-F433 HydrophobicContact CE2-CD2 3.39Å; F429-F433 AromaticContact CE2-CE2 3.83Å; F429-F433 HydrophobicContact CE2-CE2 3.83Å; F429-F433 HydrophobicContact CE2-CG 4.12Å; F429-F433 HydrophobicContact CG-CD2 4.03Å; F429-F433 HydrophobicContact CZ-CB 4.43Å; F429-F433 HydrophobicContact CZ-CD2 4.15Å; F429-F433 WeakPolarHBondContact O-CB 3.15Å; F429-F433 VanDerWaalsContact O-CD2 3.3Å; F429-F433 WeakPolarHBondContact O-CD2 3.47Å; F429-F433 PolarHBondContact O-N 2.68Å; F429-L439 HydrophobicContact CE1-CD1 4.13Å
430	Y	89.2	Confident	83.4	Confident	20 Å²	20	61.7 Å²	61.7	8%	0.078	31%	0.308	C	S	.	.	H	α-helix	trans	-57	-55	177.8	178.5	-116.8	0	0	0	111.3	M404 Q409 F411 I426 R427 T432 F433 H434 L439 D440 M443	M404-Y430 HydrophobicContact CE-CD2 4.24Å; M404-Y430 HydrophobicContact CE-CG 4.41Å; Q409-Y430 PolarHBondContact NE2-OH 2.88Å; F411-Y430 AromaticContact CE1-CD1 3.92Å; F411-Y430 HydrophobicContact CE1-CD1 3.92Å; F411-Y430 AromaticContact CE1-CG 3.94Å; F411-Y430 HydrophobicContact CE1-CG 3.94Å; F411-Y430 AromaticContact CZ-CD1 3.62Å; F411-Y430 HydrophobicContact CZ-CD1 3.62Å; F411-Y430 HydrophobicContact CZ-CE1 4.15Å; F411-Y430 HydrophobicContact CZ-CG 4.13Å; I426-Y430 WeakPolarHBondContact O-CB 3.22Å; I426-Y430 PolarHBondContact O-N 3.22Å; R427-Y430 PolarHBondContact O-N 3.34Å; Y430-T432 PolarHBondContact O-N 2.84Å; Y430-F433 PolarHBondContact O-N 3.15Å; Y430-F433 VanDerWaalsContact O-N 3.11Å; Y430-H434 HydrophobicContact CD2-CB 4.02Å; Y430-H434 HydrophobicContact CE2-CB 3.73Å; Y430-H434 VanDerWaalsContact O-CB 3.26Å; Y430-H434 WeakPolarHBondContact O-CB 3.43Å; Y430-H434 PolarHBondContact O-N 3.09Å; Y430-H434 PolarHBondContact O-ND1 3.24Å; Y430-L439 HydrophobicContact CD2-CB 4.41Å; Y430-L439 HydrophobicContact CD2-CD1 4.1Å; Y430-L439 HydrophobicContact CE2-CB 4.28Å; Y430-D440 WeakPolarHBondContact CE2-OD1 3.49Å; Y430-D440 PolarHBondContact OH-OD1 3.18Å; Y430-M443 HydrophobicContact CD2-CE 4.19Å; Y430-M443 HydrophobicContact CD2-SD 3.93Å; Y430-M443 HydrophobicContact CE2-CE 3.5Å; Y430-M443 HydrophobicContact CE2-SD 3.43Å; Y430-M443 WeakPolarHBondContact CE2-SD 3.23Å
431	N	87.6	Confident	82.1	Confident	94 Å²	94	63.6 Å²	63.6	50%	0.503	32%	0.322	S	S	.	.	H	α-helix	trans	-57.7	-36.8	179.9	-64.3	-14.1	0	0	0	112.3	R427 H434	R427-N431 WeakPolarHBondContact O-CB 3.44Å; R427-N431 VanDerWaalsContact O-CG 3.23Å; R427-N431 PolarHBondContact O-N 2.89Å; R427-N431 PolarHBondContact O-ND2 2.66Å; N431-H434 PolarHBondContact O-CE1 3.49Å; N431-H434 VanDerWaalsContact O-CE1 3.27Å; N431-H434 PolarHBondContact O-ND1 3.07Å
432	T	85.4	Confident	80.8	Confident	71 Å²	71	66.7 Å²	66.7	44%	0.436	34%	0.338	S	S	.	.	H	α-helix	trans	-77.2	-23.3	-178.8	-59.2	0	0	0	0	113.9	D428 F429 Y430 R436	D428-T432 WeakPolarHBondContact O-CB 3.4Å; D428-T432 PolarHBondContact O-N 3.17Å; D428-T432 PolarHBondContact O-OG1 3.46Å; F429-T432 PolarHBondContact O-N 3.11Å; Y430-T432 PolarHBondContact O-N 2.84Å; T432-R436 VanDerWaalsContact CG2-NH2 3.25Å; T432-R436 PolarHBondContact O-NE 3.23Å; T432-R436 PolarHBondContact O-NH2 3.13Å
433	F	82	Confident	79.4	Confident	56 Å²	56	66.2 Å²	66.2	25%	0.246	33%	0.333	C	S	.	.	H	α-helix	trans	-127.3	-7.6	-167.2	-69	-63.7	0	0	0	115.5	F429 Y430 D435 R436 F437 L439	F429-F433 AromaticContact CD2-CD2 3.34Å; F429-F433 HydrophobicContact CD2-CD2 3.34Å; F429-F433 AromaticContact CD2-CE2 3.7Å; F429-F433 HydrophobicContact CD2-CE2 3.7Å; F429-F433 HydrophobicContact CD2-CG 4.41Å; F429-F433 HydrophobicContact CE2-CB 4.49Å; F429-F433 AromaticContact CE2-CD2 3.39Å; F429-F433 HydrophobicContact CE2-CD2 3.39Å; F429-F433 AromaticContact CE2-CE2 3.83Å; F429-F433 HydrophobicContact CE2-CE2 3.83Å; F429-F433 HydrophobicContact CE2-CG 4.12Å; F429-F433 HydrophobicContact CG-CD2 4.03Å; F429-F433 HydrophobicContact CZ-CB 4.43Å; F429-F433 HydrophobicContact CZ-CD2 4.15Å; F429-F433 WeakPolarHBondContact O-CB 3.15Å; F429-F433 VanDerWaalsContact O-CD2 3.3Å; F429-F433 WeakPolarHBondContact O-CD2 3.47Å; F429-F433 PolarHBondContact O-N 2.68Å; Y430-F433 PolarHBondContact O-N 3.15Å; Y430-F433 VanDerWaalsContact O-N 3.11Å; F433-D435 PolarHBondContact O-N 3.24Å; F433-R436 PolarHBondContact O-N 3.19Å; F433-F437 HydrophobicContact CB-CD2 3.92Å; F433-F437 HydrophobicContact CB-CE2 4.48Å; F433-F437 AromaticContact CD1-CD2 3.8Å; F433-F437 HydrophobicContact CD1-CD2 3.8Å; F433-F437 AromaticContact CD1-CE2 3.54Å; F433-F437 HydrophobicContact CD1-CE2 3.54Å; F433-F437 HydrophobicContact CE1-CE2 4.09Å; F433-F437 HydrophobicContact CG-CD2 4.19Å; F433-F437 HydrophobicContact CG-CE2 4.26Å; F433-F437 PolarHBondContact O-N 2.76Å; F433-L439 HydrophobicContact CB-CD1 4.14Å
