A0A096NPA6_PAPAN Loading...

GDNF family receptor alpha-2

Receptor for neurturin (NRTN), a growth factor that supports the survival of sympathetic neurons. NRTN-binding leads to autophosphorylation and activation of the RET receptor. Also able to mediate GDNF signaling through the RET tyrosine kinase receptor.

AlphaFold DB (A0A2K5YYV7), UniProt , Accession A0A096NPA6, Species PAPAN (Papio anubis, Olive baboon), Gene GFRA2, Length 464 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.3	Low	53.4	Low	210 Å²	210	123.1 Å²	123.1	100%	1.034	64%	0.644	S	S	*	*				0	-47	0	-69.6	179.9	75.3	0	0	113.4	L3 A4	M1-L3 VanDerWaalsContact C-N 3.35Å; M1-L3 PolarHBondContact O-N 2.65Å; M1-A4 WeakPolarHBondContact O-CB 3.43Å; M1-A4 PolarHBondContact O-N 3.26Å
2	I	52.3	Low	53.2	Low	153 Å²	153	124.7 Å²	124.7	79%	0.785	64%	0.642	S	S	*	*	H	α-helix	trans	-52.1	-44.5	-173.8	-60.2	172.9	0	0	0	114.1	A4 N5 A6	I2-A4 VanDerWaalsContact C-N 3.27Å; I2-A4 PolarHBondContact O-N 3.04Å; I2-N5 PolarHBondContact O-N 3.39Å; I2-A6 PolarHBondContact O-N 3.35Å
3	L	49.5	Very low	53.2	Low	149 Å²	149	123.2 Å²	123.2	78%	0.78	64%	0.635	S	S	*	*	H	α-helix	trans	-62.8	-25.9	180	-73.8	166.4	0	0	0	114.8	M1 F7	M1-L3 VanDerWaalsContact C-N 3.35Å; M1-L3 PolarHBondContact O-N 2.65Å; L3-F7 PolarHBondContact O-N 3.34Å
4	A	51.3	Low	52.9	Low	59 Å²	59	119.1 Å²	119.1	49%	0.488	62%	0.615	S	S	.	*	H	α-helix	trans	-71.7	-42.7	179.1	0	0	0	0	0	111.4	M1 I2 A6 F7 C8	M1-A4 WeakPolarHBondContact O-CB 3.43Å; M1-A4 PolarHBondContact O-N 3.26Å; I2-A4 VanDerWaalsContact C-N 3.27Å; I2-A4 PolarHBondContact O-N 3.04Å; A4-A6 VanDerWaalsContact C-N 3.29Å; A4-A6 PolarHBondContact O-N 3.2Å; A4-F7 PolarHBondContact O-N 3.48Å; A4-F7 VanDerWaalsContact O-N 3.17Å; A4-C8 PolarHBondContact O-N 3.2Å; A4-C8 VanDerWaalsContact O-N 3.11Å
5	N	49.6	Very low	52.2	Low	111 Å²	111	120.2 Å²	120.2	59%	0.594	62%	0.616	S	S	*	*	H	α-helix	trans	-65	-34.2	179.5	-67.7	11.5	0	0	0	111.9	I2 L9	I2-N5 PolarHBondContact O-N 3.39Å; N5-L9 WeakPolarHBondContact O-CG 3.26Å; N5-L9 PolarHBondContact O-N 3.23Å; N5-L9 VanDerWaalsContact O-N 3.12Å
6	A	54.7	Low	51.9	Low	47 Å²	47	117.4 Å²	117.4	39%	0.388	61%	0.607	S	S	.	*	H	α-helix	trans	-63	-43.3	173.7	0	0	0	0	0	112	I2 A4 L9 F10	I2-A6 PolarHBondContact O-N 3.35Å; A4-A6 VanDerWaalsContact C-N 3.29Å; A4-A6 PolarHBondContact O-N 3.2Å; A6-L9 PolarHBondContact O-N 3.26Å; A6-F10 WeakPolarHBondContact O-CD2 3.43Å; A6-F10 PolarHBondContact O-N 3.25Å; A6-F10 VanDerWaalsContact O-N 3.16Å
7	F	55.2	Low	51.5	Low	146 Å²	146	117.6 Å²	117.6	64%	0.64	61%	0.608	S	S	*	*	H	α-helix	trans	-64.9	-41.7	177.6	-110.1	-87.4	0	0	0	112.6	L3 A4 L9 F10 F11	L3-F7 PolarHBondContact O-N 3.34Å; A4-F7 PolarHBondContact O-N 3.48Å; A4-F7 VanDerWaalsContact O-N 3.17Å; F7-L9 PolarHBondContact O-N 3.01Å; F7-F10 PolarHBondContact O-N 3.14Å; F7-F11 HydrophobicContact CD1-CD2 4.26Å; F7-F11 HydrophobicContact CD1-CE2 4.02Å; F7-F11 HydrophobicContact CE1-CE2 4.34Å; F7-F11 PolarHBondContact O-N 3.07Å; F7-F11 VanDerWaalsContact O-N 3.11Å
8	C	54.5	Low	51.1	Low	72 Å²	72	120.2 Å²	120.2	49%	0.486	61%	0.609	S	S	.	*	H	α-helix	trans	-60.5	-43.4	174.7	-66.4	0	0	0	0	112.1	A4 F10 F11 F12	A4-C8 PolarHBondContact O-N 3.2Å; A4-C8 VanDerWaalsContact O-N 3.11Å; C8-F10 VanDerWaalsContact C-N 3.34Å; C8-F10 PolarHBondContact O-N 2.91Å; C8-F11 PolarHBondContact O-N 2.83Å; C8-F12 WeakPolarHBondContact O-CD2 3.04Å; C8-F12 PolarHBondContact O-N 3.45Å
9	L	55.8	Low	50.3	Low	117 Å²	117	118.9 Å²	118.9	61%	0.613	61%	0.612	S	S	*	*	H	α-helix	trans	-62.3	-39	178	-76.1	166.7	0	0	0	112.6	N5 A6 F7 L13	N5-L9 WeakPolarHBondContact O-CG 3.26Å; N5-L9 PolarHBondContact O-N 3.23Å; N5-L9 VanDerWaalsContact O-N 3.12Å; A6-L9 PolarHBondContact O-N 3.26Å; F7-L9 PolarHBondContact O-N 3.01Å; L9-L13 WeakPolarHBondContact O-CB 3.46Å; L9-L13 WeakPolarHBondContact O-CG 3.33Å; L9-L13 PolarHBondContact O-N 3.45Å
10	F	55.9	Low	49.7	Very low	159 Å²	159	120.6 Å²	120.6	70%	0.697	62%	0.621	S	S	*	*	H	α-helix	trans	-66.2	-40.5	175	-93.1	-80.9	0	0	0	113	A6 F7 C8 L13 D14	A6-F10 WeakPolarHBondContact O-CD2 3.43Å; A6-F10 PolarHBondContact O-N 3.25Å; A6-F10 VanDerWaalsContact O-N 3.16Å; F7-F10 PolarHBondContact O-N 3.14Å; C8-F10 VanDerWaalsContact C-N 3.34Å; C8-F10 PolarHBondContact O-N 2.91Å; F10-L13 PolarHBondContact O-N 3.47Å; F10-D14 PolarHBondContact O-N 3.13Å
11	F	54.1	Low	49	Very low	131 Å²	131	118.3 Å²	118.3	58%	0.575	62%	0.621	S	S	*	*	H	α-helix	trans	-66.7	-43.8	176.2	-92.5	-82.3	0	0	0	112.7	F7 C8 L13 D14 E15	F7-F11 HydrophobicContact CD1-CD2 4.26Å; F7-F11 HydrophobicContact CD1-CE2 4.02Å; F7-F11 HydrophobicContact CE1-CE2 4.34Å; F7-F11 PolarHBondContact O-N 3.07Å; F7-F11 VanDerWaalsContact O-N 3.11Å; C8-F11 PolarHBondContact O-N 2.83Å; F11-L13 VanDerWaalsContact C-N 3.3Å; F11-L13 PolarHBondContact O-N 2.83Å; F11-D14 PolarHBondContact O-N 2.84Å; F11-E15 WeakPolarHBondContact O-CB 3.24Å; F11-E15 PolarHBondContact O-N 3.04Å
12	F	51.7	Low	48	Very low	142 Å²	142	112.4 Å²	112.4	62%	0.623	60%	0.6	S	S	*	*	H	α-helix	trans	-64.8	-31.7	175.7	-88.4	-75.8	0	0	0	112.9	C8 T16	C8-F12 WeakPolarHBondContact O-CD2 3.04Å; C8-F12 PolarHBondContact O-N 3.45Å; F12-T16 WeakPolarHBondContact O-CB 3.47Å; F12-T16 WeakPolarHBondContact O-CG2 3.36Å; F12-T16 PolarHBondContact O-N 3.22Å; F12-T16 VanDerWaalsContact O-N 3.07Å; F12-T16 PolarHBondContact O-OG1 3.18Å
13	L	53.4	Low	47	Very low	105 Å²	105	111.2 Å²	111.2	55%	0.55	60%	0.602	S	S	.	*	H	α-helix	trans	-71	-41.6	173.5	-79	167.4	0	0	0	112.6	L9 F10 F11 T16 L17	L9-L13 WeakPolarHBondContact O-CB 3.46Å; L9-L13 WeakPolarHBondContact O-CG 3.33Å; L9-L13 PolarHBondContact O-N 3.45Å; F10-L13 PolarHBondContact O-N 3.47Å; F11-L13 VanDerWaalsContact C-N 3.3Å; F11-L13 PolarHBondContact O-N 2.83Å; L13-T16 WeakPolarHBondContact CA-OG1 3.43Å; L13-T16 PolarHBondContact O-OG1 3.42Å; L13-L17 WeakPolarHBondContact O-CB 3.34Å; L13-L17 PolarHBondContact O-N 2.99Å
14	D	48.8	Very low	46	Very low	66 Å²	66	108.6 Å²	108.6	35%	0.353	60%	0.596	S	S	.	*	H	α-helix	trans	-65.9	-41.9	175.8	-170.7	16.1	0	0	0	111.5	F10 F11 L17 R18	F10-D14 PolarHBondContact O-N 3.13Å; F11-D14 PolarHBondContact O-N 2.84Å; D14-L17 PolarHBondContact O-N 2.89Å; D14-R18 VanDerWaalsContact CG-NE 3.27Å; D14-R18 WeakPolarHBondContact O-CB 3.27Å; D14-R18 WeakPolarHBondContact O-CG 3.3Å; D14-R18 PolarHBondContact O-N 3.12Å; D14-R18 IonicContact OD1-CZ 3.32Å; D14-R18 IonicContact OD1-NE 2.76Å; D14-R18 PolarHBondContact OD1-NE 2.99Å; D14-R18 IonicContact OD1-NH2 2.66Å; D14-R18 PolarHBondContact OD1-NH2 3.35Å; D14-R18 IonicContact OD2-CZ 2.91Å; D14-R18 VanDerWaalsContact OD2-CZ 3.31Å; D14-R18 IonicContact OD2-NE 2.61Å; D14-R18 PolarHBondContact OD2-NE 2.72Å; D14-R18 IonicContact OD2-NH2 3.33Å; D14-R18 PolarHBondContact OD2-NH2 3.3Å
15	E	42.5	Very low	45.2	Very low	136 Å²	136	111 Å²	111	64%	0.636	61%	0.61	S	S	*	*	H	α-helix	trans	-68.4	-37.4	178.8	-166.1	158.5	-141	0	0	112.6	F11 R18 S19	F11-E15 WeakPolarHBondContact O-CB 3.24Å; F11-E15 PolarHBondContact O-N 3.04Å; E15-R18 PolarHBondContact O-N 3.32Å; E15-S19 WeakPolarHBondContact O-CB 3.46Å; E15-S19 PolarHBondContact O-N 3Å
16	T	47.3	Very low	44.2	Very low	76 Å²	76	113.2 Å²	113.2	47%	0.466	62%	0.621	S	S	.	*	H	α-helix	trans	-71.1	-35.8	172.4	48.6	0	0	0	0	113	F12 L13 S19 L20	F12-T16 WeakPolarHBondContact O-CB 3.47Å; F12-T16 WeakPolarHBondContact O-CG2 3.36Å; F12-T16 PolarHBondContact O-N 3.22Å; F12-T16 VanDerWaalsContact O-N 3.07Å; F12-T16 PolarHBondContact O-OG1 3.18Å; L13-T16 WeakPolarHBondContact CA-OG1 3.43Å; L13-T16 PolarHBondContact O-OG1 3.42Å; T16-S19 PolarHBondContact O-N 2.99Å; T16-L20 PolarHBondContact O-N 3.39Å
17	L	45.1	Very low	43.3	Very low	121 Å²	121	120 Å²	120	63%	0.634	64%	0.644	S	S	*	*	H	α-helix	trans	-65	-41	172.8	-131.1	76.3	0	0	0	111.8	L13 D14 L20 A21	L13-L17 WeakPolarHBondContact O-CB 3.34Å; L13-L17 PolarHBondContact O-N 2.99Å; D14-L17 PolarHBondContact O-N 2.89Å; L17-L20 PolarHBondContact O-N 3.16Å; L17-A21 PolarHBondContact O-N 3.41Å
18	R	44.2	Very low	42.1	Very low	164 Å²	164	115.4 Å²	115.4	62%	0.619	64%	0.638	S	S	*	*	H	α-helix	trans	-65.5	-38.6	175.9	-71.4	169.5	-168.6	-146.2	8.4	112.1	D14 E15 L20 A21	D14-R18 VanDerWaalsContact CG-NE 3.27Å; D14-R18 WeakPolarHBondContact O-CB 3.27Å; D14-R18 WeakPolarHBondContact O-CG 3.3Å; D14-R18 PolarHBondContact O-N 3.12Å; D14-R18 IonicContact OD1-CZ 3.32Å; D14-R18 IonicContact OD1-NE 2.76Å; D14-R18 PolarHBondContact OD1-NE 2.99Å; D14-R18 IonicContact OD1-NH2 2.66Å; D14-R18 PolarHBondContact OD1-NH2 3.35Å; D14-R18 IonicContact OD2-CZ 2.91Å; D14-R18 VanDerWaalsContact OD2-CZ 3.31Å; D14-R18 IonicContact OD2-NE 2.61Å; D14-R18 PolarHBondContact OD2-NE 2.72Å; D14-R18 IonicContact OD2-NH2 3.33Å; D14-R18 PolarHBondContact OD2-NH2 3.3Å; E15-R18 PolarHBondContact O-N 3.32Å; R18-L20 PolarHBondContact O-N 2.88Å; R18-A21 PolarHBondContact O-N 2.97Å
19	S	36.5	Very low	41.1	Very low	96 Å²	96	118.5 Å²	118.5	67%	0.671	66%	0.657	S	S	*	*	H	α-helix	trans	-64.1	-27.7	174.4	-167.8	0	0	0	0	112.9	E15 T16	E15-S19 WeakPolarHBondContact O-CB 3.46Å; E15-S19 PolarHBondContact O-N 3Å; T16-S19 PolarHBondContact O-N 2.99Å
20	L	37.2	Very low	40	Very low	151 Å²	151	121.9 Å²	121.9	79%	0.791	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-6.5	173.1	-76	163.7	0	0	0	113.8	T16 L17 R18	T16-L20 PolarHBondContact O-N 3.39Å; L17-L20 PolarHBondContact O-N 3.16Å; R18-L20 PolarHBondContact O-N 2.88Å
21	A	35.9	Very low	38.8	Very low	74 Å²	74	122.6 Å²	122.6	61%	0.612	68%	0.68	S	S	*	*			trans	-107.1	26.2	-176	0	0	0	0	0	113.8	L17 R18 P23	L17-A21 PolarHBondContact O-N 3.41Å; R18-A21 PolarHBondContact O-N 2.97Å; A21-P23 WeakPolarHBondContact O-CD 3.36Å
22	S	32.1	Very low	38.2	Very low	85 Å²	85	125.3 Å²	125.3	59%	0.594	69%	0.694	S	S	*	*			trans	-86.2	116.4	169.1	-67.5	0	0	0	0	110.8	S24	S22-S24 VanDerWaalsContact C-N 3.35Å; S22-S24 PolarHBondContact O-N 3.43Å
23	P	31.8	Very low	37.7	Very low	128 Å²	128	121.9 Å²	121.9	83%	0.831	70%	0.699	S	S	*	*			trans	-74.4	89.1	171	30.5	-33.1	0	0	0	109.7	A21 S25	A21-P23 WeakPolarHBondContact O-CD 3.36Å; P23-S25 PolarHBondContact O-N 3.12Å; P23-S25 VanDerWaalsContact O-N 3.15Å
24	S	29.6	Very low	37	Very low	95 Å²	95	128.8 Å²	128.8	66%	0.664	72%	0.718	S	S	*	*			trans	-53.8	116.7	177.4	-61.5	0	0	0	0	111.4	S22 L26	S22-S24 VanDerWaalsContact C-N 3.35Å; S22-S24 PolarHBondContact O-N 3.43Å; S24-L26 VanDerWaalsContact C-N 3.29Å; S24-L26 PolarHBondContact O-N 3.37Å
25	S	34.2	Very low	37.5	Very low	110 Å²	110	134.6 Å²	134.6	77%	0.769	74%	0.735	S	S	*	*			trans	-75.3	75.8	-179.6	59	0	0	0	0	111.7	P23 Q27	P23-S25 PolarHBondContact O-N 3.12Å; P23-S25 VanDerWaalsContact O-N 3.15Å; S25-Q27 PolarHBondContact O-N 2.84Å; S25-Q27 VanDerWaalsContact O-N 3.09Å
26	L	28.4	Very low	38.3	Very low	157 Å²	157	133.2 Å²	133.2	82%	0.822	74%	0.738	S	S	*	*			trans	-69.5	101.5	162.5	-86.4	82.8	0	0	0	108.8	S24 G28	S24-L26 VanDerWaalsContact C-N 3.29Å; S24-L26 PolarHBondContact O-N 3.37Å; L26-G28 PolarHBondContact O-N 3.32Å
27	Q	35.7	Very low	39.6	Very low	190 Å²	190	135.5 Å²	135.5	89%	0.888	75%	0.754	S	S	*	*			trans	-70.2	86.1	161.5	-72.7	175.8	-58.3	0	0	108.7	S25	S25-Q27 PolarHBondContact O-N 2.84Å; S25-Q27 VanDerWaalsContact O-N 3.09Å
28	G	30.6	Very low	41.8	Very low	49 Å²	49	131.8 Å²	131.8	51%	0.505	74%	0.736	S	S	.	*			trans	-63.9	157.6	153.9	0	0	0	0	0	109.8	L26 E30	L26-G28 PolarHBondContact O-N 3.32Å; G28-E30 PolarHBondContact O-N 3.45Å
29	P	31.6	Very low	44.1	Very low	136 Å²	136	126.3 Å²	126.3	88%	0.883	72%	0.719	S	S	*	*			trans	-58.3	126.3	175.9	-21.3	32.8	0	0	0	110.3	L31	P29-L31 PolarHBondContact O-N 3.34Å
30	E	32.8	Very low	47	Very low	189 Å²	189	121.7 Å²	121.7	88%	0.883	69%	0.687	S	S	*	*			trans	-65.5	108.2	177.4	-70.6	-165.7	143.5	0	0	109.9	G28 H32	G28-E30 PolarHBondContact O-N 3.45Å; E30-H32 PolarHBondContact O-N 3.44Å
31	L	31.5	Very low	49.8	Very low	173 Å²	173	114.8 Å²	114.8	91%	0.906	65%	0.651	S	S	*	*			trans	-68.2	119.1	169.8	-164	77.7	0	0	0	108.2	P29 G33	P29-L31 PolarHBondContact O-N 3.34Å; L31-G33 PolarHBondContact O-N 3.31Å
32	H	40.6	Very low	52.7	Low	188 Å²	188	117.2 Å²	117.2	87%	0.87	64%	0.644	S	S	*	*	S	Bend	trans	-51.8	136.5	-175.4	-81	-91.6	0	0	0	113.5	E30	E30-H32 PolarHBondContact O-N 3.44Å
33	G	41.4	Very low	55.7	Low	71 Å²	71	113.1 Å²	113.1	73%	0.732	62%	0.616	S	S	*	*	S	Bend	trans	127	-18.8	139.3	0	0	0	0	0	118.8	L31	L31-G33 PolarHBondContact O-N 3.31Å
34	W	39.6	Very low	58.8	Low	250 Å²	250	108.9 Å²	108.9	95%	0.947	59%	0.586	S	S	*	*			trans	-113.1	77.7	-173.3	-74.7	82.5	0	0	0	113.7
35	R	58.5	Low	61.9	Low	188 Å²	188	108.2 Å²	108.2	71%	0.709	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-71.2	135	161.3	-66.3	-169.7	-174.8	-146.9	5.3	109
36	P	59.1	Low	64.8	Low	107 Å²	107	105.7 Å²	105.7	70%	0.695	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-59	140.8	173	-24.5	34.3	0	0	0	111.6	V38	P36-V38 PolarHBondContact O-N 3.45Å
37	P	75.7	Confident	68	Low	123 Å²	123	98.2 Å²	98.2	80%	0.799	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-56.1	125.6	175.2	-26.8	35.4	0	0	0	111.9
38	V	90.4	Very high	70.8	Confident	44 Å²	44	92 Å²	92	27%	0.267	49%	0.492	S	S	.	.			trans	-110.9	142.1	178.7	-73.9	0	0	0	0	110.6	P36 R42 A43 P89	P36-V38 PolarHBondContact O-N 3.45Å; V38-R42 HydrophobicContact CB-CB 4.34Å; V38-R42 HydrophobicContact CB-CG 4.39Å; V38-R42 HydrophobicContact CG1-CG 4.14Å; V38-A43 HydrophobicContact CG2-CB 4.05Å; V38-P89 HydrophobicContact CG2-CB 4.02Å
39	D	94	Very high	73.9	Confident	48 Å²	48	93.9 Å²	93.9	26%	0.257	50%	0.503	S	S	.	.	B	Isolated β-bridge	trans	-69.8	158.7	171.9	76.1	45.6	0	0	0	111.5	V41 R42 A43 R94 M99	D39-V41 PolarHBondContact O-N 3.32Å; D39-V41 VanDerWaalsContact O-N 3.12Å; D39-V41 WeakPolarHBondContact OD1-CA 3.25Å; D39-V41 WeakPolarHBondContact OD1-CB 3.42Å; D39-V41 PolarHBondContact OD1-N 3.05Å; D39-R42 PolarHBondContact O-N 2.66Å; D39-R42 PolarHBondContact OD1-N 2.97Å; D39-A43 WeakPolarHBondContact O-CB 3.48Å; D39-A43 PolarHBondContact O-N 3.11Å; D39-R94 VanDerWaalsContact CA-O 3.27Å; D39-R94 WeakPolarHBondContact CA-O 3.43Å; D39-M99 HydrophobicContact CB-CE 3.93Å; D39-M99 WeakPolarHBondContact OD2-CE 3.46Å
40	C	96.1	Very high	77	Confident	0 Å²	0	92 Å²	92	0%	0	48%	0.482	C	S	.	.	H	α-helix	trans	-60.4	-24.8	-176.8	-59	0	0	0	0	114.1	N44 C93 R94 C105 I108	C40-N44 VanDerWaalsContact O-CB 3.27Å; C40-N44 WeakPolarHBondContact O-CB 3.43Å; C40-N44 PolarHBondContact O-N 3.33Å; C40-C93 WeakPolarHBondContact CA-SG 3.37Å; C40-C93 HydrophobicContact CB-CB 3.87Å; C40-C93 WeakPolarHBondContact CB-SG 3.43Å; C40-C93 WeakPolarHBondContact SG-CB 3.08Å; C40-C93 CovalentContact SG-SG 2.04Å; C40-C93 PolarHBondContact SG-SG 3.31Å; C40-R94 PolarHBondContact N-O 3.03Å; C40-C105 VanDerWaalsContact CB-SG 3.6Å; C40-I108 HydrophobicContact CB-CB 4.12Å; C40-I108 HydrophobicContact CB-CG2 3.94Å
41	V	96.9	Very high	79.9	Confident	6 Å²	6	88 Å²	88	4%	0.036	48%	0.475	C	S	.	.	H	α-helix	trans	-70.1	-47.3	174.2	-174	0	0	0	0	109.8	D39 N44 E45 K101 Q104 C105 I108	D39-V41 PolarHBondContact O-N 3.32Å; D39-V41 VanDerWaalsContact O-N 3.12Å; D39-V41 WeakPolarHBondContact OD1-CA 3.25Å; D39-V41 WeakPolarHBondContact OD1-CB 3.42Å; D39-V41 PolarHBondContact OD1-N 3.05Å; V41-N44 PolarHBondContact O-N 3.29Å; V41-E45 WeakPolarHBondContact O-CG 3.45Å; V41-E45 PolarHBondContact O-N 3.35Å; V41-K101 HydrophobicContact CB-CD 4.43Å; V41-K101 HydrophobicContact CG1-CD 3.69Å; V41-K101 HydrophobicContact CG2-CB 4.05Å; V41-K101 HydrophobicContact CG2-CD 4.17Å; V41-Q104 HydrophobicContact CG2-CG 4.42Å; V41-C105 HydrophobicContact CG2-CB 3.89Å; V41-I108 HydrophobicContact CG2-CD1 4.34Å
42	R	95.8	Very high	82.9	Confident	124 Å²	124	84 Å²	84	47%	0.468	45%	0.454	S	S	.	.	H	α-helix	trans	-69	-36.9	178.8	-174.2	56.3	-179.2	168.4	4.6	112.3	V38 D39 N44 E45 L46	V38-R42 HydrophobicContact CB-CB 4.34Å; V38-R42 HydrophobicContact CB-CG 4.39Å; V38-R42 HydrophobicContact CG1-CG 4.14Å; D39-R42 PolarHBondContact O-N 2.66Å; D39-R42 PolarHBondContact OD1-N 2.97Å; R42-N44 VanDerWaalsContact C-N 3.34Å; R42-N44 PolarHBondContact O-N 3.12Å; R42-E45 VanDerWaalsContact CD-OE2 3.27Å; R42-E45 WeakPolarHBondContact CD-OE2 3.21Å; R42-E45 IonicContact CZ-OE2 3.51Å; R42-E45 IonicContact NE-OE2 3.62Å; R42-E45 IonicContact NH1-OE2 3.61Å; R42-E45 PolarHBondContact NH1-OE2 3.17Å; R42-E45 WeakPolarHBondContact O-CB 3.49Å; R42-E45 PolarHBondContact O-N 3.36Å; R42-L46 WeakPolarHBondContact O-CG 3Å; R42-L46 PolarHBondContact O-N 3.37Å
43	A	95.4	Very high	85.4	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-59.3	-43.4	171.6	0	0	0	0	0	112.2	V38 D39 L46 C47 P89 L90 C93	V38-A43 HydrophobicContact CG2-CB 4.05Å; D39-A43 WeakPolarHBondContact O-CB 3.48Å; D39-A43 PolarHBondContact O-N 3.11Å; A43-L46 PolarHBondContact O-N 3.11Å; A43-C47 WeakPolarHBondContact O-CB 3.36Å; A43-C47 PolarHBondContact O-N 3.47Å; A43-P89 HydrophobicContact CB-CB 4.17Å; A43-P89 WeakPolarHBondContact CB-O 3.48Å; A43-L90 HydrophobicContact CB-CD2 3.85Å; A43-L90 HydrophobicContact CB-CG 4.21Å; A43-C93 HydrophobicContact CB-CB 4.02Å
44	N	96.3	Very high	88	Confident	38 Å²	38	72.5 Å²	72.5	20%	0.203	38%	0.384	C	S	.	.	H	α-helix	trans	-65.1	-37.3	174.5	-177.7	108.7	0	0	0	112.1	C40 V41 R42 A48 Y57 L90 I108	C40-N44 VanDerWaalsContact O-CB 3.27Å; C40-N44 WeakPolarHBondContact O-CB 3.43Å; C40-N44 PolarHBondContact O-N 3.33Å; V41-N44 PolarHBondContact O-N 3.29Å; R42-N44 VanDerWaalsContact C-N 3.34Å; R42-N44 PolarHBondContact O-N 3.12Å; N44-A48 WeakPolarHBondContact O-CB 3.48Å; N44-A48 PolarHBondContact O-N 3.15Å; N44-Y57 WeakPolarHBondContact OD1-CE1 3.17Å; N44-Y57 PolarHBondContact OD1-OH 3.05Å; N44-L90 HydrophobicContact CB-CD2 4.05Å; N44-I108 HydrophobicContact CB-CD1 3.74Å; N44-I108 HydrophobicContact CB-CG1 4.34Å; N44-I108 HydrophobicContact CB-CG2 4.1Å
45	E	95.8	Very high	90.7	Very high	81 Å²	81	63.5 Å²	63.5	38%	0.379	36%	0.359	S	S	.	.	H	α-helix	trans	-62.7	-41.4	174	-72.4	169.8	-170.6	0	0	112	V41 R42 A49 K101	V41-E45 WeakPolarHBondContact O-CG 3.45Å; V41-E45 PolarHBondContact O-N 3.35Å; R42-E45 VanDerWaalsContact CD-OE2 3.27Å; R42-E45 WeakPolarHBondContact CD-OE2 3.21Å; R42-E45 IonicContact CZ-OE2 3.51Å; R42-E45 IonicContact NE-OE2 3.62Å; R42-E45 IonicContact NH1-OE2 3.61Å; R42-E45 PolarHBondContact NH1-OE2 3.17Å; R42-E45 WeakPolarHBondContact O-CB 3.49Å; R42-E45 PolarHBondContact O-N 3.36Å; E45-A49 PolarHBondContact O-N 3.35Å; E45-K101 IonicContact OE1-NZ 3.68Å
46	L	94.8	Very high	92.4	Very high	57 Å²	57	58 Å²	58	30%	0.298	34%	0.339	S	S	.	.	H	α-helix	trans	-67.3	-51.4	175.8	-66.5	170.4	0	0	0	111.5	R42 A43 A48 A49 E50	R42-L46 WeakPolarHBondContact O-CG 3Å; R42-L46 PolarHBondContact O-N 3.37Å; A43-L46 PolarHBondContact O-N 3.11Å; L46-A48 PolarHBondContact O-N 3.13Å; L46-A49 WeakPolarHBondContact O-CB 3.01Å; L46-A49 PolarHBondContact O-N 3.36Å; L46-E50 PolarHBondContact O-N 2.94Å
47	C	95.1	Very high	94.1	Very high	1 Å²	1	54 Å²	54	1%	0.007	31%	0.31	C	S	.	.	H	α-helix	trans	-60.5	-29.8	177.5	-176.6	0	0	0	0	112.8	A43 A49 E50 C53 S54 L90	A43-C47 WeakPolarHBondContact O-CB 3.36Å; A43-C47 PolarHBondContact O-N 3.47Å; C47-A49 VanDerWaalsContact C-N 3.33Å; C47-E50 PolarHBondContact O-N 3.13Å; C47-E50 VanDerWaalsContact O-O 3.06Å; C47-C53 HydrophobicContact CB-CB 4.04Å; C47-C53 WeakPolarHBondContact CB-SG 3.05Å; C47-C53 WeakPolarHBondContact SG-CB 3.14Å; C47-C53 PolarHBondContact SG-O 3.44Å; C47-C53 CovalentContact SG-SG 2.04Å; C47-C53 PolarHBondContact SG-SG 2.89Å; C47-S54 WeakPolarHBondContact O-CA 3.49Å; C47-S54 WeakPolarHBondContact O-CB 3.03Å; C47-S54 PolarHBondContact O-N 3.37Å; C47-S54 VanDerWaalsContact O-N 3.09Å; C47-L90 HydrophobicContact CB-CD1 3.71Å; C47-L90 HydrophobicContact CB-CG 4.12Å; C47-L90 VanDerWaalsContact SG-CD1 3.5Å
48	A	95.6	Very high	95	Very high	58 Å²	58	55 Å²	55	48%	0.479	30%	0.298	S	S	.	.	H	α-helix	trans	-70.8	-25.3	176.1	0	0	0	0	0	113.7	N44 L46	N44-A48 WeakPolarHBondContact O-CB 3.48Å; N44-A48 PolarHBondContact O-N 3.15Å; L46-A48 PolarHBondContact O-N 3.13Å
49	A	95.7	Very high	95.1	Very high	89 Å²	89	54.2 Å²	54.2	74%	0.736	29%	0.293	S	S	*	.	H	α-helix	trans	-78.2	-29.4	175.2	0	0	0	0	0	112.6	E45 L46 C47	E45-A49 PolarHBondContact O-N 3.35Å; L46-A49 WeakPolarHBondContact O-CB 3.01Å; L46-A49 PolarHBondContact O-N 3.36Å; C47-A49 VanDerWaalsContact C-N 3.33Å
50	E	95.5	Very high	94.8	Very high	96 Å²	96	52 Å²	52	45%	0.449	28%	0.281	S	S	.	.	S	Bend	trans	-87.8	115.9	177.9	-68.5	176.8	-161.5	0	0	111.3	L46 C47 N52 C53 S54	L46-E50 PolarHBondContact O-N 2.94Å; C47-E50 PolarHBondContact O-N 3.13Å; C47-E50 VanDerWaalsContact O-O 3.06Å; E50-N52 VanDerWaalsContact C-N 3.32Å; E50-N52 PolarHBondContact O-N 3.03Å; E50-C53 HydrophobicContact CB-CB 4.01Å; E50-C53 PolarHBondContact O-N 2.02Å; E50-S54 WeakPolarHBondContact O-CB 3.45Å; E50-S54 PolarHBondContact O-N 3.02Å
51	S	94.6	Very high	94.5	Very high	106 Å²	106	57.8 Å²	57.8	74%	0.741	30%	0.303	S	S	*	.	H	α-helix	trans	-58	-39.2	-174.9	57.9	0	0	0	0	113.9	S55	S51-S55 VanDerWaalsContact O-CB 3.26Å; S51-S55 WeakPolarHBondContact O-CB 3.42Å; S51-S55 PolarHBondContact O-N 3.18Å
52	N	93.6	Very high	94.1	Very high	88 Å²	88	64.4 Å²	64.4	47%	0.471	33%	0.334	S	S	.	.	H	α-helix	trans	-66.1	-54.3	177.3	-172.5	27.7	0	0	0	111.6	E50 S54 S55 R56	E50-N52 VanDerWaalsContact C-N 3.32Å; E50-N52 PolarHBondContact O-N 3.03Å; N52-S54 PolarHBondContact O-N 3.25Å; N52-S55 WeakPolarHBondContact O-CB 3.3Å; N52-S55 PolarHBondContact O-N 2.85Å; N52-S55 VanDerWaalsContact O-N 3.14Å; N52-R56 WeakPolarHBondContact O-CG 3.43Å; N52-R56 PolarHBondContact O-N 2.77Å
53	C	94.6	Very high	93.7	Very high	4 Å²	4	58.9 Å²	58.9	3%	0.027	31%	0.314	C	S	.	.	H	α-helix	trans	-58.2	-49.1	178.2	-169.3	0	0	0	0	111.2	C47 E50 S55 R56 Y57	C47-C53 HydrophobicContact CB-CB 4.04Å; C47-C53 WeakPolarHBondContact CB-SG 3.05Å; C47-C53 WeakPolarHBondContact SG-CB 3.14Å; C47-C53 PolarHBondContact SG-O 3.44Å; C47-C53 CovalentContact SG-SG 2.04Å; C47-C53 PolarHBondContact SG-SG 2.89Å; E50-C53 HydrophobicContact CB-CB 4.01Å; E50-C53 PolarHBondContact O-N 2.02Å; C53-S55 VanDerWaalsContact C-N 3.27Å; C53-S55 PolarHBondContact O-N 3.36Å; C53-R56 PolarHBondContact O-N 3.09Å; C53-Y57 VanDerWaalsContact O-CB 3.26Å; C53-Y57 WeakPolarHBondContact O-CB 3.27Å; C53-Y57 PolarHBondContact O-N 3.36Å
54	S	95.5	Very high	93.1	Very high	14 Å²	14	59.6 Å²	59.6	10%	0.098	32%	0.317	C	S	.	.	H	α-helix	trans	-54.8	-40.6	176	-166.7	0	0	0	0	112.2	C47 E50 N52 R58	C47-S54 WeakPolarHBondContact O-CA 3.49Å; C47-S54 WeakPolarHBondContact O-CB 3.03Å; C47-S54 PolarHBondContact O-N 3.37Å; C47-S54 VanDerWaalsContact O-N 3.09Å; E50-S54 WeakPolarHBondContact O-CB 3.45Å; E50-S54 PolarHBondContact O-N 3.02Å; N52-S54 PolarHBondContact O-N 3.25Å; S54-R58 WeakPolarHBondContact O-CG 3.5Å; S54-R58 PolarHBondContact O-N 2.82Å; S54-R58 PolarHBondContact O-NH1 3.17Å; S54-R58 PolarHBondContact OG-NH1 2.03Å; S54-R58 PolarHBondContact OG-NH2 2.03Å
55	S	96	Very high	92.2	Very high	61 Å²	61	61.4 Å²	61.4	43%	0.427	34%	0.338	S	S	.	.	H	α-helix	trans	-67.3	-55.5	176.4	-169.6	0	0	0	0	111.4	S51 N52 C53 Y57 R58 T59	S51-S55 VanDerWaalsContact O-CB 3.26Å; S51-S55 WeakPolarHBondContact O-CB 3.42Å; S51-S55 PolarHBondContact O-N 3.18Å; N52-S55 WeakPolarHBondContact O-CB 3.3Å; N52-S55 PolarHBondContact O-N 2.85Å; N52-S55 VanDerWaalsContact O-N 3.14Å; C53-S55 VanDerWaalsContact C-N 3.27Å; C53-S55 PolarHBondContact O-N 3.36Å; S55-Y57 VanDerWaalsContact C-N 3.31Å; S55-Y57 PolarHBondContact O-N 3.03Å; S55-R58 WeakPolarHBondContact O-CB 3.34Å; S55-R58 PolarHBondContact O-N 2.99Å; S55-T59 PolarHBondContact O-N 3.45Å; S55-T59 VanDerWaalsContact O-N 3.07Å; S55-T59 PolarHBondContact O-OG1 3.14Å
56	R	94.8	Very high	90.7	Very high	74 Å²	74	61.5 Å²	61.5	28%	0.279	36%	0.36	S	S	.	.	H	α-helix	trans	-62.3	-35.5	-177.6	-62.1	-51.8	-169.9	155.4	2.6	113	N52 C53 R58 T59 L60 A81 V84 L85	N52-R56 WeakPolarHBondContact O-CG 3.43Å; N52-R56 PolarHBondContact O-N 2.77Å; C53-R56 PolarHBondContact O-N 3.09Å; R56-R58 VanDerWaalsContact C-N 3.32Å; R56-R58 PolarHBondContact O-N 2.79Å; R56-T59 WeakPolarHBondContact O-CB 3.5Å; R56-T59 PolarHBondContact O-N 3.24Å; R56-L60 PolarHBondContact O-N 2.95Å; R56-A81 HydrophobicContact CB-CB 4.08Å; R56-V84 HydrophobicContact CB-CB 4.43Å; R56-V84 HydrophobicContact CB-CG1 4.28Å; R56-V84 HydrophobicContact CG-CB 3.93Å; R56-V84 HydrophobicContact CG-CG1 3.77Å; R56-V84 HydrophobicContact CG-CG2 4.37Å; R56-L85 HydrophobicContact CB-CD1 4.44Å; R56-L85 HydrophobicContact CB-CG 4.2Å
57	Y	94	Very high	89.4	Confident	21 Å²	21	64.5 Å²	64.5	8%	0.082	37%	0.368	C	S	.	.	H	α-helix	trans	-61.3	-37.2	173.1	175.5	-128.7	0	0	0	112.8	N44 C53 S55 R61 L90 S111 I112	N44-Y57 WeakPolarHBondContact OD1-CE1 3.17Å; N44-Y57 PolarHBondContact OD1-OH 3.05Å; C53-Y57 VanDerWaalsContact O-CB 3.26Å; C53-Y57 WeakPolarHBondContact O-CB 3.27Å; C53-Y57 PolarHBondContact O-N 3.36Å; S55-Y57 VanDerWaalsContact C-N 3.31Å; S55-Y57 PolarHBondContact O-N 3.03Å; Y57-R61 HydrophobicContact CD2-CG 4.24Å; Y57-R61 HydrophobicContact CE2-CG 4.03Å; Y57-R61 WeakPolarHBondContact O-CB 3.47Å; Y57-R61 VanDerWaalsContact O-CG 3.29Å; Y57-R61 WeakPolarHBondContact O-CG 3.28Å; Y57-R61 PolarHBondContact O-N 3.17Å; Y57-R61 PolarHBondContact OH-NH1 3.1Å; Y57-L90 HydrophobicContact CD1-CD1 4.47Å; Y57-L90 HydrophobicContact CD2-CD1 3.89Å; Y57-L90 HydrophobicContact CE2-CD1 4.17Å; Y57-L90 HydrophobicContact CG-CD1 4.05Å; Y57-S111 PolarHBondContact OH-OG 3.21Å; Y57-I112 HydrophobicContact CD2-CG2 3.84Å; Y57-I112 HydrophobicContact CE2-CG2 3.79Å
58	R	93.7	Very high	88.2	Confident	145 Å²	145	68.5 Å²	68.5	55%	0.547	39%	0.389	S	S	.	.	H	α-helix	trans	-68.3	-43.3	171.8	-67.2	178.9	-169.7	90.4	-3.8	111.3	S54 S55 R56 R61 Q62	S54-R58 WeakPolarHBondContact O-CG 3.5Å; S54-R58 PolarHBondContact O-N 2.82Å; S54-R58 PolarHBondContact O-NH1 3.17Å; S54-R58 PolarHBondContact OG-NH1 2.03Å; S54-R58 PolarHBondContact OG-NH2 2.03Å; S55-R58 WeakPolarHBondContact O-CB 3.34Å; S55-R58 PolarHBondContact O-N 2.99Å; R56-R58 VanDerWaalsContact C-N 3.32Å; R56-R58 PolarHBondContact O-N 2.79Å; R58-R61 PolarHBondContact O-N 2.95Å; R58-Q62 WeakPolarHBondContact O-CG 3.36Å; R58-Q62 PolarHBondContact O-N 3.25Å; R58-Q62 VanDerWaalsContact O-N 3.1Å
59	T	92.4	Very high	87.1	Confident	28 Å²	28	68.8 Å²	68.8	17%	0.172	38%	0.378	C	S	.	.	H	α-helix	trans	-58.9	-54.4	177	-53.1	0	0	0	0	111.5	S55 R56 R61 Q62 C63 E77 A81	S55-T59 PolarHBondContact O-N 3.45Å; S55-T59 VanDerWaalsContact O-N 3.07Å; S55-T59 PolarHBondContact O-OG1 3.14Å; R56-T59 WeakPolarHBondContact O-CB 3.5Å; R56-T59 PolarHBondContact O-N 3.24Å; T59-R61 VanDerWaalsContact C-N 3.28Å; T59-R61 PolarHBondContact O-N 2.86Å; T59-Q62 WeakPolarHBondContact O-CB 3.07Å; T59-Q62 PolarHBondContact O-N 3Å; T59-C63 PolarHBondContact O-N 3.07Å; T59-C63 PolarHBondContact O-SG 2.99Å; T59-E77 HydrophobicContact CG2-CB 4.46Å; T59-A81 HydrophobicContact CG2-CB 3.94Å
60	L	89.5	Confident	86.1	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-59.6	-39.7	-179.3	-175.5	64.1	0	0	0	111.5	R56 Q62 C63 L64 M72 A81 L82 L85 I112	R56-L60 PolarHBondContact O-N 2.95Å; L60-Q62 VanDerWaalsContact C-N 3.29Å; L60-Q62 PolarHBondContact O-N 3.3Å; L60-C63 WeakPolarHBondContact O-CB 3.39Å; L60-C63 PolarHBondContact O-N 2.85Å; L60-C63 VanDerWaalsContact O-N 3.08Å; L60-L64 HydrophobicContact CD1-CD1 4.12Å; L60-L64 HydrophobicContact CD1-CD2 4.42Å; L60-L64 HydrophobicContact CD1-CG 4.08Å; L60-L64 HydrophobicContact CD2-CD1 4.36Å; L60-L64 HydrophobicContact CG-CD1 3.88Å; L60-L64 HydrophobicContact CG-CG 4.23Å; L60-L64 WeakPolarHBondContact O-CG 3.45Å; L60-L64 PolarHBondContact O-N 3.5Å; L60-M72 HydrophobicContact CD1-SD 4.39Å; L60-A81 HydrophobicContact CB-CB 4.24Å; L60-L82 HydrophobicContact CD1-CB 4.43Å; L60-L82 HydrophobicContact CD2-CD1 4.35Å; L60-L85 HydrophobicContact CB-CD1 3.74Å; L60-L85 HydrophobicContact CD2-CD1 3.54Å; L60-L85 HydrophobicContact CG-CD1 4.28Å; L60-I112 HydrophobicContact CD2-CB 4.11Å; L60-I112 HydrophobicContact CD2-CG2 4.2Å
61	R	89.6	Confident	85.2	Confident	122 Å²	122	68 Å²	68	46%	0.46	37%	0.367	S	S	.	.	H	α-helix	trans	-65.1	-27	175.3	-78.1	-178	59	156.1	0.6	114.5	Y57 R58 T59 S111	Y57-R61 HydrophobicContact CD2-CG 4.24Å; Y57-R61 HydrophobicContact CE2-CG 4.03Å; Y57-R61 WeakPolarHBondContact O-CB 3.47Å; Y57-R61 VanDerWaalsContact O-CG 3.29Å; Y57-R61 WeakPolarHBondContact O-CG 3.28Å; Y57-R61 PolarHBondContact O-N 3.17Å; Y57-R61 PolarHBondContact OH-NH1 3.1Å; R58-R61 PolarHBondContact O-N 2.95Å; T59-R61 VanDerWaalsContact C-N 3.28Å; T59-R61 PolarHBondContact O-N 2.86Å; R61-S111 WeakPolarHBondContact CG-O 3.49Å
62	Q	88.3	Confident	84.5	Confident	145 Å²	145	63 Å²	63	68%	0.678	33%	0.332	S	S	*	.	H	α-helix	trans	-77.9	-35	170.4	-70.2	169.7	-21.9	0	0	111.3	R58 T59 L60 A65	R58-Q62 WeakPolarHBondContact O-CG 3.36Å; R58-Q62 PolarHBondContact O-N 3.25Å; R58-Q62 VanDerWaalsContact O-N 3.1Å; T59-Q62 WeakPolarHBondContact O-CB 3.07Å; T59-Q62 PolarHBondContact O-N 3Å; L60-Q62 VanDerWaalsContact C-N 3.29Å; L60-Q62 PolarHBondContact O-N 3.3Å; Q62-A65 PolarHBondContact O-N 3.32Å