434	H	80.2	Confident	77.7	Confident	49 Å²	49	70.2 Å²	70.2	23%	0.227	35%	0.349	C	S	.	.	H	α-helix	trans	-54.8	-51.8	179.6	70.4	-57.1	0	0	0	112.7	Y430 N431 T438 L439 D440	Y430-H434 HydrophobicContact CD2-CB 4.02Å; Y430-H434 HydrophobicContact CE2-CB 3.73Å; Y430-H434 VanDerWaalsContact O-CB 3.26Å; Y430-H434 WeakPolarHBondContact O-CB 3.43Å; Y430-H434 PolarHBondContact O-N 3.09Å; Y430-H434 PolarHBondContact O-ND1 3.24Å; N431-H434 PolarHBondContact O-CE1 3.49Å; N431-H434 VanDerWaalsContact O-CE1 3.27Å; N431-H434 PolarHBondContact O-ND1 3.07Å; H434-T438 VanDerWaalsContact O-CA 3.3Å; H434-T438 WeakPolarHBondContact O-CA 3.3Å; H434-T438 PolarHBondContact O-N 2.67Å; H434-L439 HydrophobicContact CB-CB 4.4Å; H434-L439 PolarHBondContact O-N 2.96Å; H434-D440 IonicContact CD2-OD2 3.78Å
435	D	72	Confident	76	Confident	125 Å²	125	72.5 Å²	72.5	67%	0.668	36%	0.363	S	S	*	.	H	α-helix	trans	-57.5	-51.2	173.6	-65	-44.7	0	0	0	112.8	F433 F437	F433-D435 PolarHBondContact O-N 3.24Å; D435-F437 PolarHBondContact O-N 3.42Å
436	R	70.4	Confident	73.7	Confident	173 Å²	173	74.5 Å²	74.5	65%	0.653	38%	0.381	S	S	*	.	H	α-helix	trans	-71.6	-32.1	-168.9	-79.1	-173.9	-77.3	-172.1	-7.7	114.2	T432 F433	T432-R436 VanDerWaalsContact CG2-NH2 3.25Å; T432-R436 PolarHBondContact O-NE 3.23Å; T432-R436 PolarHBondContact O-NH2 3.13Å; F433-R436 PolarHBondContact O-N 3.19Å
437	F	63.5	Low	71.4	Confident	121 Å²	121	78.8 Å²	78.8	53%	0.531	42%	0.416	S	S	.	.	H	α-helix	trans	-109.1	6.9	-178.9	-72.2	-83.7	0	0	0	113	F433 D435 L439	F433-F437 HydrophobicContact CB-CD2 3.92Å; F433-F437 HydrophobicContact CB-CE2 4.48Å; F433-F437 AromaticContact CD1-CD2 3.8Å; F433-F437 HydrophobicContact CD1-CD2 3.8Å; F433-F437 AromaticContact CD1-CE2 3.54Å; F433-F437 HydrophobicContact CD1-CE2 3.54Å; F433-F437 HydrophobicContact CE1-CE2 4.09Å; F433-F437 HydrophobicContact CG-CD2 4.19Å; F433-F437 HydrophobicContact CG-CE2 4.26Å; F433-F437 PolarHBondContact O-N 2.76Å; D435-F437 PolarHBondContact O-N 3.42Å; F437-L439 HydrophobicContact CB-CD2 3.65Å; F437-L439 HydrophobicContact CB-CG 4.04Å; F437-L439 PolarHBondContact O-N 3.49Å
438	T	68.6	Low	69	Low	88 Å²	88	84 Å²	84	54%	0.54	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	43.8	-173.5	61.1	0	0	0	0	111.7	H434 D440 S441 I442	H434-T438 VanDerWaalsContact O-CA 3.3Å; H434-T438 WeakPolarHBondContact O-CA 3.3Å; H434-T438 PolarHBondContact O-N 2.67Å; T438-D440 PolarHBondContact O-N 2.84Å; T438-D440 VanDerWaalsContact O-N 3.15Å; T438-S441 WeakPolarHBondContact O-CA 3.34Å; T438-S441 VanDerWaalsContact O-CB 3.22Å; T438-S441 WeakPolarHBondContact O-CB 3.26Å; T438-S441 PolarHBondContact O-N 3.28Å; T438-I442 PolarHBondContact O-N 3.2Å
439	L	69.4	Low	66.7	Low	2 Å²	2	82.5 Å²	82.5	1%	0.01	44%	0.441	C	S	.	.	H	α-helix	trans	-58	-34.1	-174.1	-60.4	-178.1	0	0	0	111	L401 M404 F429 Y430 F433 H434 F437 S441 I442 M443	L401-L439 HydrophobicContact CD2-CD2 3.43Å; L401-L439 VanDerWaalsContact CD2-CD2 3.43Å; M404-L439 HydrophobicContact SD-CD1 4.31Å; F429-L439 HydrophobicContact CE1-CD1 4.13Å; Y430-L439 HydrophobicContact CD2-CB 4.41Å; Y430-L439 HydrophobicContact CD2-CD1 4.1Å; Y430-L439 HydrophobicContact CE2-CB 4.28Å; F433-L439 HydrophobicContact CB-CD1 4.14Å; H434-L439 HydrophobicContact CB-CB 4.4Å; H434-L439 PolarHBondContact O-N 2.96Å; F437-L439 HydrophobicContact CB-CD2 3.65Å; F437-L439 HydrophobicContact CB-CG 4.04Å; F437-L439 PolarHBondContact O-N 3.49Å; L439-S441 PolarHBondContact O-N 2.89Å; L439-I442 HydrophobicContact CD2-CD1 4.32Å; L439-I442 CarbonylContact O-C 3.55Å; L439-I442 WeakPolarHBondContact O-CA 3.47Å; L439-I442 WeakPolarHBondContact O-CB 3.43Å; L439-I442 PolarHBondContact O-N 3.38Å; L439-M443 HydrophobicContact CB-SD 4.06Å; L439-M443 WeakPolarHBondContact O-CB 3.22Å; L439-M443 VanDerWaalsContact O-CG 3.25Å; L439-M443 WeakPolarHBondContact O-CG 3.23Å; L439-M443 PolarHBondContact O-N 3.11Å
440	D	68	Low	64.5	Low	73 Å²	73	88.5 Å²	88.5	39%	0.39	47%	0.474	S	S	.	.	H	α-helix	trans	-60.6	-26.6	174.8	-56	-32.5	0	0	0	113.5	Y430 H434 T438 K444	Y430-D440 WeakPolarHBondContact CE2-OD1 3.49Å; Y430-D440 PolarHBondContact OH-OD1 3.18Å; H434-D440 IonicContact CD2-OD2 3.78Å; T438-D440 PolarHBondContact O-N 2.84Å; T438-D440 VanDerWaalsContact O-N 3.15Å; D440-K444 PolarHBondContact O-N 3.03Å
441	S	64.6	Low	62	Low	71 Å²	71	95 Å²	95	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-77.8	-35	173.8	-156.3	0	0	0	0	111.8	T438 L439	T438-S441 WeakPolarHBondContact O-CA 3.34Å; T438-S441 VanDerWaalsContact O-CB 3.22Å; T438-S441 WeakPolarHBondContact O-CB 3.26Å; T438-S441 PolarHBondContact O-N 3.28Å; L439-S441 PolarHBondContact O-N 2.89Å
442	I	62.5	Low	59.6	Low	69 Å²	69	99.7 Å²	99.7	35%	0.354	53%	0.526	S	S	.	.	H	α-helix	trans	-74.4	-32	175	-56.9	175.3	0	0	0	111.1	K405 T438 L439 K444	K405-I442 HydrophobicContact CB-CG2 4.1Å; K405-I442 HydrophobicContact CG-CG2 4.38Å; T438-I442 PolarHBondContact O-N 3.2Å; L439-I442 HydrophobicContact CD2-CD1 4.32Å; L439-I442 CarbonylContact O-C 3.55Å; L439-I442 WeakPolarHBondContact O-CA 3.47Å; L439-I442 WeakPolarHBondContact O-CB 3.43Å; L439-I442 PolarHBondContact O-N 3.38Å; I442-K444 VanDerWaalsContact C-N 3.31Å
443	M	62.2	Low	57.2	Low	21 Å²	21	103.6 Å²	103.6	10%	0.103	54%	0.544	C	S	.	.	S	Bend	trans	-83.1	-2	179.4	-71.4	162.4	57.7	0	0	113.6	M404 Q409 Y430 L439 P445	M404-M443 HydrophobicContact CB-CG 4.01Å; M404-M443 HydrophobicContact CB-SD 4.25Å; M404-M443 HydrophobicContact CG-SD 4.46Å; M404-M443 HydrophobicContact SD-SD 4.41Å; Q409-M443 HydrophobicContact CB-CE 4.45Å; Q409-M443 HydrophobicContact CG-CE 3.35Å; Y430-M443 HydrophobicContact CD2-CE 4.19Å; Y430-M443 HydrophobicContact CD2-SD 3.93Å; Y430-M443 HydrophobicContact CE2-CE 3.5Å; Y430-M443 HydrophobicContact CE2-SD 3.43Å; Y430-M443 WeakPolarHBondContact CE2-SD 3.23Å; L439-M443 HydrophobicContact CB-SD 4.06Å; L439-M443 WeakPolarHBondContact O-CB 3.22Å; L439-M443 VanDerWaalsContact O-CG 3.25Å; L439-M443 WeakPolarHBondContact O-CG 3.23Å; L439-M443 PolarHBondContact O-N 3.11Å; M443-P445 VanDerWaalsContact O-CD 3.29Å; M443-P445 WeakPolarHBondContact O-CD 3.44Å
444	K	56.9	Low	54.9	Low	150 Å²	150	107.1 Å²	107.1	65%	0.652	57%	0.57	S	S	*	*	S	Bend	trans	-56.5	114.5	164.1	-78.9	177.8	179.4	171	0	107.9	D440 I442 C446	D440-K444 PolarHBondContact O-N 3.03Å; I442-K444 VanDerWaalsContact C-N 3.31Å; K444-C446 PolarHBondContact O-N 3.19Å
445	P	55.4	Low	52.5	Low	104 Å²	104	112.3 Å²	112.3	68%	0.675	59%	0.594	S	S	*	*			trans	-60.8	139.4	-174.9	24.3	-33.3	0	0	0	108.8	M443 A447	M443-P445 VanDerWaalsContact O-CD 3.29Å; M443-P445 WeakPolarHBondContact O-CD 3.44Å; P445-A447 HydrophobicContact CB-CB 4.42Å; P445-A447 HydrophobicContact CG-CB 4.37Å; P445-A447 PolarHBondContact O-N 2.8Å
446	C	45	Very low	50.7	Low	85 Å²	85	111 Å²	111	57%	0.574	59%	0.592	S	S	*	*			trans	-73.5	65.3	164.9	-156.2	0	0	0	0	108.9	K444 K448 A449	K444-C446 PolarHBondContact O-N 3.19Å; C446-K448 PolarHBondContact O-N 3.46Å; C446-A449 HydrophobicContact CB-CB 4.27Å; C446-A449 PolarHBondContact O-N 3.05Å; C446-A449 VanDerWaalsContact O-N 3.09Å; C446-A449 VanDerWaalsContact SG-CB 3.5Å
447	A	43.9	Very low	49	Very low	89 Å²	89	107.4 Å²	107.4	74%	0.736	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	21.3	-178	0	0	0	0	0	113.4	P445	P445-A447 HydrophobicContact CB-CB 4.42Å; P445-A447 HydrophobicContact CG-CB 4.37Å; P445-A447 PolarHBondContact O-N 2.8Å
448	K	43.2	Very low	47.4	Very low	202 Å²	202	106 Å²	106	88%	0.878	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.6	3.5	-179.8	-61.9	-169.9	176.9	-174.8	0	113.2	C446	C446-K448 PolarHBondContact O-N 3.46Å
449	A	42.2	Very low	46	Very low	54 Å²	54	107.9 Å²	107.9	45%	0.446	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.7	-20.5	-175.8	0	0	0	0	0	115.7	C446 D451	C446-A449 HydrophobicContact CB-CB 4.27Å; C446-A449 PolarHBondContact O-N 3.05Å; C446-A449 VanDerWaalsContact O-N 3.09Å; C446-A449 VanDerWaalsContact SG-CB 3.5Å; A449-D451 VanDerWaalsContact C-N 3.31Å; A449-D451 PolarHBondContact O-N 3.27Å
450	N	41.9	Very low	44.3	Very low	142 Å²	142	112.4 Å²	112.4	76%	0.759	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-0.5	178.6	-73.3	-11.3	0	0	0	114	K452	N450-K452 VanDerWaalsContact C-N 3.32Å; N450-K452 PolarHBondContact O-N 3.04Å
451	D	38	Very low	42.6	Very low	156 Å²	156	120.8 Å²	120.8	83%	0.834	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	3.8	-176.7	-130.9	23.5	0	0	0	113.7	A449	A449-D451 VanDerWaalsContact C-N 3.31Å; A449-D451 PolarHBondContact O-N 3.27Å
452	K	35.4	Very low	41.1	Very low	192 Å²	192	123.9 Å²	123.9	84%	0.835	66%	0.663	S	S	*	*	S	Bend	trans	-141.4	12	-175.1	-67.2	-162.2	175.2	-166.9	0	116.1	N450	N450-K452 VanDerWaalsContact C-N 3.32Å; N450-K452 PolarHBondContact O-N 3.04Å