63	C	87	Confident	83.7	Confident	8 Å²	8	61.2 Å²	61.2	5%	0.054	32%	0.322	C	S	.	.	H	α-helix	trans	-66	-41.5	176.8	-65.1	0	0	0	0	113.5	T59 L60 A65 R67 M72 C78	T59-C63 PolarHBondContact O-N 3.07Å; T59-C63 PolarHBondContact O-SG 2.99Å; L60-C63 WeakPolarHBondContact O-CB 3.39Å; L60-C63 PolarHBondContact O-N 2.85Å; L60-C63 VanDerWaalsContact O-N 3.08Å; C63-A65 VanDerWaalsContact C-N 3.28Å; C63-A65 PolarHBondContact O-N 3.42Å; C63-R67 WeakPolarHBondContact O-CB 3.38Å; C63-R67 WeakPolarHBondContact O-CD 3.33Å; C63-M72 HydrophobicContact CB-CG 3.84Å; C63-C78 HydrophobicContact CB-CB 3.62Å; C63-C78 WeakPolarHBondContact CB-SG 3.02Å; C63-C78 WeakPolarHBondContact SG-CA 3.45Å; C63-C78 WeakPolarHBondContact SG-CB 3.12Å; C63-C78 CovalentContact SG-SG 2.02Å; C63-C78 PolarHBondContact SG-SG 2.94Å
64	L	81.9	Confident	83.1	Confident	14 Å²	14	65 Å²	65	7%	0.073	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-4	179.7	-59	175.4	0	0	0	113.3	L60 G66 M72 I112 L114 L116	L60-L64 HydrophobicContact CD1-CD1 4.12Å; L60-L64 HydrophobicContact CD1-CD2 4.42Å; L60-L64 HydrophobicContact CD1-CG 4.08Å; L60-L64 HydrophobicContact CD2-CD1 4.36Å; L60-L64 HydrophobicContact CG-CD1 3.88Å; L60-L64 HydrophobicContact CG-CG 4.23Å; L60-L64 WeakPolarHBondContact O-CG 3.45Å; L60-L64 PolarHBondContact O-N 3.5Å; L64-G66 VanDerWaalsContact C-N 3.34Å; L64-G66 PolarHBondContact O-N 3.33Å; L64-M72 HydrophobicContact CD2-CE 4.23Å; L64-M72 HydrophobicContact CD2-CG 4.06Å; L64-I112 VanDerWaalsContact CD1-O 3.24Å; L64-I112 WeakPolarHBondContact CD1-O 3.14Å; L64-L114 WeakPolarHBondContact CD2-O 3.49Å; L64-L116 HydrophobicContact CD2-CD2 4.3Å
65	A	77.4	Confident	82.7	Confident	76 Å²	76	66.6 Å²	66.6	63%	0.628	36%	0.361	S	S	*	.	S	Bend	trans	-77.5	79.7	179.5	0	0	0	0	0	111.7	Q62 C63	Q62-A65 PolarHBondContact O-N 3.32Å; C63-A65 VanDerWaalsContact C-N 3.28Å; C63-A65 PolarHBondContact O-N 3.42Å
66	G	65.5	Low	82.4	Confident	83 Å²	83	72 Å²	72	86%	0.856	38%	0.377	S	S	*	.	S	Bend	trans	85.4	27.8	174.3	0	0	0	0	0	114.9	L64	L64-G66 VanDerWaalsContact C-N 3.34Å; L64-G66 PolarHBondContact O-N 3.33Å
67	R	66.8	Low	82.2	Confident	121 Å²	121	74.6 Å²	74.6	46%	0.457	39%	0.392	S	S	.	.			trans	-120.4	147.1	169.3	-58.7	-176.3	-179.5	-151.4	0.7	109.7	C63 T71	C63-R67 WeakPolarHBondContact O-CB 3.38Å; C63-R67 WeakPolarHBondContact O-CD 3.33Å; R67-T71 HydrophobicContact CB-CG2 4.43Å; R67-T71 HydrophobicContact CG-CG2 4.42Å
68	D	70.1	Confident	82	Confident	84 Å²	84	73.6 Å²	73.6	45%	0.449	39%	0.388	S	S	.	.			trans	-70.7	166.6	163.6	69.3	91.9	0	0	0	111	N70 T71 M72	D68-N70 VanDerWaalsContact C-N 3.31Å; D68-N70 PolarHBondContact O-N 2.67Å; D68-N70 WeakPolarHBondContact OD1-CA 3.34Å; D68-N70 WeakPolarHBondContact OD1-CB 3.41Å; D68-N70 PolarHBondContact OD1-N 3.3Å; D68-T71 PolarHBondContact O-N 3.44Å; D68-T71 PolarHBondContact OD1-N 3.42Å; D68-T71 PolarHBondContact OD1-OG1 3.04Å; D68-T71 WeakPolarHBondContact OD2-CB 3.47Å; D68-T71 PolarHBondContact OD2-OG1 3.02Å; D68-M72 WeakPolarHBondContact O-CB 3.44Å; D68-M72 PolarHBondContact O-N 3.16Å
69	R	73	Confident	81.7	Confident	64 Å²	64	70.6 Å²	70.6	24%	0.242	38%	0.38	C	S	.	.	H	α-helix	trans	-59.5	-38.5	-178.4	-160.9	-165.6	69.4	133	-4.6	113.6	M72 L73 G115 E118	R69-M72 HydrophobicContact CG-CE 4.15Å; R69-M72 WeakPolarHBondContact O-CB 3.4Å; R69-M72 PolarHBondContact O-N 2.71Å; R69-L73 HydrophobicContact CG-CD1 3.99Å; R69-L73 HydrophobicContact CG-CG 4.35Å; R69-L73 VanDerWaalsContact CZ-CD1 3.49Å; R69-L73 WeakPolarHBondContact O-CB 3.3Å; R69-L73 VanDerWaalsContact O-CG 3.32Å; R69-L73 WeakPolarHBondContact O-CG 3.48Å; R69-L73 PolarHBondContact O-N 2.83Å; R69-G115 WeakPolarHBondContact CB-O 3.38Å; R69-G115 WeakPolarHBondContact CG-O 3.44Å; R69-E118 IonicContact CZ-OE1 2.78Å; R69-E118 IonicContact NH1-OE1 2.71Å; R69-E118 PolarHBondContact NH1-OE1 3.34Å; R69-E118 IonicContact NH2-OE1 3.96Å; R69-E118 PolarHBondContact NH2-OE1 2.97Å
70	N	74.6	Confident	81.7	Confident	102 Å²	102	70.6 Å²	70.6	55%	0.545	38%	0.384	S	S	.	.	H	α-helix	trans	-76.5	-39.8	-172.6	-56.6	-25.9	0	0	0	109.8	D68 M72 L73 A74	D68-N70 VanDerWaalsContact C-N 3.31Å; D68-N70 PolarHBondContact O-N 2.67Å; D68-N70 WeakPolarHBondContact OD1-CA 3.34Å; D68-N70 WeakPolarHBondContact OD1-CB 3.41Å; D68-N70 PolarHBondContact OD1-N 3.3Å; N70-M72 VanDerWaalsContact C-N 3.25Å; N70-M72 PolarHBondContact O-N 2.86Å; N70-L73 PolarHBondContact O-N 3.39Å; N70-A74 WeakPolarHBondContact O-CB 3.41Å; N70-A74 PolarHBondContact O-N 3.28Å
71	T	77.1	Confident	81.8	Confident	68 Å²	68	70.6 Å²	70.6	42%	0.417	38%	0.383	S	S	.	.	H	α-helix	trans	-65.7	-26.1	169	-57.1	0	0	0	0	112.8	R67 D68	R67-T71 HydrophobicContact CB-CG2 4.43Å; R67-T71 HydrophobicContact CG-CG2 4.42Å; D68-T71 PolarHBondContact O-N 3.44Å; D68-T71 PolarHBondContact OD1-N 3.42Å; D68-T71 PolarHBondContact OD1-OG1 3.04Å; D68-T71 WeakPolarHBondContact OD2-CB 3.47Å; D68-T71 PolarHBondContact OD2-OG1 3.02Å
72	M	78.8	Confident	81.8	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-73	-52.1	170.5	-179.1	-82	-65.8	0	0	111.8	L60 C63 L64 D68 R69 N70 A74 N75 C78 L82 L116	L60-M72 HydrophobicContact CD1-SD 4.39Å; C63-M72 HydrophobicContact CB-CG 3.84Å; L64-M72 HydrophobicContact CD2-CE 4.23Å; L64-M72 HydrophobicContact CD2-CG 4.06Å; D68-M72 WeakPolarHBondContact O-CB 3.44Å; D68-M72 PolarHBondContact O-N 3.16Å; R69-M72 HydrophobicContact CG-CE 4.15Å; R69-M72 WeakPolarHBondContact O-CB 3.4Å; R69-M72 PolarHBondContact O-N 2.71Å; N70-M72 VanDerWaalsContact C-N 3.25Å; N70-M72 PolarHBondContact O-N 2.86Å; M72-A74 VanDerWaalsContact C-N 3.27Å; M72-A74 PolarHBondContact O-N 3.28Å; M72-N75 WeakPolarHBondContact O-CB 3.36Å; M72-N75 PolarHBondContact O-N 3.3Å; M72-C78 HydrophobicContact CG-CB 3.78Å; M72-C78 WeakPolarHBondContact O-CB 3.37Å; M72-C78 HydrophobicContact SD-CB 3.61Å; M72-L82 HydrophobicContact CE-CD2 4.45Å; M72-L116 HydrophobicContact CE-CD2 3.4Å; M72-L116 VanDerWaalsContact CE-CD2 3.4Å
73	L	77.7	Confident	81.9	Confident	51 Å²	51	63.4 Å²	63.4	27%	0.267	36%	0.356	S	S	.	.	H	α-helix	trans	-65.4	-27.9	-178.7	-70.2	171.6	0	0	0	113	R69 N70 N75 L82	R69-L73 HydrophobicContact CG-CD1 3.99Å; R69-L73 HydrophobicContact CG-CG 4.35Å; R69-L73 VanDerWaalsContact CZ-CD1 3.49Å; R69-L73 WeakPolarHBondContact O-CB 3.3Å; R69-L73 VanDerWaalsContact O-CG 3.32Å; R69-L73 WeakPolarHBondContact O-CG 3.48Å; R69-L73 PolarHBondContact O-N 2.83Å; N70-L73 PolarHBondContact O-N 3.39Å; L73-N75 PolarHBondContact O-N 3.18Å; L73-L82 HydrophobicContact CD2-CD2 4.3Å
74	A	81.7	Confident	82	Confident	84 Å²	84	65.2 Å²	65.2	69%	0.694	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-19.1	170.5	0	0	0	0	0	113.5	N70 M72	N70-A74 WeakPolarHBondContact O-CB 3.41Å; N70-A74 PolarHBondContact O-N 3.28Å; M72-A74 VanDerWaalsContact C-N 3.27Å; M72-A74 PolarHBondContact O-N 3.28Å
75	N	87.3	Confident	82.5	Confident	47 Å²	47	64.6 Å²	64.6	25%	0.251	36%	0.363	S	S	.	.	S	Bend	trans	-94.2	112.1	172.9	-177	2.9	0	0	0	111.3	M72 L73 E77 C78 Q79	M72-N75 WeakPolarHBondContact O-CB 3.36Å; M72-N75 PolarHBondContact O-N 3.3Å; L73-N75 PolarHBondContact O-N 3.18Å; N75-E77 PolarHBondContact O-N 3.06Å; N75-E77 VanDerWaalsContact O-N 3.15Å; N75-E77 PolarHBondContact OD1-N 3.36Å; N75-C78 HydrophobicContact CB-CB 4.19Å; N75-C78 PolarHBondContact ND2-SG 2.85Å; N75-C78 WeakPolarHBondContact O-CA 3.37Å; N75-C78 WeakPolarHBondContact O-CB 3.37Å; N75-C78 PolarHBondContact O-N 2.83Å; N75-Q79 PolarHBondContact O-N 2.95Å
76	K	89.4	Confident	83.1	Confident	173 Å²	173	64.8 Å²	64.8	75%	0.752	35%	0.351	S	S	*	.	H	α-helix	trans	-55	-31.7	178.4	-62.7	-174.5	178.2	-175.8	0	114.1	C78 A80	K76-C78 VanDerWaalsContact C-N 3.34Å; K76-A80 VanDerWaalsContact O-CB 3.28Å; K76-A80 WeakPolarHBondContact O-CB 3.41Å; K76-A80 PolarHBondContact O-N 2.76Å
77	E	90.3	Very high	84.2	Confident	129 Å²	129	69.3 Å²	69.3	60%	0.603	35%	0.35	S	S	*	.	H	α-helix	trans	-69.5	-33.6	176.5	-64.7	-168.3	147	0	0	112.5	T59 N75 A81	T59-E77 HydrophobicContact CG2-CB 4.46Å; N75-E77 PolarHBondContact O-N 3.06Å; N75-E77 VanDerWaalsContact O-N 3.15Å; N75-E77 PolarHBondContact OD1-N 3.36Å; E77-A81 VanDerWaalsContact O-CB 3.29Å; E77-A81 WeakPolarHBondContact O-CB 3.49Å; E77-A81 PolarHBondContact O-N 3.39Å
78	C	89.2	Confident	85.4	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-75.2	-42.9	177.5	-56.7	0	0	0	0	111.1	C63 M72 N75 K76 A81 L82	C63-C78 HydrophobicContact CB-CB 3.62Å; C63-C78 WeakPolarHBondContact CB-SG 3.02Å; C63-C78 WeakPolarHBondContact SG-CA 3.45Å; C63-C78 WeakPolarHBondContact SG-CB 3.12Å; C63-C78 CovalentContact SG-SG 2.02Å; C63-C78 PolarHBondContact SG-SG 2.94Å; M72-C78 HydrophobicContact CG-CB 3.78Å; M72-C78 WeakPolarHBondContact O-CB 3.37Å; M72-C78 HydrophobicContact SD-CB 3.61Å; N75-C78 HydrophobicContact CB-CB 4.19Å; N75-C78 PolarHBondContact ND2-SG 2.85Å; N75-C78 WeakPolarHBondContact O-CA 3.37Å; N75-C78 WeakPolarHBondContact O-CB 3.37Å; N75-C78 PolarHBondContact O-N 2.83Å; K76-C78 VanDerWaalsContact C-N 3.34Å; C78-A81 PolarHBondContact O-N 2.69Å; C78-L82 PolarHBondContact O-N 3.29Å
79	Q	89.2	Confident	86.3	Confident	82 Å²	82	61.4 Å²	61.4	38%	0.383	32%	0.319	S	S	.	.	H	α-helix	trans	-58	-53.1	172.2	-175.2	-171.4	-21.4	0	0	111	N75 A81 L82 E83	N75-Q79 PolarHBondContact O-N 2.95Å; Q79-A81 PolarHBondContact O-N 2.99Å; Q79-L82 WeakPolarHBondContact O-CB 3.44Å; Q79-L82 PolarHBondContact O-N 3.35Å; Q79-E83 WeakPolarHBondContact CG-OE1 3.37Å; Q79-E83 PolarHBondContact NE2-OE1 2.91Å; Q79-E83 WeakPolarHBondContact O-CG 3.42Å; Q79-E83 PolarHBondContact O-N 3.21Å
80	A	91	Very high	87.2	Confident	29 Å²	29	58.4 Å²	58.4	24%	0.24	31%	0.308	C	S	.	.	H	α-helix	trans	-66.3	-17.8	178.4	0	0	0	0	0	113.7	K76 V84	K76-A80 VanDerWaalsContact O-CB 3.28Å; K76-A80 WeakPolarHBondContact O-CB 3.41Å; K76-A80 PolarHBondContact O-N 2.76Å; A80-V84 WeakPolarHBondContact O-CG2 3.32Å
81	A	91.9	Very high	87.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-79.7	-39.2	169	0	0	0	0	0	112.1	R56 T59 L60 E77 C78 Q79 L85	R56-A81 HydrophobicContact CB-CB 4.08Å; T59-A81 HydrophobicContact CG2-CB 3.94Å; L60-A81 HydrophobicContact CB-CB 4.24Å; E77-A81 VanDerWaalsContact O-CB 3.29Å; E77-A81 WeakPolarHBondContact O-CB 3.49Å; E77-A81 PolarHBondContact O-N 3.39Å; C78-A81 PolarHBondContact O-N 2.69Å; Q79-A81 PolarHBondContact O-N 2.99Å; A81-L85 WeakPolarHBondContact O-CB 3.39Å; A81-L85 VanDerWaalsContact O-CD1 3.32Å; A81-L85 WeakPolarHBondContact O-CD1 3.5Å; A81-L85 WeakPolarHBondContact O-CG 3.33Å; A81-L85 PolarHBondContact O-N 3Å; A81-L85 VanDerWaalsContact O-N 3.16Å
82	L	89.5	Confident	88.4	Confident	21 Å²	21	59 Å²	59	11%	0.11	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-48.3	174.9	177.8	58.2	0	0	0	111.7	L60 M72 L73 C78 Q79 V84 L85 Q86 Y91 L116	L60-L82 HydrophobicContact CD1-CB 4.43Å; L60-L82 HydrophobicContact CD2-CD1 4.35Å; M72-L82 HydrophobicContact CE-CD2 4.45Å; L73-L82 HydrophobicContact CD2-CD2 4.3Å; C78-L82 PolarHBondContact O-N 3.29Å; Q79-L82 WeakPolarHBondContact O-CB 3.44Å; Q79-L82 PolarHBondContact O-N 3.35Å; L82-V84 VanDerWaalsContact C-N 3.33Å; L82-V84 PolarHBondContact O-N 2.69Å; L82-L85 CarbonylContact O-C 3.45Å; L82-L85 PolarHBondContact O-N 2.94Å; L82-Q86 HydrophobicContact CD1-CG 4.3Å; L82-Q86 WeakPolarHBondContact O-CG 3.09Å; L82-Q86 PolarHBondContact O-N 3.05Å; L82-Y91 HydrophobicContact CD1-CE2 4.24Å; L82-L116 HydrophobicContact CD1-CD1 3.6Å; L82-L116 HydrophobicContact CD1-CD2 4.27Å; L82-L116 HydrophobicContact CD2-CD2 3.95Å
83	E	89.9	Confident	89.1	Confident	96 Å²	96	59 Å²	59	45%	0.449	30%	0.304	S	S	.	.	H	α-helix	trans	-56.5	-43.8	179.4	-70.3	166.4	176.4	0	0	112.2	Q79 L85	Q79-E83 WeakPolarHBondContact CG-OE1 3.37Å; Q79-E83 PolarHBondContact NE2-OE1 2.91Å; Q79-E83 WeakPolarHBondContact O-CG 3.42Å; Q79-E83 PolarHBondContact O-N 3.21Å; E83-L85 VanDerWaalsContact C-N 3.32Å; E83-L85 PolarHBondContact O-N 2.92Å
84	V	90.4	Very high	89.9	Confident	45 Å²	45	59.7 Å²	59.7	27%	0.273	30%	0.303	S	S	.	.	H	α-helix	trans	-70.5	-27.9	176.3	172.2	0	0	0	0	112.5	R56 A80 L82	R56-V84 HydrophobicContact CB-CB 4.43Å; R56-V84 HydrophobicContact CB-CG1 4.28Å; R56-V84 HydrophobicContact CG-CB 3.93Å; R56-V84 HydrophobicContact CG-CG1 3.77Å; R56-V84 HydrophobicContact CG-CG2 4.37Å; A80-V84 WeakPolarHBondContact O-CG2 3.32Å; L82-V84 VanDerWaalsContact C-N 3.33Å; L82-V84 PolarHBondContact O-N 2.69Å
85	L	91.3	Very high	90.5	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-83.1	-25.2	179.4	-72.2	167.8	0	0	0	113	R56 L60 A81 L82 E83 E87 S88 L90 Y91	R56-L85 HydrophobicContact CB-CD1 4.44Å; R56-L85 HydrophobicContact CB-CG 4.2Å; L60-L85 HydrophobicContact CB-CD1 3.74Å; L60-L85 HydrophobicContact CD2-CD1 3.54Å; L60-L85 HydrophobicContact CG-CD1 4.28Å; A81-L85 WeakPolarHBondContact O-CB 3.39Å; A81-L85 VanDerWaalsContact O-CD1 3.32Å; A81-L85 WeakPolarHBondContact O-CD1 3.5Å; A81-L85 WeakPolarHBondContact O-CG 3.33Å; A81-L85 PolarHBondContact O-N 3Å; A81-L85 VanDerWaalsContact O-N 3.16Å; L82-L85 CarbonylContact O-C 3.45Å; L82-L85 PolarHBondContact O-N 2.94Å; E83-L85 VanDerWaalsContact C-N 3.32Å; E83-L85 PolarHBondContact O-N 2.92Å; L85-E87 VanDerWaalsContact C-N 3.31Å; L85-E87 PolarHBondContact O-N 3.36Å; L85-S88 VanDerWaalsContact O-CB 3.27Å; L85-S88 WeakPolarHBondContact O-CB 3.37Å; L85-S88 PolarHBondContact O-N 3.01Å; L85-S88 PolarHBondContact O-OG 3.4Å; L85-L90 HydrophobicContact CD2-CD1 4.5Å; L85-Y91 WeakPolarHBondContact O-CB 3.49Å
86	Q	90.5	Very high	90.8	Very high	81 Å²	81	58.3 Å²	58.3	38%	0.379	28%	0.279	S	S	.	.	H	α-helix	trans	-57.7	-42.9	173.9	-79.3	171.8	-35.8	0	0	111.9	L82 S88 Y91	L82-Q86 HydrophobicContact CD1-CG 4.3Å; L82-Q86 WeakPolarHBondContact O-CG 3.09Å; L82-Q86 PolarHBondContact O-N 3.05Å; Q86-S88 PolarHBondContact O-N 3.13Å; Q86-Y91 HydrophobicContact CB-CD2 4.49Å; Q86-Y91 HydrophobicContact CG-CD1 4.48Å; Q86-Y91 HydrophobicContact CG-CD2 3.86Å; Q86-Y91 HydrophobicContact CG-CE1 4.21Å; Q86-Y91 HydrophobicContact CG-CE2 3.54Å; Q86-Y91 HydrophobicContact CG-CG 4.31Å; Q86-Y91 PolarHBondContact NE2-OH 2.69Å
87	E	89.6	Confident	90.7	Very high	177 Å²	177	53.6 Å²	53.6	83%	0.827	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	0.6	174.8	-61.2	-58.8	136.6	0	0	114	L85	L85-E87 VanDerWaalsContact C-N 3.31Å; L85-E87 PolarHBondContact O-N 3.36Å
88	S	90.6	Very high	90.5	Very high	14 Å²	14	49.7 Å²	49.7	10%	0.098	25%	0.25	C	S	.	.	S	Bend	trans	-96.8	153	-176.1	84.3	0	0	0	0	112.6	L85 Q86 L90 Y91	L85-S88 VanDerWaalsContact O-CB 3.27Å; L85-S88 WeakPolarHBondContact O-CB 3.37Å; L85-S88 PolarHBondContact O-N 3.01Å; L85-S88 PolarHBondContact O-OG 3.4Å; Q86-S88 PolarHBondContact O-N 3.13Å; S88-L90 PolarHBondContact O-N 2.97Å; S88-L90 PolarHBondContact OG-N 3.01Å; S88-Y91 PolarHBondContact O-N 3.13Å; S88-Y91 VanDerWaalsContact O-N 3.14Å
89	P	89.8	Confident	90.6	Very high	26 Å²	26	51.3 Å²	51.3	17%	0.169	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-9.5	175	-24.5	34.5	0	0	0	115.5	V38 A43	V38-P89 HydrophobicContact CG2-CB 4.02Å; A43-P89 HydrophobicContact CB-CB 4.17Å; A43-P89 WeakPolarHBondContact CB-O 3.48Å
90	L	91.4	Very high	90.7	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-30.8	176.5	-83.5	174.1	0	0	0	113.5	A43 N44 C47 Y57 L85 S88 C93 I108 I112	A43-L90 HydrophobicContact CB-CD2 3.85Å; A43-L90 HydrophobicContact CB-CG 4.21Å; N44-L90 HydrophobicContact CB-CD2 4.05Å; C47-L90 HydrophobicContact CB-CD1 3.71Å; C47-L90 HydrophobicContact CB-CG 4.12Å; C47-L90 VanDerWaalsContact SG-CD1 3.5Å; Y57-L90 HydrophobicContact CD1-CD1 4.47Å; Y57-L90 HydrophobicContact CD2-CD1 3.89Å; Y57-L90 HydrophobicContact CE2-CD1 4.17Å; Y57-L90 HydrophobicContact CG-CD1 4.05Å; L85-L90 HydrophobicContact CD2-CD1 4.5Å; S88-L90 PolarHBondContact O-N 2.97Å; S88-L90 PolarHBondContact OG-N 3.01Å; L90-C93 WeakPolarHBondContact O-CB 3.46Å; L90-C93 PolarHBondContact O-N 2.69Å; L90-C93 PolarHBondContact O-SG 2.84Å; L90-I108 HydrophobicContact CD2-CG2 3.57Å; L90-I112 HydrophobicContact CB-CD1 4.12Å; L90-I112 VanDerWaalsContact O-CD1 3.26Å; L90-I112 WeakPolarHBondContact O-CD1 3.28Å
91	Y	89.3	Confident	90.9	Very high	71 Å²	71	60.9 Å²	60.9	28%	0.278	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-58.9	-170.4	-168.1	-106.6	0	0	0	111.7	L82 L85 Q86 S88 C93 H113	L82-Y91 HydrophobicContact CD1-CE2 4.24Å; L85-Y91 WeakPolarHBondContact O-CB 3.49Å; Q86-Y91 HydrophobicContact CB-CD2 4.49Å; Q86-Y91 HydrophobicContact CG-CD1 4.48Å; Q86-Y91 HydrophobicContact CG-CD2 3.86Å; Q86-Y91 HydrophobicContact CG-CE1 4.21Å; Q86-Y91 HydrophobicContact CG-CE2 3.54Å; Q86-Y91 HydrophobicContact CG-CG 4.31Å; Q86-Y91 PolarHBondContact NE2-OH 2.69Å; S88-Y91 PolarHBondContact O-N 3.13Å; S88-Y91 VanDerWaalsContact O-N 3.14Å; Y91-C93 VanDerWaalsContact C-N 3.25Å; Y91-C93 PolarHBondContact O-N 3.27Å; Y91-H113 PolarHBondContact O-CE1 2.9Å; Y91-H113 VanDerWaalsContact O-CE1 3.23Å; Y91-H113 PolarHBondContact O-NE2 3.12Å
92	D	88.1	Confident	91.1	Very high	111 Å²	111	61.8 Å²	61.8	59%	0.594	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	22.1	176.2	-84.3	-57	0	0	0	114.5	R94	D92-R94 VanDerWaalsContact C-NH1 3.32Å; D92-R94 PolarHBondContact O-NH1 3.2Å; D92-R94 IonicContact OD1-CZ 3.77Å; D92-R94 IonicContact OD1-NH1 2.78Å; D92-R94 IonicContact OD1-NH2 2.67Å; D92-R94 PolarHBondContact OD1-NH2 3.41Å
93	C	93.4	Very high	91.4	Very high	2 Å²	2	64.3 Å²	64.3	1%	0.014	31%	0.311	C	S	.	.			trans	-63.7	145.4	171.2	83.2	0	0	0	0	110.8	C40 A43 L90 Y91	C40-C93 WeakPolarHBondContact CA-SG 3.37Å; C40-C93 HydrophobicContact CB-CB 3.87Å; C40-C93 WeakPolarHBondContact CB-SG 3.43Å; C40-C93 WeakPolarHBondContact SG-CB 3.08Å; C40-C93 CovalentContact SG-SG 2.04Å; C40-C93 PolarHBondContact SG-SG 3.31Å; A43-C93 HydrophobicContact CB-CB 4.02Å; L90-C93 WeakPolarHBondContact O-CB 3.46Å; L90-C93 PolarHBondContact O-N 2.69Å; L90-C93 PolarHBondContact O-SG 2.84Å; Y91-C93 VanDerWaalsContact C-N 3.25Å; Y91-C93 PolarHBondContact O-N 3.27Å
94	R	94	Very high	91.8	Very high	64 Å²	64	63.7 Å²	63.7	24%	0.242	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-131.9	169.2	174.9	-61	-64.6	178	-89.3	-8.1	110.5	D39 C40 D92 P127 E129	D39-R94 VanDerWaalsContact CA-O 3.27Å; D39-R94 WeakPolarHBondContact CA-O 3.43Å; C40-R94 PolarHBondContact N-O 3.03Å; D92-R94 VanDerWaalsContact C-NH1 3.32Å; D92-R94 PolarHBondContact O-NH1 3.2Å; D92-R94 IonicContact OD1-CZ 3.77Å; D92-R94 IonicContact OD1-NH1 2.78Å; D92-R94 IonicContact OD1-NH2 2.67Å; D92-R94 PolarHBondContact OD1-NH2 3.41Å; R94-P127 CarbonylContact C-O 3.57Å; R94-P127 VanDerWaalsContact CA-O 3.25Å; R94-P127 WeakPolarHBondContact CA-O 3.31Å; R94-P127 WeakPolarHBondContact CB-O 3.37Å; R94-E129 HydrophobicContact CB-CG 3.73Å
95	C	95.3	Very high	92.1	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-119	161	-178.7	-63	0	0	0	0	111.6	M99 C105 L106 P127 Y128 E129	C95-M99 HydrophobicContact CB-SD 4.18Å; C95-C105 WeakPolarHBondContact CA-SG 3.48Å; C95-C105 HydrophobicContact CB-CB 3.99Å; C95-C105 WeakPolarHBondContact CB-SG 3.44Å; C95-C105 WeakPolarHBondContact SG-CB 3.35Å; C95-C105 CovalentContact SG-SG 2.04Å; C95-C105 PolarHBondContact SG-SG 3.27Å; C95-L106 HydrophobicContact CB-CD2 3.94Å; C95-P127 PolarHBondContact N-O 2.92Å; C95-Y128 HydrophobicContact CB-CD1 4.18Å; C95-Y128 HydrophobicContact CB-CE1 4.5Å; C95-Y128 CarbonylContact O-C 3.29Å; C95-Y128 VanDerWaalsContact O-CA 3.23Å; C95-Y128 WeakPolarHBondContact O-CA 3.47Å; C95-E129 PolarHBondContact O-N 3.23Å
96	K	91.8	Very high	92.4	Very high	103 Å²	103	61.5 Å²	61.5	45%	0.448	30%	0.295	S	S	.	.			trans	-114.9	128.2	177.9	-75.5	176	159.9	93.8	0	110.1	G98 M99 E129	K96-G98 PolarHBondContact O-N 3.39Å; K96-M99 HydrophobicContact CB-CB 4.08Å; K96-M99 HydrophobicContact CB-SD 4.23Å; K96-M99 PolarHBondContact N-SD 2.81Å; K96-M99 VanDerWaalsContact N-SD 3.35Å; K96-M99 VanDerWaalsContact O-CB 3.26Å; K96-M99 WeakPolarHBondContact O-CB 3.29Å; K96-M99 WeakPolarHBondContact O-CG 3.04Å; K96-M99 PolarHBondContact O-N 3.17Å; K96-M99 VanDerWaalsContact O-N 3.13Å; K96-E129 WeakPolarHBondContact CE-OE2 3.35Å; K96-E129 IonicContact NZ-OE1 2.69Å; K96-E129 PolarHBondContact NZ-OE1 2.66Å; K96-E129 IonicContact NZ-OE2 2.75Å; K96-E129 PolarHBondContact NZ-OE2 3.26Å
97	R	88	Confident	92.6	Very high	74 Å²	74	61.9 Å²	61.9	28%	0.279	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	132.2	174.2	-71.2	167.5	159	-112.7	-3.7	109.8	M99 Y128 D270 G295	R97-M99 VanDerWaalsContact C-N 3.28Å; R97-M99 PolarHBondContact O-N 3.13Å; R97-Y128 HydrophobicContact CG-CD1 3.65Å; R97-Y128 HydrophobicContact CG-CE1 3.69Å; R97-Y128 HydrophobicContact CG-CG 4.08Å; R97-D270 IonicContact CZ-OD2 3.31Å; R97-D270 IonicContact NE-OD2 3.72Å; R97-D270 PolarHBondContact NE-OD2 3.33Å; R97-D270 IonicContact NH2-OD2 2.76Å; R97-D270 PolarHBondContact NH2-OD2 2.89Å; R97-G295 PolarHBondContact NH1-O 3.19Å
98	G	85.6	Confident	92.9	Very high	46 Å²	46	53.9 Å²	53.9	47%	0.474	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	4	-178.6	0	0	0	0	0	115.5	K96 E102	K96-G98 PolarHBondContact O-N 3.39Å; G98-E102 WeakPolarHBondContact CA-OE2 3.38Å; G98-E102 PolarHBondContact N-OE2 3.2Å
99	M	91.5	Very high	93.1	Very high	34 Å²	34	53.4 Å²	53.4	17%	0.167	26%	0.255	C	S	.	.			trans	-65.4	147	179.6	74.5	-172.7	-71.1	0	0	112	D39 C95 K96 R97 K101 E102 C105	D39-M99 HydrophobicContact CB-CE 3.93Å; D39-M99 WeakPolarHBondContact OD2-CE 3.46Å; C95-M99 HydrophobicContact CB-SD 4.18Å; K96-M99 HydrophobicContact CB-CB 4.08Å; K96-M99 HydrophobicContact CB-SD 4.23Å; K96-M99 PolarHBondContact N-SD 2.81Å; K96-M99 VanDerWaalsContact N-SD 3.35Å; K96-M99 VanDerWaalsContact O-CB 3.26Å; K96-M99 WeakPolarHBondContact O-CB 3.29Å; K96-M99 WeakPolarHBondContact O-CG 3.04Å; K96-M99 PolarHBondContact O-N 3.17Å; K96-M99 VanDerWaalsContact O-N 3.13Å; R97-M99 VanDerWaalsContact C-N 3.28Å; R97-M99 PolarHBondContact O-N 3.13Å; M99-K101 PolarHBondContact O-N 3.29Å; M99-E102 VanDerWaalsContact CG-CA 3.46Å; M99-E102 HydrophobicContact CG-CB 3.75Å; M99-E102 HydrophobicContact CG-CG 4.37Å; M99-E102 WeakPolarHBondContact O-CB 3.35Å; M99-E102 PolarHBondContact O-N 3.4Å; M99-C105 HydrophobicContact CE-CB 4.07Å; M99-C105 HydrophobicContact SD-CB 3.74Å
100	K	91.3	Very high	93.2	Very high	220 Å²	220	52.6 Å²	52.6	96%	0.957	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	-24.7	-174.5	-173.6	176.7	178.1	-178.1	0	114.9
101	K	95.5	Very high	93.1	Very high	92 Å²	92	53.6 Å²	53.6	40%	0.4	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	26.4	179.7	-73.8	-179.2	167.7	-177.7	0	113	V41 E45 M99 L103 Q104 C105	V41-K101 HydrophobicContact CB-CD 4.43Å; V41-K101 HydrophobicContact CG1-CD 3.69Å; V41-K101 HydrophobicContact CG2-CB 4.05Å; V41-K101 HydrophobicContact CG2-CD 4.17Å; E45-K101 IonicContact OE1-NZ 3.68Å; M99-K101 PolarHBondContact O-N 3.29Å; K101-L103 PolarHBondContact O-N 3.37Å; K101-Q104 HydrophobicContact CB-CB 4.32Å; K101-Q104 WeakPolarHBondContact O-CA 3.32Å; K101-Q104 WeakPolarHBondContact O-CB 3.03Å; K101-Q104 PolarHBondContact O-N 3.4Å; K101-C105 PolarHBondContact O-N 3.18Å
102	E	95.7	Very high	93	Very high	20 Å²	20	50.3 Å²	50.3	9%	0.093	24%	0.243	C	C	.	.	H	α-helix	trans	-48.2	-52.6	-171.6	-169.6	171.8	177.9	0	0	113.3	G98 M99 Q104 C105 L106 Y128 L263 R267	G98-E102 WeakPolarHBondContact CA-OE2 3.38Å; G98-E102 PolarHBondContact N-OE2 3.2Å; M99-E102 VanDerWaalsContact CG-CA 3.46Å; M99-E102 HydrophobicContact CG-CB 3.75Å; M99-E102 HydrophobicContact CG-CG 4.37Å; M99-E102 WeakPolarHBondContact O-CB 3.35Å; M99-E102 PolarHBondContact O-N 3.4Å; E102-Q104 VanDerWaalsContact C-N 3.31Å; E102-Q104 PolarHBondContact O-N 2.83Å; E102-C105 WeakPolarHBondContact O-CB 3.02Å; E102-C105 PolarHBondContact O-N 2.87Å; E102-C105 VanDerWaalsContact O-N 3.1Å; E102-L106 HydrophobicContact CG-CD1 4.2Å; E102-L106 WeakPolarHBondContact O-CG 3.01Å; E102-L106 PolarHBondContact O-N 3.14Å; E102-Y128 HydrophobicContact CG-CE1 4.44Å; E102-Y128 WeakPolarHBondContact OE1-CE1 3.35Å; E102-Y128 PolarHBondContact OE1-OH 3.12Å; E102-L263 HydrophobicContact CG-CD2 3.94Å; E102-R267 IonicContact OE1-CZ 3.51Å; E102-R267 IonicContact OE1-NE 3.47Å; E102-R267 PolarHBondContact OE1-NE 3.34Å; E102-R267 IonicContact OE1-NH2 2.92Å; E102-R267 PolarHBondContact OE1-NH2 3.47Å; E102-R267 IonicContact OE2-NH2 2.8Å
103	L	96.5	Very high	92.7	Very high	74 Å²	74	46 Å²	46	39%	0.387	22%	0.22	S	C	.	.	H	α-helix	trans	-58.6	-38.4	177.7	179.7	61.4	0	0	0	113.3	K101 Q107 H262 L263	K101-L103 PolarHBondContact O-N 3.37Å; L103-Q107 HydrophobicContact CD1-CG 4.37Å; L103-Q107 WeakPolarHBondContact O-CB 3.45Å; L103-Q107 VanDerWaalsContact O-CG 3.23Å; L103-Q107 WeakPolarHBondContact O-CG 3.08Å; L103-Q107 PolarHBondContact O-N 3.49Å; L103-H262 HydrophobicContact CD1-CB 4.21Å; L103-L263 HydrophobicContact CB-CD1 4.46Å; L103-L263 HydrophobicContact CD1-CD1 4.21Å; L103-L263 HydrophobicContact CD1-CG 4.23Å
104	Q	97.6	Very high	91.7	Very high	82 Å²	82	49.7 Å²	49.7	38%	0.383	24%	0.238	S	C	.	.	H	α-helix	trans	-69.7	-39.4	176.9	-174.5	-179.1	9.5	0	0	111.1	V41 K101 E102 Q107 I108	V41-Q104 HydrophobicContact CG2-CG 4.42Å; K101-Q104 HydrophobicContact CB-CB 4.32Å; K101-Q104 WeakPolarHBondContact O-CA 3.32Å; K101-Q104 WeakPolarHBondContact O-CB 3.03Å; K101-Q104 PolarHBondContact O-N 3.4Å; E102-Q104 VanDerWaalsContact C-N 3.31Å; E102-Q104 PolarHBondContact O-N 2.83Å; Q104-Q107 PolarHBondContact O-N 3.47Å; Q104-I108 HydrophobicContact CG-CD1 4.14Å; Q104-I108 WeakPolarHBondContact O-CD1 3.48Å; Q104-I108 VanDerWaalsContact O-CG1 3.29Å; Q104-I108 WeakPolarHBondContact O-CG1 3Å; Q104-I108 PolarHBondContact O-N 3.24Å
105	C	97.6	Very high	90.3	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60	-48.9	175.5	-170.9	0	0	0	0	110.9	C40 V41 C95 M99 K101 E102 I108 Y109	C40-C105 VanDerWaalsContact CB-SG 3.6Å; V41-C105 HydrophobicContact CG2-CB 3.89Å; C95-C105 WeakPolarHBondContact CA-SG 3.48Å; C95-C105 HydrophobicContact CB-CB 3.99Å; C95-C105 WeakPolarHBondContact CB-SG 3.44Å; C95-C105 WeakPolarHBondContact SG-CB 3.35Å; C95-C105 CovalentContact SG-SG 2.04Å; C95-C105 PolarHBondContact SG-SG 3.27Å; M99-C105 HydrophobicContact CE-CB 4.07Å; M99-C105 HydrophobicContact SD-CB 3.74Å; K101-C105 PolarHBondContact O-N 3.18Å; E102-C105 WeakPolarHBondContact O-CB 3.02Å; E102-C105 PolarHBondContact O-N 2.87Å; E102-C105 VanDerWaalsContact O-N 3.1Å; C105-I108 PolarHBondContact O-N 2.02Å; C105-Y109 PolarHBondContact O-N 2.04Å
106	L	96.6	Very high	88.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-66.2	-39.3	178.4	-61.8	177	0	0	0	112.4	C95 E102 I108 Y109 W110 P127 Y128 H262 L263 S266	C95-L106 HydrophobicContact CB-CD2 3.94Å; E102-L106 HydrophobicContact CG-CD1 4.2Å; E102-L106 WeakPolarHBondContact O-CG 3.01Å; E102-L106 PolarHBondContact O-N 3.14Å; L106-I108 VanDerWaalsContact C-N 3.28Å; L106-I108 PolarHBondContact O-N 3.47Å; L106-Y109 PolarHBondContact O-N 3.4Å; L106-W110 WeakPolarHBondContact O-CB 3.24Å; L106-W110 PolarHBondContact O-N 3.43Å; L106-P127 HydrophobicContact CD2-CB 3.86Å; L106-P127 HydrophobicContact CD2-CG 3.54Å; L106-Y128 HydrophobicContact CD2-CE1 4.19Å; L106-H262 HydrophobicContact CB-CB 4.32Å; L106-L263 HydrophobicContact CD1-CD2 3.63Å; L106-L263 HydrophobicContact CD1-CG 4.17Å; L106-S266 WeakPolarHBondContact CD2-OG 3.47Å
107	Q	95.5	Very high	87	Confident	90 Å²	90	47.4 Å²	47.4	42%	0.421	25%	0.245	S	C	.	.	H	α-helix	trans	-59.5	-37.7	173.4	-81.5	172.7	-23	0	0	112.4	L103 Q104 S111 H262	L103-Q107 HydrophobicContact CD1-CG 4.37Å; L103-Q107 WeakPolarHBondContact O-CB 3.45Å; L103-Q107 VanDerWaalsContact O-CG 3.23Å; L103-Q107 WeakPolarHBondContact O-CG 3.08Å; L103-Q107 PolarHBondContact O-N 3.49Å; Q104-Q107 PolarHBondContact O-N 3.47Å; Q107-S111 VanDerWaalsContact O-CB 3.26Å; Q107-S111 WeakPolarHBondContact O-CB 3.38Å; Q107-S111 PolarHBondContact O-N 2.73Å; Q107-S111 VanDerWaalsContact O-N 3.12Å; Q107-S111 PolarHBondContact O-OG 3.34Å; Q107-H262 VanDerWaalsContact CG-CD2 3.49Å; Q107-H262 WeakPolarHBondContact CG-CD2 3.43Å
108	I	95.3	Very high	84.9	Confident	8 Å²	8	50 Å²	50	4%	0.041	26%	0.261	C	S	.	.	H	α-helix	trans	-69.1	-51.6	175.3	-67.2	159.2	0	0	0	110.1	C40 V41 N44 L90 Q104 C105 L106 W110 S111	C40-I108 HydrophobicContact CB-CB 4.12Å; C40-I108 HydrophobicContact CB-CG2 3.94Å; V41-I108 HydrophobicContact CG2-CD1 4.34Å; N44-I108 HydrophobicContact CB-CD1 3.74Å; N44-I108 HydrophobicContact CB-CG1 4.34Å; N44-I108 HydrophobicContact CB-CG2 4.1Å; L90-I108 HydrophobicContact CD2-CG2 3.57Å; Q104-I108 HydrophobicContact CG-CD1 4.14Å; Q104-I108 WeakPolarHBondContact O-CD1 3.48Å; Q104-I108 VanDerWaalsContact O-CG1 3.29Å; Q104-I108 WeakPolarHBondContact O-CG1 3Å; Q104-I108 PolarHBondContact O-N 3.24Å; C105-I108 PolarHBondContact O-N 2.02Å; L106-I108 VanDerWaalsContact C-N 3.28Å; L106-I108 PolarHBondContact O-N 3.47Å; I108-W110 PolarHBondContact O-N 3.45Å; I108-S111 PolarHBondContact O-N 3.01Å; I108-S111 PolarHBondContact O-OG 3.49Å