453	L	35.1	Very low	39.4	Very low	154 Å²	154	126.1 Å²	126.1	81%	0.806	68%	0.682	S	S	*	*	S	Bend	trans	-147.7	46.5	178.2	-154	74.2	0	0	0	114.8
454	T	33.9	Very low	38	Very low	130 Å²	130	130.1 Å²	130.1	80%	0.798	70%	0.702	S	S	*	*			trans	-165.3	76.5	142.7	-64.1	0	0	0	0	106.7	P456	T454-P456 WeakPolarHBondContact O-CD 3.3Å
455	E	29.9	Very low	36.7	Very low	158 Å²	158	133.8 Å²	133.8	74%	0.738	71%	0.713	S	S	*	*			trans	-75.9	107	157.7	-88.6	-92.4	142.5	0	0	106.8
456	P	34.8	Very low	35.6	Very low	96 Å²	96	136.8 Å²	136.8	62%	0.623	72%	0.719	S	S	*	*			trans	-61.1	139.1	140.4	32.1	-31.3	0	0	0	105.9	T454 A458	T454-P456 WeakPolarHBondContact O-CD 3.3Å; P456-A458 PolarHBondContact O-N 3.23Å
457	P	33.9	Very low	35.1	Very low	99 Å²	99	141.9 Å²	141.9	64%	0.643	73%	0.731	S	S	*	*			trans	-54.5	134.2	-176.9	24	-34.2	0	0	0	109.5	I459	P457-I459 PolarHBondContact O-N 2.98Å
458	A	30.5	Very low	34.7	Very low	91 Å²	91	143.2 Å²	143.2	75%	0.752	73%	0.732	S	S	*	*			trans	-59.8	85.3	175.7	0	0	0	0	0	111	P456 D460	P456-A458 PolarHBondContact O-N 3.23Å; A458-D460 PolarHBondContact O-N 3.45Å
459	I	39.6	Very low	34.2	Very low	127 Å²	127	141 Å²	141	65%	0.651	73%	0.729	S	S	*	*			trans	-75.4	98.4	173	-64.2	170.7	0	0	0	106.8	P457 R461 I464	P457-I459 PolarHBondContact O-N 2.98Å; I459-R461 PolarHBondContact O-N 2.56Å; I459-I464 HydrophobicContact CG2-CD1 4.31Å
460	D	33	Very low	33.9	Very low	98 Å²	98	143.8 Å²	143.8	52%	0.524	74%	0.74	S	S	.	*			trans	-32.8	118.1	162.8	179	16.7	0	0	0	110.8	A458 K462	A458-D460 PolarHBondContact O-N 3.45Å; D460-K462 PolarHBondContact O-N 2.96Å; D460-K462 IonicContact OD1-NZ 3.9Å; D460-K462 IonicContact OD2-NZ 2.68Å; D460-K462 PolarHBondContact OD2-NZ 3.21Å
461	R	32.4	Very low	33.5	Very low	249 Å²	249	142.5 Å²	142.5	94%	0.94	74%	0.737	S	S	*	*			trans	-75.2	58.4	-176.4	-73.5	-175.2	175.6	176.8	-0.7	111.6	I459	I459-R461 PolarHBondContact O-N 2.56Å
462	K	34.3	Very low	33.1	Very low	136 Å²	136	143.1 Å²	143.1	59%	0.591	73%	0.733	S	S	*	*	S	Bend	trans	-89.6	146.1	156.5	-65.6	-173.8	175.8	87	0	108.3	D460 I464	D460-K462 PolarHBondContact O-N 2.96Å; D460-K462 IonicContact OD1-NZ 3.9Å; D460-K462 IonicContact OD2-NZ 2.68Å; D460-K462 PolarHBondContact OD2-NZ 3.21Å; K462-I464 VanDerWaalsContact C-N 3.33Å; K462-I464 PolarHBondContact O-N 2.84Å
463	P	26.9	Very low	33.2	Very low	116 Å²	116	139.8 Å²	139.8	75%	0.753	73%	0.729	S	S	*	*			trans	-72	89.2	176.9	29.8	-33.7	0	0	0	109.5	Y465	P463-Y465 VanDerWaalsContact C-N 3.31Å; P463-Y465 PolarHBondContact O-N 3.15Å
464	I	32.6	Very low	33.1	Very low	105 Å²	105	139.7 Å²	139.7	54%	0.538	72%	0.724	S	S	.	*			trans	-71.4	91.2	176.3	-58.9	-179.8	0	0	0	108.6	I459 K462 Q466	I459-I464 HydrophobicContact CG2-CD1 4.31Å; K462-I464 VanDerWaalsContact C-N 3.33Å; K462-I464 PolarHBondContact O-N 2.84Å; I464-Q466 HydrophobicContact CG2-CB 3.96Å; I464-Q466 HydrophobicContact CG2-CG 3.73Å; I464-Q466 PolarHBondContact O-N 3.37Å
465	Y	29.4	Very low	32.9	Very low	226 Å²	226	140.8 Å²	140.8	89%	0.886	73%	0.725	S	S	*	*			trans	-60	85.7	155.9	-92.2	-97	0	0	0	108.9	P463	P463-Y465 VanDerWaalsContact C-N 3.31Å; P463-Y465 PolarHBondContact O-N 3.15Å
466	Q	32	Very low	33	Very low	168 Å²	168	139.9 Å²	139.9	79%	0.785	73%	0.725	S	S	*	*			trans	-95.8	103.4	169.5	-110.7	170.4	-16	0	0	110.5	I464	I464-Q466 HydrophobicContact CG2-CB 3.96Å; I464-Q466 HydrophobicContact CG2-CG 3.73Å; I464-Q466 PolarHBondContact O-N 3.37Å
467	K	34	Very low	32.7	Very low	192 Å²	192	141.5 Å²	141.5	84%	0.835	73%	0.733	S	S	*	*			trans	-49.7	130.2	168.4	-155.9	176.1	-171.1	179.5	0	108.9	L469	K467-L469 PolarHBondContact O-N 3.08Å; K467-L469 VanDerWaalsContact O-N 3.07Å
468	P	36.3	Very low	32.8	Very low	116 Å²	116	145.4 Å²	145.4	75%	0.753	74%	0.74	S	S	*	*			trans	-62.5	116.6	173.4	-14.8	27.3	0	0	0	108.5	V470	P468-V470 PolarHBondContact O-N 3.23Å; P468-V470 VanDerWaalsContact O-N 3.16Å
469	L	33	Very low	32.7	Very low	155 Å²	155	148.5 Å²	148.5	81%	0.812	74%	0.744	S	S	*	*			trans	-68.8	110.5	168.4	-172.3	80	0	0	0	107	K467 V471	K467-L469 PolarHBondContact O-N 3.08Å; K467-L469 VanDerWaalsContact O-N 3.07Å; L469-V471 PolarHBondContact O-N 3.24Å
470	V	35.5	Very low	32.4	Very low	113 Å²	113	150.8 Å²	150.8	69%	0.685	76%	0.756	S	S	*	*			trans	-66.3	106.4	170.3	176.4	0	0	0	0	107.2	P468 F472	P468-V470 PolarHBondContact O-N 3.23Å; P468-V470 VanDerWaalsContact O-N 3.16Å; V470-F472 HydrophobicContact CG1-CD2 4.31Å; V470-F472 PolarHBondContact O-N 3.15Å
471	V	33.8	Very low	32.4	Very low	116 Å²	116	151.7 Å²	151.7	70%	0.703	77%	0.766	S	S	*	*			trans	-70.8	100.1	167.8	177.6	0	0	0	0	107	L469 T473	L469-V471 PolarHBondContact O-N 3.24Å; V471-T473 PolarHBondContact O-N 3.17Å; V471-T473 VanDerWaalsContact O-N 3.14Å
472	F	30	Very low	32.3	Very low	169 Å²	169	146.3 Å²	146.3	74%	0.741	76%	0.756	S	S	*	*			trans	-65.3	106.6	170.4	-115.1	-89.3	0	0	0	108.7	V470 Q474	V470-F472 HydrophobicContact CG1-CD2 4.31Å; V470-F472 PolarHBondContact O-N 3.15Å; F472-Q474 HydrophobicContact CD1-CG 4.2Å; F472-Q474 PolarHBondContact O-N 3.5Å
473	T	35.5	Very low	32.4	Very low	122 Å²	122	147.9 Å²	147.9	75%	0.748	77%	0.765	S	S	*	*			trans	-76.9	93.2	158.4	49.7	0	0	0	0	107.5	V471 D475	V471-T473 PolarHBondContact O-N 3.17Å; V471-T473 VanDerWaalsContact O-N 3.14Å; T473-D475 PolarHBondContact O-N 2.89Å
474	Q	33.6	Very low	32.5	Very low	152 Å²	152	148.3 Å²	148.3	71%	0.71	77%	0.766	S	S	*	*			trans	-73.9	119.9	166.2	-83.5	-175	-25.4	0	0	109.2	F472 L476	F472-Q474 HydrophobicContact CD1-CG 4.2Å; F472-Q474 PolarHBondContact O-N 3.5Å; Q474-L476 PolarHBondContact O-N 3.33Å
475	D	29	Very low	32.5	Very low	153 Å²	153	149 Å²	149	82%	0.818	78%	0.777	S	S	*	*			trans	-62.4	116.9	164.5	-71.3	-47	0	0	0	109.6	T473	T473-D475 PolarHBondContact O-N 2.89Å
476	L	32.1	Very low	32.5	Very low	138 Å²	138	142.8 Å²	142.8	72%	0.723	77%	0.772	S	S	*	*			trans	-119.4	79.7	172	-97.8	163.9	0	0	0	109.8	Q474 K478	Q474-L476 PolarHBondContact O-N 3.33Å; L476-K478 PolarHBondContact O-N 2.81Å; L476-K478 VanDerWaalsContact O-N 3.12Å
477	T	29.4	Very low	32.7	Very low	130 Å²	130	142.8 Å²	142.8	80%	0.798	78%	0.776	S	S	*	*			trans	-75.2	86.9	171.2	40.7	0	0	0	0	111.1
478	K	36.4	Very low	32.3	Very low	182 Å²	182	139 Å²	139	79%	0.791	77%	0.774	S	S	*	*			trans	-139.3	107.2	165.9	-68.6	-168.4	-179.4	178.9	0	112.9	L476	L476-K478 PolarHBondContact O-N 2.81Å; L476-K478 VanDerWaalsContact O-N 3.12Å
479	N	28.8	Very low	32.6	Very low	155 Å²	155	139.9 Å²	139.9	83%	0.829	78%	0.776	S	S	*	*			trans	-10.5	130.5	157.9	-46.5	-21.8	0	0	0	116.8
480	L	33	Very low	32.7	Very low	176 Å²	176	139.6 Å²	139.6	92%	0.921	78%	0.776	S	S	*	*			trans	-147.9	141.4	134.2	-138.2	71.7	0	0	0	110
481	T	33.3	Very low	32.8	Very low	117 Å²	117	137.4 Å²	137.4	72%	0.718	78%	0.776	S	S	*	*			trans	-91.5	161.5	-170.6	33.1	0	0	0	0	113.6
482	D	30.3	Very low	32.9	Very low	136 Å²	136	140.6 Å²	140.6	73%	0.727	78%	0.78	S	S	*	*			trans	44.8	122.8	153.5	-59.3	-40.1	0	0	0	120.2
483	E	35.3	Very low	33.1	Very low	169 Å²	169	138.5 Å²	138.5	79%	0.79	78%	0.777	S	S	*	*				-178.7	147.9	97.3	-93.6	-58.3	154.5	0	0	110.4
484	T	28.4	Very low	33.1	Very low	125 Å²	125	140.3 Å²	140.3	77%	0.767	78%	0.777	S	S	*	*			trans	-120.2	140.1	178.1	-54.9	0	0	0	0	109.7
485	P	34.6	Very low	33	Very low	120 Å²	120	141.6 Å²	141.6	78%	0.779	78%	0.783	S	S	*	*			trans	-132.6	133.9	148.1	32.9	-19.4	0	0	0	113.5
486	A	27.9	Very low	33.4	Very low	94 Å²	94	142.4 Å²	142.4	78%	0.777	79%	0.787	S	S	*	*			trans	-87.5	150.4	166.5	0	0	0	0	0	110.8
487	I	36.3	Very low	33.5	Very low	169 Å²	169	140.6 Å²	140.6	87%	0.867	79%	0.786	S	S	*	*			trans	-132	135.2	164.4	-61.6	-179.4	0	0	0	107.8
488	S	26.8	Very low	33.9	Very low	113 Å²	113	140.7 Å²	140.7	79%	0.79	79%	0.786	S	S	*	*			trans	-143.2	124.3	-174.3	-177.8	0	0	0	0	110.9
489	V	42	Very low	33.8	Very low	133 Å²	133	139.6 Å²	139.6	81%	0.806	78%	0.784	S	S	*	*			trans	-157.7	102.4	165.3	-170.6	0	0	0	0	104.5
490	D	34.5	Very low	34.1	Very low	150 Å²	150	138.9 Å²	138.9	80%	0.802	78%	0.778	S	S	*	*				66.4	134.3	72.8	-159.7	19.1	0	0	0	115.1
491	G	37.6	Very low	34.3	Very low	67 Å²	67	135.1 Å²	135.1	69%	0.691	77%	0.765	S	S	*	*			trans	143.3	72.1	178.6	0	0	0	0	0	118.3
492	K	35.3	Very low	34.1	Very low	182 Å²	182	135.4 Å²	135.4	79%	0.791	76%	0.758	S	S	*	*			trans	-0.7	138.7	142.6	-67.4	167	-177.3	170.8	0	116.5
493	N	34.5	Very low	34.4	Very low	125 Å²	125	136 Å²	136	67%	0.668	77%	0.766	S	S	*	*			cis	-172.4	-168.5	35.1	-119.8	15.2	0	0	0	108.2
494	E	36	Very low	34.2	Very low	161 Å²	161	136.3 Å²	136.3	75%	0.752	76%	0.76	S	S	*	*			cis	-142.5	-115.9	3.4	-149.5	134	162.6	0	0	111.7
495	Q	32.1	Very low	34.5	Very low	179 Å²	179	136.8 Å²	136.8	84%	0.836	76%	0.758	S	S	*	*			trans	-147.6	152.9	-178.9	-64.3	172.8	-49	0	0	112.6
496	D	37.9	Very low	34.6	Very low	169 Å²	169	137.1 Å²	137.1	90%	0.904	75%	0.752	S	S	*	*				-160	156.3	126.3	-126	-27.6	0	0	0	113.5
497	S	32.9	Very low	35	Very low	100 Å²	100	137.6 Å²	137.6	70%	0.699	75%	0.745	S	S	*	*			trans	-116	164.9	-165.7	-74.1	0	0	0	0	115.6