109	Y	94.5	Very high	83.2	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-52.5	-53.2	178.2	178.5	-85.1	0	0	0	111.9	C105 L106 S111 I112 H113 P127	C105-Y109 PolarHBondContact O-N 2.04Å; L106-Y109 PolarHBondContact O-N 3.4Å; Y109-S111 VanDerWaalsContact C-N 3.25Å; Y109-S111 PolarHBondContact O-N 3.37Å; Y109-I112 WeakPolarHBondContact O-CG1 3.45Å; Y109-I112 PolarHBondContact O-N 3.08Å; Y109-H113 HydrophobicContact CD1-CB 4.15Å; Y109-H113 AromaticContact CD1-ND1 3.77Å; Y109-H113 AromaticContact CD2-CE1 3.56Å; Y109-H113 AromaticContact CD2-ND1 3.5Å; Y109-H113 WeakPolarHBondContact CD2-ND1 3.31Å; Y109-H113 HydrophobicContact CE1-CB 3.71Å; Y109-H113 AromaticContact CE1-CG 3.6Å; Y109-H113 AromaticContact CE1-ND1 3.66Å; Y109-H113 AromaticContact CE2-CE1 3.24Å; Y109-H113 WeakPolarHBondContact CE2-CE1 3.19Å; Y109-H113 AromaticContact CE2-CG 3.9Å; Y109-H113 AromaticContact CE2-ND1 3.38Å; Y109-H113 WeakPolarHBondContact CE2-ND1 3.41Å; Y109-H113 AromaticContact CE2-NE2 3.65Å; Y109-H113 AromaticContact CG-ND1 3.69Å; Y109-H113 AromaticContact CZ-CD2 3.68Å; Y109-H113 AromaticContact CZ-CE1 3.66Å; Y109-H113 AromaticContact CZ-CG 3.48Å; Y109-H113 VanDerWaalsContact CZ-CG 3.48Å; Y109-H113 AromaticContact CZ-ND1 3.46Å; Y109-H113 AromaticContact CZ-NE2 3.78Å; Y109-H113 PolarHBondContact O-N 3.07Å; Y109-H113 PolarHBondContact O-ND1 3.33Å; Y109-P127 HydrophobicContact CD1-CB 3.54Å; Y109-P127 HydrophobicContact CD2-CB 3.81Å; Y109-P127 HydrophobicContact CE1-CB 3.66Å; Y109-P127 HydrophobicContact CE2-CB 3.93Å; Y109-P127 HydrophobicContact CG-CB 3.62Å
110	W	92.2	Very high	81.4	Confident	10 Å²	10	55.2 Å²	55.2	4%	0.038	29%	0.294	C	S	.	.	H	α-helix	trans	-67	-25.5	-179.9	-70.3	120.8	0	0	0	112.6	L106 I108 I112 H113 L114 E124 H262 R265 S266	L106-W110 WeakPolarHBondContact O-CB 3.24Å; L106-W110 PolarHBondContact O-N 3.43Å; I108-W110 PolarHBondContact O-N 3.45Å; W110-I112 PolarHBondContact O-N 3.26Å; W110-H113 HydrophobicContact CE3-CB 4.46Å; W110-L114 WeakPolarHBondContact O-CB 3.41Å; W110-L114 PolarHBondContact O-N 3.18Å; W110-E124 HydrophobicContact CH2-CB 4.28Å; W110-E124 VanDerWaalsContact CH2-OE2 3.24Å; W110-E124 WeakPolarHBondContact CH2-OE2 3.18Å; W110-E124 WeakPolarHBondContact CZ3-OE2 3.24Å; W110-H262 AromaticContact CD1-CG 3.87Å; W110-H262 AromaticContact CD1-ND1 3.14Å; W110-H262 AromaticContact CG-ND1 3.57Å; W110-R265 HydrophobicContact CH2-CG 4.19Å; W110-R265 HydrophobicContact CZ2-CB 4.5Å; W110-R265 HydrophobicContact CZ2-CG 3.73Å; W110-S266 PolarHBondContact NE1-OG 3.44Å
111	S	90.2	Very high	80.2	Confident	20 Å²	20	52 Å²	52	14%	0.14	28%	0.282	C	S	.	.	H	α-helix	trans	-68.8	-12	178.4	75.3	0	0	0	0	114.7	Y57 R61 Q107 I108 Y109	Y57-S111 PolarHBondContact OH-OG 3.21Å; R61-S111 WeakPolarHBondContact CG-O 3.49Å; Q107-S111 VanDerWaalsContact O-CB 3.26Å; Q107-S111 WeakPolarHBondContact O-CB 3.38Å; Q107-S111 PolarHBondContact O-N 2.73Å; Q107-S111 VanDerWaalsContact O-N 3.12Å; Q107-S111 PolarHBondContact O-OG 3.34Å; I108-S111 PolarHBondContact O-N 3.01Å; I108-S111 PolarHBondContact O-OG 3.49Å; Y109-S111 VanDerWaalsContact C-N 3.25Å; Y109-S111 PolarHBondContact O-N 3.37Å
112	I	86.3	Confident	79.6	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.015	27%	0.268	C	S	.	.	H	α-helix	trans	-114.8	-33.3	169.7	68.2	-179.7	0	0	0	112.6	Y57 L60 L64 L90 Y109 W110 L116	Y57-I112 HydrophobicContact CD2-CG2 3.84Å; Y57-I112 HydrophobicContact CE2-CG2 3.79Å; L60-I112 HydrophobicContact CD2-CB 4.11Å; L60-I112 HydrophobicContact CD2-CG2 4.2Å; L64-I112 VanDerWaalsContact CD1-O 3.24Å; L64-I112 WeakPolarHBondContact CD1-O 3.14Å; L90-I112 HydrophobicContact CB-CD1 4.12Å; L90-I112 VanDerWaalsContact O-CD1 3.26Å; L90-I112 WeakPolarHBondContact O-CD1 3.28Å; Y109-I112 WeakPolarHBondContact O-CG1 3.45Å; Y109-I112 PolarHBondContact O-N 3.08Å; W110-I112 PolarHBondContact O-N 3.26Å; I112-L116 WeakPolarHBondContact O-CD1 3.49Å; I112-L116 VanDerWaalsContact O-CG 3.23Å; I112-L116 WeakPolarHBondContact O-CG 3.07Å
113	H	82.2	Confident	79.2	Confident	21 Å²	21	50.2 Å²	50.2	10%	0.097	27%	0.273	C	S	.	.	H	α-helix	trans	-82.4	-20	-177.3	-69.7	88.4	0	0	0	114.4	Y91 Y109 W110 G115 L116	Y91-H113 PolarHBondContact O-CE1 2.9Å; Y91-H113 VanDerWaalsContact O-CE1 3.23Å; Y91-H113 PolarHBondContact O-NE2 3.12Å; Y109-H113 HydrophobicContact CD1-CB 4.15Å; Y109-H113 AromaticContact CD1-ND1 3.77Å; Y109-H113 AromaticContact CD2-CE1 3.56Å; Y109-H113 AromaticContact CD2-ND1 3.5Å; Y109-H113 WeakPolarHBondContact CD2-ND1 3.31Å; Y109-H113 HydrophobicContact CE1-CB 3.71Å; Y109-H113 AromaticContact CE1-CG 3.6Å; Y109-H113 AromaticContact CE1-ND1 3.66Å; Y109-H113 AromaticContact CE2-CE1 3.24Å; Y109-H113 WeakPolarHBondContact CE2-CE1 3.19Å; Y109-H113 AromaticContact CE2-CG 3.9Å; Y109-H113 AromaticContact CE2-ND1 3.38Å; Y109-H113 WeakPolarHBondContact CE2-ND1 3.41Å; Y109-H113 AromaticContact CE2-NE2 3.65Å; Y109-H113 AromaticContact CG-ND1 3.69Å; Y109-H113 AromaticContact CZ-CD2 3.68Å; Y109-H113 AromaticContact CZ-CE1 3.66Å; Y109-H113 AromaticContact CZ-CG 3.48Å; Y109-H113 VanDerWaalsContact CZ-CG 3.48Å; Y109-H113 AromaticContact CZ-ND1 3.46Å; Y109-H113 AromaticContact CZ-NE2 3.78Å; Y109-H113 PolarHBondContact O-N 3.07Å; Y109-H113 PolarHBondContact O-ND1 3.33Å; W110-H113 HydrophobicContact CE3-CB 4.46Å; H113-G115 PolarHBondContact O-N 3.35Å; H113-L116 PolarHBondContact O-N 2.97Å; H113-L116 VanDerWaalsContact O-N 3.07Å
114	L	73.4	Confident	78.8	Confident	78 Å²	78	47.7 Å²	47.7	41%	0.408	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	110	-179.8	176.8	65.7	0	0	0	110.6	L64 W110	L64-L114 WeakPolarHBondContact CD2-O 3.49Å; W110-L114 WeakPolarHBondContact O-CB 3.41Å; W110-L114 PolarHBondContact O-N 3.18Å
115	G	63.8	Low	78.5	Confident	31 Å²	31	46 Å²	46	32%	0.32	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	10.3	179.6	0	0	0	0	0	115	R69 H113	R69-G115 WeakPolarHBondContact CB-O 3.38Å; R69-G115 WeakPolarHBondContact CG-O 3.44Å; H113-G115 PolarHBondContact O-N 3.35Å
116	L	59	Low	78.3	Confident	29 Å²	29	46.9 Å²	46.9	15%	0.152	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-27.3	169.2	-70.2	-172.1	0	0	0	113.6	L64 M72 L82 I112 H113 E118	L64-L116 HydrophobicContact CD2-CD2 4.3Å; M72-L116 HydrophobicContact CE-CD2 3.4Å; M72-L116 VanDerWaalsContact CE-CD2 3.4Å; L82-L116 HydrophobicContact CD1-CD1 3.6Å; L82-L116 HydrophobicContact CD1-CD2 4.27Å; L82-L116 HydrophobicContact CD2-CD2 3.95Å; I112-L116 WeakPolarHBondContact O-CD1 3.49Å; I112-L116 VanDerWaalsContact O-CG 3.23Å; I112-L116 WeakPolarHBondContact O-CG 3.07Å; H113-L116 PolarHBondContact O-N 2.97Å; H113-L116 VanDerWaalsContact O-N 3.07Å; L116-E118 PolarHBondContact O-N 2.96Å
117	T	58	Low	78.1	Confident	59 Å²	59	46.9 Å²	46.9	36%	0.362	27%	0.266	S	S	.	.	S	Bend	trans	-68.7	107.8	-178.8	50.2	0	0	0	0	111.4
118	E	45.1	Very low	78.1	Confident	129 Å²	129	42.9 Å²	42.9	60%	0.603	25%	0.247	S	C	*	.			trans	-64.5	137.5	171.2	-75.6	-172.5	150.3	0	0	111.9	R69 L116 E120	R69-E118 IonicContact CZ-OE1 2.78Å; R69-E118 IonicContact NH1-OE1 2.71Å; R69-E118 PolarHBondContact NH1-OE1 3.34Å; R69-E118 IonicContact NH2-OE1 3.96Å; R69-E118 PolarHBondContact NH2-OE1 2.97Å; L116-E118 PolarHBondContact O-N 2.96Å; E118-E120 PolarHBondContact O-N 3.27Å
119	G	48.8	Very low	77.9	Confident	81 Å²	81	45.5 Å²	45.5	84%	0.835	26%	0.259	S	S	*	.	S	Bend	trans	69.3	-33.6	159.4	0	0	0	0	0	117	E121	G119-E121 PolarHBondContact O-N 3.29Å; G119-E121 VanDerWaalsContact O-N 3.09Å
120	E	54.6	Low	77.4	Confident	109 Å²	109	50 Å²	50	51%	0.509	29%	0.289	S	S	.	.			trans	-86.6	41.2	-177.6	-53.9	-159.3	115.7	0	0	112.3	E118 F122 Y123	E118-E120 PolarHBondContact O-N 3.27Å; E120-F122 PolarHBondContact O-N 3.24Å; E120-Y123 VanDerWaalsContact CB-O 3.29Å; E120-Y123 WeakPolarHBondContact CB-O 3.41Å; E120-Y123 CarbonylContact O-C 3.58Å; E120-Y123 VanDerWaalsContact O-C 3.29Å; E120-Y123 PolarHBondContact O-N 2.98Å; E120-Y123 VanDerWaalsContact O-O 3.09Å
121	E	66.3	Low	76.7	Confident	152 Å²	152	51.5 Å²	51.5	71%	0.71	30%	0.299	S	S	*	.	S	Bend	trans	-58.1	-14.5	165.6	-74.8	-161.7	-169.3	0	0	112.2	G119 R255 R259	G119-E121 PolarHBondContact O-N 3.29Å; G119-E121 VanDerWaalsContact O-N 3.09Å; E121-R255 PolarHBondContact O-NH2 3.46Å; E121-R259 PolarHBondContact O-NH1 2.59Å; E121-R259 VanDerWaalsContact O-NH1 3.13Å; E121-R259 PolarHBondContact O-NH2 2.83Å
122	F	81.7	Confident	75.6	Confident	23 Å²	23	56.8 Å²	56.8	10%	0.101	33%	0.33	C	S	.	.	S	Bend	trans	-73.6	-57.1	167	-158.9	-104.5	0	0	0	113.1	E120 R255 E334 K337 F338	E120-F122 PolarHBondContact O-N 3.24Å; F122-R255 VanDerWaalsContact CA-NH2 3.32Å; F122-R255 PolarHBondContact O-NH2 3.09Å; F122-E334 HydrophobicContact CD2-CG 3.64Å; F122-E334 WeakPolarHBondContact CD2-OE1 3.47Å; F122-E334 HydrophobicContact CE2-CG 3.43Å; F122-E334 VanDerWaalsContact CE2-CG 3.43Å; F122-K337 HydrophobicContact CD1-CD 4.29Å; F122-K337 HydrophobicContact CE1-CD 3.77Å; F122-K337 HydrophobicContact CE1-CG 3.89Å; F122-K337 HydrophobicContact CE2-CD 4.16Å; F122-K337 HydrophobicContact CE2-CG 4.46Å; F122-K337 HydrophobicContact CZ-CB 4.04Å; F122-K337 HydrophobicContact CZ-CD 3.7Å; F122-K337 HydrophobicContact CZ-CG 3.67Å; F122-F338 HydrophobicContact CE2-CB 4.12Å; F122-F338 HydrophobicContact CZ-CB 3.85Å
123	Y	87.3	Confident	74.5	Confident	51 Å²	51	59.7 Å²	59.7	20%	0.2	35%	0.351	C	S	.	.	S	Bend	trans	-116.4	107.6	-175.1	-63.5	-45.6	0	0	0	112.1	E120 H272 D341	E120-Y123 VanDerWaalsContact CB-O 3.29Å; E120-Y123 WeakPolarHBondContact CB-O 3.41Å; E120-Y123 CarbonylContact O-C 3.58Å; E120-Y123 VanDerWaalsContact O-C 3.29Å; E120-Y123 PolarHBondContact O-N 2.98Å; E120-Y123 VanDerWaalsContact O-O 3.09Å; Y123-H272 HydrophobicContact CD1-CB 3.68Å; Y123-H272 AromaticContact CD1-CG 3.68Å; Y123-H272 AromaticContact CD1-ND1 3.84Å; Y123-H272 HydrophobicContact CE1-CB 4.23Å; Y123-H272 HydrophobicContact CG-CB 4.45Å; Y123-D341 WeakPolarHBondContact CE1-OD2 3.41Å; Y123-D341 PolarHBondContact OH-OD2 3.25Å
124	E	89.6	Confident	73.5	Confident	21 Å²	21	66.1 Å²	66.1	10%	0.098	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-82.1	146.8	177.5	-63.8	176.5	-119.7	0	0	112.4	W110 R259 R265 A269	W110-E124 HydrophobicContact CH2-CB 4.28Å; W110-E124 VanDerWaalsContact CH2-OE2 3.24Å; W110-E124 WeakPolarHBondContact CH2-OE2 3.18Å; W110-E124 WeakPolarHBondContact CZ3-OE2 3.24Å; E124-R259 IonicContact OE1-CZ 3.5Å; E124-R259 IonicContact OE1-NE 2.68Å; E124-R259 PolarHBondContact OE1-NE 3.08Å; E124-R259 IonicContact OE1-NH2 3.11Å; E124-R259 PolarHBondContact OE1-NH2 3.25Å; E124-R265 IonicContact OE1-NE 2.92Å; E124-R265 IonicContact OE1-NH2 3.42Å; E124-R265 IonicContact OE2-CZ 3.01Å; E124-R265 IonicContact OE2-NE 3.5Å; E124-R265 PolarHBondContact OE2-NE 3.4Å; E124-R265 IonicContact OE2-NH2 3.46Å; E124-R265 PolarHBondContact OE2-NH2 3.1Å; E124-A269 HydrophobicContact CB-CB 4.05Å
125	A	89.8	Confident	73	Confident	46 Å²	46	62.6 Å²	62.6	38%	0.38	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-59.9	138.7	174	0	0	0	0	0	111.8
126	S	93.5	Very high	72.6	Confident	20 Å²	20	62.8 Å²	62.8	14%	0.14	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-73.4	130.3	174	-175.9	0	0	0	0	110.8	Y128 D270	S126-Y128 VanDerWaalsContact C-N 3.28Å; S126-Y128 PolarHBondContact OG-N 3.33Å; S126-D270 WeakPolarHBondContact CB-OD1 3.44Å; S126-D270 WeakPolarHBondContact OG-CB 3.36Å; S126-D270 PolarHBondContact OG-OD1 2.96Å
127	P	94.1	Very high	72.5	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.362	C	S	.	.			trans	-80.6	-7.7	173.6	33	-35.1	0	0	0	113.3	R94 C95 L106 Y109 S266	R94-P127 CarbonylContact C-O 3.57Å; R94-P127 VanDerWaalsContact CA-O 3.25Å; R94-P127 WeakPolarHBondContact CA-O 3.31Å; R94-P127 WeakPolarHBondContact CB-O 3.37Å; C95-P127 PolarHBondContact N-O 2.92Å; L106-P127 HydrophobicContact CD2-CB 3.86Å; L106-P127 HydrophobicContact CD2-CG 3.54Å; Y109-P127 HydrophobicContact CD1-CB 3.54Å; Y109-P127 HydrophobicContact CD2-CB 3.81Å; Y109-P127 HydrophobicContact CE1-CB 3.66Å; Y109-P127 HydrophobicContact CE2-CB 3.93Å; Y109-P127 HydrophobicContact CG-CB 3.62Å; P127-S266 WeakPolarHBondContact CG-OG 3.41Å
128	Y	94.7	Very high	72.6	Confident	6 Å²	6	62.2 Å²	62.2	2%	0.024	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-85.4	156.4	-175.8	-60.8	-76.7	0	0	0	112	C95 R97 E102 L106 S126 R267 D270	C95-Y128 HydrophobicContact CB-CD1 4.18Å; C95-Y128 HydrophobicContact CB-CE1 4.5Å; C95-Y128 CarbonylContact O-C 3.29Å; C95-Y128 VanDerWaalsContact O-CA 3.23Å; C95-Y128 WeakPolarHBondContact O-CA 3.47Å; R97-Y128 HydrophobicContact CG-CD1 3.65Å; R97-Y128 HydrophobicContact CG-CE1 3.69Å; R97-Y128 HydrophobicContact CG-CG 4.08Å; E102-Y128 HydrophobicContact CG-CE1 4.44Å; E102-Y128 WeakPolarHBondContact OE1-CE1 3.35Å; E102-Y128 PolarHBondContact OE1-OH 3.12Å; L106-Y128 HydrophobicContact CD2-CE1 4.19Å; S126-Y128 VanDerWaalsContact C-N 3.28Å; S126-Y128 PolarHBondContact OG-N 3.33Å; Y128-R267 WeakPolarHBondContact OH-CD 3.42Å; Y128-R267 PolarHBondContact OH-NE 3.22Å; Y128-R267 VanDerWaalsContact OH-NE 3.1Å; Y128-D270 HydrophobicContact CD2-CB 3.85Å; Y128-D270 WeakPolarHBondContact CD2-OD2 3.43Å; Y128-D270 HydrophobicContact CE2-CB 4.22Å
129	E	90.2	Very high	73.1	Confident	62 Å²	62	57.9 Å²	57.9	29%	0.29	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-64	134.1	168.1	-73.8	177.9	-160.2	0	0	110.7	R94 C95 K96 V131	R94-E129 HydrophobicContact CB-CG 3.73Å; C95-E129 PolarHBondContact O-N 3.23Å; K96-E129 WeakPolarHBondContact CE-OE2 3.35Å; K96-E129 IonicContact NZ-OE1 2.69Å; K96-E129 PolarHBondContact NZ-OE1 2.66Å; K96-E129 IonicContact NZ-OE2 2.75Å; K96-E129 PolarHBondContact NZ-OE2 3.26Å; E129-V131 PolarHBondContact O-N 3.03Å
130	P	83.9	Confident	73.5	Confident	99 Å²	99	62.2 Å²	62.2	64%	0.643	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-57.2	135.3	177.2	-26.6	35.2	0	0	0	112.7	T132	P130-T132 PolarHBondContact O-N 3.06Å; P130-T132 VanDerWaalsContact O-N 3.09Å
131	V	77.8	Confident	73.4	Confident	41 Å²	41	61 Å²	61	25%	0.248	31%	0.314	C	S	.	.			trans	-74.8	101.7	-179.6	-178.5	0	0	0	0	110.1	E129 N289 Q291 A292	E129-V131 PolarHBondContact O-N 3.03Å; V131-N289 PolarHBondContact O-ND2 3.42Å; V131-Q291 HydrophobicContact CG1-CG 4.1Å; V131-A292 HydrophobicContact CB-CB 4.18Å
132	T	68.5	Low	72.6	Confident	131 Å²	131	54.5 Å²	54.5	80%	0.804	29%	0.287	S	S	*	.			trans	-83.5	-16	-179	52.6	0	0	0	0	114.5	P130	P130-T132 PolarHBondContact O-N 3.06Å; P130-T132 VanDerWaalsContact O-N 3.09Å
133	S	61.9	Low	70.9	Confident	64 Å²	64	57.2 Å²	57.2	45%	0.448	31%	0.309	S	S	.	.			trans	-69.5	143.2	176.1	-50	0	0	0	0	112.1	Q291	S133-Q291 WeakPolarHBondContact O-CG 3.08Å
134	R	61.9	Low	68.9	Low	157 Å²	157	61 Å²	61	59%	0.592	33%	0.331	S	S	*	.			trans	-92.6	160.8	-179.9	-62.1	-175.8	177.3	-155.6	-3.4	111.4	S136 D137	R134-S136 WeakPolarHBondContact CB-OG 3.34Å; R134-S136 PolarHBondContact O-N 3.43Å; R134-D137 PolarHBondContact N-OD2 3.03Å; R134-D137 WeakPolarHBondContact O-CB 3.31Å; R134-D137 PolarHBondContact O-N 2.96Å; R134-D137 VanDerWaalsContact O-N 3.08Å
135	L	61.6	Low	66.7	Low	3 Å²	3	65.8 Å²	65.8	2%	0.016	35%	0.351	C	S	.	.	H	α-helix	trans	-57.1	-38.8	171.6	-87.5	-171.7	0	0	0	111.8	D137 I138 F139 Y290 Q291 L294 F355 D360	L135-D137 PolarHBondContact O-N 3.4Å; L135-D137 VanDerWaalsContact O-N 3.13Å; L135-I138 WeakPolarHBondContact O-CB 3.33Å; L135-I138 PolarHBondContact O-N 3.1Å; L135-F139 HydrophobicContact CB-CD2 4.23Å; L135-F139 HydrophobicContact CB-CE2 4.07Å; L135-F139 HydrophobicContact CD1-CE2 4.31Å; L135-F139 WeakPolarHBondContact O-CD2 3.49Å; L135-F139 PolarHBondContact O-N 3.15Å; L135-Y290 HydrophobicContact CD1-CD2 3.92Å; L135-Y290 HydrophobicContact CD1-CG 4.23Å; L135-Q291 HydrophobicContact CD2-CB 3.87Å; L135-Q291 HydrophobicContact CG-CB 3.95Å; L135-L294 HydrophobicContact CD2-CD1 4.24Å; L135-F355 HydrophobicContact CD2-CD2 3.83Å; L135-F355 HydrophobicContact CD2-CE2 4.35Å; L135-D360 HydrophobicContact CB-CB 4.17Å
136	S	56.1	Low	64.6	Low	36 Å²	36	65.8 Å²	65.8	25%	0.252	35%	0.349	S	S	.	.	H	α-helix	trans	-54.7	-25.6	175.3	26	0	0	0	0	114.1	R134 F139 R140 D360	R134-S136 WeakPolarHBondContact CB-OG 3.34Å; R134-S136 PolarHBondContact O-N 3.43Å; S136-F139 PolarHBondContact O-N 2.93Å; S136-R140 WeakPolarHBondContact O-CB 3.47Å; S136-R140 WeakPolarHBondContact O-CD 3.42Å; S136-R140 WeakPolarHBondContact O-CG 3.03Å; S136-R140 PolarHBondContact O-N 3.35Å; S136-D360 WeakPolarHBondContact CA-OD2 3.46Å; S136-D360 WeakPolarHBondContact CB-OD2 3.49Å; S136-D360 PolarHBondContact N-OD2 2.78Å; S136-D360 PolarHBondContact OG-OD2 3.38Å
137	D	57.8	Low	61.8	Low	66 Å²	66	68.3 Å²	68.3	35%	0.353	38%	0.378	S	S	.	.	H	α-helix	trans	-72.2	-39.7	174.7	-59.6	-45.4	0	0	0	111.4	R134 L135 R140 L141	R134-D137 PolarHBondContact N-OD2 3.03Å; R134-D137 WeakPolarHBondContact O-CB 3.31Å; R134-D137 PolarHBondContact O-N 2.96Å; R134-D137 VanDerWaalsContact O-N 3.08Å; L135-D137 PolarHBondContact O-N 3.4Å; L135-D137 VanDerWaalsContact O-N 3.13Å; D137-R140 PolarHBondContact O-N 2.72Å; D137-L141 WeakPolarHBondContact O-CG 3.15Å; D137-L141 PolarHBondContact O-N 3.07Å
138	I	59.2	Low	59.2	Low	10 Å²	10	73.8 Å²	73.8	5%	0.051	41%	0.412	C	S	.	.	H	α-helix	trans	-67	-42.4	171.1	-61.7	177.9	0	0	0	110.4	L135 R140 L141 A142 E214 Y217 F355	L135-I138 WeakPolarHBondContact O-CB 3.33Å; L135-I138 PolarHBondContact O-N 3.1Å; I138-R140 VanDerWaalsContact C-N 3.32Å; I138-R140 PolarHBondContact O-N 2.76Å; I138-L141 PolarHBondContact O-N 2.96Å; I138-A142 WeakPolarHBondContact O-CB 3.44Å; I138-A142 PolarHBondContact O-N 3.15Å; I138-E214 HydrophobicContact CG2-CB 4.15Å; I138-Y217 HydrophobicContact CD1-CD2 3.96Å; I138-Y217 HydrophobicContact CD1-CE2 3.84Å; I138-F355 HydrophobicContact CG2-CE2 4.31Å
139	F	56.1	Low	56.5	Low	38 Å²	38	77.4 Å²	77.4	17%	0.167	45%	0.451	C	S	.	.	H	α-helix	trans	-65.4	-33.9	178.6	-72	-55.2	0	0	0	112.9	L135 S136 A142 S143 F355 D360	L135-F139 HydrophobicContact CB-CD2 4.23Å; L135-F139 HydrophobicContact CB-CE2 4.07Å; L135-F139 HydrophobicContact CD1-CE2 4.31Å; L135-F139 WeakPolarHBondContact O-CD2 3.49Å; L135-F139 PolarHBondContact O-N 3.15Å; S136-F139 PolarHBondContact O-N 2.93Å; F139-A142 PolarHBondContact O-N 2.81Å; F139-S143 VanDerWaalsContact O-CB 3.25Å; F139-S143 WeakPolarHBondContact O-CB 3.26Å; F139-S143 PolarHBondContact O-N 2.59Å; F139-S143 PolarHBondContact O-OG 2.91Å; F139-F355 HydrophobicContact CZ-CD2 4.22Å; F139-D360 HydrophobicContact CD2-CB 4.2Å; F139-D360 HydrophobicContact CE2-CB 4.25Å
140	R	57	Low	54.2	Low	172 Å²	172	78.8 Å²	78.8	65%	0.649	47%	0.472	S	S	*	.	H	α-helix	trans	-60.8	-48.1	171.2	-79.2	166	170.5	-173.2	-5.6	111.7	S136 D137 I138 S143 I144	S136-R140 WeakPolarHBondContact O-CB 3.47Å; S136-R140 WeakPolarHBondContact O-CD 3.42Å; S136-R140 WeakPolarHBondContact O-CG 3.03Å; S136-R140 PolarHBondContact O-N 3.35Å; D137-R140 PolarHBondContact O-N 2.72Å; I138-R140 VanDerWaalsContact C-N 3.32Å; I138-R140 PolarHBondContact O-N 2.76Å; R140-S143 PolarHBondContact O-N 3.1Å; R140-I144 WeakPolarHBondContact O-CG1 3.26Å; R140-I144 PolarHBondContact O-N 2.88Å; R140-I144 VanDerWaalsContact O-N 3.1Å
141	L	51.7	Low	52.1	Low	83 Å²	83	79.7 Å²	79.7	44%	0.435	47%	0.472	S	S	.	.	H	α-helix	trans	-62.1	-46.8	175	-65.9	170.3	0	0	0	112	D137 I138 S143 I144 F145	D137-L141 WeakPolarHBondContact O-CG 3.15Å; D137-L141 PolarHBondContact O-N 3.07Å; I138-L141 PolarHBondContact O-N 2.96Å; L141-S143 VanDerWaalsContact C-N 3.27Å; L141-S143 PolarHBondContact O-N 3.16Å; L141-I144 PolarHBondContact O-N 3.21Å; L141-F145 VanDerWaalsContact O-CD2 3.28Å; L141-F145 WeakPolarHBondContact O-CD2 3.48Å; L141-F145 PolarHBondContact O-N 2.81Å; L141-F145 VanDerWaalsContact O-N 3.12Å
142	A	49.5	Very low	50.7	Low	16 Å²	16	82.8 Å²	82.8	13%	0.132	49%	0.493	C	S	.	.	H	α-helix	trans	-64	-30.9	179.1	0	0	0	0	0	113	I138 F139 S146 E214	I138-A142 WeakPolarHBondContact O-CB 3.44Å; I138-A142 PolarHBondContact O-N 3.15Å; F139-A142 PolarHBondContact O-N 2.81Å; A142-S146 VanDerWaalsContact O-CB 3.31Å; A142-S146 WeakPolarHBondContact O-CB 3.44Å; A142-S146 PolarHBondContact O-N 3.36Å; A142-S146 PolarHBondContact O-OG 2.99Å; A142-E214 HydrophobicContact CB-CB 4.22Å
143	S	47.7	Very low	49.5	Very low	80 Å²	80	82.7 Å²	82.7	56%	0.559	49%	0.492	S	S	*	.	H	α-helix	trans	-71.7	-40.9	174.9	-60	0	0	0	0	111.6	F139 R140 L141 F145 S146	F139-S143 VanDerWaalsContact O-CB 3.25Å; F139-S143 WeakPolarHBondContact O-CB 3.26Å; F139-S143 PolarHBondContact O-N 2.59Å; F139-S143 PolarHBondContact O-OG 2.91Å; R140-S143 PolarHBondContact O-N 3.1Å; L141-S143 VanDerWaalsContact C-N 3.27Å; L141-S143 PolarHBondContact O-N 3.16Å; S143-F145 VanDerWaalsContact C-N 3.29Å; S143-F145 PolarHBondContact O-N 3.07Å; S143-S146 CarbonylContact O-C 3.57Å; S143-S146 PolarHBondContact O-N 2.94Å
144	I	45.5	Very low	48.7	Very low	131 Å²	131	84.6 Å²	84.6	67%	0.672	50%	0.501	S	S	*	.	H	α-helix	trans	-59.6	-39.8	173.6	-67.7	162.2	0	0	0	110.9	R140 L141 S146	R140-I144 WeakPolarHBondContact O-CG1 3.26Å; R140-I144 PolarHBondContact O-N 2.88Å; R140-I144 VanDerWaalsContact O-N 3.1Å; L141-I144 PolarHBondContact O-N 3.21Å; I144-S146 VanDerWaalsContact C-N 3.35Å
145	F	43.3	Very low	48.3	Very low	120 Å²	120	79.9 Å²	79.9	53%	0.526	49%	0.492	S	S	.	.	H	α-helix	trans	-74.7	-19.1	173.5	-74.6	-64.5	0	0	0	114.6	L141 S143 G147 E214	L141-F145 VanDerWaalsContact O-CD2 3.28Å; L141-F145 WeakPolarHBondContact O-CD2 3.48Å; L141-F145 PolarHBondContact O-N 2.81Å; L141-F145 VanDerWaalsContact O-N 3.12Å; S143-F145 VanDerWaalsContact C-N 3.29Å; S143-F145 PolarHBondContact O-N 3.07Å; F145-G147 VanDerWaalsContact C-N 3.33Å; F145-G147 PolarHBondContact O-N 3.27Å; F145-E214 HydrophobicContact CD2-CG 4.08Å; F145-E214 HydrophobicContact CE2-CG 4.11Å
146	S	44.6	Very low	47.8	Very low	47 Å²	47	83 Å²	83	33%	0.329	52%	0.517	S	S	.	.			trans	-99.9	47.2	-179.1	-51.5	0	0	0	0	110.7	A142 S143 I144 T148 R218	A142-S146 VanDerWaalsContact O-CB 3.31Å; A142-S146 WeakPolarHBondContact O-CB 3.44Å; A142-S146 PolarHBondContact O-N 3.36Å; A142-S146 PolarHBondContact O-OG 2.99Å; S143-S146 CarbonylContact O-C 3.57Å; S143-S146 PolarHBondContact O-N 2.94Å; I144-S146 VanDerWaalsContact C-N 3.35Å; S146-T148 PolarHBondContact O-N 3.24Å; S146-R218 PolarHBondContact OG-NH1 3.37Å
147	G	35.8	Very low	47.9	Very low	72 Å²	72	90.8 Å²	90.8	74%	0.742	55%	0.547	S	S	*	.			trans	-68.9	40.2	-171.4	0	0	0	0	0	116.8	F145	F145-G147 VanDerWaalsContact C-N 3.33Å; F145-G147 PolarHBondContact O-N 3.27Å
148	T	37.6	Very low	48.6	Very low	116 Å²	116	89.3 Å²	89.3	71%	0.712	54%	0.542	S	S	*	.	S	Bend	trans	-137.1	119.6	171	52	0	0	0	0	107.6	S146 A150	S146-T148 PolarHBondContact O-N 3.24Å; T148-A150 PolarHBondContact O-N 3.28Å; T148-A150 VanDerWaalsContact O-N 3.15Å
149	G	39	Very low	49.9	Very low	82 Å²	82	90.5 Å²	90.5	85%	0.845	55%	0.548	S	S	*	.			trans	-57.9	119.3	174.5	0	0	0	0	0	110.1	D151	G149-D151 PolarHBondContact O-N 3.34Å
150	A	41.8	Very low	51.6	Low	90 Å²	90	91.4 Å²	91.4	74%	0.744	55%	0.553	S	S	*	*			trans	-84.2	107.8	-176.7	0	0	0	0	0	110.3	T148	T148-A150 PolarHBondContact O-N 3.28Å; T148-A150 VanDerWaalsContact O-N 3.15Å
151	D	40.5	Very low	53.4	Low	118 Å²	118	83.3 Å²	83.3	63%	0.631	52%	0.523	S	S	*	.			trans	-56.4	127	169.7	-81.2	-52.3	0	0	0	110.1	G149 V153 V154	G149-D151 PolarHBondContact O-N 3.34Å; D151-V153 PolarHBondContact O-N 2.93Å; D151-V154 HydrophobicContact CB-CG2 4.38Å; D151-V154 PolarHBondContact O-N 3.25Å
152	P	47.3	Very low	55.5	Low	106 Å²	106	82.4 Å²	82.4	69%	0.688	52%	0.518	S	S	*	.	H	α-helix	trans	-54.7	-27.7	-174.6	-29.4	35.4	0	0	0	114.5	V154 S155	P152-V154 VanDerWaalsContact C-N 3.33Å; P152-V154 PolarHBondContact O-N 2.95Å; P152-S155 WeakPolarHBondContact O-CB 3.27Å; P152-S155 PolarHBondContact O-N 2.91Å
153	V	43.4	Very low	57.5	Low	129 Å²	129	83.8 Å²	83.8	78%	0.782	52%	0.523	S	S	*	.	H	α-helix	trans	-67.7	-28.6	-178.2	-174.2	0	0	0	0	112.7	D151	D151-V153 PolarHBondContact O-N 2.93Å
154	V	46.4	Very low	59.8	Low	105 Å²	105	80 Å²	80	64%	0.636	50%	0.497	S	S	*	.	H	α-helix	trans	-79.3	-32.2	180	-175.8	0	0	0	0	111.5	D151 P152 A156 K157	D151-V154 HydrophobicContact CB-CG2 4.38Å; D151-V154 PolarHBondContact O-N 3.25Å; P152-V154 VanDerWaalsContact C-N 3.33Å; P152-V154 PolarHBondContact O-N 2.95Å; V154-A156 VanDerWaalsContact C-N 3.25Å; V154-A156 PolarHBondContact O-N 2.81Å; V154-K157 PolarHBondContact O-N 3.13Å
155	S	52.2	Low	62.2	Low	58 Å²	58	74 Å²	74	41%	0.406	47%	0.467	S	S	.	.	H	α-helix	trans	-59.5	-32.1	-177.3	-168.9	0	0	0	0	113.5	P152 K157 S158	P152-S155 WeakPolarHBondContact O-CB 3.27Å; P152-S155 PolarHBondContact O-N 2.91Å; S155-K157 PolarHBondContact O-N 3.37Å; S155-S158 WeakPolarHBondContact CA-OG 3.41Å; S155-S158 PolarHBondContact O-N 3.42Å; S155-S158 PolarHBondContact O-OG 2.75Å
156	A	51.1	Low	64.7	Low	67 Å²	67	73.6 Å²	73.6	55%	0.554	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-1.2	-178.5	0	0	0	0	0	115.3	V154	V154-A156 VanDerWaalsContact C-N 3.25Å; V154-A156 PolarHBondContact O-N 2.81Å
157	K	58.4	Low	67.1	Low	201 Å²	201	72.5 Å²	72.5	87%	0.874	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.8	4.7	175.8	-65.9	-176.7	179.4	176.8	0	114.1	V154 S155	V154-K157 PolarHBondContact O-N 3.13Å; S155-K157 PolarHBondContact O-N 3.37Å
158	S	71.9	Confident	70	Confident	35 Å²	35	69.1 Å²	69.1	25%	0.245	42%	0.424	C	S	.	.			trans	-85.9	125.1	-177.3	43.8	0	0	0	0	113.1	S155 H160	S155-S158 WeakPolarHBondContact CA-OG 3.41Å; S155-S158 PolarHBondContact O-N 3.42Å; S155-S158 PolarHBondContact O-OG 2.75Å; S158-H160 PolarHBondContact O-CD2 2.92Å; S158-H160 PolarHBondContact O-N 2.84Å
159	N	87.6	Confident	72.8	Confident	34 Å²	34	67.2 Å²	67.2	18%	0.182	41%	0.409	C	S	.	.			trans	-80	94.7	172.1	-176	-59.6	0	0	0	109	C161 L162 D163 C229	N159-C161 PolarHBondContact O-N 3.16Å; N159-C161 VanDerWaalsContact O-N 3.12Å; N159-L162 HydrophobicContact CB-CB 3.93Å; N159-L162 WeakPolarHBondContact O-CA 3.25Å; N159-L162 VanDerWaalsContact O-CB 3.3Å; N159-L162 WeakPolarHBondContact O-CB 3.49Å; N159-L162 PolarHBondContact O-N 3.04Å; N159-L162 WeakPolarHBondContact OD1-CB 3.47Å; N159-L162 PolarHBondContact OD1-N 3.01Å; N159-D163 PolarHBondContact O-N 2.91Å; N159-D163 VanDerWaalsContact O-N 3.07Å; N159-C229 VanDerWaalsContact ND2-CA 3.35Å; N159-C229 WeakPolarHBondContact ND2-CA 3.48Å; N159-C229 VanDerWaalsContact ND2-CB 3.32Å; N159-C229 WeakPolarHBondContact ND2-CB 3.44Å; N159-C229 PolarHBondContact ND2-N 3.05Å
160	H	90.9	Very high	75.6	Confident	57 Å²	57	70.4 Å²	70.4	26%	0.264	41%	0.406	S	S	.	.	H	α-helix	trans	-56	-35	-171.7	-60.1	159.8	0	0	0	113.8	S158 D163 A164 C222 S223	S158-H160 PolarHBondContact O-CD2 2.92Å; S158-H160 PolarHBondContact O-N 2.84Å; H160-D163 PolarHBondContact O-N 3.14Å; H160-A164 WeakPolarHBondContact O-CB 3.49Å; H160-A164 PolarHBondContact O-N 2.63Å; H160-C222 HydrophobicContact CB-CB 4.34Å; H160-S223 PolarHBondContact ND1-OG 3.49Å
161	C	95.1	Very high	78.2	Confident	3 Å²	3	67.9 Å²	67.9	2%	0.02	38%	0.38	C	S	.	.	H	α-helix	trans	-66.6	-33.2	174.4	-58.4	0	0	0	0	113.2	N159 A165 C222 C224 C229 R232	N159-C161 PolarHBondContact O-N 3.16Å; N159-C161 VanDerWaalsContact O-N 3.12Å; C161-A165 WeakPolarHBondContact O-CB 3.28Å; C161-A165 PolarHBondContact O-N 3.47Å; C161-A165 VanDerWaalsContact O-N 3.1Å; C161-C222 WeakPolarHBondContact CA-SG 3.41Å; C161-C222 HydrophobicContact CB-CB 3.95Å; C161-C222 WeakPolarHBondContact CB-SG 3.34Å; C161-C222 WeakPolarHBondContact SG-CB 3.35Å; C161-C222 CovalentContact SG-SG 2.02Å; C161-C222 PolarHBondContact SG-SG 3.03Å; C161-C224 PolarHBondContact SG-SG 3.2Å; C161-C229 PolarHBondContact SG-SG 2.96Å; C161-R232 HydrophobicContact CB-CB 4.36Å; C161-R232 HydrophobicContact CB-CG 3.89Å
162	L	95.3	Very high	80.9	Confident	63 Å²	63	67.7 Å²	67.7	33%	0.33	38%	0.379	S	S	.	.	H	α-helix	trans	-70.1	-40.7	172.8	177.3	61	0	0	0	110.9	N159 A165 K166	N159-L162 HydrophobicContact CB-CB 3.93Å; N159-L162 WeakPolarHBondContact O-CA 3.25Å; N159-L162 VanDerWaalsContact O-CB 3.3Å; N159-L162 WeakPolarHBondContact O-CB 3.49Å; N159-L162 PolarHBondContact O-N 3.04Å; N159-L162 WeakPolarHBondContact OD1-CB 3.47Å; N159-L162 PolarHBondContact OD1-N 3.01Å; L162-A165 CarbonylContact O-C 3.53Å; L162-A165 WeakPolarHBondContact O-CA 3.47Å; L162-A165 WeakPolarHBondContact O-CB 3.05Å; L162-A165 PolarHBondContact O-N 3.25Å; L162-K166 WeakPolarHBondContact O-CG 3.33Å; L162-K166 PolarHBondContact O-N 3.42Å