498	V	38.4	Very low	34.9	Very low	133 Å²	133	137.1 Å²	137.1	81%	0.806	74%	0.739	S	S	*	*			trans	161.6	102.8	145.3	156.4	0	0	0	0	107.2
499	Q	34.6	Very low	35.3	Very low	159 Å²	159	138.6 Å²	138.6	74%	0.743	74%	0.737	S	S	*	*				58.7	134	74.9	-67.4	-157.7	17	0	0	113.6
500	I	34.4	Very low	34.6	Very low	139 Å²	139	138.4 Å²	138.4	71%	0.713	73%	0.732	S	S	*	*			cis	165.4	166.6	3.7	-116	167.9	0	0	0	104.3
501	P	36.9	Very low	34.6	Very low	97 Å²	97	140.1 Å²	140.1	63%	0.63	74%	0.737	S	S	*	*			cis	-143	-172.5	-27.3	44.9	-26.1	0	0	0	116.1
502	E	30.4	Very low	34.2	Very low	124 Å²	124	146 Å²	146	58%	0.579	74%	0.744	S	S	*	*			trans	46.6	124.7	141.9	-75.2	-172.3	131.9	0	0	125	R504	E502-R504 VanDerWaalsContact CD-NH2 3.33Å; E502-R504 IonicContact OE1-CZ 3.57Å; E502-R504 IonicContact OE1-NE 3.35Å; E502-R504 PolarHBondContact OE1-NE 3.27Å; E502-R504 IonicContact OE1-NH2 3.18Å; E502-R504 PolarHBondContact OE1-NH2 2.93Å; E502-R504 IonicContact OE2-NH2 3.45Å; E502-R504 PolarHBondContact OE2-NH2 3.47Å
503	V	35.2	Very low	34.2	Very low	149 Å²	149	143.5 Å²	143.5	90%	0.903	74%	0.744	S	S	*	*				-136.2	146.3	113.7	-178.6	0	0	0	0	108.7
504	R	32.1	Very low	34.1	Very low	175 Å²	175	145.5 Å²	145.5	66%	0.66	75%	0.749	S	S	*	*			trans	-86.9	160.8	-174.4	-57.6	169	-173.8	153	6	110.6	E502	E502-R504 VanDerWaalsContact CD-NH2 3.33Å; E502-R504 IonicContact OE1-CZ 3.57Å; E502-R504 IonicContact OE1-NE 3.35Å; E502-R504 PolarHBondContact OE1-NE 3.27Å; E502-R504 IonicContact OE1-NH2 3.18Å; E502-R504 PolarHBondContact OE1-NH2 2.93Å; E502-R504 IonicContact OE2-NH2 3.45Å; E502-R504 PolarHBondContact OE2-NH2 3.47Å
505	D	34.7	Very low	34	Very low	135 Å²	135	142.6 Å²	142.6	72%	0.722	75%	0.747	S	S	*	*				-175.1	138.9	85	-99.2	-16.9	0	0	0	116.3
506	I	35.2	Very low	34.2	Very low	126 Å²	126	141.4 Å²	141.4	65%	0.646	75%	0.746	S	S	*	*				82.4	95.7	128.7	-65.4	170.9	0	0	0	122.1
507	T	37.2	Very low	34.1	Very low	104 Å²	104	141.2 Å²	141.2	64%	0.638	74%	0.74	S	S	*	*			trans	72.3	149.7	132.3	69	0	0	0	0	122.1
508	H	34.8	Very low	34.3	Very low	159 Å²	159	143 Å²	143	74%	0.736	74%	0.741	S	S	*	*			cis	-158.1	139.2	-14.5	-102	-45	0	0	0	110.9
509	L	34.1	Very low	34.2	Very low	145 Å²	145	144.3 Å²	144.3	76%	0.759	74%	0.743	S	S	*	*			trans	19.6	124.5	143.5	-58.2	162.5	0	0	0	119.7
510	N	27.4	Very low	34.1	Very low	128 Å²	128	147.1 Å²	147.1	68%	0.684	75%	0.747	S	S	*	*				73.9	113.5	56.5	-168.2	34.8	0	0	0	115.6
511	M	34.8	Very low	33.8	Very low	187 Å²	187	145.2 Å²	145.2	92%	0.921	75%	0.746	S	S	*	*			trans	-154.8	142.9	153.1	-85	-52.7	166.5	0	0	110.6
512	K	29	Very low	33.5	Very low	191 Å²	191	147.4 Å²	147.4	83%	0.83	76%	0.758	S	S	*	*			trans	-154.2	110.2	-170.4	-179.1	-178.9	-179.3	-178.5	0	112
513	T	34.7	Very low	33.5	Very low	128 Å²	128	146.5 Å²	146.5	79%	0.785	77%	0.765	S	S	*	*			trans	-171.6	153.9	172.8	2.6	0	0	0	0	105.8
514	E	33.6	Very low	33.2	Very low	167 Å²	167	148.7 Å²	148.7	78%	0.78	77%	0.766	S	S	*	*			cis	-163.8	123.5	11.1	-153.2	159.2	-165.1	0	0	104.3
515	S	33.7	Very low	33.3	Very low	101 Å²	101	144.9 Å²	144.9	71%	0.706	77%	0.772	S	S	*	*				58.2	114	89	-70	0	0	0	0	117.2
516	D	36.1	Very low	33.1	Very low	154 Å²	154	146.6 Å²	146.6	82%	0.824	78%	0.78	S	S	*	*			trans	58.2	157.2	154	-48	-43.4	0	0	0	118.5
517	E	35.8	Very low	33	Very low	165 Å²	165	143.9 Å²	143.9	77%	0.771	78%	0.783	S	S	*	*			cis	-143.9	163.4	22.6	-87.3	-173.1	113.2	0	0	113.3
518	L	36.4	Very low	32.8	Very low	137 Å²	137	147.8 Å²	147.8	72%	0.717	79%	0.792	S	S	*	*			trans	38.3	129.6	140.1	-55.5	169.9	0	0	0	119.8
519	D	37.7	Very low	32.7	Very low	161 Å²	161	149.4 Å²	149.4	86%	0.861	80%	0.799	S	S	*	*				-155.8	162.6	71.2	-137	-19.7	0	0	0	115.3
520	R	31.4	Very low	32.4	Very low	218 Å²	218	145.8 Å²	145.8	82%	0.823	80%	0.797	S	S	*	*			trans	-127.3	157.6	-162.9	-139.4	-175.3	-162.3	-158.1	7.3	112.7
521	S	29.5	Very low	32.7	Very low	99 Å²	99	149.1 Å²	149.1	69%	0.692	81%	0.808	S	S	*	*			trans	74.8	121	155.4	-47.8	0	0	0	0	119.5
522	T	30.7	Very low	32.4	Very low	142 Å²	142	149.7 Å²	149.7	87%	0.871	81%	0.806	S	S	*	*				-157.1	133.7	121.8	-73	0	0	0	0	108.5
523	S	30.4	Very low	32.8	Very low	106 Å²	106	148.1 Å²	148.1	74%	0.741	80%	0.804	S	S	*	*			trans	-138.9	157.4	178.3	-56.5	0	0	0	0	109.8
524	Q	29	Very low	32.5	Very low	194 Å²	194	148.3 Å²	148.3	91%	0.907	80%	0.801	S	S	*	*			trans	72	109.4	166	-59.9	-178.4	-17.8	0	0	119.8
525	A	33.5	Very low	32.6	Very low	96 Å²	96	148.1 Å²	148.1	79%	0.793	81%	0.805	S	S	*	*				-163.7	109	126.5	0	0	0	0	0	107.5