163	D	93.2	Very high	83.3	Confident	45 Å²	45	66 Å²	66	24%	0.241	36%	0.364	C	S	.	.	H	α-helix	trans	-72.1	-34.7	-179.9	-63.1	-44.9	0	0	0	112.4	N159 H160 A165 K166 A167	N159-D163 PolarHBondContact O-N 2.91Å; N159-D163 VanDerWaalsContact O-N 3.07Å; H160-D163 PolarHBondContact O-N 3.14Å; D163-A165 VanDerWaalsContact C-N 3.33Å; D163-A165 PolarHBondContact O-N 3.24Å; D163-K166 WeakPolarHBondContact O-CB 3.27Å; D163-K166 PolarHBondContact O-N 2.87Å; D163-K166 WeakPolarHBondContact OD1-CD 3.11Å; D163-K166 WeakPolarHBondContact OD1-CE 3.5Å; D163-K166 IonicContact OD1-NZ 2.65Å; D163-K166 PolarHBondContact OD1-NZ 2.98Å; D163-A167 PolarHBondContact O-N 3.5Å
164	A	94.5	Very high	85.9	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.008	33%	0.327	C	S	.	.	H	α-helix	trans	-58.5	-44.4	165.2	0	0	0	0	0	112.2	H160 K166 A167 C168 R218 M219	H160-A164 WeakPolarHBondContact O-CB 3.49Å; H160-A164 PolarHBondContact O-N 2.63Å; A164-K166 VanDerWaalsContact C-N 3.32Å; A164-K166 PolarHBondContact O-N 3.37Å; A164-A167 PolarHBondContact O-N 2.86Å; A164-C168 PolarHBondContact O-N 2.82Å; A164-R218 VanDerWaalsContact CB-C 3.44Å; A164-R218 HydrophobicContact CB-CB 4.17Å; A164-R218 HydrophobicContact CB-CG 3.8Å; A164-R218 WeakPolarHBondContact CB-O 3.26Å; A164-M219 HydrophobicContact CB-CB 4.46Å; A164-M219 HydrophobicContact CB-CG 3.84Å
165	A	95.7	Very high	88.4	Confident	6 Å²	6	58.6 Å²	58.6	5%	0.05	31%	0.313	C	S	.	.	H	α-helix	trans	-66	-30.5	176.2	0	0	0	0	0	113.1	C161 L162 D163 N169 R178	C161-A165 WeakPolarHBondContact O-CB 3.28Å; C161-A165 PolarHBondContact O-N 3.47Å; C161-A165 VanDerWaalsContact O-N 3.1Å; L162-A165 CarbonylContact O-C 3.53Å; L162-A165 WeakPolarHBondContact O-CA 3.47Å; L162-A165 WeakPolarHBondContact O-CB 3.05Å; L162-A165 PolarHBondContact O-N 3.25Å; D163-A165 VanDerWaalsContact C-N 3.33Å; D163-A165 PolarHBondContact O-N 3.24Å; A165-N169 PolarHBondContact O-N 3.34Å; A165-N169 PolarHBondContact O-ND2 3.41Å; A165-N169 PolarHBondContact O-OD1 2.7Å; A165-R178 VanDerWaalsContact CB-NH2 3.34Å; A165-R178 PolarHBondContact O-NH1 3.22Å
166	K	95.9	Very high	90.6	Very high	110 Å²	110	63.3 Å²	63.3	48%	0.478	33%	0.326	S	S	.	.	H	α-helix	trans	-67.6	-50.3	169.7	-68.2	171.6	-169.6	161.4	0	110.7	L162 D163 A164 C168 N169 L170	L162-K166 WeakPolarHBondContact O-CG 3.33Å; L162-K166 PolarHBondContact O-N 3.42Å; D163-K166 WeakPolarHBondContact O-CB 3.27Å; D163-K166 PolarHBondContact O-N 2.87Å; D163-K166 WeakPolarHBondContact OD1-CD 3.11Å; D163-K166 WeakPolarHBondContact OD1-CE 3.5Å; D163-K166 IonicContact OD1-NZ 2.65Å; D163-K166 PolarHBondContact OD1-NZ 2.98Å; A164-K166 VanDerWaalsContact C-N 3.32Å; A164-K166 PolarHBondContact O-N 3.37Å; K166-C168 VanDerWaalsContact C-N 3.33Å; K166-C168 PolarHBondContact O-N 2.68Å; K166-N169 WeakPolarHBondContact O-CA 3.4Å; K166-N169 WeakPolarHBondContact O-CB 3.34Å; K166-N169 PolarHBondContact O-N 3.22Å; K166-L170 PolarHBondContact O-N 2.94Å
167	A	94.9	Very high	92.9	Very high	25 Å²	25	61.5 Å²	61.5	21%	0.207	31%	0.307	C	S	.	.	H	α-helix	trans	-57.2	-43.6	-179.4	0	0	0	0	0	112.4	D163 A164 N169 L170 N171 Y215	D163-A167 PolarHBondContact O-N 3.5Å; A164-A167 PolarHBondContact O-N 2.86Å; A167-N169 VanDerWaalsContact C-N 3.34Å; A167-N169 PolarHBondContact O-N 3.2Å; A167-L170 PolarHBondContact O-N 3.11Å; A167-N171 PolarHBondContact O-N 3.29Å; A167-Y215 HydrophobicContact CB-CD1 4.44Å; A167-Y215 HydrophobicContact CB-CE1 4.45Å
168	C	97.1	Very high	94.8	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.6	-37.1	173.1	179.8	0	0	0	0	113.1	A164 K166 L170 N171 C174 K175 M219	A164-C168 PolarHBondContact O-N 2.82Å; K166-C168 VanDerWaalsContact C-N 3.33Å; K166-C168 PolarHBondContact O-N 2.68Å; C168-L170 VanDerWaalsContact C-N 3.3Å; C168-L170 PolarHBondContact O-N 3.03Å; C168-N171 PolarHBondContact O-N 3.23Å; C168-C174 VanDerWaalsContact CA-SG 3.55Å; C168-C174 HydrophobicContact CB-CB 4.03Å; C168-C174 WeakPolarHBondContact CB-SG 3.45Å; C168-C174 WeakPolarHBondContact O-CB 3.06Å; C168-C174 WeakPolarHBondContact SG-CB 3.34Å; C168-C174 CovalentContact SG-SG 2.03Å; C168-C174 PolarHBondContact SG-SG 3.36Å; C168-K175 PolarHBondContact O-N 3.45Å; C168-K175 VanDerWaalsContact O-N 3.12Å; C168-M219 HydrophobicContact CB-SD 3.51Å; C168-M219 VanDerWaalsContact CB-SD 3.51Å
169	N	96.8	Very high	96	Very high	77 Å²	77	55.5 Å²	55.5	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-71.8	-23.6	178.9	-72.5	-1.7	0	0	0	113	A165 K166 A167 K175 R178	A165-N169 PolarHBondContact O-N 3.34Å; A165-N169 PolarHBondContact O-ND2 3.41Å; A165-N169 PolarHBondContact O-OD1 2.7Å; K166-N169 WeakPolarHBondContact O-CA 3.4Å; K166-N169 WeakPolarHBondContact O-CB 3.34Å; K166-N169 PolarHBondContact O-N 3.22Å; A167-N169 VanDerWaalsContact C-N 3.34Å; A167-N169 PolarHBondContact O-N 3.2Å; N169-K175 WeakPolarHBondContact O-CD 3.43Å; N169-R178 PolarHBondContact OD1-NH1 3.31Å
170	L	96.8	Very high	96.5	Very high	148 Å²	148	56 Å²	56	78%	0.775	29%	0.291	S	S	*	.	H	α-helix	trans	-78.5	-25.2	173.3	-65.6	173.9	0	0	0	112.7	K166 A167 C168	K166-L170 PolarHBondContact O-N 2.94Å; A167-L170 PolarHBondContact O-N 3.11Å; C168-L170 VanDerWaalsContact C-N 3.3Å; C168-L170 PolarHBondContact O-N 3.03Å
171	N	97.1	Very high	96.9	Very high	38 Å²	38	53.5 Å²	53.5	20%	0.203	28%	0.279	C	S	.	.	S	Bend	trans	-88	119.1	174.5	-178.9	-66.8	0	0	0	111.1	A167 C168 N173 C174 K175 Y215	A167-N171 PolarHBondContact O-N 3.29Å; C168-N171 PolarHBondContact O-N 3.23Å; N171-N173 VanDerWaalsContact C-N 3.35Å; N171-N173 PolarHBondContact O-N 3.27Å; N171-N173 WeakPolarHBondContact OD1-CB 3.23Å; N171-N173 PolarHBondContact OD1-N 3.43Å; N171-C174 HydrophobicContact CB-CB 3.98Å; N171-C174 PolarHBondContact O-N 3.24Å; N171-C174 PolarHBondContact OD1-N 2.99Å; N171-K175 VanDerWaalsContact O-CB 3.25Å; N171-K175 WeakPolarHBondContact O-CB 3.27Å; N171-K175 PolarHBondContact O-N 3.04Å; N171-Y215 HydrophobicContact CB-CE1 3.82Å; N171-Y215 HydrophobicContact CB-CE2 4.19Å; N171-Y215 VanDerWaalsContact ND2-CE2 3.34Å; N171-Y215 WeakPolarHBondContact ND2-CE2 3.49Å; N171-Y215 VanDerWaalsContact ND2-CZ 3.31Å; N171-Y215 PolarHBondContact ND2-OH 2.04Å
172	D	97.8	Very high	97.1	Very high	113 Å²	113	56 Å²	56	60%	0.604	29%	0.291	S	S	*	.	H	α-helix	trans	-61.6	-35.5	-175.4	-80.7	-47.1	0	0	0	114.7	K175 K176	D172-K175 WeakPolarHBondContact OD1-CE 3.26Å; D172-K175 IonicContact OD1-NZ 3.83Å; D172-K175 PolarHBondContact OD1-NZ 3.2Å; D172-K176 WeakPolarHBondContact O-CB 3.48Å; D172-K176 PolarHBondContact O-N 3.07Å
173	N	97.7	Very high	97.2	Very high	71 Å²	71	56.4 Å²	56.4	38%	0.38	30%	0.3	S	S	.	.	H	α-helix	trans	-69.2	-46.3	176.7	-176.5	45.9	0	0	0	111	N171 K176 L177 R210	N171-N173 VanDerWaalsContact C-N 3.35Å; N171-N173 PolarHBondContact O-N 3.27Å; N171-N173 WeakPolarHBondContact OD1-CB 3.23Å; N171-N173 PolarHBondContact OD1-N 3.43Å; N173-K176 PolarHBondContact O-N 3.13Å; N173-L177 WeakPolarHBondContact O-CB 3.26Å; N173-L177 PolarHBondContact O-N 3.22Å; N173-L177 WeakPolarHBondContact OD1-CD1 3.26Å; N173-R210 PolarHBondContact ND2-O 2.96Å
174	C	98.3	Very high	97.4	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.9	-51.8	177.6	-165.5	0	0	0	0	111.2	C168 N171 K176 L177 R178 V211 Y215	C168-C174 VanDerWaalsContact CA-SG 3.55Å; C168-C174 HydrophobicContact CB-CB 4.03Å; C168-C174 WeakPolarHBondContact CB-SG 3.45Å; C168-C174 WeakPolarHBondContact O-CB 3.06Å; C168-C174 WeakPolarHBondContact SG-CB 3.34Å; C168-C174 CovalentContact SG-SG 2.03Å; C168-C174 PolarHBondContact SG-SG 3.36Å; N171-C174 HydrophobicContact CB-CB 3.98Å; N171-C174 PolarHBondContact O-N 3.24Å; N171-C174 PolarHBondContact OD1-N 2.99Å; C174-K176 PolarHBondContact O-N 2.85Å; C174-L177 PolarHBondContact O-N 2.82Å; C174-R178 WeakPolarHBondContact O-CB 3.24Å; C174-R178 PolarHBondContact O-N 2.9Å; C174-V211 HydrophobicContact CB-CG1 3.8Å; C174-V211 WeakPolarHBondContact SG-CG1 3.24Å; C174-Y215 HydrophobicContact CB-CG 4.34Å
175	K	98.4	Very high	97.6	Very high	78 Å²	78	57 Å²	57	34%	0.339	30%	0.302	S	S	.	.	H	α-helix	trans	-49.8	-52.4	173.2	177.3	174.7	59.5	-150.3	0	111.8	C168 N169 N171 D172 R178 S179	C168-K175 PolarHBondContact O-N 3.45Å; C168-K175 VanDerWaalsContact O-N 3.12Å; N169-K175 WeakPolarHBondContact O-CD 3.43Å; N171-K175 VanDerWaalsContact O-CB 3.25Å; N171-K175 WeakPolarHBondContact O-CB 3.27Å; N171-K175 PolarHBondContact O-N 3.04Å; D172-K175 WeakPolarHBondContact OD1-CE 3.26Å; D172-K175 IonicContact OD1-NZ 3.83Å; D172-K175 PolarHBondContact OD1-NZ 3.2Å; K175-R178 PolarHBondContact O-N 3.07Å; K175-S179 WeakPolarHBondContact O-CB 3.16Å; K175-S179 PolarHBondContact O-N 2.91Å; K175-S179 PolarHBondContact O-OG 3.38Å
176	K	98.6	Very high	97.6	Very high	157 Å²	157	61 Å²	61	68%	0.683	32%	0.323	S	S	*	.	H	α-helix	trans	-62	-49.4	-177.5	179.9	176.5	-179.9	175.6	0	112.5	D172 N173 C174 S180	D172-K176 WeakPolarHBondContact O-CB 3.48Å; D172-K176 PolarHBondContact O-N 3.07Å; N173-K176 PolarHBondContact O-N 3.13Å; C174-K176 PolarHBondContact O-N 2.85Å; K176-S180 WeakPolarHBondContact O-CB 3.39Å; K176-S180 PolarHBondContact O-N 2.92Å
177	L	98.5	Very high	97.4	Very high	30 Å²	30	63.2 Å²	63.2	16%	0.157	33%	0.328	C	S	.	.	H	α-helix	trans	-71	-32.9	-179.7	-69.5	172.6	0	0	0	111.8	N173 C174 S180 Y181 F207 R210 V211	N173-L177 WeakPolarHBondContact O-CB 3.26Å; N173-L177 PolarHBondContact O-N 3.22Å; N173-L177 WeakPolarHBondContact OD1-CD1 3.26Å; C174-L177 PolarHBondContact O-N 2.82Å; L177-S180 WeakPolarHBondContact O-CB 3.29Å; L177-S180 PolarHBondContact O-N 3.01Å; L177-Y181 WeakPolarHBondContact O-CD1 3.44Å; L177-Y181 PolarHBondContact O-N 3.12Å; L177-F207 HydrophobicContact CB-CD2 3.91Å; L177-R210 HydrophobicContact CD1-CB 3.83Å; L177-V211 HydrophobicContact CB-CG2 3.82Å; L177-V211 HydrophobicContact CD1-CG2 3.56Å; L177-V211 HydrophobicContact CG-CG2 4.3Å
178	R	98.6	Very high	97.2	Very high	39 Å²	39	67.3 Å²	67.3	15%	0.147	34%	0.343	C	S	.	.	H	α-helix	trans	-62.7	-53.4	172.5	-175.1	-179	-175.6	-170.7	13.4	112.1	A165 N169 C174 K175 S180 Y181 I182 F207	A165-R178 VanDerWaalsContact CB-NH2 3.34Å; A165-R178 PolarHBondContact O-NH1 3.22Å; N169-R178 PolarHBondContact OD1-NH1 3.31Å; C174-R178 WeakPolarHBondContact O-CB 3.24Å; C174-R178 PolarHBondContact O-N 2.9Å; K175-R178 PolarHBondContact O-N 3.07Å; R178-S180 PolarHBondContact O-N 3.44Å; R178-Y181 HydrophobicContact CB-CE1 4.15Å; R178-Y181 HydrophobicContact CG-CE1 3.92Å; R178-Y181 WeakPolarHBondContact O-CD1 3.47Å; R178-Y181 PolarHBondContact O-N 2.81Å; R178-I182 HydrophobicContact CG-CD1 3.71Å; R178-I182 HydrophobicContact CG-CG1 4.45Å; R178-I182 WeakPolarHBondContact O-CB 3.36Å; R178-I182 VanDerWaalsContact O-CG1 3.3Å; R178-I182 WeakPolarHBondContact O-CG1 3.45Å; R178-I182 PolarHBondContact O-N 3.07Å; R178-F207 HydrophobicContact CB-CD2 4.44Å; R178-F207 HydrophobicContact CB-CE2 3.89Å
179	S	98.3	Very high	96.9	Very high	71 Å²	71	71 Å²	71	50%	0.497	36%	0.362	S	S	.	.	H	α-helix	trans	-59.5	-34.3	175.1	-64.9	0	0	0	0	112	K175 S183	K175-S179 WeakPolarHBondContact O-CB 3.16Å; K175-S179 PolarHBondContact O-N 2.91Å; K175-S179 PolarHBondContact O-OG 3.38Å; S179-S183 VanDerWaalsContact O-CB 3.26Å; S179-S183 WeakPolarHBondContact O-CB 3.45Å; S179-S183 PolarHBondContact O-N 3.18Å; S179-S183 PolarHBondContact O-OG 2.93Å
180	S	98.3	Very high	96.5	Very high	45 Å²	45	69.1 Å²	69.1	32%	0.315	36%	0.355	S	S	.	.	H	α-helix	trans	-61.6	-54.7	174.6	-170.4	0	0	0	0	112.2	K176 L177 R178 S183 I184	K176-S180 WeakPolarHBondContact O-CB 3.39Å; K176-S180 PolarHBondContact O-N 2.92Å; L177-S180 WeakPolarHBondContact O-CB 3.29Å; L177-S180 PolarHBondContact O-N 3.01Å; R178-S180 PolarHBondContact O-N 3.44Å; S180-S183 PolarHBondContact O-OG 2.94Å; S180-S183 VanDerWaalsContact O-OG 3.12Å; S180-I184 WeakPolarHBondContact O-CD1 3.46Å; S180-I184 VanDerWaalsContact O-CG1 3.27Å; S180-I184 WeakPolarHBondContact O-CG1 3.39Å; S180-I184 PolarHBondContact O-N 3.1Å
181	Y	98.6	Very high	95.9	Very high	3 Å²	3	68.1 Å²	68.1	1%	0.012	36%	0.357	C	S	.	.	H	α-helix	trans	-67.6	-41.3	179.9	84.6	-104	0	0	0	112.2	L177 R178 S183 I184 C185 L204 F207 T236 L238	L177-Y181 WeakPolarHBondContact O-CD1 3.44Å; L177-Y181 PolarHBondContact O-N 3.12Å; R178-Y181 HydrophobicContact CB-CE1 4.15Å; R178-Y181 HydrophobicContact CG-CE1 3.92Å; R178-Y181 WeakPolarHBondContact O-CD1 3.47Å; R178-Y181 PolarHBondContact O-N 2.81Å; Y181-S183 PolarHBondContact O-N 3.44Å; Y181-I184 PolarHBondContact O-N 2.94Å; Y181-C185 VanDerWaalsContact O-CB 3.3Å; Y181-C185 WeakPolarHBondContact O-CB 3.45Å; Y181-C185 PolarHBondContact O-N 2.93Å; Y181-C185 PolarHBondContact O-SG 3.1Å; Y181-L204 HydrophobicContact CD2-CD2 3.51Å; Y181-L204 HydrophobicContact CD2-CG 4.26Å; Y181-L204 HydrophobicContact CE2-CD2 3.75Å; Y181-L204 HydrophobicContact CG-CD2 3.98Å; Y181-F207 HydrophobicContact CD1-CB 3.83Å; Y181-F207 HydrophobicContact CD1-CD1 4.15Å; Y181-F207 AromaticContact CD1-CD2 3.8Å; Y181-F207 HydrophobicContact CD1-CD2 3.8Å; Y181-F207 HydrophobicContact CD1-CE2 4.4Å; Y181-F207 AromaticContact CD1-CG 3.67Å; Y181-F207 HydrophobicContact CD1-CG 3.67Å; Y181-F207 HydrophobicContact CE1-CB 4.34Å; Y181-F207 AromaticContact CE1-CD1 3.79Å; Y181-F207 HydrophobicContact CE1-CD1 3.79Å; Y181-F207 AromaticContact CE1-CD2 3.73Å; Y181-F207 HydrophobicContact CE1-CD2 3.73Å; Y181-F207 AromaticContact CE1-CE1 3.93Å; Y181-F207 HydrophobicContact CE1-CE1 3.93Å; Y181-F207 AromaticContact CE1-CE2 3.89Å; Y181-F207 HydrophobicContact CE1-CE2 3.89Å; Y181-F207 AromaticContact CE1-CG 3.69Å; Y181-F207 HydrophobicContact CE1-CG 3.69Å; Y181-F207 AromaticContact CE1-CZ 3.99Å; Y181-F207 HydrophobicContact CE1-CZ 3.99Å; Y181-T236 WeakPolarHBondContact CE2-O 3.36Å; Y181-T236 PolarHBondContact OH-O 3.01Å; Y181-L238 HydrophobicContact CE2-CD1 4.23Å
182	I	98.4	Very high	95.2	Very high	55 Å²	55	71.5 Å²	71.5	28%	0.282	38%	0.379	S	S	.	.	H	α-helix	trans	-61.4	-44.5	180	-66.6	176.4	0	0	0	111.3	R178 I184 C185 N186 L238	R178-I182 HydrophobicContact CG-CD1 3.71Å; R178-I182 HydrophobicContact CG-CG1 4.45Å; R178-I182 WeakPolarHBondContact O-CB 3.36Å; R178-I182 VanDerWaalsContact O-CG1 3.3Å; R178-I182 WeakPolarHBondContact O-CG1 3.45Å; R178-I182 PolarHBondContact O-N 3.07Å; I182-I184 VanDerWaalsContact C-N 3.32Å; I182-I184 PolarHBondContact O-N 3.29Å; I182-C185 PolarHBondContact O-N 3.22Å; I182-N186 VanDerWaalsContact O-CB 3.24Å; I182-N186 WeakPolarHBondContact O-CB 3.33Å; I182-N186 PolarHBondContact O-N 3.42Å; I182-L238 HydrophobicContact CG1-CD1 4.02Å; I182-L238 HydrophobicContact CG2-CD2 4.32Å
183	S	97.6	Very high	94.7	Very high	73 Å²	73	69.7 Å²	69.7	51%	0.51	37%	0.367	S	S	.	.	H	α-helix	trans	-69.3	-27.7	178.9	59.8	0	0	0	0	113.5	S179 S180 Y181 R187	S179-S183 VanDerWaalsContact O-CB 3.26Å; S179-S183 WeakPolarHBondContact O-CB 3.45Å; S179-S183 PolarHBondContact O-N 3.18Å; S179-S183 PolarHBondContact O-OG 2.93Å; S180-S183 PolarHBondContact O-OG 2.94Å; S180-S183 VanDerWaalsContact O-OG 3.12Å; Y181-S183 PolarHBondContact O-N 3.44Å; S183-R187 WeakPolarHBondContact O-CB 3.43Å
184	I	97.9	Very high	94.4	Very high	58 Å²	58	71 Å²	71	30%	0.297	37%	0.367	S	S	.	.	H	α-helix	trans	-77.6	-42.3	174.2	-68.5	167.8	0	0	0	111.4	S180 Y181 I182 K199 A203	S180-I184 WeakPolarHBondContact O-CD1 3.46Å; S180-I184 VanDerWaalsContact O-CG1 3.27Å; S180-I184 WeakPolarHBondContact O-CG1 3.39Å; S180-I184 PolarHBondContact O-N 3.1Å; Y181-I184 PolarHBondContact O-N 2.94Å; I182-I184 VanDerWaalsContact C-N 3.32Å; I182-I184 PolarHBondContact O-N 3.29Å; I184-K199 HydrophobicContact CG2-CB 3.74Å; I184-A203 HydrophobicContact CB-CB 4.45Å; I184-A203 HydrophobicContact CD1-CB 3.82Å; I184-A203 HydrophobicContact CG2-CB 4.45Å
185	C	97.7	Very high	94.3	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-76.8	-37.7	-177	-63.3	0	0	0	0	113.1	Y181 I182 R187 C195 C200 L238 C241	Y181-C185 VanDerWaalsContact O-CB 3.3Å; Y181-C185 WeakPolarHBondContact O-CB 3.45Å; Y181-C185 PolarHBondContact O-N 2.93Å; Y181-C185 PolarHBondContact O-SG 3.1Å; I182-C185 PolarHBondContact O-N 3.22Å; C185-R187 VanDerWaalsContact C-N 3.32Å; C185-R187 PolarHBondContact O-N 3.33Å; C185-C195 WeakPolarHBondContact O-CB 3.04Å; C185-C200 HydrophobicContact CB-CB 3.87Å; C185-C200 WeakPolarHBondContact CB-SG 3.43Å; C185-C200 WeakPolarHBondContact SG-CA 3.28Å; C185-C200 WeakPolarHBondContact SG-CB 3.27Å; C185-C200 CovalentContact SG-SG 2.03Å; C185-C200 PolarHBondContact SG-SG 3.36Å; C185-L238 HydrophobicContact CB-CB 4.24Å; C185-L238 HydrophobicContact CB-CD2 3.86Å; C185-C241 HydrophobicContact CB-CB 4.38Å; C185-C241 WeakPolarHBondContact O-CB 3.44Å; C185-C241 PolarHBondContact O-SG 3.5Å
186	N	95.9	Very high	94.1	Very high	90 Å²	90	70 Å²	70	48%	0.481	37%	0.366	S	S	.	.	S	Bend	trans	-78.6	-14.7	-178.3	-166.1	28.4	0	0	0	113.5	I182 E188 R194 L238	I182-N186 VanDerWaalsContact O-CB 3.24Å; I182-N186 WeakPolarHBondContact O-CB 3.33Å; I182-N186 PolarHBondContact O-N 3.42Å; N186-E188 PolarHBondContact O-N 3.09Å; N186-E188 VanDerWaalsContact O-N 3.13Å; N186-R194 PolarHBondContact O-NH1 3.1Å; N186-R194 PolarHBondContact OD1-NH2 2.78Å; N186-L238 HydrophobicContact CB-CD2 3.86Å
187	R	92.8	Very high	94	Very high	157 Å²	157	65.6 Å²	65.6	59%	0.592	35%	0.345	S	S	*	.			trans	-75.5	106.1	-174.3	-170.3	-177.2	72.2	176	8.9	111.7	S183 C185	S183-R187 WeakPolarHBondContact O-CB 3.43Å; C185-R187 VanDerWaalsContact C-N 3.32Å; C185-R187 PolarHBondContact O-N 3.33Å
188	E	90.4	Very high	93.9	Very high	110 Å²	110	74.5 Å²	74.5	51%	0.514	38%	0.377	S	S	.	.			trans	-60	150.9	169.6	-162.7	172.7	154.3	0	0	112.1	N186 R194	N186-E188 PolarHBondContact O-N 3.09Å; N186-E188 VanDerWaalsContact O-N 3.13Å; E188-R194 WeakPolarHBondContact CA-O 3.33Å
189	I	89.9	Confident	93.9	Very high	78 Å²	78	78.2 Å²	78.2	40%	0.4	39%	0.394	S	S	.	.			trans	-124	-41.7	-175.2	-67.6	171.1	0	0	0	110.6	E193 N196	I189-E193 HydrophobicContact CB-CB 4.35Å; I189-E193 HydrophobicContact CB-CG 4.3Å; I189-E193 HydrophobicContact CD1-CG 4.36Å; I189-E193 WeakPolarHBondContact CD1-OE1 3.22Å; I189-E193 PolarHBondContact N-O 3.35Å; I189-N196 HydrophobicContact CD1-CB 3.6Å
190	S	88.2	Confident	93.9	Very high	37 Å²	37	74.9 Å²	74.9	26%	0.259	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-153.6	166.8	170	73.4	0	0	0	0	109.3	T192 E193	S190-T192 PolarHBondContact O-N 2.97Å; S190-T192 PolarHBondContact OG-N 2.92Å; S190-T192 PolarHBondContact OG-OG1 3.01Å; S190-T192 VanDerWaalsContact OG-OG1 3.07Å; S190-E193 PolarHBondContact N-O 3.17Å; S190-E193 CarbonylContact O-C 3.56Å; S190-E193 PolarHBondContact O-N 3Å; S190-E193 VanDerWaalsContact O-N 3.14Å; S190-E193 VanDerWaalsContact O-O 3.12Å; S190-E193 PolarHBondContact OG-N 3.32Å
191	P	84.9	Confident	93.9	Very high	128 Å²	128	73.1 Å²	73.1	83%	0.831	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-7.9	171.9	-25.4	35.7	0	0	0	114.8
192	T	83.7	Confident	93.9	Very high	108 Å²	108	78.9 Å²	78.9	66%	0.663	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	-12.9	179.1	56.4	0	0	0	0	114.5	S190 K246	S190-T192 PolarHBondContact O-N 2.97Å; S190-T192 PolarHBondContact OG-N 2.92Å; S190-T192 PolarHBondContact OG-OG1 3.01Å; S190-T192 VanDerWaalsContact OG-OG1 3.07Å; T192-K246 PolarHBondContact O-NZ 3.2Å; T192-K246 VanDerWaalsContact O-NZ 3.15Å
193	E	87.3	Confident	93.9	Very high	75 Å²	75	76.5 Å²	76.5	35%	0.35	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-122.7	95.4	172.7	-174.8	-174.8	171.8	0	0	109.7	I189 S190 C195 N196	I189-E193 HydrophobicContact CB-CB 4.35Å; I189-E193 HydrophobicContact CB-CG 4.3Å; I189-E193 HydrophobicContact CD1-CG 4.36Å; I189-E193 WeakPolarHBondContact CD1-OE1 3.22Å; I189-E193 PolarHBondContact N-O 3.35Å; S190-E193 PolarHBondContact N-O 3.17Å; S190-E193 CarbonylContact O-C 3.56Å; S190-E193 PolarHBondContact O-N 3Å; S190-E193 VanDerWaalsContact O-N 3.14Å; S190-E193 VanDerWaalsContact O-O 3.12Å; S190-E193 PolarHBondContact OG-N 3.32Å; E193-C195 VanDerWaalsContact C-N 3.26Å; E193-C195 WeakPolarHBondContact CG-O 3.48Å; E193-C195 PolarHBondContact O-N 3.06Å; E193-N196 PolarHBondContact OE1-ND2 2.68Å
194	R	90.1	Very high	94	Very high	100 Å²	100	73 Å²	73	38%	0.377	35%	0.347	S	S	.	.			trans	-62.7	-28.4	-176.1	179.6	57	-172.2	90.5	-6.2	113.9	N186 E188	N186-R194 PolarHBondContact O-NH1 3.1Å; N186-R194 PolarHBondContact OD1-NH2 2.78Å; E188-R194 WeakPolarHBondContact CA-O 3.33Å
195	C	95.5	Very high	94	Very high	13 Å²	13	73.5 Å²	73.5	9%	0.088	35%	0.345	C	S	.	.	S	Bend	trans	-166.5	166.6	174.2	78.2	0	0	0	0	110.9	C185 E193 R197 C241	C185-C195 WeakPolarHBondContact O-CB 3.04Å; E193-C195 VanDerWaalsContact C-N 3.26Å; E193-C195 WeakPolarHBondContact CG-O 3.48Å; E193-C195 PolarHBondContact O-N 3.06Å; C195-R197 PolarHBondContact O-N 3.02Å; C195-R197 VanDerWaalsContact O-N 3.13Å; C195-C241 HydrophobicContact CB-CB 3.81Å; C195-C241 WeakPolarHBondContact CB-SG 3.25Å; C195-C241 WeakPolarHBondContact SG-CA 3.04Å; C195-C241 WeakPolarHBondContact SG-CB 3.27Å; C195-C241 CovalentContact SG-SG 2.02Å; C195-C241 PolarHBondContact SG-SG 3.04Å
196	N	96	Very high	93.9	Very high	44 Å²	44	77.2 Å²	77.2	24%	0.235	36%	0.362	C	S	.	.			trans	-83.9	87	168.7	-162.3	-106.2	0	0	0	111.1	I189 E193 R198 K199 C200	I189-N196 HydrophobicContact CD1-CB 3.6Å; E193-N196 PolarHBondContact OE1-ND2 2.68Å; N196-R198 VanDerWaalsContact C-N 3.26Å; N196-R198 PolarHBondContact O-N 2.86Å; N196-R198 VanDerWaalsContact O-N 3.13Å; N196-K199 HydrophobicContact CB-CB 4.26Å; N196-K199 HydrophobicContact CB-CD 4.19Å; N196-K199 PolarHBondContact O-N 3Å; N196-K199 WeakPolarHBondContact OD1-CD 3.24Å; N196-K199 WeakPolarHBondContact OD1-CG 3.26Å; N196-K199 PolarHBondContact OD1-N 2.78Å; N196-C200 PolarHBondContact O-N 3Å
197	R	96.5	Very high	94	Very high	63 Å²	63	73 Å²	73	24%	0.238	34%	0.34	C	S	.	.	H	α-helix	trans	-46.8	-45	-176.3	-170.8	165.1	-167.8	177.9	6.6	113.2	C195 K199 C200 H201 C241 S242 Y243 D245	C195-R197 PolarHBondContact O-N 3.02Å; C195-R197 VanDerWaalsContact O-N 3.13Å; R197-K199 PolarHBondContact O-N 2.9Å; R197-C200 WeakPolarHBondContact O-CB 3.33Å; R197-C200 PolarHBondContact O-N 3.46Å; R197-H201 WeakPolarHBondContact O-CB 3.11Å; R197-H201 PolarHBondContact O-N 2.77Å; R197-C241 WeakPolarHBondContact CG-O 3.47Å; R197-S242 PolarHBondContact NE-O 2.95Å; R197-S242 PolarHBondContact NH2-O 2.87Å; R197-Y243 VanDerWaalsContact NH2-C 3.33Å; R197-Y243 PolarHBondContact NH2-O 2.04Å; R197-D245 IonicContact CZ-OD2 3.09Å; R197-D245 IonicContact NH1-OD2 2.75Å; R197-D245 PolarHBondContact NH1-OD2 2.97Å
198	R	96.5	Very high	94.2	Very high	217 Å²	217	66.8 Å²	66.8	82%	0.819	32%	0.317	S	S	*	.	H	α-helix	trans	-60.5	-37.4	178.2	-167.8	177.7	-174.3	-172.1	4	114.1	N196 K202	N196-R198 VanDerWaalsContact C-N 3.26Å; N196-R198 PolarHBondContact O-N 2.86Å; N196-R198 VanDerWaalsContact O-N 3.13Å; R198-K202 PolarHBondContact O-N 3.39Å
199	K	97.9	Very high	94.3	Very high	118 Å²	118	64.5 Å²	64.5	51%	0.513	31%	0.308	S	S	.	.	H	α-helix	trans	-75.8	-39.2	174.6	-74.7	169.5	-171.5	169.3	0	111.4	I184 N196 R197 K202 A203	I184-K199 HydrophobicContact CG2-CB 3.74Å; N196-K199 HydrophobicContact CB-CB 4.26Å; N196-K199 HydrophobicContact CB-CD 4.19Å; N196-K199 PolarHBondContact O-N 3Å; N196-K199 WeakPolarHBondContact OD1-CD 3.24Å; N196-K199 WeakPolarHBondContact OD1-CG 3.26Å; N196-K199 PolarHBondContact OD1-N 2.78Å; R197-K199 PolarHBondContact O-N 2.9Å; K199-K202 PolarHBondContact O-N 3.35Å; K199-A203 PolarHBondContact O-N 2.92Å
200	C	98.6	Very high	94.5	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-59	-53.1	174.5	174.9	0	0	0	0	111.6	C185 N196 R197 K202 A203 L204 C241	C185-C200 HydrophobicContact CB-CB 3.87Å; C185-C200 WeakPolarHBondContact CB-SG 3.43Å; C185-C200 WeakPolarHBondContact SG-CA 3.28Å; C185-C200 WeakPolarHBondContact SG-CB 3.27Å; C185-C200 CovalentContact SG-SG 2.03Å; C185-C200 PolarHBondContact SG-SG 3.36Å; N196-C200 PolarHBondContact O-N 3Å; R197-C200 WeakPolarHBondContact O-CB 3.33Å; R197-C200 PolarHBondContact O-N 3.46Å; C200-K202 VanDerWaalsContact C-N 3.35Å; C200-K202 PolarHBondContact O-N 3.49Å; C200-A203 WeakPolarHBondContact O-CB 3.31Å; C200-A203 PolarHBondContact O-N 2.93Å; C200-L204 PolarHBondContact O-N 2.98Å; C200-C241 VanDerWaalsContact CB-SG 3.51Å; C200-C241 PolarHBondContact SG-SG 3.33Å
201	H	98.6	Very high	94.9	Very high	9 Å²	9	67.4 Å²	67.4	4%	0.042	31%	0.309	C	S	.	.	H	α-helix	trans	-52	-48	173.4	-82.7	-172.9	0	0	0	112.7	R197 A203 L204 R205 S242 G302 F303	R197-H201 WeakPolarHBondContact O-CB 3.11Å; R197-H201 PolarHBondContact O-N 2.77Å; H201-A203 VanDerWaalsContact C-N 3.3Å; H201-A203 PolarHBondContact O-N 2.96Å; H201-L204 PolarHBondContact O-N 3Å; H201-R205 WeakPolarHBondContact O-CG 3.01Å; H201-R205 PolarHBondContact O-N 3.13Å; H201-S242 PolarHBondContact NE2-O 3.12Å; H201-G302 WeakPolarHBondContact CB-O 3.33Å; H201-F303 PolarHBondContact CE1-O 3Å; H201-F303 VanDerWaalsContact CE1-O 3.28Å
202	K	98.1	Very high	95.3	Very high	123 Å²	123	63.8 Å²	63.8	54%	0.535	29%	0.286	S	S	.	.	H	α-helix	trans	-60.2	-38.4	176.4	-174.8	177.4	179.6	179.6	0	112.5	R198 K199 C200 Q206	R198-K202 PolarHBondContact O-N 3.39Å; K199-K202 PolarHBondContact O-N 3.35Å; C200-K202 VanDerWaalsContact C-N 3.35Å; C200-K202 PolarHBondContact O-N 3.49Å; K202-Q206 WeakPolarHBondContact O-CB 3.47Å; K202-Q206 WeakPolarHBondContact O-CG 3.35Å; K202-Q206 PolarHBondContact O-N 2.98Å; K202-Q206 VanDerWaalsContact O-N 3.13Å
203	A	98.4	Very high	95.5	Very high	6 Å²	6	60.2 Å²	60.2	5%	0.05	27%	0.265	C	S	.	.	H	α-helix	trans	-73.2	-37	178.4	0	0	0	0	0	112.5	I184 K199 C200 H201 Q206 F207	I184-A203 HydrophobicContact CB-CB 4.45Å; I184-A203 HydrophobicContact CD1-CB 3.82Å; I184-A203 HydrophobicContact CG2-CB 4.45Å; K199-A203 PolarHBondContact O-N 2.92Å; C200-A203 WeakPolarHBondContact O-CB 3.31Å; C200-A203 PolarHBondContact O-N 2.93Å; H201-A203 VanDerWaalsContact C-N 3.3Å; H201-A203 PolarHBondContact O-N 2.96Å; A203-Q206 CarbonylContact O-C 3.43Å; A203-Q206 PolarHBondContact O-N 3.25Å; A203-F207 PolarHBondContact O-N 3.24Å
204	L	98.7	Very high	95.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-48.5	172.9	-76.6	166	0	0	0	111.5	Y181 C200 H201 Q206 F207 F208 I237	Y181-L204 HydrophobicContact CD2-CD2 3.51Å; Y181-L204 HydrophobicContact CD2-CG 4.26Å; Y181-L204 HydrophobicContact CE2-CD2 3.75Å; Y181-L204 HydrophobicContact CG-CD2 3.98Å; C200-L204 PolarHBondContact O-N 2.98Å; H201-L204 PolarHBondContact O-N 3Å; L204-Q206 VanDerWaalsContact C-N 3.33Å; L204-Q206 PolarHBondContact O-N 2.88Å; L204-F207 WeakPolarHBondContact O-CA 3.5Å; L204-F207 WeakPolarHBondContact O-CB 3.38Å; L204-F207 PolarHBondContact O-N 3.39Å; L204-F208 HydrophobicContact CD2-CE2 4.27Å; L204-F208 VanDerWaalsContact O-CD2 3.32Å; L204-F208 WeakPolarHBondContact O-CD2 3.47Å; L204-F208 PolarHBondContact O-N 3.17Å; L204-I237 HydrophobicContact CD2-CB 4.21Å; L204-I237 HydrophobicContact CD2-CG2 4.4Å
205	R	97.8	Very high	95.7	Very high	67 Å²	67	53.8 Å²	53.8	25%	0.253	24%	0.239	S	C	.	.	H	α-helix	trans	-57.2	-46.7	173.8	-63.7	-167.8	-53.3	-111	20.4	111.2	H201 F207 F208 D209 I301 G302 F303	H201-R205 WeakPolarHBondContact O-CG 3.01Å; H201-R205 PolarHBondContact O-N 3.13Å; R205-F207 PolarHBondContact O-N 3.49Å; R205-F208 PolarHBondContact O-N 2.91Å; R205-D209 WeakPolarHBondContact O-CB 3.21Å; R205-D209 PolarHBondContact O-N 3.35Å; R205-D209 VanDerWaalsContact O-OD2 3.07Å; R205-I301 WeakPolarHBondContact CG-O 3.41Å; R205-G302 WeakPolarHBondContact CD-O 3.23Å; R205-G302 PolarHBondContact NH1-O 3.5Å; R205-F303 HydrophobicContact CG-CE2 4.18Å; R205-F303 HydrophobicContact CG-CZ 4.49Å
206	Q	96.4	Very high	95.7	Very high	79 Å²	79	53.2 Å²	53.2	37%	0.369	24%	0.235	S	C	.	.	H	α-helix	trans	-62.1	-22.3	174.8	-76	-176	-18.2	0	0	115	K202 A203 L204 R210	K202-Q206 WeakPolarHBondContact O-CB 3.47Å; K202-Q206 WeakPolarHBondContact O-CG 3.35Å; K202-Q206 PolarHBondContact O-N 2.98Å; K202-Q206 VanDerWaalsContact O-N 3.13Å; A203-Q206 CarbonylContact O-C 3.43Å; A203-Q206 PolarHBondContact O-N 3.25Å; L204-Q206 VanDerWaalsContact C-N 3.33Å; L204-Q206 PolarHBondContact O-N 2.88Å; Q206-R210 VanDerWaalsContact O-CB 3.29Å; Q206-R210 WeakPolarHBondContact O-CB 3.4Å; Q206-R210 WeakPolarHBondContact O-CG 3.28Å
207	F	98.4	Very high	95.7	Very high	1 Å²	1	52.5 Å²	52.5	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-78	-53.9	171.2	174.3	-101.1	0	0	0	110.4	L177 R178 Y181 A203 L204 R205 D209 R210 V211 T216 M219	L177-F207 HydrophobicContact CB-CD2 3.91Å; R178-F207 HydrophobicContact CB-CD2 4.44Å; R178-F207 HydrophobicContact CB-CE2 3.89Å; Y181-F207 HydrophobicContact CD1-CB 3.83Å; Y181-F207 HydrophobicContact CD1-CD1 4.15Å; Y181-F207 AromaticContact CD1-CD2 3.8Å; Y181-F207 HydrophobicContact CD1-CD2 3.8Å; Y181-F207 HydrophobicContact CD1-CE2 4.4Å; Y181-F207 AromaticContact CD1-CG 3.67Å; Y181-F207 HydrophobicContact CD1-CG 3.67Å; Y181-F207 HydrophobicContact CE1-CB 4.34Å; Y181-F207 AromaticContact CE1-CD1 3.79Å; Y181-F207 HydrophobicContact CE1-CD1 3.79Å; Y181-F207 AromaticContact CE1-CD2 3.73Å; Y181-F207 HydrophobicContact CE1-CD2 3.73Å; Y181-F207 AromaticContact CE1-CE1 3.93Å; Y181-F207 HydrophobicContact CE1-CE1 3.93Å; Y181-F207 AromaticContact CE1-CE2 3.89Å; Y181-F207 HydrophobicContact CE1-CE2 3.89Å; Y181-F207 AromaticContact CE1-CG 3.69Å; Y181-F207 HydrophobicContact CE1-CG 3.69Å; Y181-F207 AromaticContact CE1-CZ 3.99Å; Y181-F207 HydrophobicContact CE1-CZ 3.99Å; A203-F207 PolarHBondContact O-N 3.24Å; L204-F207 WeakPolarHBondContact O-CA 3.5Å; L204-F207 WeakPolarHBondContact O-CB 3.38Å; L204-F207 PolarHBondContact O-N 3.39Å; R205-F207 PolarHBondContact O-N 3.49Å; F207-D209 PolarHBondContact O-N 3.45Å; F207-R210 PolarHBondContact O-N 2.87Å; F207-V211 HydrophobicContact CD2-CB 4.31Å; F207-V211 HydrophobicContact CD2-CG2 3.55Å; F207-V211 HydrophobicContact CE2-CB 4.23Å; F207-V211 HydrophobicContact CE2-CG1 4.31Å; F207-V211 HydrophobicContact CE2-CG2 3.71Å; F207-V211 HydrophobicContact CG-CG2 4.31Å; F207-V211 WeakPolarHBondContact O-CB 3.38Å; F207-V211 PolarHBondContact O-N 3.38Å; F207-T216 HydrophobicContact CD1-CG2 4.27Å; F207-T216 HydrophobicContact CE1-CG2 3.78Å; F207-T216 HydrophobicContact CZ-CG2 4.01Å; F207-M219 HydrophobicContact CZ-CE 4.28Å
208	F	96.9	Very high	95.5	Very high	27 Å²	27	53.6 Å²	53.6	12%	0.118	23%	0.233	C	C	.	.	H	α-helix	trans	-69.9	-29.6	-177.2	-72.1	-74.2	0	0	0	114.4	L204 R205 T216 L220 I237 I301	L204-F208 HydrophobicContact CD2-CE2 4.27Å; L204-F208 VanDerWaalsContact O-CD2 3.32Å; L204-F208 WeakPolarHBondContact O-CD2 3.47Å; L204-F208 PolarHBondContact O-N 3.17Å; R205-F208 PolarHBondContact O-N 2.91Å; F208-T216 HydrophobicContact CD1-CG2 4.13Å; F208-T216 HydrophobicContact CE1-CG2 4.48Å; F208-L220 HydrophobicContact CE1-CD2 3.99Å; F208-L220 HydrophobicContact CZ-CD2 4.34Å; F208-I237 HydrophobicContact CE2-CG2 4.23Å; F208-I237 HydrophobicContact CZ-CG2 4.27Å; F208-I301 HydrophobicContact CD2-CB 4.2Å; F208-I301 HydrophobicContact CD2-CG2 3.97Å; F208-I301 HydrophobicContact CE1-CD1 4.44Å; F208-I301 HydrophobicContact CE2-CB 4.18Å; F208-I301 HydrophobicContact CE2-CD1 4.14Å; F208-I301 HydrophobicContact CE2-CG2 3.62Å; F208-I301 HydrophobicContact CZ-CD1 4.01Å; F208-I301 HydrophobicContact CZ-CG2 4.46Å
209	D	92.8	Very high	95.5	Very high	62 Å²	62	43.4 Å²	43.4	33%	0.332	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-7.1	175.6	-60.8	-49.8	0	0	0	113.3	R205 F207 R267	R205-D209 WeakPolarHBondContact O-CB 3.21Å; R205-D209 PolarHBondContact O-N 3.35Å; R205-D209 VanDerWaalsContact O-OD2 3.07Å; F207-D209 PolarHBondContact O-N 3.45Å; D209-R267 IonicContact OD1-CZ 2.73Å; D209-R267 IonicContact OD1-NH1 3.36Å; D209-R267 PolarHBondContact OD1-NH1 2.99Å; D209-R267 IonicContact OD1-NH2 3.63Å; D209-R267 PolarHBondContact OD1-NH2 2.7Å
210	R	94.2	Very high	95.5	Very high	169 Å²	169	37.9 Å²	37.9	64%	0.638	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-135.7	-13.8	-172.8	-59.6	-176.6	167	-150.2	-5.9	117	N173 L177 Q206 F207	N173-R210 PolarHBondContact ND2-O 2.96Å; L177-R210 HydrophobicContact CD1-CB 3.83Å; Q206-R210 VanDerWaalsContact O-CB 3.29Å; Q206-R210 WeakPolarHBondContact O-CB 3.4Å; Q206-R210 WeakPolarHBondContact O-CG 3.28Å; F207-R210 PolarHBondContact O-N 2.87Å
211	V	95.6	Very high	95.4	Very high	6 Å²	6	37.9 Å²	37.9	4%	0.036	17%	0.171	C	C	.	.	S	Bend	trans	-93.8	129.5	170	176.8	0	0	0	0	107.8	C174 L177 F207 Y215 T216	C174-V211 HydrophobicContact CB-CG1 3.8Å; C174-V211 WeakPolarHBondContact SG-CG1 3.24Å; L177-V211 HydrophobicContact CB-CG2 3.82Å; L177-V211 HydrophobicContact CD1-CG2 3.56Å; L177-V211 HydrophobicContact CG-CG2 4.3Å; F207-V211 HydrophobicContact CD2-CB 4.31Å; F207-V211 HydrophobicContact CD2-CG2 3.55Å; F207-V211 HydrophobicContact CE2-CB 4.23Å; F207-V211 HydrophobicContact CE2-CG1 4.31Å; F207-V211 HydrophobicContact CE2-CG2 3.71Å; F207-V211 HydrophobicContact CG-CG2 4.31Å; F207-V211 WeakPolarHBondContact O-CB 3.38Å; F207-V211 PolarHBondContact O-N 3.38Å; V211-Y215 HydrophobicContact CG1-CD2 4.41Å; V211-T216 HydrophobicContact CB-CG2 3.53Å; V211-T216 HydrophobicContact CG1-CG2 3.56Å; V211-T216 WeakPolarHBondContact O-CG2 3.45Å
212	P	92.3	Very high	95.2	Very high	53 Å²	53	37.8 Å²	37.8	34%	0.344	17%	0.171	S	C	.	.			trans	-54.3	147	179	-28.4	36.4	0	0	0	114	E214 Y215 T216	P212-E214 VanDerWaalsContact C-N 3.27Å; P212-E214 WeakPolarHBondContact CB-OE1 3.5Å; P212-E214 WeakPolarHBondContact CB-OE2 3.39Å; P212-E214 PolarHBondContact O-N 3.48Å; P212-Y215 HydrophobicContact CB-CD2 4.19Å; P212-Y215 PolarHBondContact O-N 2.87Å; P212-T216 PolarHBondContact O-N 3.36Å
213	S	89.8	Confident	94.9	Very high	32 Å²	32	33 Å²	33	22%	0.224	15%	0.153	C	C	.	.	H	α-helix	trans	-61.4	-31.5	-171.7	41.3	0	0	0	0	113.7	Y215 T216 Y217	S213-Y215 PolarHBondContact O-N 3.27Å; S213-Y215 VanDerWaalsContact O-N 3.14Å; S213-T216 WeakPolarHBondContact CA-OG1 3.19Å; S213-T216 PolarHBondContact O-N 3.34Å; S213-Y217 VanDerWaalsContact O-CB 3.26Å; S213-Y217 WeakPolarHBondContact O-CB 3.02Å; S213-Y217 PolarHBondContact O-N 3.03Å
214	E	87.4	Confident	94.7	Very high	22 Å²	22	33.3 Å²	33.3	10%	0.103	16%	0.155	C	C	.	.	H	α-helix	trans	-63.7	-16.4	176.9	70.5	-81.6	-168.5	0	0	113.7	I138 A142 F145 P212 R218	I138-E214 HydrophobicContact CG2-CB 4.15Å; A142-E214 HydrophobicContact CB-CB 4.22Å; F145-E214 HydrophobicContact CD2-CG 4.08Å; F145-E214 HydrophobicContact CE2-CG 4.11Å; P212-E214 VanDerWaalsContact C-N 3.27Å; P212-E214 WeakPolarHBondContact CB-OE1 3.5Å; P212-E214 WeakPolarHBondContact CB-OE2 3.39Å; P212-E214 PolarHBondContact O-N 3.48Å; E214-R218 VanDerWaalsContact O-CB 3.24Å; E214-R218 WeakPolarHBondContact O-CB 3.44Å
215	Y	93.8	Very high	94.4	Very high	18 Å²	18	40.2 Å²	40.2	7%	0.071	19%	0.187	C	C	.	.	H	α-helix	trans	-99.5	-48.4	168.4	-58.6	-76.3	0	0	0	112.4	A167 N171 C174 V211 P212 S213 R218 M219	A167-Y215 HydrophobicContact CB-CD1 4.44Å; A167-Y215 HydrophobicContact CB-CE1 4.45Å; N171-Y215 HydrophobicContact CB-CE1 3.82Å; N171-Y215 HydrophobicContact CB-CE2 4.19Å; N171-Y215 VanDerWaalsContact ND2-CE2 3.34Å; N171-Y215 WeakPolarHBondContact ND2-CE2 3.49Å; N171-Y215 VanDerWaalsContact ND2-CZ 3.31Å; N171-Y215 PolarHBondContact ND2-OH 2.04Å; C174-Y215 HydrophobicContact CB-CG 4.34Å; V211-Y215 HydrophobicContact CG1-CD2 4.41Å; P212-Y215 HydrophobicContact CB-CD2 4.19Å; P212-Y215 PolarHBondContact O-N 2.87Å; S213-Y215 PolarHBondContact O-N 3.27Å; S213-Y215 VanDerWaalsContact O-N 3.14Å; Y215-R218 PolarHBondContact O-N 3.06Å; Y215-M219 PolarHBondContact O-N 2.83Å; Y215-M219 VanDerWaalsContact O-N 3.08Å
216	T	95.9	Very high	94.2	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.012	20%	0.195	C	C	.	.	H	α-helix	trans	-67.5	-44.5	-173.3	58.7	0	0	0	0	112.1	F207 F208 V211 P212 S213 M219 L220	F207-T216 HydrophobicContact CD1-CG2 4.27Å; F207-T216 HydrophobicContact CE1-CG2 3.78Å; F207-T216 HydrophobicContact CZ-CG2 4.01Å; F208-T216 HydrophobicContact CD1-CG2 4.13Å; F208-T216 HydrophobicContact CE1-CG2 4.48Å; V211-T216 HydrophobicContact CB-CG2 3.53Å; V211-T216 HydrophobicContact CG1-CG2 3.56Å; V211-T216 WeakPolarHBondContact O-CG2 3.45Å; P212-T216 PolarHBondContact O-N 3.36Å; S213-T216 WeakPolarHBondContact CA-OG1 3.19Å; S213-T216 PolarHBondContact O-N 3.34Å; T216-M219 PolarHBondContact O-N 2.95Å; T216-L220 VanDerWaalsContact O-CB 3.26Å; T216-L220 WeakPolarHBondContact O-CB 3.41Å; T216-L220 PolarHBondContact O-N 3.41Å
217	Y	95.1	Very high	94.1	Very high	28 Å²	28	42.1 Å²	42.1	11%	0.11	20%	0.201	C	C	.	.	H	α-helix	trans	-72.9	-36.2	-180	-64.9	7.5	0	0	0	110.7	I138 S213 M219 L220 F221 G295 A298 F355	I138-Y217 HydrophobicContact CD1-CD2 3.96Å; I138-Y217 HydrophobicContact CD1-CE2 3.84Å; S213-Y217 VanDerWaalsContact O-CB 3.26Å; S213-Y217 WeakPolarHBondContact O-CB 3.02Å; S213-Y217 PolarHBondContact O-N 3.03Å; Y217-M219 VanDerWaalsContact C-N 3.25Å; Y217-M219 PolarHBondContact O-N 3.48Å; Y217-L220 PolarHBondContact O-N 2.03Å; Y217-F221 HydrophobicContact CD1-CD2 4.49Å; Y217-F221 AromaticContact CD1-CE2 4Å; Y217-F221 HydrophobicContact CD1-CE2 4Å; Y217-F221 HydrophobicContact CD2-CE2 4.36Å; Y217-F221 HydrophobicContact CG-CD2 4.04Å; Y217-F221 AromaticContact CG-CE2 3.89Å; Y217-F221 HydrophobicContact CG-CE2 3.89Å; Y217-F221 PolarHBondContact O-N 3.44Å; Y217-G295 VanDerWaalsContact OH-CA 3.24Å; Y217-G295 WeakPolarHBondContact OH-CA 3.34Å; Y217-A298 HydrophobicContact CE1-CB 4Å; Y217-F355 VanDerWaalsContact C-CE1 3.48Å; Y217-F355 HydrophobicContact CD2-CE2 4.1Å; Y217-F355 HydrophobicContact CD2-CZ 4.44Å; Y217-F355 HydrophobicContact CG-CZ 4.46Å; Y217-F355 WeakPolarHBondContact O-CE1 3.45Å
218	R	92.9	Very high	94	Very high	87 Å²	87	45 Å²	45	33%	0.328	23%	0.226	S	C	.	.	H	α-helix	trans	-61.8	-32.4	174.6	-159.6	-179	178.2	158.8	2.4	112.2	S146 A164 E214 Y215 C222	S146-R218 PolarHBondContact OG-NH1 3.37Å; A164-R218 VanDerWaalsContact CB-C 3.44Å; A164-R218 HydrophobicContact CB-CB 4.17Å; A164-R218 HydrophobicContact CB-CG 3.8Å; A164-R218 WeakPolarHBondContact CB-O 3.26Å; E214-R218 VanDerWaalsContact O-CB 3.24Å; E214-R218 WeakPolarHBondContact O-CB 3.44Å; Y215-R218 PolarHBondContact O-N 3.06Å; R218-C222 WeakPolarHBondContact O-CB 3.3Å
219	M	95.9	Very high	94	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.015	22%	0.221	C	C	.	.	H	α-helix	trans	-81.6	-33.1	172.5	-79.3	-179.8	42.1	0	0	114.2	A164 C168 F207 Y215 T216 Y217 C222 T236	A164-M219 HydrophobicContact CB-CB 4.46Å; A164-M219 HydrophobicContact CB-CG 3.84Å; C168-M219 HydrophobicContact CB-SD 3.51Å; C168-M219 VanDerWaalsContact CB-SD 3.51Å; F207-M219 HydrophobicContact CZ-CE 4.28Å; Y215-M219 PolarHBondContact O-N 2.83Å; Y215-M219 VanDerWaalsContact O-N 3.08Å; T216-M219 PolarHBondContact O-N 2.95Å; Y217-M219 VanDerWaalsContact C-N 3.25Å; Y217-M219 PolarHBondContact O-N 3.48Å; M219-C222 PolarHBondContact O-SG 2.94Å; M219-T236 HydrophobicContact CB-CG2 4.47Å; M219-T236 HydrophobicContact CE-CG2 4.34Å; M219-T236 PolarHBondContact O-OG1 3.47Å
220	L	97.8	Very high	94.2	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-84.7	-42.1	-173.7	-176.8	63	0	0	0	112.8	F208 T216 Y217 R233 T236 I237 Y297 A298 I301 Y309	F208-L220 HydrophobicContact CE1-CD2 3.99Å; F208-L220 HydrophobicContact CZ-CD2 4.34Å; T216-L220 VanDerWaalsContact O-CB 3.26Å; T216-L220 WeakPolarHBondContact O-CB 3.41Å; T216-L220 PolarHBondContact O-N 3.41Å; Y217-L220 PolarHBondContact O-N 2.03Å; L220-R233 WeakPolarHBondContact O-CG 3.26Å; L220-T236 HydrophobicContact CD1-CG2 4.29Å; L220-I237 HydrophobicContact CD1-CG2 4.46Å; L220-Y297 HydrophobicContact CD2-CE1 4.47Å; L220-A298 HydrophobicContact CD2-CB 4.07Å; L220-I301 HydrophobicContact CD1-CD1 3.93Å; L220-I301 HydrophobicContact CD2-CD1 3.52Å; L220-I301 HydrophobicContact CG-CD1 4.4Å; L220-Y309 WeakPolarHBondContact O-CE2 3.25Å; L220-Y309 PolarHBondContact O-OH 3.43Å
221	F	96.4	Very high	94.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-111.8	25	-170.1	-52.9	-57.3	0	0	0	113.4	Y217 L294 Y297 A298 I352 F355 G356	Y217-F221 HydrophobicContact CD1-CD2 4.49Å; Y217-F221 AromaticContact CD1-CE2 4Å; Y217-F221 HydrophobicContact CD1-CE2 4Å; Y217-F221 HydrophobicContact CD2-CE2 4.36Å; Y217-F221 HydrophobicContact CG-CD2 4.04Å; Y217-F221 AromaticContact CG-CE2 3.89Å; Y217-F221 HydrophobicContact CG-CE2 3.89Å; Y217-F221 PolarHBondContact O-N 3.44Å; F221-L294 HydrophobicContact CD1-CD2 4.21Å; F221-L294 HydrophobicContact CD2-CD1 4.33Å; F221-L294 HydrophobicContact CD2-CD2 4.13Å; F221-L294 HydrophobicContact CE1-CD2 3.98Å; F221-L294 HydrophobicContact CE2-CB 3.86Å; F221-L294 HydrophobicContact CE2-CD1 4.47Å; F221-L294 HydrophobicContact CE2-CD2 3.93Å; F221-L294 HydrophobicContact CE2-CG 4.29Å; F221-L294 HydrophobicContact CG-CD2 4.27Å; F221-L294 HydrophobicContact CZ-CB 4.18Å; F221-L294 HydrophobicContact CZ-CD2 3.83Å; F221-Y297 AromaticContact CE1-CD1 3.56Å; F221-Y297 HydrophobicContact CE1-CD1 3.56Å; F221-Y297 AromaticContact CE1-CE1 3.8Å; F221-Y297 HydrophobicContact CE1-CE1 3.8Å; F221-Y297 HydrophobicContact CE1-CG 4.46Å; F221-Y297 AromaticContact CZ-CD1 3.72Å; F221-Y297 HydrophobicContact CZ-CD1 3.72Å; F221-Y297 HydrophobicContact CZ-CE1 4.34Å; F221-A298 HydrophobicContact CZ-CB 4.34Å; F221-I352 HydrophobicContact CB-CG2 4.2Å; F221-I352 HydrophobicContact CD1-CD1 4.3Å; F221-I352 HydrophobicContact CD1-CG1 3.85Å; F221-I352 HydrophobicContact CD1-CG2 4.22Å; F221-I352 HydrophobicContact CE1-CD1 4.42Å; F221-I352 HydrophobicContact CE1-CG1 4.18Å; F221-F355 HydrophobicContact CB-CD1 3.77Å; F221-F355 HydrophobicContact CB-CE1 4.43Å; F221-F355 HydrophobicContact CB-CG 4.38Å; F221-F355 HydrophobicContact CD2-CD1 4.48Å; F221-G356 WeakPolarHBondContact O-CA 3.44Å
222	C	94.3	Very high	94.5	Very high	7 Å²	7	40.3 Å²	40.3	5%	0.047	21%	0.205	C	C	.	.			trans	-62.1	136.5	178.8	42.5	0	0	0	0	112.7	H160 C161 R218 M219 R233	H160-C222 HydrophobicContact CB-CB 4.34Å; C161-C222 WeakPolarHBondContact CA-SG 3.41Å; C161-C222 HydrophobicContact CB-CB 3.95Å; C161-C222 WeakPolarHBondContact CB-SG 3.34Å; C161-C222 WeakPolarHBondContact SG-CB 3.35Å; C161-C222 CovalentContact SG-SG 2.02Å; C161-C222 PolarHBondContact SG-SG 3.03Å; R218-C222 WeakPolarHBondContact O-CB 3.3Å; M219-C222 PolarHBondContact O-SG 2.94Å; C222-R233 WeakPolarHBondContact O-CD 3.15Å; C222-R233 PolarHBondContact O-NH1 2.92Å
223	S	92.1	Very high	94.8	Very high	22 Å²	22	37.9 Å²	37.9	15%	0.154	19%	0.189	C	C	.	.			trans	-70.3	152.6	169.5	53.9	0	0	0	0	110.9	H160 C229 G356	H160-S223 PolarHBondContact ND1-OG 3.49Å; S223-C229 PolarHBondContact O-SG 2.81Å; S223-C229 VanDerWaalsContact O-SG 3.4Å; S223-G356 VanDerWaalsContact CB-O 3.27Å; S223-G356 WeakPolarHBondContact CB-O 3.37Å; S223-G356 PolarHBondContact OG-O 2.91Å
224	C	93.6	Very high	95.2	Very high	14 Å²	14	38.1 Å²	38.1	10%	0.095	19%	0.185	C	C	.	.			trans	-142.7	148	-175.8	-71.2	0	0	0	0	112.2	C161 C229 A230	C161-C224 PolarHBondContact SG-SG 3.2Å; C224-C229 WeakPolarHBondContact CA-SG 3.48Å; C224-C229 HydrophobicContact CB-CB 3.54Å; C224-C229 WeakPolarHBondContact CB-SG 3.36Å; C224-C229 WeakPolarHBondContact SG-CB 3.16Å; C224-C229 PolarHBondContact SG-O 2.71Å; C224-C229 CovalentContact SG-SG 2.04Å; C224-C229 PolarHBondContact SG-SG 2.9Å; C224-A230 HydrophobicContact CB-CB 4.26Å; C224-A230 PolarHBondContact SG-N 3.42Å; C224-A230 VanDerWaalsContact SG-N 3.4Å
225	Q	92.3	Very high	95.7	Very high	144 Å²	144	40.3 Å²	40.3	67%	0.673	20%	0.195	S	C	*	.	S	Bend	trans	-113.7	-18.9	175.9	-59.1	178.2	18.6	0	0	112.2
226	D	93.8	Very high	95.9	Very high	78 Å²	78	40.1 Å²	40.1	42%	0.417	20%	0.196	S	C	.	.	S	Bend	trans	-128.4	165.1	-179.9	69	13.1	0	0	0	112.8	A228 C229 A230	D226-A228 VanDerWaalsContact C-N 3.26Å; D226-A228 PolarHBondContact O-N 3.37Å; D226-A228 PolarHBondContact OD1-N 3.12Å; D226-C229 WeakPolarHBondContact OD1-CA 3.42Å; D226-C229 WeakPolarHBondContact OD1-CB 3.35Å; D226-C229 PolarHBondContact OD1-N 3.32Å; D226-A230 PolarHBondContact O-N 2.98Å
227	Q	95.7	Very high	96	Very high	108 Å²	108	40 Å²	40	51%	0.505	20%	0.195	S	C	.	.	H	α-helix	trans	-64.2	-31.1	178.4	-158.9	82.4	15.3	0	0	111.9	A230 E231 S312	Q227-A230 PolarHBondContact O-N 3.38Å; Q227-E231 WeakPolarHBondContact O-CB 3.42Å; Q227-E231 PolarHBondContact O-N 2.95Å; Q227-S312 PolarHBondContact NE2-O 2.7Å; Q227-S312 PolarHBondContact NE2-OG 2.76Å; Q227-S312 PolarHBondContact OE1-O 3.41Å
228	A	96	Very high	96.2	Very high	63 Å²	63	39.9 Å²	39.9	52%	0.521	20%	0.196	S	C	.	.	H	α-helix	trans	-70.7	-36.4	-176.8	0	0	0	0	0	112.5	D226 R232	D226-A228 VanDerWaalsContact C-N 3.26Å; D226-A228 PolarHBondContact O-N 3.37Å; D226-A228 PolarHBondContact OD1-N 3.12Å; A228-R232 VanDerWaalsContact O-CB 3.31Å; A228-R232 WeakPolarHBondContact O-CB 3.42Å; A228-R232 PolarHBondContact O-N 3.1Å; A228-R232 VanDerWaalsContact O-N 3.13Å
229	C	96.8	Very high	96.4	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.014	18%	0.181	C	C	.	.	H	α-helix	trans	-65	-48.1	167.6	-178.4	0	0	0	0	111	N159 C161 S223 C224 D226 R232 R233	N159-C229 VanDerWaalsContact ND2-CA 3.35Å; N159-C229 WeakPolarHBondContact ND2-CA 3.48Å; N159-C229 VanDerWaalsContact ND2-CB 3.32Å; N159-C229 WeakPolarHBondContact ND2-CB 3.44Å; N159-C229 PolarHBondContact ND2-N 3.05Å; C161-C229 PolarHBondContact SG-SG 2.96Å; S223-C229 PolarHBondContact O-SG 2.81Å; S223-C229 VanDerWaalsContact O-SG 3.4Å; C224-C229 WeakPolarHBondContact CA-SG 3.48Å; C224-C229 HydrophobicContact CB-CB 3.54Å; C224-C229 WeakPolarHBondContact CB-SG 3.36Å; C224-C229 WeakPolarHBondContact SG-CB 3.16Å; C224-C229 PolarHBondContact SG-O 2.71Å; C224-C229 CovalentContact SG-SG 2.04Å; C224-C229 PolarHBondContact SG-SG 2.9Å; D226-C229 WeakPolarHBondContact OD1-CA 3.42Å; D226-C229 WeakPolarHBondContact OD1-CB 3.35Å; D226-C229 PolarHBondContact OD1-N 3.32Å; C229-R232 CarbonylContact O-C 3.55Å; C229-R232 WeakPolarHBondContact O-CA 3.39Å; C229-R232 WeakPolarHBondContact O-CB 3.5Å; C229-R232 PolarHBondContact O-N 3.33Å; C229-R232 VanDerWaalsContact O-N 3.17Å; C229-R233 PolarHBondContact O-N 3.25Å
230	A	97.1	Very high	96.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-69.8	-34.3	-175.4	0	0	0	0	0	113.1	C224 D226 Q227 R233 R234 S312	C224-A230 HydrophobicContact CB-CB 4.26Å; C224-A230 PolarHBondContact SG-N 3.42Å; C224-A230 VanDerWaalsContact SG-N 3.4Å; D226-A230 PolarHBondContact O-N 2.98Å; Q227-A230 PolarHBondContact O-N 3.38Å; A230-R233 WeakPolarHBondContact O-CB 3.46Å; A230-R233 PolarHBondContact O-N 2.85Å; A230-R234 PolarHBondContact O-N 3.39Å; A230-S312 WeakPolarHBondContact CB-O 3.39Å
231	E	97.8	Very high	96.5	Very high	55 Å²	55	38.4 Å²	38.4	26%	0.257	20%	0.199	S	C	.	.	H	α-helix	trans	-70.1	-38.7	169.2	-169.1	61.3	-144.2	0	0	110.9	Q227 R233 R234 Q235 S312	Q227-E231 WeakPolarHBondContact O-CB 3.42Å; Q227-E231 PolarHBondContact O-N 2.95Å; E231-R233 PolarHBondContact O-N 2.95Å; E231-R234 PolarHBondContact O-N 3.22Å; E231-R234 IonicContact OE1-CZ 2.67Å; E231-R234 IonicContact OE1-NE 2.71Å; E231-R234 PolarHBondContact OE1-NE 3.34Å; E231-R234 IonicContact OE1-NH2 3.34Å; E231-R234 IonicContact OE2-NE 3.85Å; E231-R234 PolarHBondContact OE2-NE 2.97Å; E231-Q235 HydrophobicContact CG-CG 4.09Å; E231-Q235 VanDerWaalsContact O-CB 3.28Å; E231-Q235 WeakPolarHBondContact O-CB 3.27Å; E231-Q235 WeakPolarHBondContact O-CG 3.38Å; E231-Q235 PolarHBondContact O-N 3Å; E231-Q235 WeakPolarHBondContact OE1-CG 3.14Å; E231-Q235 PolarHBondContact OE1-NE2 3.17Å; E231-S312 WeakPolarHBondContact OE2-CB 3.39Å; E231-S312 PolarHBondContact OE2-OG 2.83Å
232	R	97.8	Very high	96.6	Very high	108 Å²	108	38.4 Å²	38.4	41%	0.408	20%	0.199	S	C	.	.	H	α-helix	trans	-56.4	-38.1	171.2	177.4	179.4	-60.9	-71.5	-1.1	111.8	C161 A228 C229 T236	C161-R232 HydrophobicContact CB-CB 4.36Å; C161-R232 HydrophobicContact CB-CG 3.89Å; A228-R232 VanDerWaalsContact O-CB 3.31Å; A228-R232 WeakPolarHBondContact O-CB 3.42Å; A228-R232 PolarHBondContact O-N 3.1Å; A228-R232 VanDerWaalsContact O-N 3.13Å; C229-R232 CarbonylContact O-C 3.55Å; C229-R232 WeakPolarHBondContact O-CA 3.39Å; C229-R232 WeakPolarHBondContact O-CB 3.5Å; C229-R232 PolarHBondContact O-N 3.33Å; C229-R232 VanDerWaalsContact O-N 3.17Å; R232-T236 PolarHBondContact O-N 3.15Å; R232-T236 PolarHBondContact O-OG1 3.2Å
233	R	97.8	Very high	96.8	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-66.8	-50.6	174.3	-172.1	175.2	66.6	-149.9	-4.2	111.7	L220 C222 C229 A230 E231 Q235 T236 Y309 S313	L220-R233 WeakPolarHBondContact O-CG 3.26Å; C222-R233 WeakPolarHBondContact O-CD 3.15Å; C222-R233 PolarHBondContact O-NH1 2.92Å; C229-R233 PolarHBondContact O-N 3.25Å; A230-R233 WeakPolarHBondContact O-CB 3.46Å; A230-R233 PolarHBondContact O-N 2.85Å; E231-R233 PolarHBondContact O-N 2.95Å; R233-Q235 PolarHBondContact O-N 3.41Å; R233-T236 WeakPolarHBondContact O-CB 3.46Å; R233-T236 PolarHBondContact O-N 3.47Å; R233-T236 VanDerWaalsContact O-N 3.13Å; R233-T236 PolarHBondContact O-OG1 3.4Å; R233-Y309 HydrophobicContact CG-CD2 4.03Å; R233-Y309 HydrophobicContact CG-CE1 4.46Å; R233-Y309 HydrophobicContact CG-CE2 3.56Å; R233-S313 PolarHBondContact NH2-O 3.09Å
234	R	98.4	Very high	97	Very high	36 Å²	36	39.8 Å²	39.8	14%	0.136	20%	0.202	C	C	.	.	H	α-helix	trans	-56.9	-35.4	175.8	-162.1	-172.2	93.5	81.9	0.4	112.6	A230 E231 P239 E244 N308 D311	A230-R234 PolarHBondContact O-N 3.39Å; E231-R234 PolarHBondContact O-N 3.22Å; E231-R234 IonicContact OE1-CZ 2.67Å; E231-R234 IonicContact OE1-NE 2.71Å; E231-R234 PolarHBondContact OE1-NE 3.34Å; E231-R234 IonicContact OE1-NH2 3.34Å; E231-R234 IonicContact OE2-NE 3.85Å; E231-R234 PolarHBondContact OE2-NE 2.97Å; R234-P239 WeakPolarHBondContact O-CD 3Å; R234-E244 IonicContact CZ-OE1 2.7Å; R234-E244 VanDerWaalsContact CZ-OE1 3.32Å; R234-E244 IonicContact NH1-OE1 3.2Å; R234-E244 PolarHBondContact NH1-OE1 2.6Å; R234-E244 IonicContact NH2-OE1 3.93Å; R234-E244 PolarHBondContact NH2-OE1 2.88Å; R234-N308 PolarHBondContact O-ND2 2.89Å; R234-D311 VanDerWaalsContact CD-O 3.31Å; R234-D311 WeakPolarHBondContact CD-O 3.27Å
235	Q	98.3	Very high	97.1	Very high	68 Å²	68	43 Å²	43	32%	0.318	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-82.1	-5.8	-179.3	-67.6	-66.2	-27.9	0	0	114.6	E231 R233 I237 L238	E231-Q235 HydrophobicContact CG-CG 4.09Å; E231-Q235 VanDerWaalsContact O-CB 3.28Å; E231-Q235 WeakPolarHBondContact O-CB 3.27Å; E231-Q235 WeakPolarHBondContact O-CG 3.38Å; E231-Q235 PolarHBondContact O-N 3Å; E231-Q235 WeakPolarHBondContact OE1-CG 3.14Å; E231-Q235 PolarHBondContact OE1-NE2 3.17Å; R233-Q235 PolarHBondContact O-N 3.41Å; Q235-I237 PolarHBondContact O-N 3.47Å; Q235-L238 PolarHBondContact O-N 3.03Å
236	T	98.5	Very high	97.1	Very high	14 Å²	14	44.6 Å²	44.6	9%	0.086	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-52.3	-35.3	-176.2	-74.7	0	0	0	0	113.4	Y181 M219 L220 R232 R233	Y181-T236 WeakPolarHBondContact CE2-O 3.36Å; Y181-T236 PolarHBondContact OH-O 3.01Å; M219-T236 HydrophobicContact CB-CG2 4.47Å; M219-T236 HydrophobicContact CE-CG2 4.34Å; M219-T236 PolarHBondContact O-OG1 3.47Å; L220-T236 HydrophobicContact CD1-CG2 4.29Å; R232-T236 PolarHBondContact O-N 3.15Å; R232-T236 PolarHBondContact O-OG1 3.2Å; R233-T236 WeakPolarHBondContact O-CB 3.46Å; R233-T236 PolarHBondContact O-N 3.47Å; R233-T236 VanDerWaalsContact O-N 3.13Å; R233-T236 PolarHBondContact O-OG1 3.4Å
237	I	98.6	Very high	97.2	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-101.6	7.1	-178.5	66.6	168.7	0	0	0	114.7	L204 F208 L220 Q235 S242 I301 T306 N308	L204-I237 HydrophobicContact CD2-CB 4.21Å; L204-I237 HydrophobicContact CD2-CG2 4.4Å; F208-I237 HydrophobicContact CE2-CG2 4.23Å; F208-I237 HydrophobicContact CZ-CG2 4.27Å; L220-I237 HydrophobicContact CD1-CG2 4.46Å; Q235-I237 PolarHBondContact O-N 3.47Å; I237-S242 WeakPolarHBondContact O-CB 3.07Å; I237-S242 PolarHBondContact O-OG 3.32Å; I237-I301 HydrophobicContact CB-CG2 4.47Å; I237-I301 HydrophobicContact CG2-CD1 4.35Å; I237-I301 HydrophobicContact CG2-CG2 3.83Å; I237-T306 HydrophobicContact CD1-CG2 3.81Å; I237-N308 HydrophobicContact CD1-CB 3.99Å
238	L	98.3	Very high	97.3	Very high	25 Å²	25	47.3 Å²	47.3	13%	0.131	23%	0.232	C	C	.	.			trans	52.1	71.8	-170.6	-81.2	69.2	0	0	0	112.1	Y181 I182 C185 N186 Q235 S240 C241 S242	Y181-L238 HydrophobicContact CE2-CD1 4.23Å; I182-L238 HydrophobicContact CG1-CD1 4.02Å; I182-L238 HydrophobicContact CG2-CD2 4.32Å; C185-L238 HydrophobicContact CB-CB 4.24Å; C185-L238 HydrophobicContact CB-CD2 3.86Å; N186-L238 HydrophobicContact CB-CD2 3.86Å; Q235-L238 PolarHBondContact O-N 3.03Å; L238-S240 VanDerWaalsContact C-N 3.28Å; L238-S240 PolarHBondContact O-N 3.22Å; L238-C241 PolarHBondContact O-N 2.92Å; L238-C241 VanDerWaalsContact O-N 3.09Å; L238-S242 PolarHBondContact O-N 2.9Å; L238-S242 PolarHBondContact O-OG 2.04Å; L238-S242 VanDerWaalsContact O-OG 3.05Å
239	P	98.2	Very high	97.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.2	-35	-171.3	21.1	-33.3	0	0	0	114.2	R234 C241 S242 Y243 E244	R234-P239 WeakPolarHBondContact O-CD 3Å; P239-C241 PolarHBondContact O-N 3.23Å; P239-S242 PolarHBondContact O-N 3.12Å; P239-Y243 HydrophobicContact CB-CD1 4.04Å; P239-Y243 HydrophobicContact CB-CG 4.45Å; P239-Y243 PolarHBondContact O-N 2.79Å; P239-E244 HydrophobicContact CB-CG 4.29Å; P239-E244 PolarHBondContact O-N 2.96Å
240	S	96.7	Very high	97.5	Very high	52 Å²	52	47.3 Å²	47.3	36%	0.364	23%	0.226	S	C	.	.	H	α-helix	trans	-66	8.6	176.5	55.6	0	0	0	0	115.5	L238 E244	L238-S240 VanDerWaalsContact C-N 3.28Å; L238-S240 PolarHBondContact O-N 3.22Å; S240-E244 VanDerWaalsContact CA-OE2 3.27Å; S240-E244 WeakPolarHBondContact CA-OE2 3.48Å; S240-E244 PolarHBondContact N-OE2 2.69Å
241	C	97.8	Very high	97.5	Very high	7 Å²	7	47.3 Å²	47.3	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-138.1	-38.4	172.4	169.9	0	0	0	0	112.5	C185 C195 R197 C200 L238 P239	C185-C241 HydrophobicContact CB-CB 4.38Å; C185-C241 WeakPolarHBondContact O-CB 3.44Å; C185-C241 PolarHBondContact O-SG 3.5Å; C195-C241 HydrophobicContact CB-CB 3.81Å; C195-C241 WeakPolarHBondContact CB-SG 3.25Å; C195-C241 WeakPolarHBondContact SG-CA 3.04Å; C195-C241 WeakPolarHBondContact SG-CB 3.27Å; C195-C241 CovalentContact SG-SG 2.02Å; C195-C241 PolarHBondContact SG-SG 3.04Å; R197-C241 WeakPolarHBondContact CG-O 3.47Å; C200-C241 VanDerWaalsContact CB-SG 3.51Å; C200-C241 PolarHBondContact SG-SG 3.33Å; L238-C241 PolarHBondContact O-N 2.92Å; L238-C241 VanDerWaalsContact O-N 3.09Å; P239-C241 PolarHBondContact O-N 3.23Å
242	S	98.2	Very high	97.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-94.8	-26.9	-173.9	62.5	0	0	0	0	114.5	R197 H201 I237 L238 P239	R197-S242 PolarHBondContact NE-O 2.95Å; R197-S242 PolarHBondContact NH2-O 2.87Å; H201-S242 PolarHBondContact NE2-O 3.12Å; I237-S242 WeakPolarHBondContact O-CB 3.07Å; I237-S242 PolarHBondContact O-OG 3.32Å; L238-S242 PolarHBondContact O-N 2.9Å; L238-S242 PolarHBondContact O-OG 2.04Å; L238-S242 VanDerWaalsContact O-OG 3.05Å; P239-S242 PolarHBondContact O-N 3.12Å
243	Y	98.6	Very high	97.5	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.016	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-59.9	-166.3	176.9	-118.8	0	0	0	111.9	R197 P239 T306 N308 S320 P321 W322	R197-Y243 VanDerWaalsContact NH2-C 3.33Å; R197-Y243 PolarHBondContact NH2-O 2.04Å; P239-Y243 HydrophobicContact CB-CD1 4.04Å; P239-Y243 HydrophobicContact CB-CG 4.45Å; P239-Y243 PolarHBondContact O-N 2.79Å; Y243-T306 WeakPolarHBondContact CD2-O 3.23Å; Y243-N308 HydrophobicContact CD1-CB 3.74Å; Y243-N308 HydrophobicContact CD2-CB 3.81Å; Y243-N308 HydrophobicContact CE1-CB 3.83Å; Y243-N308 HydrophobicContact CE2-CB 3.91Å; Y243-N308 HydrophobicContact CG-CB 3.75Å; Y243-S320 VanDerWaalsContact CE2-O 3.24Å; Y243-S320 WeakPolarHBondContact CE2-O 3.46Å; Y243-S320 PolarHBondContact OH-O 3.29Å; Y243-S320 VanDerWaalsContact OH-O 3.07Å; Y243-S320 PolarHBondContact OH-OG 2.69Å; Y243-S320 VanDerWaalsContact OH-OG 3.04Å; Y243-P321 PolarHBondContact OH-O 3.24Å; Y243-W322 HydrophobicContact CD1-CE3 4.06Å; Y243-W322 HydrophobicContact CD2-CB 4Å; Y243-W322 AromaticContact CE1-CE3 3.66Å; Y243-W322 HydrophobicContact CE1-CE3 3.66Å; Y243-W322 HydrophobicContact CE1-CZ3 4.19Å; Y243-W322 HydrophobicContact CE2-CB 3.81Å; Y243-W322 HydrophobicContact CE2-CE3 4.5Å; Y243-W322 AromaticContact CZ-CE3 3.88Å; Y243-W322 WeakPolarHBondContact O-CB 2.99Å
244	E	97.1	Very high	97.5	Very high	54 Å²	54	47.3 Å²	47.3	25%	0.252	24%	0.236	S	C	.	.			trans	-69.4	142.5	-179.2	-63.2	161.1	-174.5	0	0	110.6	R234 P239 S240 W322	R234-E244 IonicContact CZ-OE1 2.7Å; R234-E244 VanDerWaalsContact CZ-OE1 3.32Å; R234-E244 IonicContact NH1-OE1 3.2Å; R234-E244 PolarHBondContact NH1-OE1 2.6Å; R234-E244 IonicContact NH2-OE1 3.93Å; R234-E244 PolarHBondContact NH2-OE1 2.88Å; P239-E244 HydrophobicContact CB-CG 4.29Å; P239-E244 PolarHBondContact O-N 2.96Å; S240-E244 VanDerWaalsContact CA-OE2 3.27Å; S240-E244 WeakPolarHBondContact CA-OE2 3.48Å; S240-E244 PolarHBondContact N-OE2 2.69Å; E244-W322 HydrophobicContact CB-CH2 4.3Å; E244-W322 HydrophobicContact CB-CZ2 4.49Å; E244-W322 HydrophobicContact CB-CZ3 4.36Å; E244-W322 HydrophobicContact CG-CE3 4.25Å; E244-W322 HydrophobicContact CG-CH2 4.12Å; E244-W322 HydrophobicContact CG-CZ3 3.83Å
245	D	94.8	Very high	97.4	Very high	82 Å²	82	46 Å²	46	44%	0.439	23%	0.231	S	C	.	.			trans	-145.4	174.4	171.9	-141	-50	0	0	0	110.3	R197 E247 W322	R197-D245 IonicContact CZ-OD2 3.09Å; R197-D245 IonicContact NH1-OD2 2.75Å; R197-D245 PolarHBondContact NH1-OD2 2.97Å; D245-E247 PolarHBondContact O-N 2.87Å; D245-W322 WeakPolarHBondContact O-CZ2 3.42Å
246	K	94	Very high	97.3	Very high	178 Å²	178	44.5 Å²	44.5	77%	0.774	23%	0.234	S	C	*	.	S	Bend	trans	-61.4	-27.9	-174.2	-64.5	177.6	-176	172.7	0	113.7	T192	T192-K246 PolarHBondContact O-NZ 3.2Å; T192-K246 VanDerWaalsContact O-NZ 3.15Å
247	E	95.5	Very high	97.2	Very high	152 Å²	152	47.4 Å²	47.4	71%	0.71	25%	0.251	S	S	*	.	S	Bend	trans	-136.6	162.4	177.9	66	-169.1	159.5	0	0	111	D245 W322	D245-E247 PolarHBondContact O-N 2.87Å; E247-W322 PolarHBondContact O-NE1 3.12Å