526	L	31.1	Very low	32.4	Very low	170 Å²	170	148.5 Å²	148.5	89%	0.89	81%	0.808	S	S	*	*				71.4	115.9	78.1	-94	167.3	0	0	0	116.2
527	G	32.4	Very low	32.3	Very low	70 Å²	70	148.1 Å²	148.1	72%	0.722	81%	0.811	S	S	*	*			trans	144.3	89.8	175.8	0	0	0	0	0	109.5
528	K	32.7	Very low	32	Very low	186 Å²	186	151.5 Å²	151.5	81%	0.809	82%	0.816	S	S	*	*				66.8	137.5	64.6	-75.4	-163.5	173.5	-175.1	0	114.6
529	H	33	Very low	31.9	Very low	192 Å²	192	153.1 Å²	153.1	89%	0.889	83%	0.825	S	S	*	*			trans	71.7	123.5	-165.4	-59.1	-87.7	0	0	0	114.1
530	G	28.6	Very low	31.6	Very low	69 Å²	69	150.5 Å²	150.5	71%	0.711	82%	0.819	S	S	*	*			cis	103.7	89.2	-12.8	0	0	0	0	0	115.6
531	E	32.3	Very low	31.7	Very low	199 Å²	199	145.1 Å²	145.1	93%	0.93	82%	0.815	S	S	*	*			trans	-162.1	153.1	142.2	-118.5	171.1	-177	0	0	111.9
532	K	29.7	Very low	31.8	Very low	199 Å²	199	150.9 Å²	150.9	87%	0.865	82%	0.822	S	S	*	*			trans	-112.8	129.4	179.5	-66.7	173.3	176.3	177.1	0	109.3
533	I	36.2	Very low	32	Very low	157 Å²	157	151.6 Å²	151.6	81%	0.805	81%	0.808	S	S	*	*			trans	-139.3	112.6	153.2	-59.5	-176	0	0	0	109.3
534	N	29.7	Very low	32.2	Very low	132 Å²	132	156.1 Å²	156.1	71%	0.706	81%	0.809	S	S	*	*			trans	-77	145.2	161	-66.5	-16.1	0	0	0	108.4
535	N	35.6	Very low	32.3	Very low	164 Å²	164	153.9 Å²	153.9	88%	0.877	81%	0.809	S	S	*	*			trans	-162.2	136.3	139.1	-99.3	-30.8	0	0	0	112.6
536	S	28.8	Very low	32.3	Very low	109 Å²	109	154.4 Å²	154.4	76%	0.762	81%	0.813	S	S	*	*			trans	-93.7	133.3	-176.2	54.7	0	0	0	0	112.5
537	V	34.8	Very low	32.2	Very low	145 Å²	145	151.8 Å²	151.8	88%	0.879	81%	0.809	S	S	*	*			trans	-136.6	136.4	151.9	-178	0	0	0	0	109.7
538	R	29.3	Very low	32.1	Very low	236 Å²	236	154.1 Å²	154.1	89%	0.891	81%	0.814	S	S	*	*			trans	-124	113.1	-170.2	177.2	-164	-157.8	170.7	9.4	108.8
539	L	33.7	Very low	32.2	Very low	172 Å²	172	154.3 Å²	154.3	90%	0.901	82%	0.815	S	S	*	*			trans	-140.8	151.4	166.5	-77.6	-178.8	0	0	0	111.3
540	S	31.1	Very low	32	Very low	105 Å²	105	155.3 Å²	155.3	73%	0.734	82%	0.817	S	S	*	*			trans	-125.1	147.8	-154.2	63.5	0	0	0	0	116.4
541	S	32.9	Very low	32.2	Very low	106 Å²	106	158.6 Å²	158.6	74%	0.741	82%	0.823	S	S	*	*			trans	50.4	113.4	133.6	-59.6	0	0	0	0	122.4
542	R	31.7	Very low	32.2	Very low	220 Å²	220	153.3 Å²	153.3	83%	0.83	81%	0.813	S	S	*	*			trans	-151.3	148.6	134.3	-83.5	-164.9	173.2	180	1.1	107.4
543	R	35.9	Very low	32.4	Very low	157 Å²	157	149.9 Å²	149.9	59%	0.592	81%	0.811	S	S	*	*			cis	-162.9	149.3	7.7	-124.2	179.2	176.7	-174.9	1.6	111.7
544	R	35.2	Very low	32.7	Very low	201 Å²	201	151.8 Å²	151.8	76%	0.758	82%	0.817	S	S	*	*			trans	66.3	113.7	144.9	-72.2	167.9	-179.8	-171.6	-6.1	121.8
545	T	29.3	Very low	32.8	Very low	147 Å²	147	151.5 Å²	151.5	90%	0.902	82%	0.82	S	S	*	*			trans	-103	156.8	146	51.2	0	0	0	0	110.4
546	A	33.6	Very low	32.6	Very low	107 Å²	107	151.8 Å²	151.8	88%	0.884	82%	0.821	S	S	*	*			trans	-119.6	143.7	167.2	0	0	0	0	0	109.5
547	S	29.2	Very low	32.9	Very low	115 Å²	115	150.8 Å²	150.8	80%	0.804	81%	0.814	S	S	*	*			trans	-107.6	143.5	-171.9	177.7	0	0	0	0	111.2
548	S	31	Very low	32.8	Very low	118 Å²	118	152.2 Å²	152.2	83%	0.825	81%	0.811	S	S	*	*			trans	-133.7	150	159.6	-167.5	0	0	0	0	109.5
549	K	35	Very low	33.1	Very low	191 Å²	191	146.7 Å²	146.7	83%	0.83	80%	0.799	S	S	*	*			trans	-99.6	145.4	-161.9	-60.8	174.2	-179.3	176.9	0	112
550	F	29.3	Very low	33.3	Very low	212 Å²	212	145.6 Å²	145.6	93%	0.93	79%	0.788	S	S	*	*			trans	-76.7	150.5	164.7	-90.2	-97.2	0	0	0	111.4
551	V	32.7	Very low	33.6	Very low	139 Å²	139	147.1 Å²	147.1	84%	0.842	79%	0.788	S	S	*	*			trans	-119.6	135.3	163.7	175	0	0	0	0	106.9
552	A	32.1	Very low	33.8	Very low	87 Å²	87	147.9 Å²	147.9	72%	0.719	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-95.2	153.9	177.8	0	0	0	0	0	111.1
553	P	32.9	Very low	33.9	Very low	127 Å²	127	144.3 Å²	144.3	83%	0.825	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-86.7	134.5	173.5	33.7	-31.2	0	0	0	111.5
554	E	43	Very low	34	Very low	198 Å²	198	141.5 Å²	141.5	93%	0.925	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-89.9	143.1	168	-74.1	-171.1	144.1	0	0	111.6
555	T	30.8	Very low	34.2	Very low	125 Å²	125	139.6 Å²	139.6	77%	0.767	78%	0.78	S	S	*	*			trans	-105.8	135.8	171.3	52.6	0	0	0	0	109.9
556	L	32.5	Very low	34.4	Very low	171 Å²	171	139.9 Å²	139.9	90%	0.895	78%	0.775	S	S	*	*			trans	158.5	152.6	159.1	-86.7	149.3	0	0	0	107.5