248	K	97.5	Very high	97.1	Very high	91 Å²	91	47.4 Å²	47.4	40%	0.396	25%	0.251	S	S	.	.			trans	-107	106	170.6	-79.6	-173.3	171.3	-163.4	0	108.7	W322	K248-W322 HydrophobicContact CD-CD2 4.43Å; K248-W322 HydrophobicContact CD-CZ2 4.37Å; K248-W322 VanDerWaalsContact CE-CE3 3.43Å; K248-W322 HydrophobicContact CG-CD2 3.94Å; K248-W322 VanDerWaalsContact CG-CE2 3.49Å; K248-W322 HydrophobicContact CG-CG 4.27Å; K248-W322 HydrophobicContact CG-CH2 4.48Å; K248-W322 HydrophobicContact CG-CZ2 3.81Å
249	P	97.9	Very high	96.9	Very high	50 Å²	50	49 Å²	49	33%	0.325	26%	0.255	S	S	.	.			trans	-65.7	172.6	176.7	29.2	-36.6	0	0	0	111.6	L254 C323 S324	P249-L254 HydrophobicContact CG-CB 4.49Å; P249-C323 CarbonylContact O-C 3.6Å; P249-C323 VanDerWaalsContact O-CA 3.27Å; P249-C323 WeakPolarHBondContact O-CA 3.47Å; P249-C323 VanDerWaalsContact O-CB 3.28Å; P249-C323 WeakPolarHBondContact O-CB 3.33Å; P249-S324 PolarHBondContact O-N 2.93Å
250	N	98.4	Very high	96.7	Very high	15 Å²	15	54.5 Å²	54.5	8%	0.08	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-66.5	140.5	169.4	-167	-78	0	0	0	110.5	L252 D253 L254 S324 R326 S328	N250-L252 VanDerWaalsContact C-N 3.3Å; N250-L252 PolarHBondContact O-N 3.42Å; N250-L252 WeakPolarHBondContact OD1-CB 3.48Å; N250-L252 PolarHBondContact OD1-N 3.05Å; N250-D253 HydrophobicContact CB-CB 4.21Å; N250-D253 WeakPolarHBondContact CB-OD2 3.45Å; N250-D253 PolarHBondContact O-N 3.06Å; N250-L254 PolarHBondContact O-N 3.01Å; N250-S324 CarbonylContact C-O 3.52Å; N250-S324 VanDerWaalsContact CA-O 3.28Å; N250-S324 WeakPolarHBondContact CA-O 3.42Å; N250-R326 PolarHBondContact ND2-O 3.19Å; N250-S328 PolarHBondContact ND2-N 2.05Å; N250-S328 PolarHBondContact ND2-OG 3.23Å
251	C	98.5	Very high	96.6	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.4	-30.4	-179.9	-61.3	0	0	0	0	113.3	R255 C323 S324 F338	C251-R255 WeakPolarHBondContact O-CB 3.44Å; C251-R255 PolarHBondContact O-N 2.85Å; C251-C323 WeakPolarHBondContact CA-SG 3.27Å; C251-C323 HydrophobicContact CB-CB 3.88Å; C251-C323 WeakPolarHBondContact CB-SG 3.44Å; C251-C323 WeakPolarHBondContact SG-CB 2.95Å; C251-C323 CovalentContact SG-SG 2.03Å; C251-C323 PolarHBondContact SG-SG 3.43Å; C251-S324 PolarHBondContact N-O 3.43Å; C251-S324 PolarHBondContact SG-N 2.86Å; C251-S324 VanDerWaalsContact SG-N 3.43Å; C251-S324 PolarHBondContact SG-O 2.92Å; C251-F338 HydrophobicContact CB-CD1 3.85Å; C251-F338 HydrophobicContact CB-CE1 4.02Å
252	L	97.7	Very high	96.5	Very high	31 Å²	31	57.6 Å²	57.6	16%	0.162	30%	0.299	C	S	.	.	H	α-helix	trans	-72.4	-38.4	176.5	-60.5	177.6	0	0	0	111.6	N250 R255 G256 M331 E334 C335	N250-L252 VanDerWaalsContact C-N 3.3Å; N250-L252 PolarHBondContact O-N 3.42Å; N250-L252 WeakPolarHBondContact OD1-CB 3.48Å; N250-L252 PolarHBondContact OD1-N 3.05Å; L252-R255 WeakPolarHBondContact O-CB 3.44Å; L252-R255 PolarHBondContact O-N 3.04Å; L252-G256 PolarHBondContact O-N 3.48Å; L252-M331 HydrophobicContact CD1-CB 3.55Å; L252-M331 HydrophobicContact CD1-CG 4.48Å; L252-E334 HydrophobicContact CD2-CG 4.22Å; L252-C335 HydrophobicContact CD1-CB 3.89Å; L252-C335 HydrophobicContact CD2-CB 4.38Å; L252-C335 HydrophobicContact CG-CB 3.85Å
253	D	97.1	Very high	96.4	Very high	112 Å²	112	59 Å²	59	60%	0.599	31%	0.306	S	S	*	.	H	α-helix	trans	-62.8	-47	172.1	-67.4	-30.7	0	0	0	111.1	N250 R255 G256 V257	N250-D253 HydrophobicContact CB-CB 4.21Å; N250-D253 WeakPolarHBondContact CB-OD2 3.45Å; N250-D253 PolarHBondContact O-N 3.06Å; D253-R255 VanDerWaalsContact C-N 3.27Å; D253-R255 PolarHBondContact O-N 2.61Å; D253-G256 CarbonylContact O-C 3.46Å; D253-G256 WeakPolarHBondContact O-CA 3.06Å; D253-G256 PolarHBondContact O-N 3.29Å; D253-V257 PolarHBondContact O-N 3.31Å
254	L	97.8	Very high	96.4	Very high	22 Å²	22	59 Å²	59	12%	0.115	31%	0.307	C	S	.	.	H	α-helix	trans	-62.2	-35.4	177.7	-172	63.4	0	0	0	111.9	P249 N250 V257 C258 D304 M305 C323	P249-L254 HydrophobicContact CG-CB 4.49Å; N250-L254 PolarHBondContact O-N 3.01Å; L254-V257 PolarHBondContact O-N 2.97Å; L254-C258 WeakPolarHBondContact O-CB 3.24Å; L254-C258 PolarHBondContact O-N 2.81Å; L254-D304 HydrophobicContact CD1-CB 3.99Å; L254-M305 HydrophobicContact CB-CE 4.02Å; L254-M305 HydrophobicContact CD2-CE 4.12Å; L254-M305 HydrophobicContact CD2-SD 3.88Å; L254-M305 HydrophobicContact CG-CE 3.76Å; L254-M305 HydrophobicContact CG-SD 4.18Å; L254-C323 HydrophobicContact CD2-CB 3.92Å
255	R	96.7	Very high	96.3	Very high	9 Å²	9	58.3 Å²	58.3	3%	0.034	30%	0.302	C	S	.	.	H	α-helix	trans	-68.8	-37.7	172.4	176.4	172.6	166.8	-118.1	-0.2	111.5	E121 F122 C251 L252 D253 C258 R259 L268 M305 E334 F338	E121-R255 PolarHBondContact O-NH2 3.46Å; F122-R255 VanDerWaalsContact CA-NH2 3.32Å; F122-R255 PolarHBondContact O-NH2 3.09Å; C251-R255 WeakPolarHBondContact O-CB 3.44Å; C251-R255 PolarHBondContact O-N 2.85Å; L252-R255 WeakPolarHBondContact O-CB 3.44Å; L252-R255 PolarHBondContact O-N 3.04Å; D253-R255 VanDerWaalsContact C-N 3.27Å; D253-R255 PolarHBondContact O-N 2.61Å; R255-C258 PolarHBondContact O-N 3.36Å; R255-R259 WeakPolarHBondContact O-CB 3.15Å; R255-R259 VanDerWaalsContact O-CG 3.3Å; R255-R259 WeakPolarHBondContact O-CG 3.45Å; R255-R259 PolarHBondContact O-N 3.32Å; R255-L268 HydrophobicContact CG-CD2 4.29Å; R255-M305 VanDerWaalsContact CA-CE 3.48Å; R255-M305 HydrophobicContact CB-CE 3.81Å; R255-M305 VanDerWaalsContact N-CE 3.34Å; R255-E334 IonicContact CZ-OE1 2.73Å; R255-E334 IonicContact NH1-OE1 3.18Å; R255-E334 PolarHBondContact NH1-OE1 3.47Å; R255-E334 IonicContact NH2-OE1 3.41Å; R255-F338 HydrophobicContact CB-CZ 4.4Å; R255-F338 HydrophobicContact CG-CE2 4.48Å
256	G	95	Very high	96.4	Very high	36 Å²	36	54.4 Å²	54.4	37%	0.371	28%	0.281	S	S	.	.	H	α-helix	trans	-59.9	-47.2	170	0	0	0	0	0	112.6	L252 D253 R259	L252-G256 PolarHBondContact O-N 3.48Å; D253-G256 CarbonylContact O-C 3.46Å; D253-G256 WeakPolarHBondContact O-CA 3.06Å; D253-G256 PolarHBondContact O-N 3.29Å; G256-R259 WeakPolarHBondContact O-CB 3.45Å; G256-R259 PolarHBondContact O-N 3.43Å
257	V	96.7	Very high	96.6	Very high	75 Å²	75	46.2 Å²	46.2	46%	0.455	25%	0.245	S	C	.	.	H	α-helix	trans	-58.9	-51.3	173.7	174.3	0	0	0	0	110.8	D253 L254 R259 T260	D253-V257 PolarHBondContact O-N 3.31Å; L254-V257 PolarHBondContact O-N 2.97Å; V257-R259 PolarHBondContact O-N 3.23Å; V257-T260 WeakPolarHBondContact O-CB 3.48Å; V257-T260 PolarHBondContact O-N 3.12Å; V257-T260 PolarHBondContact O-OG1 3.15Å
258	C	96.9	Very high	96.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58	-34.5	178.3	-175.2	0	0	0	0	113.1	L254 R255 T260 D261 C264 R265	L254-C258 WeakPolarHBondContact O-CB 3.24Å; L254-C258 PolarHBondContact O-N 2.81Å; R255-C258 PolarHBondContact O-N 3.36Å; C258-T260 PolarHBondContact O-N 2.75Å; C258-D261 PolarHBondContact O-N 2.87Å; C258-D261 VanDerWaalsContact O-O 3.11Å; C258-C264 VanDerWaalsContact CA-SG 3.54Å; C258-C264 HydrophobicContact CB-CB 4.11Å; C258-C264 WeakPolarHBondContact CB-SG 3.31Å; C258-C264 WeakPolarHBondContact O-CB 3.43Å; C258-C264 WeakPolarHBondContact SG-CB 3.4Å; C258-C264 CovalentContact SG-SG 2.04Å; C258-C264 PolarHBondContact SG-SG 2.91Å; C258-R265 PolarHBondContact O-N 2.89Å
259	R	93.9	Very high	96.6	Very high	59 Å²	59	35.1 Å²	35.1	22%	0.223	20%	0.195	C	C	.	.	H	α-helix	trans	-65.7	-16.7	175.4	-83	174.9	154.6	171.7	-2.4	114.6	E121 E124 R255 G256 V257 R265	E121-R259 PolarHBondContact O-NH1 2.59Å; E121-R259 VanDerWaalsContact O-NH1 3.13Å; E121-R259 PolarHBondContact O-NH2 2.83Å; E124-R259 IonicContact OE1-CZ 3.5Å; E124-R259 IonicContact OE1-NE 2.68Å; E124-R259 PolarHBondContact OE1-NE 3.08Å; E124-R259 IonicContact OE1-NH2 3.11Å; E124-R259 PolarHBondContact OE1-NH2 3.25Å; R255-R259 WeakPolarHBondContact O-CB 3.15Å; R255-R259 VanDerWaalsContact O-CG 3.3Å; R255-R259 WeakPolarHBondContact O-CG 3.45Å; R255-R259 PolarHBondContact O-N 3.32Å; G256-R259 WeakPolarHBondContact O-CB 3.45Å; G256-R259 PolarHBondContact O-N 3.43Å; V257-R259 PolarHBondContact O-N 3.23Å; R259-R265 HydrophobicContact CG-CG 4.44Å; R259-R265 PolarHBondContact O-NH1 3.42Å
260	T	93	Very high	96.5	Very high	116 Å²	116	33 Å²	33	71%	0.712	18%	0.181	S	C	*	.	H	α-helix	trans	-82.6	-27	175.3	70	0	0	0	0	113.5	V257 C258	V257-T260 WeakPolarHBondContact O-CB 3.48Å; V257-T260 PolarHBondContact O-N 3.12Å; V257-T260 PolarHBondContact O-OG1 3.15Å; C258-T260 PolarHBondContact O-N 2.75Å
261	D	95.4	Very high	96.5	Very high	64 Å²	64	32.3 Å²	32.3	34%	0.342	18%	0.177	S	C	.	.	S	Bend	trans	-94.7	118.6	175.5	179	-96.6	0	0	0	110.5	C258 L263 C264 R265	C258-D261 PolarHBondContact O-N 2.87Å; C258-D261 VanDerWaalsContact O-O 3.11Å; D261-L263 PolarHBondContact O-N 3.27Å; D261-L263 VanDerWaalsContact O-N 3.13Å; D261-L263 WeakPolarHBondContact OD1-CA 3.41Å; D261-L263 WeakPolarHBondContact OD1-CB 3.13Å; D261-L263 PolarHBondContact OD1-N 3.45Å; D261-C264 HydrophobicContact CB-CB 4.06Å; D261-C264 PolarHBondContact O-N 2.96Å; D261-C264 PolarHBondContact OD1-N 3.31Å; D261-R265 VanDerWaalsContact O-CB 3.27Å; D261-R265 WeakPolarHBondContact O-CB 3.49Å; D261-R265 PolarHBondContact O-N 3.38Å
262	H	95.2	Very high	96.4	Very high	59 Å²	59	32.6 Å²	32.6	27%	0.273	18%	0.179	S	C	.	.	H	α-helix	trans	-58.8	-29.1	-176.5	-68.5	-65.9	0	0	0	113.6	L103 L106 Q107 W110 S266	L103-H262 HydrophobicContact CD1-CB 4.21Å; L106-H262 HydrophobicContact CB-CB 4.32Å; Q107-H262 VanDerWaalsContact CG-CD2 3.49Å; Q107-H262 WeakPolarHBondContact CG-CD2 3.43Å; W110-H262 AromaticContact CD1-CG 3.87Å; W110-H262 AromaticContact CD1-ND1 3.14Å; W110-H262 AromaticContact CG-ND1 3.57Å; H262-S266 VanDerWaalsContact O-CB 3.24Å; H262-S266 WeakPolarHBondContact O-CB 3.42Å; H262-S266 PolarHBondContact O-N 2.64Å; H262-S266 PolarHBondContact O-OG 3.04Å
263	L	96.9	Very high	96.2	Very high	30 Å²	30	32.4 Å²	32.4	16%	0.157	18%	0.182	C	C	.	.	H	α-helix	trans	-77.3	-47.1	177.8	-73.6	157.7	0	0	0	110.9	E102 L103 L106 D261 S266 R267 F303	E102-L263 HydrophobicContact CG-CD2 3.94Å; L103-L263 HydrophobicContact CB-CD1 4.46Å; L103-L263 HydrophobicContact CD1-CD1 4.21Å; L103-L263 HydrophobicContact CD1-CG 4.23Å; L106-L263 HydrophobicContact CD1-CD2 3.63Å; L106-L263 HydrophobicContact CD1-CG 4.17Å; D261-L263 PolarHBondContact O-N 3.27Å; D261-L263 VanDerWaalsContact O-N 3.13Å; D261-L263 WeakPolarHBondContact OD1-CA 3.41Å; D261-L263 WeakPolarHBondContact OD1-CB 3.13Å; D261-L263 PolarHBondContact OD1-N 3.45Å; L263-S266 PolarHBondContact O-N 2.94Å; L263-R267 WeakPolarHBondContact O-CB 3.47Å; L263-R267 VanDerWaalsContact O-CG 3.26Å; L263-R267 WeakPolarHBondContact O-CG 3.47Å; L263-R267 PolarHBondContact O-N 2.04Å; L263-F303 HydrophobicContact CB-CE1 3.53Å; L263-F303 HydrophobicContact CB-CZ 3.73Å
264	C	97.9	Very high	96.1	Very high	3 Å²	3	28.3 Å²	28.3	2%	0.02	16%	0.16	C	C	.	.	H	α-helix	trans	-58.4	-53.4	176.2	-167	0	0	0	0	110.9	C258 D261 S266 R267 L268 F303	C258-C264 VanDerWaalsContact CA-SG 3.54Å; C258-C264 HydrophobicContact CB-CB 4.11Å; C258-C264 WeakPolarHBondContact CB-SG 3.31Å; C258-C264 WeakPolarHBondContact O-CB 3.43Å; C258-C264 WeakPolarHBondContact SG-CB 3.4Å; C258-C264 CovalentContact SG-SG 2.04Å; C258-C264 PolarHBondContact SG-SG 2.91Å; D261-C264 HydrophobicContact CB-CB 4.06Å; D261-C264 PolarHBondContact O-N 2.96Å; D261-C264 PolarHBondContact OD1-N 3.31Å; C264-S266 VanDerWaalsContact C-N 3.32Å; C264-S266 PolarHBondContact O-N 2.97Å; C264-R267 PolarHBondContact O-N 3.23Å; C264-L268 WeakPolarHBondContact O-CB 2.98Å; C264-L268 PolarHBondContact O-N 3.41Å; C264-F303 HydrophobicContact CB-CB 4.26Å; C264-F303 HydrophobicContact CB-CD1 3.72Å; C264-F303 HydrophobicContact CB-CE1 4.37Å; C264-F303 HydrophobicContact CB-CG 4.19Å
265	R	96.4	Very high	96	Very high	40 Å²	40	27.3 Å²	27.3	15%	0.151	16%	0.155	C	C	.	.	H	α-helix	trans	-50	-50.1	176.1	-173.3	-176.9	-177.8	140.1	0.1	112.1	W110 E124 C258 R259 D261 L268 A269	W110-R265 HydrophobicContact CH2-CG 4.19Å; W110-R265 HydrophobicContact CZ2-CB 4.5Å; W110-R265 HydrophobicContact CZ2-CG 3.73Å; E124-R265 IonicContact OE1-NE 2.92Å; E124-R265 IonicContact OE1-NH2 3.42Å; E124-R265 IonicContact OE2-CZ 3.01Å; E124-R265 IonicContact OE2-NE 3.5Å; E124-R265 PolarHBondContact OE2-NE 3.4Å; E124-R265 IonicContact OE2-NH2 3.46Å; E124-R265 PolarHBondContact OE2-NH2 3.1Å; C258-R265 PolarHBondContact O-N 2.89Å; R259-R265 HydrophobicContact CG-CG 4.44Å; R259-R265 PolarHBondContact O-NH1 3.42Å; D261-R265 VanDerWaalsContact O-CB 3.27Å; D261-R265 WeakPolarHBondContact O-CB 3.49Å; D261-R265 PolarHBondContact O-N 3.38Å; R265-L268 PolarHBondContact O-N 3.5Å; R265-A269 WeakPolarHBondContact O-CB 3.03Å; R265-A269 PolarHBondContact O-N 2.85Å
266	S	96.6	Very high	95.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-68.6	-39.7	-179.5	-65.9	0	0	0	0	113.4	L106 W110 P127 H262 L263 C264 L268 A269 D270	L106-S266 WeakPolarHBondContact CD2-OG 3.47Å; W110-S266 PolarHBondContact NE1-OG 3.44Å; P127-S266 WeakPolarHBondContact CG-OG 3.41Å; H262-S266 VanDerWaalsContact O-CB 3.24Å; H262-S266 WeakPolarHBondContact O-CB 3.42Å; H262-S266 PolarHBondContact O-N 2.64Å; H262-S266 PolarHBondContact O-OG 3.04Å; L263-S266 PolarHBondContact O-N 2.94Å; C264-S266 VanDerWaalsContact C-N 3.32Å; C264-S266 PolarHBondContact O-N 2.97Å; S266-L268 VanDerWaalsContact C-N 3.3Å; S266-A269 PolarHBondContact O-N 2.8Å; S266-D270 WeakPolarHBondContact O-CB 3.41Å; S266-D270 PolarHBondContact O-N 2.96Å
267	R	97.6	Very high	95.6	Very high	7 Å²	7	32.5 Å²	32.5	3%	0.026	17%	0.17	C	C	.	.	H	α-helix	trans	-69.7	-29.7	177.9	-63.9	-72.9	-178.9	107.2	-7.5	111.4	E102 Y128 D209 L263 C264 F271 G299 M300 F303	E102-R267 IonicContact OE1-CZ 3.51Å; E102-R267 IonicContact OE1-NE 3.47Å; E102-R267 PolarHBondContact OE1-NE 3.34Å; E102-R267 IonicContact OE1-NH2 2.92Å; E102-R267 PolarHBondContact OE1-NH2 3.47Å; E102-R267 IonicContact OE2-NH2 2.8Å; Y128-R267 WeakPolarHBondContact OH-CD 3.42Å; Y128-R267 PolarHBondContact OH-NE 3.22Å; Y128-R267 VanDerWaalsContact OH-NE 3.1Å; D209-R267 IonicContact OD1-CZ 2.73Å; D209-R267 IonicContact OD1-NH1 3.36Å; D209-R267 PolarHBondContact OD1-NH1 2.99Å; D209-R267 IonicContact OD1-NH2 3.63Å; D209-R267 PolarHBondContact OD1-NH2 2.7Å; L263-R267 WeakPolarHBondContact O-CB 3.47Å; L263-R267 VanDerWaalsContact O-CG 3.26Å; L263-R267 WeakPolarHBondContact O-CG 3.47Å; L263-R267 PolarHBondContact O-N 2.04Å; C264-R267 PolarHBondContact O-N 3.23Å; R267-F271 PolarHBondContact O-N 3.25Å; R267-F271 VanDerWaalsContact O-N 3.15Å; R267-G299 WeakPolarHBondContact CD-O 3.05Å; R267-G299 WeakPolarHBondContact CG-O 3.43Å; R267-G299 PolarHBondContact NH1-O 2.89Å; R267-M300 HydrophobicContact CB-CG 4.37Å; R267-F303 HydrophobicContact CB-CE2 4.42Å; R267-F303 HydrophobicContact CG-CE2 3.91Å; R267-F303 HydrophobicContact CG-CZ 4.24Å
268	L	97.6	Very high	95.1	Very high	8 Å²	8	30.1 Å²	30.1	4%	0.042	16%	0.157	C	C	.	.	H	α-helix	trans	-73.5	-43	172	-176.6	60.1	0	0	0	112.7	R255 C264 R265 S266 D270 F271 H272 M300 M305 F338 F342	R255-L268 HydrophobicContact CG-CD2 4.29Å; C264-L268 WeakPolarHBondContact O-CB 2.98Å; C264-L268 PolarHBondContact O-N 3.41Å; R265-L268 PolarHBondContact O-N 3.5Å; S266-L268 VanDerWaalsContact C-N 3.3Å; L268-D270 VanDerWaalsContact C-N 3.29Å; L268-D270 PolarHBondContact O-N 2.95Å; L268-F271 HydrophobicContact CD1-CD1 4.35Å; L268-F271 WeakPolarHBondContact O-CB 3.29Å; L268-F271 PolarHBondContact O-N 2.99Å; L268-F271 VanDerWaalsContact O-N 3.17Å; L268-H272 PolarHBondContact O-N 2.73Å; L268-M300 HydrophobicContact CD1-SD 3.72Å; L268-M305 HydrophobicContact CD1-CG 4.21Å; L268-F338 HydrophobicContact CD1-CE2 4.14Å; L268-F338 HydrophobicContact CD1-CZ 4.37Å; L268-F338 HydrophobicContact CD2-CE2 4.32Å; L268-F338 HydrophobicContact CD2-CZ 4.47Å; L268-F342 HydrophobicContact CD1-CZ 4.29Å
269	A	95.9	Very high	94.6	Very high	2 Å²	2	40.5 Å²	40.5	2%	0.017	20%	0.198	C	C	.	.	H	α-helix	trans	-58.3	-41.9	172.5	0	0	0	0	0	111.6	E124 R265 S266 F271 H272 A273	E124-A269 HydrophobicContact CB-CB 4.05Å; R265-A269 WeakPolarHBondContact O-CB 3.03Å; R265-A269 PolarHBondContact O-N 2.85Å; S266-A269 PolarHBondContact O-N 2.8Å; A269-F271 VanDerWaalsContact C-N 3.34Å; A269-F271 PolarHBondContact O-N 3.38Å; A269-H272 PolarHBondContact O-N 3.13Å; A269-A273 WeakPolarHBondContact O-CB 3.49Å; A269-A273 PolarHBondContact O-N 2.73Å
270	D	95.9	Very high	94.3	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-67.3	-32.1	176.5	-152.5	31.6	0	0	0	112.8	R97 S126 Y128 S266 L268 N274 S296	R97-D270 IonicContact CZ-OD2 3.31Å; R97-D270 IonicContact NE-OD2 3.72Å; R97-D270 PolarHBondContact NE-OD2 3.33Å; R97-D270 IonicContact NH2-OD2 2.76Å; R97-D270 PolarHBondContact NH2-OD2 2.89Å; S126-D270 WeakPolarHBondContact CB-OD1 3.44Å; S126-D270 WeakPolarHBondContact OG-CB 3.36Å; S126-D270 PolarHBondContact OG-OD1 2.96Å; Y128-D270 HydrophobicContact CD2-CB 3.85Å; Y128-D270 WeakPolarHBondContact CD2-OD2 3.43Å; Y128-D270 HydrophobicContact CE2-CB 4.22Å; S266-D270 WeakPolarHBondContact O-CB 3.41Å; S266-D270 PolarHBondContact O-N 2.96Å; L268-D270 VanDerWaalsContact C-N 3.29Å; L268-D270 PolarHBondContact O-N 2.95Å; D270-N274 WeakPolarHBondContact O-CB 3.46Å; D270-N274 PolarHBondContact O-N 3.48Å; D270-N274 VanDerWaalsContact O-N 3.12Å; D270-N274 PolarHBondContact O-ND2 3.07Å; D270-N274 PolarHBondContact OD1-ND2 3.1Å; D270-S296 WeakPolarHBondContact O-CB 3.08Å; D270-S296 PolarHBondContact O-OG 3.48Å
271	F	97.6	Very high	94	Very high	1 Å²	1	42.6 Å²	42.6	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-50.2	169.8	173.7	-107.6	0	0	0	111.8	R267 L268 A269 A273 N274 C275 Y297 M300 D341 F342 L348	R267-F271 PolarHBondContact O-N 3.25Å; R267-F271 VanDerWaalsContact O-N 3.15Å; L268-F271 HydrophobicContact CD1-CD1 4.35Å; L268-F271 WeakPolarHBondContact O-CB 3.29Å; L268-F271 PolarHBondContact O-N 2.99Å; L268-F271 VanDerWaalsContact O-N 3.17Å; A269-F271 VanDerWaalsContact C-N 3.34Å; A269-F271 PolarHBondContact O-N 3.38Å; F271-A273 VanDerWaalsContact C-N 3.32Å; F271-A273 PolarHBondContact O-N 2.81Å; F271-N274 PolarHBondContact O-N 3.42Å; F271-C275 HydrophobicContact CD2-CB 3.76Å; F271-C275 WeakPolarHBondContact CD2-SG 3.39Å; F271-C275 HydrophobicContact CE2-CB 3.59Å; F271-C275 VanDerWaalsContact CE2-SG 3.51Å; F271-C275 HydrophobicContact CZ-CB 4.21Å; F271-C275 WeakPolarHBondContact O-CA 3.35Å; F271-C275 VanDerWaalsContact O-CB 3.28Å; F271-C275 WeakPolarHBondContact O-CB 3.37Å; F271-C275 PolarHBondContact O-N 3.36Å; F271-Y297 HydrophobicContact CE2-CD2 4.21Å; F271-M300 HydrophobicContact CB-CE 3.63Å; F271-M300 HydrophobicContact CB-CG 4.43Å; F271-M300 HydrophobicContact CB-SD 3.64Å; F271-M300 HydrophobicContact CD1-CE 3.65Å; F271-M300 HydrophobicContact CD1-SD 4.08Å; F271-M300 HydrophobicContact CD2-CE 3.38Å; F271-M300 HydrophobicContact CE1-CE 4.11Å; F271-M300 HydrophobicContact CE2-CE 3.87Å; F271-M300 HydrophobicContact CG-CE 3.24Å; F271-M300 HydrophobicContact CG-SD 3.84Å; F271-M300 HydrophobicContact CZ-CE 4.21Å; F271-D341 HydrophobicContact CE1-CB 4.37Å; F271-D341 WeakPolarHBondContact CZ-O 3.24Å; F271-F342 HydrophobicContact CD1-CE1 4.23Å; F271-F342 HydrophobicContact CD1-CE2 4.47Å; F271-F342 AromaticContact CD1-CZ 3.98Å; F271-F342 HydrophobicContact CD1-CZ 3.98Å; F271-F342 AromaticContact CE1-CD1 3.96Å; F271-F342 HydrophobicContact CE1-CD1 3.96Å; F271-F342 HydrophobicContact CE1-CD2 4.1Å; F271-F342 AromaticContact CE1-CE1 3.67Å; F271-F342 HydrophobicContact CE1-CE1 3.67Å; F271-F342 AromaticContact CE1-CE2 3.78Å; F271-F342 HydrophobicContact CE1-CE2 3.78Å; F271-F342 HydrophobicContact CE1-CG 4.18Å; F271-F342 AromaticContact CE1-CZ 3.55Å; F271-F342 HydrophobicContact CE1-CZ 3.55Å; F271-F342 AromaticContact CZ-CD1 3.85Å; F271-F342 HydrophobicContact CZ-CD1 3.85Å; F271-F342 AromaticContact CZ-CE1 3.92Å; F271-F342 HydrophobicContact CZ-CE1 3.92Å; F271-F342 HydrophobicContact CZ-CG 4.17Å; F271-F342 HydrophobicContact CZ-CZ 4.27Å; F271-L348 HydrophobicContact CE2-CD2 4.06Å; F271-L348 HydrophobicContact CZ-CD2 4.15Å
272	H	96.1	Very high	93.7	Very high	7 Å²	7	46 Å²	46	3%	0.032	23%	0.227	C	C	.	.	H	α-helix	trans	-62.4	-38.5	176.3	-61.5	153.6	0	0	0	112.2	Y123 L268 A269 N274 R276 F338	Y123-H272 HydrophobicContact CD1-CB 3.68Å; Y123-H272 AromaticContact CD1-CG 3.68Å; Y123-H272 AromaticContact CD1-ND1 3.84Å; Y123-H272 HydrophobicContact CE1-CB 4.23Å; Y123-H272 HydrophobicContact CG-CB 4.45Å; L268-H272 PolarHBondContact O-N 2.73Å; A269-H272 PolarHBondContact O-N 3.13Å; H272-N274 PolarHBondContact O-N 3.49Å; H272-R276 WeakPolarHBondContact O-CB 3.42Å; H272-R276 WeakPolarHBondContact O-CD 3.35Å; H272-R276 WeakPolarHBondContact O-CG 3.26Å; H272-R276 PolarHBondContact O-N 3.41Å; H272-F338 AromaticContact CE1-CE2 3.73Å; H272-F338 AromaticContact NE2-CD2 3.8Å; H272-F338 AromaticContact NE2-CE2 3.51Å
273	A	93.8	Very high	93.3	Very high	27 Å²	27	43.3 Å²	43.3	22%	0.223	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-44.5	178.3	0	0	0	0	0	113	A269 F271	A269-A273 WeakPolarHBondContact O-CB 3.49Å; A269-A273 PolarHBondContact O-N 2.73Å; F271-A273 VanDerWaalsContact C-N 3.32Å; F271-A273 PolarHBondContact O-N 2.81Å
274	N	94.5	Very high	93.1	Very high	26 Å²	26	43.2 Å²	43.2	14%	0.139	22%	0.216	C	C	.	.	H	α-helix	trans	-102.2	-19.6	-169.9	-60.6	-60.4	0	0	0	115.1	D270 F271 H272 P286 A292 C293 S296	D270-N274 WeakPolarHBondContact O-CB 3.46Å; D270-N274 PolarHBondContact O-N 3.48Å; D270-N274 VanDerWaalsContact O-N 3.12Å; D270-N274 PolarHBondContact O-ND2 3.07Å; D270-N274 PolarHBondContact OD1-ND2 3.1Å; F271-N274 PolarHBondContact O-N 3.42Å; H272-N274 PolarHBondContact O-N 3.49Å; N274-P286 WeakPolarHBondContact O-CD 3.1Å; N274-A292 HydrophobicContact CB-CB 3.94Å; N274-C293 WeakPolarHBondContact O-CB 3.47Å; N274-S296 WeakPolarHBondContact CB-OG 3.42Å; N274-S296 PolarHBondContact ND2-OG 3.25Å
275	C	96.1	Very high	92.9	Very high	1 Å²	1	43 Å²	43	1%	0.007	22%	0.215	C	C	.	.	H	α-helix	trans	-108.7	-8.3	178.8	-68.4	0	0	0	0	114.7	F271 A277 C293 N345	F271-C275 HydrophobicContact CD2-CB 3.76Å; F271-C275 WeakPolarHBondContact CD2-SG 3.39Å; F271-C275 HydrophobicContact CE2-CB 3.59Å; F271-C275 VanDerWaalsContact CE2-SG 3.51Å; F271-C275 HydrophobicContact CZ-CB 4.21Å; F271-C275 WeakPolarHBondContact O-CA 3.35Å; F271-C275 VanDerWaalsContact O-CB 3.28Å; F271-C275 WeakPolarHBondContact O-CB 3.37Å; F271-C275 PolarHBondContact O-N 3.36Å; C275-A277 PolarHBondContact O-N 3.18Å; C275-C293 VanDerWaalsContact CA-SG 3.59Å; C275-C293 HydrophobicContact CB-CB 4.09Å; C275-C293 WeakPolarHBondContact CB-SG 3.46Å; C275-C293 VanDerWaalsContact SG-C 3.51Å; C275-C293 WeakPolarHBondContact SG-CA 3.28Å; C275-C293 WeakPolarHBondContact SG-CB 3.21Å; C275-C293 PolarHBondContact SG-O 3.39Å; C275-C293 CovalentContact SG-SG 2.05Å; C275-C293 PolarHBondContact SG-SG 2.83Å; C275-N345 PolarHBondContact O-ND2 3.01Å; C275-N345 PolarHBondContact O-OD1 3.43Å
276	R	92.6	Very high	92.6	Very high	120 Å²	120	42.4 Å²	42.4	45%	0.453	22%	0.216	S	C	.	.	S	Bend	trans	-51	133.5	178.6	56.1	-174.6	176.9	163.5	2.7	111.8	H272 S278 P286	H272-R276 WeakPolarHBondContact O-CB 3.42Å; H272-R276 WeakPolarHBondContact O-CD 3.35Å; H272-R276 WeakPolarHBondContact O-CG 3.26Å; H272-R276 PolarHBondContact O-N 3.41Å; R276-S278 PolarHBondContact O-N 3.44Å; R276-P286 HydrophobicContact CG-CG 3.89Å; R276-P286 WeakPolarHBondContact O-CD 3.14Å
277	A	90.7	Very high	92.2	Very high	34 Å²	34	47 Å²	47	28%	0.281	25%	0.254	S	S	.	.			trans	-65.1	124	-179.5	0	0	0	0	0	110.9	C275 P346	C275-A277 PolarHBondContact O-N 3.18Å; A277-P346 HydrophobicContact CB-CG 4.07Å
278	S	86.6	Confident	91.7	Very high	25 Å²	25	48.9 Å²	48.9	18%	0.175	27%	0.265	C	S	.	.			trans	-120	108.4	-176.7	163.6	0	0	0	0	110.6	R276 Q280 T281 S284	R276-S278 PolarHBondContact O-N 3.44Å; S278-Q280 PolarHBondContact O-N 3.32Å; S278-T281 WeakPolarHBondContact CB-OG1 3.26Å; S278-T281 PolarHBondContact O-N 3.31Å; S278-T281 PolarHBondContact O-OG1 3.21Å; S278-T281 PolarHBondContact OG-OG1 3.29Å; S278-S284 PolarHBondContact N-O 3.17Å; S278-S284 WeakPolarHBondContact O-CA 3.24Å
279	Y	85.4	Confident	91.2	Very high	217 Å²	217	50.1 Å²	50.1	85%	0.851	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-4.4	178.4	-56.8	-76.2	0	0	0	114.1
280	Q	88.2	Confident	91	Very high	191 Å²	191	51.1 Å²	51.1	89%	0.893	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-13.9	179.8	-63.1	178.9	-5.8	0	0	113.5	S278	S278-Q280 PolarHBondContact O-N 3.32Å
281	T	87.8	Confident	90.7	Very high	29 Å²	29	51.7 Å²	51.7	18%	0.178	28%	0.278	C	S	.	.	S	Bend	trans	-116.1	139.3	-167.8	41.5	0	0	0	0	111	S278 T283 S284 C285	S278-T281 WeakPolarHBondContact CB-OG1 3.26Å; S278-T281 PolarHBondContact O-N 3.31Å; S278-T281 PolarHBondContact O-OG1 3.21Å; S278-T281 PolarHBondContact OG-OG1 3.29Å; T281-T283 VanDerWaalsContact C-N 3.28Å; T281-T283 PolarHBondContact O-N 3.2Å; T281-S284 WeakPolarHBondContact O-CA 3.38Å; T281-S284 PolarHBondContact O-N 3.03Å; T281-C285 VanDerWaalsContact CB-O 3.25Å; T281-C285 WeakPolarHBondContact CB-O 3.36Å; T281-C285 WeakPolarHBondContact CG2-O 3.34Å; T281-C285 PolarHBondContact OG1-N 3.27Å; T281-C285 PolarHBondContact OG1-O 2.77Å; T281-C285 VanDerWaalsContact OG1-O 3.1Å
282	V	88.4	Confident	90.4	Very high	135 Å²	135	51.9 Å²	51.9	82%	0.818	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-36.2	-169.8	-179.1	0	0	0	0	112.4	S284 D288	V282-S284 VanDerWaalsContact C-N 3.28Å; V282-D288 PolarHBondContact N-OD1 3.14Å
283	T	86.7	Confident	90.3	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.018	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-8.4	176.9	58.9	0	0	0	0	114.5	T281 C285 D288 Y290 N350 V361	T281-T283 VanDerWaalsContact C-N 3.28Å; T281-T283 PolarHBondContact O-N 3.2Å; T283-C285 PolarHBondContact O-N 3.02Å; T283-C285 WeakPolarHBondContact OG1-CB 3.5Å; T283-C285 PolarHBondContact OG1-N 2.96Å; T283-D288 VanDerWaalsContact CB-OD1 3.27Å; T283-D288 WeakPolarHBondContact CB-OD1 3.26Å; T283-D288 HydrophobicContact CG2-CB 3.82Å; T283-D288 VanDerWaalsContact CG2-OD1 3.25Å; T283-D288 WeakPolarHBondContact CG2-OD1 3.43Å; T283-D288 PolarHBondContact N-OD1 3.44Å; T283-D288 WeakPolarHBondContact OG1-CA 3.15Å; T283-D288 PolarHBondContact OG1-OD1 3.09Å; T283-Y290 HydrophobicContact CG2-CE1 3.92Å; T283-Y290 HydrophobicContact CG2-CE2 4.13Å; T283-N350 PolarHBondContact O-ND2 2.96Å; T283-V361 HydrophobicContact CG2-CG1 4.45Å; T283-V361 HydrophobicContact CG2-CG2 3.7Å
284	S	93.6	Very high	90.4	Very high	27 Å²	27	50.2 Å²	50.2	19%	0.189	27%	0.267	C	S	.	.	S	Bend	trans	65	3.3	-158.7	-47.3	0	0	0	0	116.4	S278 T281 V282 C347	S278-S284 PolarHBondContact N-O 3.17Å; S278-S284 WeakPolarHBondContact O-CA 3.24Å; T281-S284 WeakPolarHBondContact O-CA 3.38Å; T281-S284 PolarHBondContact O-N 3.03Å; V282-S284 VanDerWaalsContact C-N 3.28Å; S284-C347 WeakPolarHBondContact O-CB 3.1Å
285	C	91.9	Very high	90.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.265	C	S	.	.	S	Bend	trans	-101.3	148	179.6	-65.9	0	0	0	0	113.8	T281 T283 A287 D288 Y290 C347	T281-C285 VanDerWaalsContact CB-O 3.25Å; T281-C285 WeakPolarHBondContact CB-O 3.36Å; T281-C285 WeakPolarHBondContact CG2-O 3.34Å; T281-C285 PolarHBondContact OG1-N 3.27Å; T281-C285 PolarHBondContact OG1-O 2.77Å; T281-C285 VanDerWaalsContact OG1-O 3.1Å; T283-C285 PolarHBondContact O-N 3.02Å; T283-C285 WeakPolarHBondContact OG1-CB 3.5Å; T283-C285 PolarHBondContact OG1-N 2.96Å; C285-A287 PolarHBondContact O-N 2.86Å; C285-D288 PolarHBondContact O-N 3.27Å; C285-Y290 HydrophobicContact CB-CD1 4.46Å; C285-Y290 WeakPolarHBondContact SG-CD1 3.49Å; C285-C347 WeakPolarHBondContact CA-SG 3.36Å; C285-C347 HydrophobicContact CB-CB 4Å; C285-C347 WeakPolarHBondContact CB-SG 3.34Å; C285-C347 WeakPolarHBondContact SG-CA 3.48Å; C285-C347 WeakPolarHBondContact SG-CB 3.43Å; C285-C347 CovalentContact SG-SG 2.03Å; C285-C347 PolarHBondContact SG-SG 2.82Å
286	P	91.1	Very high	90.4	Very high	27 Å²	27	49.4 Å²	49.4	18%	0.175	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-50.3	128.6	170.4	-26.5	35.3	0	0	0	112.7	N274 R276 D288 N289	N274-P286 WeakPolarHBondContact O-CD 3.1Å; R276-P286 HydrophobicContact CG-CG 3.89Å; R276-P286 WeakPolarHBondContact O-CD 3.14Å; P286-D288 PolarHBondContact O-N 2.97Å; P286-N289 PolarHBondContact O-N 2.86Å
287	A	87.2	Confident	90.7	Very high	96 Å²	96	43.8 Å²	43.8	79%	0.793	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	50.8	26	-176.6	0	0	0	0	0	114.9	C285 N289	C285-A287 PolarHBondContact O-N 2.86Å; A287-N289 PolarHBondContact O-N 3.27Å; A287-N289 VanDerWaalsContact O-N 3.15Å
288	D	87.8	Confident	91	Very high	46 Å²	46	42.4 Å²	42.4	25%	0.246	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	52.3	27.1	-172.6	-68.2	-60.8	0	0	0	114.7	V282 T283 C285 P286 Y290	V282-D288 PolarHBondContact N-OD1 3.14Å; T283-D288 VanDerWaalsContact CB-OD1 3.27Å; T283-D288 WeakPolarHBondContact CB-OD1 3.26Å; T283-D288 HydrophobicContact CG2-CB 3.82Å; T283-D288 VanDerWaalsContact CG2-OD1 3.25Å; T283-D288 WeakPolarHBondContact CG2-OD1 3.43Å; T283-D288 PolarHBondContact N-OD1 3.44Å; T283-D288 WeakPolarHBondContact OG1-CA 3.15Å; T283-D288 PolarHBondContact OG1-OD1 3.09Å; C285-D288 PolarHBondContact O-N 3.27Å; P286-D288 PolarHBondContact O-N 2.97Å; D288-Y290 PolarHBondContact O-N 3.48Å
289	N	87.6	Confident	91.5	Very high	35 Å²	35	41.4 Å²	41.4	19%	0.187	23%	0.226	C	C	.	.			trans	-99.9	83.6	-170	-170	-12.8	0	0	0	113.3	V131 P286 A287 Q291 A292 C293	V131-N289 PolarHBondContact O-ND2 3.42Å; P286-N289 PolarHBondContact O-N 2.86Å; A287-N289 PolarHBondContact O-N 3.27Å; A287-N289 VanDerWaalsContact O-N 3.15Å; N289-Q291 PolarHBondContact O-N 3.23Å; N289-Q291 WeakPolarHBondContact OD1-CB 3.28Å; N289-Q291 PolarHBondContact OD1-N 2.93Å; N289-Q291 VanDerWaalsContact OD1-N 3.12Å; N289-A292 HydrophobicContact CB-CB 4.18Å; N289-A292 PolarHBondContact O-N 2.86Å; N289-A292 PolarHBondContact OD1-N 3.32Å; N289-C293 PolarHBondContact O-N 3.4Å
290	Y	90.6	Very high	92.2	Very high	23 Å²	23	31.2 Å²	31.2	9%	0.09	19%	0.186	C	C	.	.	H	α-helix	trans	-55	-33.5	171.9	-68.7	-35.2	0	0	0	113.6	L135 T283 C285 D288 C293 L294 N350 A351 A354 V361	L135-Y290 HydrophobicContact CD1-CD2 3.92Å; L135-Y290 HydrophobicContact CD1-CG 4.23Å; T283-Y290 HydrophobicContact CG2-CE1 3.92Å; T283-Y290 HydrophobicContact CG2-CE2 4.13Å; C285-Y290 HydrophobicContact CB-CD1 4.46Å; C285-Y290 WeakPolarHBondContact SG-CD1 3.49Å; D288-Y290 PolarHBondContact O-N 3.48Å; Y290-C293 PolarHBondContact O-N 3.49Å; Y290-L294 WeakPolarHBondContact O-CG 3.24Å; Y290-L294 PolarHBondContact O-N 3.35Å; Y290-N350 HydrophobicContact CE1-CB 3.73Å; Y290-N350 WeakPolarHBondContact OH-CB 3.49Å; Y290-A351 VanDerWaalsContact CD1-CA 3.48Å; Y290-A351 HydrophobicContact CD1-CB 3.48Å; Y290-A351 VanDerWaalsContact CD1-CB 3.48Å; Y290-A351 HydrophobicContact CE1-CB 4.21Å; Y290-A351 HydrophobicContact CG-CB 3.89Å; Y290-A354 HydrophobicContact CD2-CB 3.82Å; Y290-A354 HydrophobicContact CE2-CB 3.53Å; Y290-V361 HydrophobicContact CD2-CG2 3.78Å; Y290-V361 HydrophobicContact CE2-CG2 3.25Å
291	Q	90	Very high	92.7	Very high	16 Å²	16	22.3 Å²	22.3	8%	0.075	14%	0.144	C	C	.	.	H	α-helix	trans	-67	-41	-177.7	169.7	50.8	20.8	0	0	111.8	V131 S133 L135 N289 C293 G295	V131-Q291 HydrophobicContact CG1-CG 4.1Å; S133-Q291 WeakPolarHBondContact O-CG 3.08Å; L135-Q291 HydrophobicContact CD2-CB 3.87Å; L135-Q291 HydrophobicContact CG-CB 3.95Å; N289-Q291 PolarHBondContact O-N 3.23Å; N289-Q291 WeakPolarHBondContact OD1-CB 3.28Å; N289-Q291 PolarHBondContact OD1-N 2.93Å; N289-Q291 VanDerWaalsContact OD1-N 3.12Å; Q291-C293 VanDerWaalsContact C-N 3.32Å; Q291-C293 PolarHBondContact O-N 3.35Å; Q291-G295 PolarHBondContact O-N 3.39Å
292	A	91.1	Very high	93.2	Very high	4 Å²	4	20.9 Å²	20.9	3%	0.033	14%	0.136	C	C	.	.	H	α-helix	trans	-61.1	-41.8	173.8	0	0	0	0	0	111.4	V131 N274 N289 S296	V131-A292 HydrophobicContact CB-CB 4.18Å; N274-A292 HydrophobicContact CB-CB 3.94Å; N289-A292 HydrophobicContact CB-CB 4.18Å; N289-A292 PolarHBondContact O-N 2.86Å; N289-A292 PolarHBondContact OD1-N 3.32Å; A292-S296 VanDerWaalsContact O-CB 3.27Å; A292-S296 WeakPolarHBondContact O-CB 3.44Å; A292-S296 PolarHBondContact O-N 2.91Å; A292-S296 PolarHBondContact O-OG 3.31Å
293	C	95.4	Very high	93.6	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-66.7	-50.8	177.1	177.8	0	0	0	0	112.7	N274 C275 N289 Y290 Q291 G295 S296 Y297	N274-C293 WeakPolarHBondContact O-CB 3.47Å; C275-C293 VanDerWaalsContact CA-SG 3.59Å; C275-C293 HydrophobicContact CB-CB 4.09Å; C275-C293 WeakPolarHBondContact CB-SG 3.46Å; C275-C293 VanDerWaalsContact SG-C 3.51Å; C275-C293 WeakPolarHBondContact SG-CA 3.28Å; C275-C293 WeakPolarHBondContact SG-CB 3.21Å; C275-C293 PolarHBondContact SG-O 3.39Å; C275-C293 CovalentContact SG-SG 2.05Å; C275-C293 PolarHBondContact SG-SG 2.83Å; N289-C293 PolarHBondContact O-N 3.4Å; Y290-C293 PolarHBondContact O-N 3.49Å; Q291-C293 VanDerWaalsContact C-N 3.32Å; Q291-C293 PolarHBondContact O-N 3.35Å; C293-G295 VanDerWaalsContact C-N 3.35Å; C293-G295 PolarHBondContact O-N 2.8Å; C293-S296 WeakPolarHBondContact O-CA 3.04Å; C293-S296 WeakPolarHBondContact O-CB 3.44Å; C293-S296 PolarHBondContact O-N 2.84Å; C293-Y297 PolarHBondContact O-N 3.46Å
294	L	95.6	Very high	94.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.4	-40.4	-179.2	-67.6	178.7	0	0	0	112.6	L135 F221 Y290 S296 A298 A351 I352 F355	L135-L294 HydrophobicContact CD2-CD1 4.24Å; F221-L294 HydrophobicContact CD1-CD2 4.21Å; F221-L294 HydrophobicContact CD2-CD1 4.33Å; F221-L294 HydrophobicContact CD2-CD2 4.13Å; F221-L294 HydrophobicContact CE1-CD2 3.98Å; F221-L294 HydrophobicContact CE2-CB 3.86Å; F221-L294 HydrophobicContact CE2-CD1 4.47Å; F221-L294 HydrophobicContact CE2-CD2 3.93Å; F221-L294 HydrophobicContact CE2-CG 4.29Å; F221-L294 HydrophobicContact CG-CD2 4.27Å; F221-L294 HydrophobicContact CZ-CB 4.18Å; F221-L294 HydrophobicContact CZ-CD2 3.83Å; Y290-L294 WeakPolarHBondContact O-CG 3.24Å; Y290-L294 PolarHBondContact O-N 3.35Å; L294-S296 VanDerWaalsContact C-N 3.28Å; L294-S296 PolarHBondContact O-N 3.04Å; L294-A298 WeakPolarHBondContact O-CB 3.44Å; L294-A298 PolarHBondContact O-N 2.04Å; L294-A351 HydrophobicContact CD1-CB 4.41Å; L294-A351 HydrophobicContact CD2-CB 3.84Å; L294-A351 HydrophobicContact CG-CB 3.92Å; L294-I352 HydrophobicContact CD2-CG1 3.65Å; L294-F355 HydrophobicContact CD1-CB 3.63Å; L294-F355 HydrophobicContact CD1-CD2 3.81Å; L294-F355 HydrophobicContact CD1-CG 3.9Å
295	G	93.9	Very high	94.3	Very high	9 Å²	9	16.9 Å²	16.9	9%	0.093	11%	0.107	C	C	.	.	H	α-helix	trans	-64	-34.2	172.5	0	0	0	0	0	112.6	R97 Y217 Q291 C293 G299	R97-G295 PolarHBondContact NH1-O 3.19Å; Y217-G295 VanDerWaalsContact OH-CA 3.24Å; Y217-G295 WeakPolarHBondContact OH-CA 3.34Å; Q291-G295 PolarHBondContact O-N 3.39Å; C293-G295 VanDerWaalsContact C-N 3.35Å; C293-G295 PolarHBondContact O-N 2.8Å; G295-G299 PolarHBondContact O-N 3.43Å
296	S	96.4	Very high	94.7	Very high	1 Å²	1	17 Å²	17	1%	0.007	11%	0.108	C	C	.	.	H	α-helix	trans	-69.8	-48.9	176.5	-60.6	0	0	0	0	112.4	D270 N274 A292 C293 L294 G299	D270-S296 WeakPolarHBondContact O-CB 3.08Å; D270-S296 PolarHBondContact O-OG 3.48Å; N274-S296 WeakPolarHBondContact CB-OG 3.42Å; N274-S296 PolarHBondContact ND2-OG 3.25Å; A292-S296 VanDerWaalsContact O-CB 3.27Å; A292-S296 WeakPolarHBondContact O-CB 3.44Å; A292-S296 PolarHBondContact O-N 2.91Å; A292-S296 PolarHBondContact O-OG 3.31Å; C293-S296 WeakPolarHBondContact O-CA 3.04Å; C293-S296 WeakPolarHBondContact O-CB 3.44Å; C293-S296 PolarHBondContact O-N 2.84Å; L294-S296 VanDerWaalsContact C-N 3.28Å; L294-S296 PolarHBondContact O-N 3.04Å; S296-G299 WeakPolarHBondContact O-CA 3.03Å; S296-G299 PolarHBondContact O-N 3.48Å; S296-G299 VanDerWaalsContact O-N 3.09Å
297	Y	98.3	Very high	95	Very high	1 Å²	1	15.7 Å²	15.7	0%	0.004	10%	0.099	C	C	.	.	H	α-helix	trans	-54.7	-53.3	173	178.1	-85	0	0	0	112.2	L220 F221 F271 C293 G299 M300 I301 P307 V319 L348	L220-Y297 HydrophobicContact CD2-CE1 4.47Å; F221-Y297 AromaticContact CE1-CD1 3.56Å; F221-Y297 HydrophobicContact CE1-CD1 3.56Å; F221-Y297 AromaticContact CE1-CE1 3.8Å; F221-Y297 HydrophobicContact CE1-CE1 3.8Å; F221-Y297 HydrophobicContact CE1-CG 4.46Å; F221-Y297 AromaticContact CZ-CD1 3.72Å; F221-Y297 HydrophobicContact CZ-CD1 3.72Å; F221-Y297 HydrophobicContact CZ-CE1 4.34Å; F271-Y297 HydrophobicContact CE2-CD2 4.21Å; C293-Y297 PolarHBondContact O-N 3.46Å; Y297-G299 PolarHBondContact O-N 3.42Å; Y297-G299 VanDerWaalsContact O-N 3.17Å; Y297-M300 PolarHBondContact O-N 3.39Å; Y297-M300 VanDerWaalsContact O-N 3.1Å; Y297-I301 HydrophobicContact CE1-CD1 4.47Å; Y297-P307 HydrophobicContact CD1-CG 4.48Å; Y297-P307 HydrophobicContact CD2-CB 4.38Å; Y297-P307 HydrophobicContact CD2-CG 3.97Å; Y297-P307 HydrophobicContact CE1-CG 4.03Å; Y297-P307 HydrophobicContact CE2-CB 3.53Å; Y297-P307 HydrophobicContact CE2-CG 3.45Å; Y297-P307 VanDerWaalsContact CE2-CG 3.45Å; Y297-P307 HydrophobicContact CG-CG 4.46Å; Y297-P307 VanDerWaalsContact CZ-CG 3.48Å; Y297-V319 HydrophobicContact CE2-CB 4.08Å; Y297-V319 HydrophobicContact CE2-CG1 4.39Å; Y297-V319 HydrophobicContact CE2-CG2 3.75Å; Y297-V319 WeakPolarHBondContact OH-CG1 3.26Å; Y297-L348 HydrophobicContact CD2-CD1 3.83Å; Y297-L348 HydrophobicContact CD2-CD2 3.9Å; Y297-L348 HydrophobicContact CD2-CG 4.48Å; Y297-L348 HydrophobicContact CE2-CD2 4.2Å; Y297-L348 HydrophobicContact CG-CD1 4.1Å
298	A	97.9	Very high	95.6	Very high	5 Å²	5	11.2 Å²	11.2	4%	0.041	6%	0.062	C	C	.	.	H	α-helix	trans	-61.1	-27.9	179	0	0	0	0	0	112.2	Y217 L220 F221 L294 M300 I301	Y217-A298 HydrophobicContact CE1-CB 4Å; L220-A298 HydrophobicContact CD2-CB 4.07Å; F221-A298 HydrophobicContact CZ-CB 4.34Å; L294-A298 WeakPolarHBondContact O-CB 3.44Å; L294-A298 PolarHBondContact O-N 2.04Å; A298-M300 VanDerWaalsContact C-N 3.27Å; A298-M300 PolarHBondContact O-N 3.11Å; A298-I301 PolarHBondContact O-N 3.45Å
299	G	97.2	Very high	96.1	Very high	5 Å²	5	9.1 Å²	9.1	5%	0.052	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-18.6	176.9	0	0	0	0	0	115.8	R267 G295 S296 Y297 F303	R267-G299 WeakPolarHBondContact CD-O 3.05Å; R267-G299 WeakPolarHBondContact CG-O 3.43Å; R267-G299 PolarHBondContact NH1-O 2.89Å; G295-G299 PolarHBondContact O-N 3.43Å; S296-G299 WeakPolarHBondContact O-CA 3.03Å; S296-G299 PolarHBondContact O-N 3.48Å; S296-G299 VanDerWaalsContact O-N 3.09Å; Y297-G299 PolarHBondContact O-N 3.42Å; Y297-G299 VanDerWaalsContact O-N 3.17Å; G299-F303 WeakPolarHBondContact O-CE2 3.01Å
300	M	98.5	Very high	96.6	Very high	3 Å²	3	10.8 Å²	10.8	2%	0.015	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-11	176.1	-64.8	-171.2	-68.9	0	0	113.4	R267 L268 F271 Y297 A298 G302 F303 P307 F342	R267-M300 HydrophobicContact CB-CG 4.37Å; L268-M300 HydrophobicContact CD1-SD 3.72Å; F271-M300 HydrophobicContact CB-CE 3.63Å; F271-M300 HydrophobicContact CB-CG 4.43Å; F271-M300 HydrophobicContact CB-SD 3.64Å; F271-M300 HydrophobicContact CD1-CE 3.65Å; F271-M300 HydrophobicContact CD1-SD 4.08Å; F271-M300 HydrophobicContact CD2-CE 3.38Å; F271-M300 HydrophobicContact CE1-CE 4.11Å; F271-M300 HydrophobicContact CE2-CE 3.87Å; F271-M300 HydrophobicContact CG-CE 3.24Å; F271-M300 HydrophobicContact CG-SD 3.84Å; F271-M300 HydrophobicContact CZ-CE 4.21Å; Y297-M300 PolarHBondContact O-N 3.39Å; Y297-M300 VanDerWaalsContact O-N 3.1Å; A298-M300 VanDerWaalsContact C-N 3.27Å; A298-M300 PolarHBondContact O-N 3.11Å; M300-G302 PolarHBondContact O-N 3.31Å; M300-F303 PolarHBondContact O-N 2.03Å; M300-P307 HydrophobicContact CB-CG 4.47Å; M300-P307 HydrophobicContact CE-CG 4.24Å; M300-F342 HydrophobicContact CE-CE1 3.6Å; M300-F342 HydrophobicContact CE-CZ 4.17Å; M300-F342 HydrophobicContact SD-CE1 4.35Å; M300-F342 HydrophobicContact SD-CZ 4.43Å
301	I	98.8	Very high	96.8	Very high	3 Å²	3	13.3 Å²	13.3	2%	0.015	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	126.2	-176.7	-61.4	174.6	0	0	0	110.5	R205 F208 L220 I237 Y297 A298 T306	R205-I301 WeakPolarHBondContact CG-O 3.41Å; F208-I301 HydrophobicContact CD2-CB 4.2Å; F208-I301 HydrophobicContact CD2-CG2 3.97Å; F208-I301 HydrophobicContact CE1-CD1 4.44Å; F208-I301 HydrophobicContact CE2-CB 4.18Å; F208-I301 HydrophobicContact CE2-CD1 4.14Å; F208-I301 HydrophobicContact CE2-CG2 3.62Å; F208-I301 HydrophobicContact CZ-CD1 4.01Å; F208-I301 HydrophobicContact CZ-CG2 4.46Å; L220-I301 HydrophobicContact CD1-CD1 3.93Å; L220-I301 HydrophobicContact CD2-CD1 3.52Å; L220-I301 HydrophobicContact CG-CD1 4.4Å; I237-I301 HydrophobicContact CB-CG2 4.47Å; I237-I301 HydrophobicContact CG2-CD1 4.35Å; I237-I301 HydrophobicContact CG2-CG2 3.83Å; Y297-I301 HydrophobicContact CE1-CD1 4.47Å; A298-I301 PolarHBondContact O-N 3.45Å; I301-T306 HydrophobicContact CG2-CG2 4.39Å
302	G	98.3	Very high	97	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.7	23.4	-175.1	0	0	0	0	0	113.8	H201 R205 M300 T306	H201-G302 WeakPolarHBondContact CB-O 3.33Å; R205-G302 WeakPolarHBondContact CD-O 3.23Å; R205-G302 PolarHBondContact NH1-O 3.5Å; M300-G302 PolarHBondContact O-N 3.31Å; G302-T306 WeakPolarHBondContact CA-OG1 3.13Å; G302-T306 PolarHBondContact N-OG1 2.97Å
303	F	98.5	Very high	97.2	Very high	9 Å²	9	14.4 Å²	14.4	4%	0.039	9%	0.086	C	C	.	.	S	Bend	trans	-116.4	178.3	162.9	-67.7	-83.5	0	0	0	110.7	H201 R205 L263 C264 R267 G299 M300 M305 T306	H201-F303 PolarHBondContact CE1-O 3Å; H201-F303 VanDerWaalsContact CE1-O 3.28Å; R205-F303 HydrophobicContact CG-CE2 4.18Å; R205-F303 HydrophobicContact CG-CZ 4.49Å; L263-F303 HydrophobicContact CB-CE1 3.53Å; L263-F303 HydrophobicContact CB-CZ 3.73Å; C264-F303 HydrophobicContact CB-CB 4.26Å; C264-F303 HydrophobicContact CB-CD1 3.72Å; C264-F303 HydrophobicContact CB-CE1 4.37Å; C264-F303 HydrophobicContact CB-CG 4.19Å; R267-F303 HydrophobicContact CB-CE2 4.42Å; R267-F303 HydrophobicContact CG-CE2 3.91Å; R267-F303 HydrophobicContact CG-CZ 4.24Å; G299-F303 WeakPolarHBondContact O-CE2 3.01Å; M300-F303 PolarHBondContact O-N 2.03Å; F303-M305 PolarHBondContact O-N 3.17Å; F303-T306 PolarHBondContact N-OG1 3.26Å; F303-T306 VanDerWaalsContact N-OG1 3.1Å; F303-T306 WeakPolarHBondContact O-CB 3.45Å; F303-T306 PolarHBondContact O-N 2.86Å; F303-T306 VanDerWaalsContact O-N 3.07Å; F303-T306 PolarHBondContact O-OG1 3.43Å
304	D	97.1	Very high	97	Very high	71 Å²	71	15.8 Å²	15.8	38%	0.38	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-36.4	178.4	-51.2	-59.6	0	0	0	111.2	L254 T306	L254-D304 HydrophobicContact CD1-CB 3.99Å; D304-T306 PolarHBondContact O-N 3.4Å; D304-T306 VanDerWaalsContact O-N 3.15Å
305	M	97.9	Very high	96.6	Very high	1 Å²	1	21 Å²	21	1%	0.005	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	36.2	171.2	-156.2	62.8	71.4	0	0	113.3	L254 R255 L268 F303 P307 P321 F338 F342	L254-M305 HydrophobicContact CB-CE 4.02Å; L254-M305 HydrophobicContact CD2-CE 4.12Å; L254-M305 HydrophobicContact CD2-SD 3.88Å; L254-M305 HydrophobicContact CG-CE 3.76Å; L254-M305 HydrophobicContact CG-SD 4.18Å; R255-M305 VanDerWaalsContact CA-CE 3.48Å; R255-M305 HydrophobicContact CB-CE 3.81Å; R255-M305 VanDerWaalsContact N-CE 3.34Å; L268-M305 HydrophobicContact CD1-CG 4.21Å; F303-M305 PolarHBondContact O-N 3.17Å; M305-P307 VanDerWaalsContact O-CD 3.26Å; M305-P307 WeakPolarHBondContact O-CD 3.33Å; M305-P321 HydrophobicContact CG-CB 4.28Å; M305-P321 HydrophobicContact SD-CB 3.52Å; M305-P321 VanDerWaalsContact SD-CB 3.52Å; M305-P321 HydrophobicContact SD-CG 3.84Å; M305-F338 HydrophobicContact CE-CE1 3.98Å; M305-F338 HydrophobicContact CE-CZ 3.7Å; M305-F338 HydrophobicContact CG-CZ 4.38Å; M305-F338 HydrophobicContact SD-CE1 3.99Å; M305-F338 HydrophobicContact SD-CZ 3.78Å; M305-F342 HydrophobicContact CG-CZ 4.41Å
306	T	98.8	Very high	96.4	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.012	14%	0.137	C	C	.	.			trans	-64.9	120.3	176.5	-70.8	0	0	0	0	110.2	I237 Y243 I301 G302 F303 D304	I237-T306 HydrophobicContact CD1-CG2 3.81Å; Y243-T306 WeakPolarHBondContact CD2-O 3.23Å; I301-T306 HydrophobicContact CG2-CG2 4.39Å; G302-T306 WeakPolarHBondContact CA-OG1 3.13Å; G302-T306 PolarHBondContact N-OG1 2.97Å; F303-T306 PolarHBondContact N-OG1 3.26Å; F303-T306 VanDerWaalsContact N-OG1 3.1Å; F303-T306 WeakPolarHBondContact O-CB 3.45Å; F303-T306 PolarHBondContact O-N 2.86Å; F303-T306 VanDerWaalsContact O-N 3.07Å; F303-T306 PolarHBondContact O-OG1 3.43Å; D304-T306 PolarHBondContact O-N 3.4Å; D304-T306 VanDerWaalsContact O-N 3.15Å
307	P	98.7	Very high	96.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	153.9	172.3	36.9	-36.5	0	0	0	111.6	Y297 M300 M305 S320 F342	Y297-P307 HydrophobicContact CD1-CG 4.48Å; Y297-P307 HydrophobicContact CD2-CB 4.38Å; Y297-P307 HydrophobicContact CD2-CG 3.97Å; Y297-P307 HydrophobicContact CE1-CG 4.03Å; Y297-P307 HydrophobicContact CE2-CB 3.53Å; Y297-P307 HydrophobicContact CE2-CG 3.45Å; Y297-P307 VanDerWaalsContact CE2-CG 3.45Å; Y297-P307 HydrophobicContact CG-CG 4.46Å; Y297-P307 VanDerWaalsContact CZ-CG 3.48Å; M300-P307 HydrophobicContact CB-CG 4.47Å; M300-P307 HydrophobicContact CE-CG 4.24Å; M305-P307 VanDerWaalsContact O-CD 3.26Å; M305-P307 WeakPolarHBondContact O-CD 3.33Å; P307-S320 CarbonylContact C-O 3.53Å; P307-S320 VanDerWaalsContact CA-O 3.26Å; P307-S320 WeakPolarHBondContact CA-O 3.4Å; P307-F342 HydrophobicContact CB-CD1 4.17Å; P307-F342 HydrophobicContact CB-CE1 4.23Å
308	N	98.8	Very high	96.3	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	168.4	164.2	-161.3	21.4	0	0	0	111.7	R234 I237 Y243 V310 V319 S320	R234-N308 PolarHBondContact O-ND2 2.89Å; I237-N308 HydrophobicContact CD1-CB 3.99Å; Y243-N308 HydrophobicContact CD1-CB 3.74Å; Y243-N308 HydrophobicContact CD2-CB 3.81Å; Y243-N308 HydrophobicContact CE1-CB 3.83Å; Y243-N308 HydrophobicContact CE2-CB 3.91Å; Y243-N308 HydrophobicContact CG-CB 3.75Å; N308-V310 PolarHBondContact O-N 3.15Å; N308-V319 VanDerWaalsContact O-CA 3.24Å; N308-V319 WeakPolarHBondContact O-CA 3.07Å; N308-S320 PolarHBondContact N-O 3.04Å; N308-S320 PolarHBondContact O-N 3Å
309	Y	98.6	Very high	96.3	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.008	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	130.3	165.4	-63.3	-87.7	0	0	0	110.4	L220 R233 I317 V318 V319	L220-Y309 WeakPolarHBondContact O-CE2 3.25Å; L220-Y309 PolarHBondContact O-OH 3.43Å; R233-Y309 HydrophobicContact CG-CD2 4.03Å; R233-Y309 HydrophobicContact CG-CE1 4.46Å; R233-Y309 HydrophobicContact CG-CE2 3.56Å; Y309-I317 HydrophobicContact CE1-CG2 4.05Å; Y309-V318 WeakPolarHBondContact CA-O 3.47Å; Y309-V319 HydrophobicContact CD1-CG1 3.89Å; Y309-V319 HydrophobicContact CE1-CG1 4.07Å; Y309-V319 HydrophobicContact CG-CG1 4.19Å
310	V	97.6	Very high	96.4	Very high	70 Å²	70	25.5 Å²	25.5	42%	0.424	16%	0.156	S	C	.	.	S	Bend	trans	-71.4	-39.5	-175.4	-179.9	0	0	0	0	111.1	N308 V318	N308-V310 PolarHBondContact O-N 3.15Å; V310-V318 HydrophobicContact CG2-CG1 4.05Å; V310-V318 PolarHBondContact N-O 3.1Å; V310-V318 VanDerWaalsContact N-O 3.12Å
311	D	94.8	Very high	96.4	Very high	76 Å²	76	25.3 Å²	25.3	41%	0.406	16%	0.156	S	C	.	.	S	Bend	trans	-130.2	-166.3	179.1	68.3	16.4	0	0	0	111.3	R234 S313	R234-D311 VanDerWaalsContact CD-O 3.31Å; R234-D311 WeakPolarHBondContact CD-O 3.27Å; D311-S313 WeakPolarHBondContact OD1-CB 3.5Å; D311-S313 PolarHBondContact OD1-N 3.05Å
312	S	95.9	Very high	96.4	Very high	16 Å²	16	27.7 Å²	27.7	11%	0.112	17%	0.165	C	C	.	.			trans	-112.5	37.5	169	34.6	0	0	0	0	113	Q227 A230 E231	Q227-S312 PolarHBondContact NE2-O 2.7Å; Q227-S312 PolarHBondContact NE2-OG 2.76Å; Q227-S312 PolarHBondContact OE1-O 3.41Å; A230-S312 WeakPolarHBondContact CB-O 3.39Å; E231-S312 WeakPolarHBondContact OE2-CB 3.39Å; E231-S312 PolarHBondContact OE2-OG 2.83Å
313	S	95.4	Very high	96.4	Very high	28 Å²	28	28 Å²	28	20%	0.196	17%	0.166	C	C	.	.			trans	-63.1	131.6	172.7	-172.8	0	0	0	0	111.2	R233 D311 G316	R233-S313 PolarHBondContact NH2-O 3.09Å; D311-S313 WeakPolarHBondContact OD1-CB 3.5Å; D311-S313 PolarHBondContact OD1-N 3.05Å; S313-G316 WeakPolarHBondContact OG-CA 3.49Å; S313-G316 PolarHBondContact OG-N 2.95Å
314	P	90.7	Very high	96.4	Very high	29 Å²	29	29.2 Å²	29.2	19%	0.188	18%	0.176	C	C	.	.	S	Bend	trans	-60.6	-47.7	178	-24.1	34	0	0	0	112.4
315	T	86.2	Confident	96.5	Very high	108 Å²	108	26.6 Å²	26.6	66%	0.663	16%	0.163	S	C	*	.	S	Bend	trans	-109.4	-26.4	-172	52	0	0	0	0	113.9	I317	T315-I317 PolarHBondContact O-N 3.49Å
316	G	90.8	Very high	96.4	Very high	29 Å²	29	37 Å²	37	30%	0.299	20%	0.202	S	C	.	.			trans	-76.3	67.6	178.3	0	0	0	0	0	112.3	S313 V318	S313-G316 WeakPolarHBondContact OG-CA 3.49Å; S313-G316 PolarHBondContact OG-N 2.95Å; G316-V318 PolarHBondContact O-N 3.33Å
317	I	94.3	Very high	96.3	Very high	20 Å²	20	40.5 Å²	40.5	10%	0.103	24%	0.239	C	C	.	.			trans	-69.9	99.2	178.3	-68.1	168.4	0	0	0	109.3	Y309 T315 I352 Q353	Y309-I317 HydrophobicContact CE1-CG2 4.05Å; T315-I317 PolarHBondContact O-N 3.49Å; I317-I352 HydrophobicContact CD1-CG2 4.02Å; I317-I352 HydrophobicContact CG2-CB 4.36Å; I317-I352 HydrophobicContact CG2-CD1 4.12Å; I317-I352 HydrophobicContact CG2-CG2 4.07Å; I317-Q353 HydrophobicContact CD1-CG 3.84Å
318	V	97.8	Very high	96.3	Very high	55 Å²	55	41.2 Å²	41.2	33%	0.333	24%	0.244	S	C	.	.			trans	-126.6	134.2	171.2	-175.4	0	0	0	0	108.3	Y309 V310 G316 T343	Y309-V318 WeakPolarHBondContact CA-O 3.47Å; V310-V318 HydrophobicContact CG2-CG1 4.05Å; V310-V318 PolarHBondContact N-O 3.1Å; V310-V318 VanDerWaalsContact N-O 3.12Å; G316-V318 PolarHBondContact O-N 3.33Å; V318-T343 HydrophobicContact CG1-CG2 4.2Å
319	V	98.5	Very high	96.2	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.018	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	149.4	179.9	-64.6	0	0	0	0	110.1	Y297 N308 Y309 F342 T343 L348	Y297-V319 HydrophobicContact CE2-CB 4.08Å; Y297-V319 HydrophobicContact CE2-CG1 4.39Å; Y297-V319 HydrophobicContact CE2-CG2 3.75Å; Y297-V319 WeakPolarHBondContact OH-CG1 3.26Å; N308-V319 VanDerWaalsContact O-CA 3.24Å; N308-V319 WeakPolarHBondContact O-CA 3.07Å; Y309-V319 HydrophobicContact CD1-CG1 3.89Å; Y309-V319 HydrophobicContact CE1-CG1 4.07Å; Y309-V319 HydrophobicContact CG-CG1 4.19Å; V319-F342 WeakPolarHBondContact CG2-O 3.47Å; V319-F342 CarbonylContact O-C 3.55Å; V319-F342 VanDerWaalsContact O-C 3.3Å; V319-F342 WeakPolarHBondContact O-CB 3.27Å; V319-T343 WeakPolarHBondContact O-CG2 3.45Å; V319-L348 HydrophobicContact CG2-CD2 3.6Å; V319-L348 HydrophobicContact CG2-CG 4.44Å
320	S	98.5	Very high	96.1	Very high	9 Å²	9	51.7 Å²	51.7	6%	0.063	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	160.4	172.6	75.5	0	0	0	0	111.3	Y243 P307 N308	Y243-S320 VanDerWaalsContact CE2-O 3.24Å; Y243-S320 WeakPolarHBondContact CE2-O 3.46Å; Y243-S320 PolarHBondContact OH-O 3.29Å; Y243-S320 VanDerWaalsContact OH-O 3.07Å; Y243-S320 PolarHBondContact OH-OG 2.69Å; Y243-S320 VanDerWaalsContact OH-OG 3.04Å; P307-S320 CarbonylContact C-O 3.53Å; P307-S320 VanDerWaalsContact CA-O 3.26Å; P307-S320 WeakPolarHBondContact CA-O 3.4Å; N308-S320 PolarHBondContact N-O 3.04Å; N308-S320 PolarHBondContact O-N 3Å
321	P	98.5	Very high	96	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	167.2	155.5	29.8	-34.8	0	0	0	111.5	Y243 M305 C323 L339 F342	Y243-P321 PolarHBondContact OH-O 3.24Å; M305-P321 HydrophobicContact CG-CB 4.28Å; M305-P321 HydrophobicContact SD-CB 3.52Å; M305-P321 VanDerWaalsContact SD-CB 3.52Å; M305-P321 HydrophobicContact SD-CG 3.84Å; P321-C323 VanDerWaalsContact C-N 3.35Å; P321-C323 PolarHBondContact O-N 3.44Å; P321-C323 VanDerWaalsContact O-N 3.11Å; P321-L339 HydrophobicContact CG-CD1 4.42Å; P321-F342 HydrophobicContact CG-CD2 4.44Å; P321-F342 HydrophobicContact CG-CE1 4.49Å; P321-F342 HydrophobicContact CG-CE2 4.34Å; P321-F342 HydrophobicContact CG-CZ 4.36Å
322	W	98.5	Very high	96.1	Very high	53 Å²	53	53.9 Å²	53.9	20%	0.201	32%	0.317	C	S	.	.	S	Bend	trans	-85.8	73.5	177.2	-172.2	-97.8	0	0	0	111.6	Y243 E244 D245 E247 K248	Y243-W322 HydrophobicContact CD1-CE3 4.06Å; Y243-W322 HydrophobicContact CD2-CB 4Å; Y243-W322 AromaticContact CE1-CE3 3.66Å; Y243-W322 HydrophobicContact CE1-CE3 3.66Å; Y243-W322 HydrophobicContact CE1-CZ3 4.19Å; Y243-W322 HydrophobicContact CE2-CB 3.81Å; Y243-W322 HydrophobicContact CE2-CE3 4.5Å; Y243-W322 AromaticContact CZ-CE3 3.88Å; Y243-W322 WeakPolarHBondContact O-CB 2.99Å; E244-W322 HydrophobicContact CB-CH2 4.3Å; E244-W322 HydrophobicContact CB-CZ2 4.49Å; E244-W322 HydrophobicContact CB-CZ3 4.36Å; E244-W322 HydrophobicContact CG-CE3 4.25Å; E244-W322 HydrophobicContact CG-CH2 4.12Å; E244-W322 HydrophobicContact CG-CZ3 3.83Å; D245-W322 WeakPolarHBondContact O-CZ2 3.42Å; E247-W322 PolarHBondContact O-NE1 3.12Å; K248-W322 HydrophobicContact CD-CD2 4.43Å; K248-W322 HydrophobicContact CD-CZ2 4.37Å; K248-W322 VanDerWaalsContact CE-CE3 3.43Å; K248-W322 HydrophobicContact CG-CD2 3.94Å; K248-W322 VanDerWaalsContact CG-CE2 3.49Å; K248-W322 HydrophobicContact CG-CG 4.27Å; K248-W322 HydrophobicContact CG-CH2 4.48Å; K248-W322 HydrophobicContact CG-CZ2 3.81Å
323	C	98.5	Very high	96.2	Very high	6 Å²	6	60.5 Å²	60.5	4%	0.041	35%	0.345	C	S	.	.			trans	-148.9	-175.8	176.5	62.4	0	0	0	0	111.1	P249 C251 L254 P321	P249-C323 CarbonylContact O-C 3.6Å; P249-C323 VanDerWaalsContact O-CA 3.27Å; P249-C323 WeakPolarHBondContact O-CA 3.47Å; P249-C323 VanDerWaalsContact O-CB 3.28Å; P249-C323 WeakPolarHBondContact O-CB 3.33Å; C251-C323 WeakPolarHBondContact CA-SG 3.27Å; C251-C323 HydrophobicContact CB-CB 3.88Å; C251-C323 WeakPolarHBondContact CB-SG 3.44Å; C251-C323 WeakPolarHBondContact SG-CB 2.95Å; C251-C323 CovalentContact SG-SG 2.03Å; C251-C323 PolarHBondContact SG-SG 3.43Å; L254-C323 HydrophobicContact CD2-CB 3.92Å; P321-C323 VanDerWaalsContact C-N 3.35Å; P321-C323 PolarHBondContact O-N 3.44Å; P321-C323 VanDerWaalsContact O-N 3.11Å
324	S	98.4	Very high	96.2	Very high	34 Å²	34	62 Å²	62	24%	0.238	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-149.2	174.8	169	71.9	0	0	0	0	110.9	P249 N250 C251 R326	P249-S324 PolarHBondContact O-N 2.93Å; N250-S324 CarbonylContact C-O 3.52Å; N250-S324 VanDerWaalsContact CA-O 3.28Å; N250-S324 WeakPolarHBondContact CA-O 3.42Å; C251-S324 PolarHBondContact N-O 3.43Å; C251-S324 PolarHBondContact SG-N 2.86Å; C251-S324 VanDerWaalsContact SG-N 3.43Å; C251-S324 PolarHBondContact SG-O 2.92Å; S324-R326 PolarHBondContact OG-N 3.18Å
325	C	98.5	Very high	96.5	Very high	16 Å²	16	60.6 Å²	60.6	11%	0.108	34%	0.341	C	S	.	.			trans	-96.1	8.9	173.6	-62.7	0	0	0	0	114.5	G327 S328 C335 E336	C325-G327 PolarHBondContact O-N 2.02Å; C325-S328 WeakPolarHBondContact O-CB 3.48Å; C325-S328 PolarHBondContact O-N 3.08Å; C325-S328 PolarHBondContact O-OG 2.92Å; C325-C335 WeakPolarHBondContact CA-SG 3.39Å; C325-C335 HydrophobicContact CB-CB 3.71Å; C325-C335 WeakPolarHBondContact CB-SG 3.24Å; C325-C335 WeakPolarHBondContact SG-CB 3.01Å; C325-C335 PolarHBondContact SG-O 2.73Å; C325-C335 VanDerWaalsContact SG-O 3.4Å; C325-C335 CovalentContact SG-SG 2.04Å; C325-C335 PolarHBondContact SG-SG 2.98Å; C325-E336 PolarHBondContact SG-N 3.25Å; C325-E336 VanDerWaalsContact SG-N 3.41Å
326	R	97.9	Very high	97.1	Very high	219 Å²	219	59.6 Å²	59.6	83%	0.826	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	132	172.5	-169.6	177.6	-176.8	-171.5	0.2	109.9	N250 S324	N250-R326 PolarHBondContact ND2-O 3.19Å; S324-R326 PolarHBondContact OG-N 3.18Å
327	G	96.6	Very high	97.4	Very high	76 Å²	76	62.6 Å²	62.6	78%	0.784	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	3.8	178.5	0	0	0	0	0	115.6	C325 G329	C325-G327 PolarHBondContact O-N 2.02Å; G327-G329 PolarHBondContact O-N 3.29Å
328	S	96.9	Very high	97.5	Very high	15 Å²	15	61.7 Å²	61.7	11%	0.105	33%	0.328	C	S	.	.			trans	-66.3	-24.2	179.7	-49.9	0	0	0	0	114	N250 C325 N330 M331 E332	N250-S328 PolarHBondContact ND2-N 2.05Å; N250-S328 PolarHBondContact ND2-OG 3.23Å; C325-S328 WeakPolarHBondContact O-CB 3.48Å; C325-S328 PolarHBondContact O-N 3.08Å; C325-S328 PolarHBondContact O-OG 2.92Å; S328-N330 PolarHBondContact O-N 3.01Å; S328-M331 WeakPolarHBondContact O-CB 3.13Å; S328-M331 PolarHBondContact O-N 2.94Å; S328-E332 VanDerWaalsContact CB-CA 3.49Å
329	G	96.6	Very high	97.5	Very high	51 Å²	51	60.9 Å²	60.9	53%	0.526	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	55.6	-128.7	-173.3	0	0	0	0	0	110.9	G327 M331 E332	G327-G329 PolarHBondContact O-N 3.29Å; G329-M331 PolarHBondContact O-N 3Å; G329-E332 WeakPolarHBondContact O-CB 3.11Å; G329-E332 PolarHBondContact O-N 2.84Å; G329-E332 VanDerWaalsContact O-N 3.1Å
330	N	96.9	Very high	97.5	Very high	173 Å²	173	64.6 Å²	64.6	93%	0.925	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-59.9	-14.6	178.5	-60.3	2.5	0	0	0	114.2	S328	S328-N330 PolarHBondContact O-N 3.01Å
331	M	96	Very high	97.4	Very high	91 Å²	91	64.8 Å²	64.8	45%	0.448	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-94.1	10.3	179.4	-51.3	-57.1	-64	0	0	113.4	L252 S328 G329 E333 E334 C335	L252-M331 HydrophobicContact CD1-CB 3.55Å; L252-M331 HydrophobicContact CD1-CG 4.48Å; S328-M331 WeakPolarHBondContact O-CB 3.13Å; S328-M331 PolarHBondContact O-N 2.94Å; G329-M331 PolarHBondContact O-N 3Å; M331-E333 PolarHBondContact O-N 3.09Å; M331-E334 HydrophobicContact CE-CB 4.38Å; M331-E334 WeakPolarHBondContact CE-OE2 3.29Å; M331-E334 PolarHBondContact O-N 3.07Å; M331-C335 PolarHBondContact O-N 2.99Å
332	E	97.4	Very high	97.4	Very high	101 Å²	101	65 Å²	65	47%	0.472	34%	0.337	S	S	.	.	H	α-helix	trans	-59.8	-42.6	-176.1	-170.6	154.7	-131.3	0	0	112.7	S328 G329 E334 C335 E336	S328-E332 VanDerWaalsContact CB-CA 3.49Å; G329-E332 WeakPolarHBondContact O-CB 3.11Å; G329-E332 PolarHBondContact O-N 2.84Å; G329-E332 VanDerWaalsContact O-N 3.1Å; E332-E334 PolarHBondContact O-N 2.96Å; E332-C335 PolarHBondContact O-N 3.45Å; E332-E336 WeakPolarHBondContact O-CG 3.29Å; E332-E336 PolarHBondContact O-N 3.45Å