557	S	34.3	Very low	34.7	Very low	88 Å²	88	139.3 Å²	139.3	62%	0.615	77%	0.765	S	S	*	*			cis	-174	131.7	-32.8	50.6	0	0	0	0	109.4
558	H	33.5	Very low	35	Very low	175 Å²	175	138.9 Å²	138.9	81%	0.81	76%	0.762	S	S	*	*			trans	49.4	145.7	147.6	-90.6	-81.7	0	0	0	124.3
559	N	36.2	Very low	35.6	Very low	120 Å²	120	139 Å²	139	64%	0.642	76%	0.76	S	S	*	*			trans	84.6	143.5	156.2	-58	-15.8	0	0	0	117.8
560	H	38.1	Very low	36.2	Very low	148 Å²	148	135.3 Å²	135.3	69%	0.685	76%	0.755	S	S	*	*			cis	-157.9	142.6	-4.6	-117.6	-44.9	0	0	0	111.6
561	L	36.5	Very low	36.7	Very low	137 Å²	137	134.4 Å²	134.4	72%	0.717	75%	0.754	S	S	*	*			trans	54.9	144.5	139.9	-72.7	166.3	0	0	0	124.7
562	N	36.6	Very low	36.8	Very low	122 Å²	122	132 Å²	132	65%	0.652	74%	0.744	S	S	*	*			trans	79.1	142.3	146.5	-76.8	24.1	0	0	0	120.9
563	E	34	Very low	37.2	Very low	146 Å²	146	133.8 Å²	133.8	68%	0.682	75%	0.746	S	S	*	*			cis	-169.3	159.9	-21.9	-157	174.5	158.3	0	0	108.9
564	S	39.2	Very low	37.5	Very low	97 Å²	97	132.2 Å²	132.2	68%	0.678	74%	0.737	S	S	*	*			trans	65	148	156.1	62.7	0	0	0	0	119.9
565	Q	38.1	Very low	37.4	Very low	161 Å²	161	134.4 Å²	134.4	75%	0.752	74%	0.737	S	S	*	*			cis	-165.4	153.4	-10.3	-110.4	-177	38.2	0	0	110.6
566	L	35	Very low	37.8	Very low	153 Å²	153	131.5 Å²	131.5	80%	0.801	73%	0.732	S	S	*	*			trans	41.8	151.3	145.3	-89.2	73.8	0	0	0	122.4
567	S	38.3	Very low	38.3	Very low	96 Å²	96	135 Å²	135	67%	0.671	73%	0.734	S	S	*	*			cis	-164.6	148.2	6.6	51.7	0	0	0	0	114.9
568	S	36.8	Very low	38.5	Very low	106 Å²	106	135.1 Å²	135.1	74%	0.741	73%	0.734	S	S	*	*			trans	34.4	137.1	145.5	59.7	0	0	0	0	125.8
569	P	42.3	Very low	38.9	Very low	121 Å²	121	138.6 Å²	138.6	79%	0.786	74%	0.74	S	S	*	*			trans	-107	-147.4	163.3	45.9	-35.8	0	0	0	110.8
570	P	48.9	Very low	39	Very low	112 Å²	112	136.3 Å²	136.3	73%	0.727	75%	0.745	S	S	*	*			cis	-127.7	-178.1	-30.9	39.4	-23.9	0	0	0	113.4
571	Q	38.4	Very low	39.1	Very low	193 Å²	193	140.9 Å²	140.9	90%	0.902	76%	0.756	S	S	*	*			trans	-163.5	162.8	148.3	-116.2	173.6	39.3	0	0	117.2
572	S	36.2	Very low	39.2	Very low	90 Å²	90	138.4 Å²	138.4	63%	0.629	76%	0.756	S	S	*	*			trans	-57.8	175.7	-175.8	55.2	0	0	0	0	117.6
573	V	40.3	Very low	39.5	Very low	124 Å²	124	141.5 Å²	141.5	75%	0.752	76%	0.764	S	S	*	*			cis	-169.5	147.4	48.9	-117.4	0	0	0	0	114.5
574	S	39.5	Very low	39.8	Very low	93 Å²	93	144.6 Å²	144.6	65%	0.65	77%	0.769	S	S	*	*			trans	51.4	150.9	133.3	109.5	0	0	0	0	121.2
575	R	40.4	Very low	40	Very low	244 Å²	244	146.2 Å²	146.2	92%	0.921	77%	0.769	S	S	*	*			cis	-161.6	163.9	18.9	-95.6	147.2	179.1	179	0.3	106.1
576	G	39.5	Very low	40.4	Very low	65 Å²	65	149.2 Å²	149.2	67%	0.67	77%	0.774	S	S	*	*			cis	154.3	174.2	-1.6	0	0	0	0	0	111.6
577	R	41.6	Very low	40.6	Very low	245 Å²	245	153.5 Å²	153.5	93%	0.925	78%	0.78	S	S	*	*			trans	69.9	148.7	164.7	-63.1	-177.4	172.3	-171	-1.8	117.6
578	S	39.2	Very low	41.1	Very low	89 Å²	89	158.1 Å²	158.1	62%	0.622	81%	0.811	S	S	*	*			cis	-173.8	148.2	-10.9	-103.5	0	0	0	0	111.8
579	R	42.3	Very low	41.4	Very low	248 Å²	248	160.7 Å²	160.7	94%	0.936	82%	0.815	S	S	*	*			trans	62.9	142.3	155	-59.8	163.2	176.6	178.9	-3.9	117.1
580	G	37.5	Very low	41.3	Very low	73 Å²	73	162.8 Å²	162.8	75%	0.753	82%	0.817	S	S	*	*			cis	145.7	159.3	-4.1	0	0	0	0	0	112.8
581	R	41	Very low	40.9	Very low	243 Å²	243	165.6 Å²	165.6	92%	0.917	82%	0.822	S	S	*	*			trans	100.1	120.6	164.1	-153.1	178.6	-155.2	-174	6.8	117.9
582	A	37.6	Very low	41	Very low	86 Å²	86	164 Å²	164	71%	0.711	82%	0.817	S	S	*	*			trans	-93.4	159.2	172.2	0	0	0	0	0	113
583	K	42.8	Very low	41.3	Very low	187 Å²	187	168.6 Å²	168.6	81%	0.813	83%	0.828	S	S	*	*			trans	-176.5	132.1	137.6	-98.1	163.3	-177.3	-171.8	0	107.4
584	R	42	Very low	41.4	Very low	210 Å²	210	171.6 Å²	171.6	79%	0.792	83%	0.834	S	S	*	*			cis	109.6	113	41.2	-151.3	-165.8	-172.2	-141.1	4.7	109.2
585	L	42	Very low	41.5	Very low	131 Å²	131	177.2 Å²	177.2	69%	0.686	85%	0.847	S	S	*	*			trans	68.8	156.6	161.7	-59.7	152.2	0	0	0	115.8
586	R	45.9	Very low	41.6	Very low	224 Å²	224	172.1 Å²	172.1	85%	0.845	84%	0.841	S	S	*	*			cis	-153.3	167.1	9	-143	167	-171.2	-164.3	2.1	111.4
587	R	40.9	Very low	41.8	Very low	244 Å²	244	181 Å²	181	92%	0.921	86%	0.855	S	S	*	*			trans	-40.1	139.2	170.9	-63.9	171	169.8	173.3	-6.5	115.5
588	S	48.9	Very low	41.8	Very low	192 Å²	192	175.2 Å²	175.2	100%	1.343	85%	0.849	S	S	*	*				-144.5	0	124.8	59.8	0	0	0	0	107.6

Retrieved 588 of 588 residues in 212 ms (Link to these results)

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