333	E	96.8	Very high	97.4	Very high	154 Å²	154	64.5 Å²	64.5	72%	0.72	34%	0.34	S	S	*	.	H	α-helix	trans	-62.5	-40.7	176.1	-169.8	-173.1	162.9	0	0	112.6	M331 E336 K337	M331-E333 PolarHBondContact O-N 3.09Å; E333-E336 PolarHBondContact O-N 3.14Å; E333-K337 VanDerWaalsContact O-CB 3.26Å; E333-K337 WeakPolarHBondContact O-CB 3.16Å; E333-K337 PolarHBondContact O-N 3.07Å
334	E	96	Very high	97.3	Very high	60 Å²	60	70.7 Å²	70.7	28%	0.28	37%	0.368	S	S	.	.	H	α-helix	trans	-65.4	-42.4	175.6	-173.5	-179	156.5	0	0	110.9	F122 L252 R255 M331 E332 K337 F338	F122-E334 HydrophobicContact CD2-CG 3.64Å; F122-E334 WeakPolarHBondContact CD2-OE1 3.47Å; F122-E334 HydrophobicContact CE2-CG 3.43Å; F122-E334 VanDerWaalsContact CE2-CG 3.43Å; L252-E334 HydrophobicContact CD2-CG 4.22Å; R255-E334 IonicContact CZ-OE1 2.73Å; R255-E334 IonicContact NH1-OE1 3.18Å; R255-E334 PolarHBondContact NH1-OE1 3.47Å; R255-E334 IonicContact NH2-OE1 3.41Å; M331-E334 HydrophobicContact CE-CB 4.38Å; M331-E334 WeakPolarHBondContact CE-OE2 3.29Å; M331-E334 PolarHBondContact O-N 3.07Å; E332-E334 PolarHBondContact O-N 2.96Å; E334-K337 PolarHBondContact O-N 3.16Å; E334-F338 WeakPolarHBondContact O-CB 3.46Å; E334-F338 PolarHBondContact O-N 3.47Å
335	C	98.1	Very high	97.2	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-62.4	-47.3	177.1	-178.1	0	0	0	0	111.8	L252 C325 M331 E332 K337 F338 L339	L252-C335 HydrophobicContact CD1-CB 3.89Å; L252-C335 HydrophobicContact CD2-CB 4.38Å; L252-C335 HydrophobicContact CG-CB 3.85Å; C325-C335 WeakPolarHBondContact CA-SG 3.39Å; C325-C335 HydrophobicContact CB-CB 3.71Å; C325-C335 WeakPolarHBondContact CB-SG 3.24Å; C325-C335 WeakPolarHBondContact SG-CB 3.01Å; C325-C335 PolarHBondContact SG-O 2.73Å; C325-C335 VanDerWaalsContact SG-O 3.4Å; C325-C335 CovalentContact SG-SG 2.04Å; C325-C335 PolarHBondContact SG-SG 2.98Å; M331-C335 PolarHBondContact O-N 2.99Å; E332-C335 PolarHBondContact O-N 3.45Å; C335-K337 VanDerWaalsContact C-N 3.34Å; C335-K337 PolarHBondContact O-N 2.64Å; C335-F338 PolarHBondContact O-N 2.93Å; C335-L339 PolarHBondContact O-N 3.32Å
336	E	98.1	Very high	97.1	Very high	86 Å²	86	70.5 Å²	70.5	40%	0.402	37%	0.366	S	S	.	.	H	α-helix	trans	-62.7	-42.5	177.4	-73.8	-165.9	159.6	0	0	111.5	C325 E332 E333 F338 L339 R340	C325-E336 PolarHBondContact SG-N 3.25Å; C325-E336 VanDerWaalsContact SG-N 3.41Å; E332-E336 WeakPolarHBondContact O-CG 3.29Å; E332-E336 PolarHBondContact O-N 3.45Å; E333-E336 PolarHBondContact O-N 3.14Å; E336-F338 VanDerWaalsContact C-N 3.27Å; E336-F338 PolarHBondContact O-N 3Å; E336-L339 PolarHBondContact O-N 3.1Å; E336-L339 VanDerWaalsContact O-N 3.1Å; E336-R340 VanDerWaalsContact CB-NH2 3.28Å; E336-R340 WeakPolarHBondContact O-CB 3.23Å; E336-R340 WeakPolarHBondContact O-CG 3.46Å; E336-R340 PolarHBondContact O-N 2.95Å; E336-R340 IonicContact OE2-CZ 3.01Å; E336-R340 IonicContact OE2-NH1 2.7Å; E336-R340 PolarHBondContact OE2-NH1 2.7Å; E336-R340 IonicContact OE2-NH2 2.73Å; E336-R340 PolarHBondContact OE2-NH2 3.3Å
337	K	96.4	Very high	97	Very high	93 Å²	93	60.1 Å²	60.1	40%	0.404	33%	0.326	S	S	.	.	H	α-helix	trans	-56.2	-44.8	175.4	-177.2	-173.9	175.2	-172.6	0	110.9	F122 E333 E334 C335 L339 R340 D341	F122-K337 HydrophobicContact CD1-CD 4.29Å; F122-K337 HydrophobicContact CE1-CD 3.77Å; F122-K337 HydrophobicContact CE1-CG 3.89Å; F122-K337 HydrophobicContact CE2-CD 4.16Å; F122-K337 HydrophobicContact CE2-CG 4.46Å; F122-K337 HydrophobicContact CZ-CB 4.04Å; F122-K337 HydrophobicContact CZ-CD 3.7Å; F122-K337 HydrophobicContact CZ-CG 3.67Å; E333-K337 VanDerWaalsContact O-CB 3.26Å; E333-K337 WeakPolarHBondContact O-CB 3.16Å; E333-K337 PolarHBondContact O-N 3.07Å; E334-K337 PolarHBondContact O-N 3.16Å; C335-K337 VanDerWaalsContact C-N 3.34Å; C335-K337 PolarHBondContact O-N 2.64Å; K337-L339 VanDerWaalsContact C-N 3.33Å; K337-L339 PolarHBondContact O-N 2.58Å; K337-R340 PolarHBondContact O-N 2.85Å; K337-D341 PolarHBondContact O-N 3.21Å
338	F	97	Very high	97	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65	-35.9	176.6	172.6	-102.9	0	0	0	112.5	F122 C251 R255 L268 H272 M305 E334 C335 E336 F342	F122-F338 HydrophobicContact CE2-CB 4.12Å; F122-F338 HydrophobicContact CZ-CB 3.85Å; C251-F338 HydrophobicContact CB-CD1 3.85Å; C251-F338 HydrophobicContact CB-CE1 4.02Å; R255-F338 HydrophobicContact CB-CZ 4.4Å; R255-F338 HydrophobicContact CG-CE2 4.48Å; L268-F338 HydrophobicContact CD1-CE2 4.14Å; L268-F338 HydrophobicContact CD1-CZ 4.37Å; L268-F338 HydrophobicContact CD2-CE2 4.32Å; L268-F338 HydrophobicContact CD2-CZ 4.47Å; H272-F338 AromaticContact CE1-CE2 3.73Å; H272-F338 AromaticContact NE2-CD2 3.8Å; H272-F338 AromaticContact NE2-CE2 3.51Å; M305-F338 HydrophobicContact CE-CE1 3.98Å; M305-F338 HydrophobicContact CE-CZ 3.7Å; M305-F338 HydrophobicContact CG-CZ 4.38Å; M305-F338 HydrophobicContact SD-CE1 3.99Å; M305-F338 HydrophobicContact SD-CZ 3.78Å; E334-F338 WeakPolarHBondContact O-CB 3.46Å; E334-F338 PolarHBondContact O-N 3.47Å; C335-F338 PolarHBondContact O-N 2.93Å; E336-F338 VanDerWaalsContact C-N 3.27Å; E336-F338 PolarHBondContact O-N 3Å; F338-F342 HydrophobicContact CE1-CE2 4.23Å; F338-F342 HydrophobicContact CE2-CE2 4.02Å; F338-F342 AromaticContact CZ-CE2 3.82Å; F338-F342 HydrophobicContact CZ-CE2 3.82Å; F338-F342 HydrophobicContact CZ-CZ 4.25Å; F338-F342 WeakPolarHBondContact O-CD2 3.19Å
339	L	98	Very high	96.9	Very high	38 Å²	38	62 Å²	62	20%	0.199	31%	0.307	C	S	.	.	H	α-helix	trans	-72.9	-36.4	176.9	-171	58.1	0	0	0	112.2	P321 C335 E336 K337 D341 F342 T343	P321-L339 HydrophobicContact CG-CD1 4.42Å; C335-L339 PolarHBondContact O-N 3.32Å; E336-L339 PolarHBondContact O-N 3.1Å; E336-L339 VanDerWaalsContact O-N 3.1Å; K337-L339 VanDerWaalsContact C-N 3.33Å; K337-L339 PolarHBondContact O-N 2.58Å; L339-D341 VanDerWaalsContact C-N 3.28Å; L339-D341 PolarHBondContact O-N 2.84Å; L339-F342 WeakPolarHBondContact O-CB 3.45Å; L339-F342 PolarHBondContact O-N 3.25Å; L339-T343 HydrophobicContact CD1-CG2 4.12Å; L339-T343 HydrophobicContact CG-CG2 4.06Å; L339-T343 PolarHBondContact O-N 3.23Å; L339-T343 PolarHBondContact O-OG1 3.06Å
340	R	97.7	Very high	96.8	Very high	82 Å²	82	61.5 Å²	61.5	31%	0.309	29%	0.293	S	S	.	.	H	α-helix	trans	-60.5	-31.7	177.5	-79.4	-173.2	-81.8	-97.4	-2.1	113.2	E336 K337 F342 T343 E344 N345	E336-R340 VanDerWaalsContact CB-NH2 3.28Å; E336-R340 WeakPolarHBondContact O-CB 3.23Å; E336-R340 WeakPolarHBondContact O-CG 3.46Å; E336-R340 PolarHBondContact O-N 2.95Å; E336-R340 IonicContact OE2-CZ 3.01Å; E336-R340 IonicContact OE2-NH1 2.7Å; E336-R340 PolarHBondContact OE2-NH1 2.7Å; E336-R340 IonicContact OE2-NH2 2.73Å; E336-R340 PolarHBondContact OE2-NH2 3.3Å; K337-R340 PolarHBondContact O-N 2.85Å; R340-F342 PolarHBondContact O-N 2.8Å; R340-F342 VanDerWaalsContact O-N 3.1Å; R340-T343 PolarHBondContact O-N 2.97Å; R340-E344 HydrophobicContact CB-CB 4.28Å; R340-E344 WeakPolarHBondContact CD-OE2 3.17Å; R340-E344 HydrophobicContact CG-CB 4.2Å; R340-E344 HydrophobicContact CG-CG 4.28Å; R340-E344 WeakPolarHBondContact CG-OE2 3.32Å; R340-E344 CarbonylContact O-C 3.6Å; R340-E344 PolarHBondContact O-N 3.49Å; R340-N345 PolarHBondContact O-N 2.92Å
341	D	97	Very high	96.6	Very high	13 Å²	13	53.2 Å²	53.2	7%	0.07	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-17.4	171.6	-78	-46.7	0	0	0	113.5	Y123 F271 K337 L339 N345	Y123-D341 WeakPolarHBondContact CE1-OD2 3.41Å; Y123-D341 PolarHBondContact OH-OD2 3.25Å; F271-D341 HydrophobicContact CE1-CB 4.37Å; F271-D341 WeakPolarHBondContact CZ-O 3.24Å; K337-D341 PolarHBondContact O-N 3.21Å; L339-D341 VanDerWaalsContact C-N 3.28Å; L339-D341 PolarHBondContact O-N 2.84Å; D341-N345 WeakPolarHBondContact O-CB 3.35Å; D341-N345 PolarHBondContact O-ND2 3.47Å
342	F	98.3	Very high	96.5	Very high	5 Å²	5	49 Å²	49	2%	0.022	23%	0.228	C	C	.	.	H	α-helix	trans	-103.3	-46.8	171	-59.2	-103	0	0	0	112.4	L268 F271 M300 M305 P307 V319 P321 F338 L339 R340	L268-F342 HydrophobicContact CD1-CZ 4.29Å; F271-F342 HydrophobicContact CD1-CE1 4.23Å; F271-F342 HydrophobicContact CD1-CE2 4.47Å; F271-F342 AromaticContact CD1-CZ 3.98Å; F271-F342 HydrophobicContact CD1-CZ 3.98Å; F271-F342 AromaticContact CE1-CD1 3.96Å; F271-F342 HydrophobicContact CE1-CD1 3.96Å; F271-F342 HydrophobicContact CE1-CD2 4.1Å; F271-F342 AromaticContact CE1-CE1 3.67Å; F271-F342 HydrophobicContact CE1-CE1 3.67Å; F271-F342 AromaticContact CE1-CE2 3.78Å; F271-F342 HydrophobicContact CE1-CE2 3.78Å; F271-F342 HydrophobicContact CE1-CG 4.18Å; F271-F342 AromaticContact CE1-CZ 3.55Å; F271-F342 HydrophobicContact CE1-CZ 3.55Å; F271-F342 AromaticContact CZ-CD1 3.85Å; F271-F342 HydrophobicContact CZ-CD1 3.85Å; F271-F342 AromaticContact CZ-CE1 3.92Å; F271-F342 HydrophobicContact CZ-CE1 3.92Å; F271-F342 HydrophobicContact CZ-CG 4.17Å; F271-F342 HydrophobicContact CZ-CZ 4.27Å; M300-F342 HydrophobicContact CE-CE1 3.6Å; M300-F342 HydrophobicContact CE-CZ 4.17Å; M300-F342 HydrophobicContact SD-CE1 4.35Å; M300-F342 HydrophobicContact SD-CZ 4.43Å; M305-F342 HydrophobicContact CG-CZ 4.41Å; P307-F342 HydrophobicContact CB-CD1 4.17Å; P307-F342 HydrophobicContact CB-CE1 4.23Å; V319-F342 WeakPolarHBondContact CG2-O 3.47Å; V319-F342 CarbonylContact O-C 3.55Å; V319-F342 VanDerWaalsContact O-C 3.3Å; V319-F342 WeakPolarHBondContact O-CB 3.27Å; P321-F342 HydrophobicContact CG-CD2 4.44Å; P321-F342 HydrophobicContact CG-CE1 4.49Å; P321-F342 HydrophobicContact CG-CE2 4.34Å; P321-F342 HydrophobicContact CG-CZ 4.36Å; F338-F342 HydrophobicContact CE1-CE2 4.23Å; F338-F342 HydrophobicContact CE2-CE2 4.02Å; F338-F342 AromaticContact CZ-CE2 3.82Å; F338-F342 HydrophobicContact CZ-CE2 3.82Å; F338-F342 HydrophobicContact CZ-CZ 4.25Å; F338-F342 WeakPolarHBondContact O-CD2 3.19Å; L339-F342 WeakPolarHBondContact O-CB 3.45Å; L339-F342 PolarHBondContact O-N 3.25Å; R340-F342 PolarHBondContact O-N 2.8Å; R340-F342 VanDerWaalsContact O-N 3.1Å
343	T	97.8	Very high	96.2	Very high	41 Å²	41	46.9 Å²	46.9	25%	0.252	22%	0.218	S	C	.	.	H	α-helix	trans	-86.7	-33.7	-167.6	56.1	0	0	0	0	114.6	V318 V319 L339 R340	V318-T343 HydrophobicContact CG1-CG2 4.2Å; V319-T343 WeakPolarHBondContact O-CG2 3.45Å; L339-T343 HydrophobicContact CD1-CG2 4.12Å; L339-T343 HydrophobicContact CG-CG2 4.06Å; L339-T343 PolarHBondContact O-N 3.23Å; L339-T343 PolarHBondContact O-OG1 3.06Å; R340-T343 PolarHBondContact O-N 2.97Å
344	E	96.7	Very high	95.8	Very high	137 Å²	137	40 Å²	40	64%	0.64	19%	0.187	S	C	*	.	S	Bend	trans	-117.9	12.1	-171.8	-70.2	176.9	-160.9	0	0	112.3	R340 P346	R340-E344 HydrophobicContact CB-CB 4.28Å; R340-E344 WeakPolarHBondContact CD-OE2 3.17Å; R340-E344 HydrophobicContact CG-CB 4.2Å; R340-E344 HydrophobicContact CG-CG 4.28Å; R340-E344 WeakPolarHBondContact CG-OE2 3.32Å; R340-E344 CarbonylContact O-C 3.6Å; R340-E344 PolarHBondContact O-N 3.49Å; E344-P346 VanDerWaalsContact O-CD 3.24Å; E344-P346 WeakPolarHBondContact O-CD 3.44Å
345	N	96.9	Very high	95.4	Very high	6 Å²	6	37.9 Å²	37.9	3%	0.032	18%	0.177	C	C	.	.			trans	-79.7	112	-171.7	-176.9	-18.2	0	0	0	112.6	C275 R340 D341 C347 L348 R349	C275-N345 PolarHBondContact O-ND2 3.01Å; C275-N345 PolarHBondContact O-OD1 3.43Å; R340-N345 PolarHBondContact O-N 2.92Å; D341-N345 WeakPolarHBondContact O-CB 3.35Å; D341-N345 PolarHBondContact O-ND2 3.47Å; N345-C347 PolarHBondContact O-N 3.41Å; N345-C347 WeakPolarHBondContact OD1-CA 3.34Å; N345-C347 VanDerWaalsContact OD1-CB 3.28Å; N345-C347 WeakPolarHBondContact OD1-CB 3.38Å; N345-C347 PolarHBondContact OD1-N 3.48Å; N345-L348 HydrophobicContact CB-CB 4.06Å; N345-L348 PolarHBondContact O-N 3.27Å; N345-L348 PolarHBondContact OD1-N 2.89Å; N345-R349 WeakPolarHBondContact O-CB 3.43Å; N345-R349 PolarHBondContact O-N 2.6Å
346	P	96	Very high	94.8	Very high	40 Å²	40	38.6 Å²	38.6	26%	0.26	18%	0.184	S	C	.	.	H	α-helix	trans	-66.4	-35.3	178.5	27.5	-34.9	0	0	0	112.5	A277 E344 N350	A277-P346 HydrophobicContact CB-CG 4.07Å; E344-P346 VanDerWaalsContact O-CD 3.24Å; E344-P346 WeakPolarHBondContact O-CD 3.44Å; P346-N350 WeakPolarHBondContact O-CB 3.25Å; P346-N350 PolarHBondContact O-N 2.94Å; P346-N350 PolarHBondContact O-ND2 3.33Å; P346-N350 PolarHBondContact O-OD1 2.84Å
347	C	96.2	Very high	94	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-58.8	-53.5	176.6	170	0	0	0	0	110.8	S284 C285 N345 N350 A351	S284-C347 WeakPolarHBondContact O-CB 3.1Å; C285-C347 WeakPolarHBondContact CA-SG 3.36Å; C285-C347 HydrophobicContact CB-CB 4Å; C285-C347 WeakPolarHBondContact CB-SG 3.34Å; C285-C347 WeakPolarHBondContact SG-CA 3.48Å; C285-C347 WeakPolarHBondContact SG-CB 3.43Å; C285-C347 CovalentContact SG-SG 2.03Å; C285-C347 PolarHBondContact SG-SG 2.82Å; N345-C347 PolarHBondContact O-N 3.41Å; N345-C347 WeakPolarHBondContact OD1-CA 3.34Å; N345-C347 VanDerWaalsContact OD1-CB 3.28Å; N345-C347 WeakPolarHBondContact OD1-CB 3.38Å; N345-C347 PolarHBondContact OD1-N 3.48Å; C347-N350 PolarHBondContact O-N 3.05Å; C347-A351 VanDerWaalsContact O-CB 3.23Å; C347-A351 WeakPolarHBondContact O-CB 3.37Å; C347-A351 PolarHBondContact O-N 3.33Å
348	L	96.3	Very high	92.9	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-64.8	-42.8	-178	-176.3	59.6	0	0	0	111.8	F271 Y297 V319 N345 A351 I352	F271-L348 HydrophobicContact CE2-CD2 4.06Å; F271-L348 HydrophobicContact CZ-CD2 4.15Å; Y297-L348 HydrophobicContact CD2-CD1 3.83Å; Y297-L348 HydrophobicContact CD2-CD2 3.9Å; Y297-L348 HydrophobicContact CD2-CG 4.48Å; Y297-L348 HydrophobicContact CE2-CD2 4.2Å; Y297-L348 HydrophobicContact CG-CD1 4.1Å; V319-L348 HydrophobicContact CG2-CD2 3.6Å; V319-L348 HydrophobicContact CG2-CG 4.44Å; N345-L348 HydrophobicContact CB-CB 4.06Å; N345-L348 PolarHBondContact O-N 3.27Å; N345-L348 PolarHBondContact OD1-N 2.89Å; L348-A351 PolarHBondContact O-N 3.07Å; L348-I352 HydrophobicContact CD1-CD1 3.96Å; L348-I352 HydrophobicContact CD1-CG1 4.32Å; L348-I352 HydrophobicContact CG-CD1 4.06Å; L348-I352 VanDerWaalsContact O-CG1 3.28Å; L348-I352 WeakPolarHBondContact O-CG1 3.43Å; L348-I352 PolarHBondContact O-N 3.06Å
349	R	95.4	Very high	91.3	Very high	128 Å²	128	41 Å²	41	48%	0.483	22%	0.218	S	C	.	.	H	α-helix	trans	-61.3	-48.8	176.1	-177.3	174.8	-179.9	-103.4	5.7	111.8	N345 Q353	N345-R349 WeakPolarHBondContact O-CB 3.43Å; N345-R349 PolarHBondContact O-N 2.6Å; R349-Q353 WeakPolarHBondContact O-CB 3.42Å; R349-Q353 VanDerWaalsContact O-CG 3.31Å; R349-Q353 WeakPolarHBondContact O-CG 3.47Å; R349-Q353 PolarHBondContact O-N 3.15Å
350	N	93	Very high	89.2	Confident	41 Å²	41	41.3 Å²	41.3	22%	0.219	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-42.5	178.5	-67.3	-13.9	0	0	0	111	T283 Y290 P346 C347 Q353 A354	T283-N350 PolarHBondContact O-ND2 2.96Å; Y290-N350 HydrophobicContact CE1-CB 3.73Å; Y290-N350 WeakPolarHBondContact OH-CB 3.49Å; P346-N350 WeakPolarHBondContact O-CB 3.25Å; P346-N350 PolarHBondContact O-N 2.94Å; P346-N350 PolarHBondContact O-ND2 3.33Å; P346-N350 PolarHBondContact O-OD1 2.84Å; C347-N350 PolarHBondContact O-N 3.05Å; N350-Q353 PolarHBondContact O-N 3.01Å; N350-A354 WeakPolarHBondContact O-CB 3.43Å; N350-A354 PolarHBondContact O-N 3.21Å
351	A	93.1	Very high	86.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-46.8	178.9	0	0	0	0	0	112.4	Y290 L294 C347 L348 F355	Y290-A351 VanDerWaalsContact CD1-CA 3.48Å; Y290-A351 HydrophobicContact CD1-CB 3.48Å; Y290-A351 VanDerWaalsContact CD1-CB 3.48Å; Y290-A351 HydrophobicContact CE1-CB 4.21Å; Y290-A351 HydrophobicContact CG-CB 3.89Å; L294-A351 HydrophobicContact CD1-CB 4.41Å; L294-A351 HydrophobicContact CD2-CB 3.84Å; L294-A351 HydrophobicContact CG-CB 3.92Å; C347-A351 VanDerWaalsContact O-CB 3.23Å; C347-A351 WeakPolarHBondContact O-CB 3.37Å; C347-A351 PolarHBondContact O-N 3.33Å; L348-A351 PolarHBondContact O-N 3.07Å; A351-F355 VanDerWaalsContact O-CB 3.31Å; A351-F355 WeakPolarHBondContact O-CB 3.35Å; A351-F355 PolarHBondContact O-N 2.94Å
352	I	93.8	Very high	84.3	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-66.3	-41.1	178.8	-63.2	169.2	0	0	0	110.5	F221 L294 I317 L348 G356	F221-I352 HydrophobicContact CB-CG2 4.2Å; F221-I352 HydrophobicContact CD1-CD1 4.3Å; F221-I352 HydrophobicContact CD1-CG1 3.85Å; F221-I352 HydrophobicContact CD1-CG2 4.22Å; F221-I352 HydrophobicContact CE1-CD1 4.42Å; F221-I352 HydrophobicContact CE1-CG1 4.18Å; L294-I352 HydrophobicContact CD2-CG1 3.65Å; I317-I352 HydrophobicContact CD1-CG2 4.02Å; I317-I352 HydrophobicContact CG2-CB 4.36Å; I317-I352 HydrophobicContact CG2-CD1 4.12Å; I317-I352 HydrophobicContact CG2-CG2 4.07Å; L348-I352 HydrophobicContact CD1-CD1 3.96Å; L348-I352 HydrophobicContact CD1-CG1 4.32Å; L348-I352 HydrophobicContact CG-CD1 4.06Å; L348-I352 VanDerWaalsContact O-CG1 3.28Å; L348-I352 WeakPolarHBondContact O-CG1 3.43Å; L348-I352 PolarHBondContact O-N 3.06Å; I352-G356 PolarHBondContact O-N 2.71Å
353	Q	91.1	Very high	81.5	Confident	56 Å²	56	50.4 Å²	50.4	26%	0.262	28%	0.279	S	S	.	.	H	α-helix	trans	-66.1	-45.9	177.2	-73.6	179.3	-9.8	0	0	112.2	I317 R349 N350 F355 G356 N357	I317-Q353 HydrophobicContact CD1-CG 3.84Å; R349-Q353 WeakPolarHBondContact O-CB 3.42Å; R349-Q353 VanDerWaalsContact O-CG 3.31Å; R349-Q353 WeakPolarHBondContact O-CG 3.47Å; R349-Q353 PolarHBondContact O-N 3.15Å; N350-Q353 PolarHBondContact O-N 3.01Å; Q353-F355 PolarHBondContact O-N 3.2Å; Q353-G356 PolarHBondContact O-N 3.35Å; Q353-N357 WeakPolarHBondContact O-CB 3.32Å; Q353-N357 PolarHBondContact O-N 2.92Å; Q353-N357 PolarHBondContact O-ND2 3.17Å
354	A	88.7	Confident	78.2	Confident	10 Å²	10	53 Å²	53	8%	0.083	30%	0.299	C	S	.	.	H	α-helix	trans	-60.8	-44.6	177.1	0	0	0	0	0	111.5	Y290 N350 N357 G358 T359	Y290-A354 HydrophobicContact CD2-CB 3.82Å; Y290-A354 HydrophobicContact CE2-CB 3.53Å; N350-A354 WeakPolarHBondContact O-CB 3.43Å; N350-A354 PolarHBondContact O-N 3.21Å; A354-N357 PolarHBondContact O-N 3.49Å; A354-G358 PolarHBondContact O-N 3.3Å; A354-T359 CarbonylContact C-O 3.3Å; A354-T359 WeakPolarHBondContact CA-OG1 3.28Å; A354-T359 WeakPolarHBondContact CB-O 3.44Å; A354-T359 PolarHBondContact O-N 3.03Å; A354-T359 PolarHBondContact O-OG1 2.97Å
355	F	88.4	Confident	75.3	Confident	16 Å²	16	51.7 Å²	51.7	7%	0.07	30%	0.303	C	S	.	.	H	α-helix	trans	-62	-50.1	175	-170.1	-83.4	0	0	0	112.1	L135 I138 F139 Y217 F221 L294 A351 Q353 N357 G358	L135-F355 HydrophobicContact CD2-CD2 3.83Å; L135-F355 HydrophobicContact CD2-CE2 4.35Å; I138-F355 HydrophobicContact CG2-CE2 4.31Å; F139-F355 HydrophobicContact CZ-CD2 4.22Å; Y217-F355 VanDerWaalsContact C-CE1 3.48Å; Y217-F355 HydrophobicContact CD2-CE2 4.1Å; Y217-F355 HydrophobicContact CD2-CZ 4.44Å; Y217-F355 HydrophobicContact CG-CZ 4.46Å; Y217-F355 WeakPolarHBondContact O-CE1 3.45Å; F221-F355 HydrophobicContact CB-CD1 3.77Å; F221-F355 HydrophobicContact CB-CE1 4.43Å; F221-F355 HydrophobicContact CB-CG 4.38Å; F221-F355 HydrophobicContact CD2-CD1 4.48Å; L294-F355 HydrophobicContact CD1-CB 3.63Å; L294-F355 HydrophobicContact CD1-CD2 3.81Å; L294-F355 HydrophobicContact CD1-CG 3.9Å; A351-F355 VanDerWaalsContact O-CB 3.31Å; A351-F355 WeakPolarHBondContact O-CB 3.35Å; A351-F355 PolarHBondContact O-N 2.94Å; Q353-F355 PolarHBondContact O-N 3.2Å; F355-N357 PolarHBondContact O-N 2.75Å; F355-G358 PolarHBondContact O-N 3.46Å; F355-G358 VanDerWaalsContact O-N 3.12Å
356	G	85.3	Confident	72.3	Confident	14 Å²	14	61.2 Å²	61.2	14%	0.144	34%	0.344	C	S	.	.	H	α-helix	trans	-62.1	-26	179.9	0	0	0	0	0	113.9	F221 S223 I352 Q353	F221-G356 WeakPolarHBondContact O-CA 3.44Å; S223-G356 VanDerWaalsContact CB-O 3.27Å; S223-G356 WeakPolarHBondContact CB-O 3.37Å; S223-G356 PolarHBondContact OG-O 2.91Å; I352-G356 PolarHBondContact O-N 2.71Å; Q353-G356 PolarHBondContact O-N 3.35Å
357	N	81.7	Confident	69.3	Low	111 Å²	111	61.8 Å²	61.8	59%	0.594	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-4.5	178.4	-67.5	-12.6	0	0	0	113.8	Q353 A354 F355 T359	Q353-N357 WeakPolarHBondContact O-CB 3.32Å; Q353-N357 PolarHBondContact O-N 2.92Å; Q353-N357 PolarHBondContact O-ND2 3.17Å; A354-N357 PolarHBondContact O-N 3.49Å; F355-N357 PolarHBondContact O-N 2.75Å; N357-T359 VanDerWaalsContact C-N 3.31Å; N357-T359 HydrophobicContact CB-CG2 4.36Å
358	G	73	Confident	66.3	Low	47 Å²	47	66.8 Å²	66.8	49%	0.485	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	16.7	-177	0	0	0	0	0	114.6	A354 F355	A354-G358 PolarHBondContact O-N 3.3Å; F355-G358 PolarHBondContact O-N 3.46Å; F355-G358 VanDerWaalsContact O-N 3.12Å
359	T	62.3	Low	63.2	Low	72 Å²	72	71.7 Å²	71.7	44%	0.442	42%	0.424	S	S	.	.			trans	-107	112	-174.7	54.1	0	0	0	0	110.9	A354 N357	A354-T359 CarbonylContact C-O 3.3Å; A354-T359 WeakPolarHBondContact CA-OG1 3.28Å; A354-T359 WeakPolarHBondContact CB-O 3.44Å; A354-T359 PolarHBondContact O-N 3.03Å; A354-T359 PolarHBondContact O-OG1 2.97Å; N357-T359 VanDerWaalsContact C-N 3.31Å; N357-T359 HydrophobicContact CB-CG2 4.36Å
360	D	54	Low	60.2	Low	44 Å²	44	74.5 Å²	74.5	24%	0.235	44%	0.44	C	S	.	.			trans	-82.4	157.5	159.5	-163.7	7.2	0	0	0	109.8	L135 S136 F139 N362	L135-D360 HydrophobicContact CB-CB 4.17Å; S136-D360 WeakPolarHBondContact CA-OD2 3.46Å; S136-D360 WeakPolarHBondContact CB-OD2 3.49Å; S136-D360 PolarHBondContact N-OD2 2.78Å; S136-D360 PolarHBondContact OG-OD2 3.38Å; F139-D360 HydrophobicContact CD2-CB 4.2Å; F139-D360 HydrophobicContact CE2-CB 4.25Å; D360-N362 PolarHBondContact O-N 2.82Å
361	V	48.8	Very low	57.2	Low	49 Å²	49	80.7 Å²	80.7	30%	0.297	47%	0.468	S	S	.	.			trans	-76.9	112.5	177.7	-163.5	0	0	0	0	108.4	T283 Y290 V363	T283-V361 HydrophobicContact CG2-CG1 4.45Å; T283-V361 HydrophobicContact CG2-CG2 3.7Å; Y290-V361 HydrophobicContact CD2-CG2 3.78Å; Y290-V361 HydrophobicContact CE2-CG2 3.25Å; V361-V363 HydrophobicContact CB-CG2 4.1Å; V361-V363 HydrophobicContact CG1-CG2 3.52Å; V361-V363 PolarHBondContact O-N 3.39Å
362	N	43	Very low	54.3	Low	162 Å²	162	84.9 Å²	84.9	87%	0.866	50%	0.502	S	S	*	.			trans	-72.2	60.4	171.3	-84.1	-34.5	0	0	0	111.4	D360 S364	D360-N362 PolarHBondContact O-N 2.82Å; N362-S364 PolarHBondContact O-N 2.95Å
363	V	41.1	Very low	51.3	Low	80 Å²	80	91.5 Å²	91.5	49%	0.485	54%	0.543	S	S	.	.			trans	-70.9	72.1	159.6	-167.4	0	0	0	0	107.6	V361 P365	V361-V363 HydrophobicContact CB-CG2 4.1Å; V361-V363 HydrophobicContact CG1-CG2 3.52Å; V361-V363 PolarHBondContact O-N 3.39Å; V363-P365 WeakPolarHBondContact O-CD 3.36Å
364	S	27.7	Very low	48.5	Very low	95 Å²	95	97.5 Å²	97.5	66%	0.664	57%	0.571	S	S	*	*			trans	-59.3	121.9	157.2	-177.6	0	0	0	0	106.4	N362 K366	N362-S364 PolarHBondContact O-N 2.95Å; S364-K366 VanDerWaalsContact C-N 3.3Å; S364-K366 PolarHBondContact O-N 3.2Å
365	P	36.6	Very low	45.7	Very low	111 Å²	111	101.2 Å²	101.2	72%	0.721	60%	0.602	S	S	*	*			trans	-68.4	94.3	179.3	28.3	-33.1	0	0	0	108.3	V363 G367	V363-P365 WeakPolarHBondContact O-CD 3.36Å; P365-G367 PolarHBondContact O-N 2.73Å
366	K	33.4	Very low	43	Very low	206 Å²	206	106.6 Å²	106.6	90%	0.896	64%	0.638	S	S	*	*			trans	-61.1	90.9	155.7	-78	-174.1	175.7	-179.5	0	106.5	S364	S364-K366 VanDerWaalsContact C-N 3.3Å; S364-K366 PolarHBondContact O-N 3.2Å
367	G	33.2	Very low	40.4	Very low	52 Å²	52	117.7 Å²	117.7	54%	0.536	68%	0.676	S	S	.	*			trans	-51.1	149.5	162.6	0	0	0	0	0	108.9	P365 S369	P365-G367 PolarHBondContact O-N 2.73Å; G367-S369 PolarHBondContact O-N 2.67Å
368	P	32.1	Very low	38.1	Very low	104 Å²	104	119 Å²	119	68%	0.675	69%	0.687	S	S	*	*			trans	-53	120.5	-175.3	22.4	-33.5	0	0	0	109.3	F370	P368-F370 VanDerWaalsContact C-N 3.29Å; P368-F370 HydrophobicContact CG-CE2 4.12Å; P368-F370 HydrophobicContact CG-CZ 4.46Å; P368-F370 WeakPolarHBondContact O-CD2 3.35Å; P368-F370 PolarHBondContact O-N 2.76Å
369	S	31.9	Very low	35.9	Very low	105 Å²	105	124.1 Å²	124.1	73%	0.734	70%	0.699	S	S	*	*			trans	-68.9	94.3	175	55.4	0	0	0	0	107.5	G367 Q371	G367-S369 PolarHBondContact O-N 2.67Å; S369-Q371 VanDerWaalsContact C-N 3.28Å; S369-Q371 PolarHBondContact O-N 3.03Å
370	F	32	Very low	34.3	Very low	187 Å²	187	129 Å²	129	82%	0.82	71%	0.714	S	S	*	*			trans	-57.8	96.1	168.3	-71.6	-83.6	0	0	0	107.8	P368 A372	P368-F370 VanDerWaalsContact C-N 3.29Å; P368-F370 HydrophobicContact CG-CE2 4.12Å; P368-F370 HydrophobicContact CG-CZ 4.46Å; P368-F370 WeakPolarHBondContact O-CD2 3.35Å; P368-F370 PolarHBondContact O-N 2.76Å; F370-A372 PolarHBondContact O-N 2.98Å
371	Q	29.9	Very low	32.9	Very low	172 Å²	172	133 Å²	133	80%	0.804	74%	0.74	S	S	*	*			trans	-64.5	104.2	168.7	-73.2	-174.9	-19.3	0	0	106.5	S369 T373	S369-Q371 VanDerWaalsContact C-N 3.28Å; S369-Q371 PolarHBondContact O-N 3.03Å; Q371-T373 PolarHBondContact O-N 2.85Å
372	A	31.5	Very low	32.3	Very low	88 Å²	88	136.6 Å²	136.6	73%	0.727	76%	0.764	S	S	*	*			trans	-61.8	104.7	176.5	0	0	0	0	0	108.5	F370 Q374	F370-A372 PolarHBondContact O-N 2.98Å; A372-Q374 PolarHBondContact O-N 2.81Å
373	T	31.4	Very low	31.5	Very low	141 Å²	141	134.1 Å²	134.1	87%	0.865	76%	0.76	S	S	*	*			trans	-61.9	103.7	-178.1	-46.4	0	0	0	0	109.2	Q371 A375	Q371-T373 PolarHBondContact O-N 2.85Å; T373-A375 PolarHBondContact O-N 2.93Å
374	Q	33	Very low	30.9	Very low	181 Å²	181	137.8 Å²	137.8	85%	0.846	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-70	131.6	174.9	-64.3	-171.8	8.3	0	0	109.1	A372	A372-Q374 PolarHBondContact O-N 2.81Å
375	A	29.8	Very low	31.6	Very low	89 Å²	89	137.9 Å²	137.9	74%	0.736	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-66	134.1	178.4	0	0	0	0	0	110.5	T373 R377	T373-A375 PolarHBondContact O-N 2.93Å; A375-R377 PolarHBondContact O-N 2.95Å
376	P	31.7	Very low	31.4	Very low	128 Å²	128	139.1 Å²	139.1	83%	0.831	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-61.4	133	177.3	-23.5	34	0	0	0	112.1
377	R	30.3	Very low	31.3	Very low	248 Å²	248	135.6 Å²	135.6	94%	0.936	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-82.7	145.7	166	-86.6	-176.9	168.2	172.2	-3.9	110.5	A375	A375-R377 PolarHBondContact O-N 2.95Å
378	V	33	Very low	31.4	Very low	137 Å²	137	139.6 Å²	139.6	83%	0.83	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-92.6	133.4	174.7	175.1	0	0	0	0	109.8
379	E	26.7	Very low	31.4	Very low	156 Å²	156	139 Å²	139	73%	0.729	77%	0.772	S	S	*	*			trans	157	146.2	153.5	-93.9	-163.6	130.7	0	0	108.8
380	K	28.5	Very low	31.3	Very low	174 Å²	174	140.2 Å²	140.2	76%	0.757	77%	0.771	S	S	*	*			cis	-168.1	133.7	-11.6	-164.5	179.5	-151.2	145.9	0	108.7
381	T	24.8	Very low	31.5	Very low	128 Å²	128	135.5 Å²	135.5	79%	0.785	76%	0.761	S	S	*	*			trans	-76.4	155.4	171.4	1	0	0	0	0	111.2
382	P	35.6	Very low	31.7	Very low	124 Å²	124	134.1 Å²	134.1	81%	0.805	76%	0.764	S	S	*	*				-132.2	-170.8	61.9	41.3	-24.3	0	0	0	112.5
383	S	26.5	Very low	31.8	Very low	110 Å²	110	134.9 Å²	134.9	77%	0.769	76%	0.764	S	S	*	*			cis	-149.6	154.4	15.9	54.7	0	0	0	0	114.8
384	L	28.2	Very low	31.9	Very low	157 Å²	157	136.2 Å²	136.2	82%	0.822	77%	0.765	S	S	*	*			trans	-82.9	-172.3	162	-86.8	168.4	0	0	0	110.3
385	P	43.6	Very low	31.6	Very low	97 Å²	97	131.3 Å²	131.3	63%	0.63	76%	0.763	S	S	*	*			cis	-131.3	-163.1	5.4	46.4	-29.1	0	0	0	113.2
386	D	32.1	Very low	31.6	Very low	137 Å²	137	133 Å²	133	73%	0.733	76%	0.764	S	S	*	*			cis	-116.7	-141.5	-7.5	-59.1	-81	0	0	0	107.8
387	D	31.2	Very low	31.5	Very low	133 Å²	133	132.2 Å²	132.2	71%	0.711	76%	0.762	S	S	*	*			cis	-167.8	159.2	-17.3	-132.3	12.9	0	0	0	105.4
388	L	34.8	Very low	31.5	Very low	135 Å²	135	125.9 Å²	125.9	71%	0.707	75%	0.751	S	S	*	*			cis	-161.6	157.3	-20.3	-168.1	56.4	0	0	0	108.8
389	S	31.9	Very low	31.4	Very low	91 Å²	91	126.6 Å²	126.6	64%	0.636	75%	0.748	S	S	*	*			trans	61.3	142.6	159.6	-79.6	0	0	0	0	120.7
390	D	30.6	Very low	31.3	Very low	132 Å²	132	125.7 Å²	125.7	71%	0.706	75%	0.754	S	S	*	*			cis	-160.4	164.9	-12.7	-133	-57.4	0	0	0	114.3
391	S	36.8	Very low	31.3	Very low	87 Å²	87	123 Å²	123	61%	0.608	75%	0.752	S	S	*	*			trans	22.2	147	153.3	18.4	0	0	0	0	123.3
392	T	34.3	Very low	31.4	Very low	143 Å²	143	122 Å²	122	88%	0.877	75%	0.749	S	S	*	*			cis	-167.3	162.5	-14.1	9.9	0	0	0	0	109.8
393	S	33.8	Very low	31.1	Very low	104 Å²	104	122.9 Å²	122.9	73%	0.727	75%	0.752	S	S	*	*			trans	-148.5	134.5	164.1	64.7	0	0	0	0	112.1
394	L	33.5	Very low	31.5	Very low	170 Å²	170	123 Å²	123	89%	0.89	75%	0.753	S	S	*	*			trans	-173.8	160.8	140.4	-130.7	68.4	0	0	0	112.6
395	G	26.4	Very low	31.6	Very low	78 Å²	78	121.2 Å²	121.2	80%	0.804	75%	0.748	S	S	*	*			trans	176.4	92.6	170.4	0	0	0	0	0	112.3
396	T	30.2	Very low	30.9	Very low	123 Å²	123	123.7 Å²	123.7	76%	0.755	75%	0.752	S	S	*	*			trans	-134.5	115	-173.8	-50.3	0	0	0	0	112.5
397	S	27.9	Very low	30.7	Very low	113 Å²	113	124.5 Å²	124.5	79%	0.79	75%	0.751	S	S	*	*			trans	-155.3	142.4	159	53	0	0	0	0	108.1
398	V	31.2	Very low	30.5	Very low	115 Å²	115	126.7 Å²	126.7	70%	0.697	76%	0.757	S	S	*	*			cis	93.4	91.3	22	-174.8	0	0	0	0	114.3
399	I	31.1	Very low	30.1	Very low	151 Å²	151	123.8 Å²	123.8	77%	0.774	76%	0.76	S	S	*	*			trans	65.8	126.7	147.1	-58.2	169.3	0	0	0	119.3
400	T	25	Very low	30.1	Very low	138 Å²	138	128.1 Å²	128.1	85%	0.847	78%	0.775	S	S	*	*				-168.7	147	126.8	-76	0	0	0	0	110.4
401	T	28.5	Very low	30.5	Very low	117 Å²	117	131.8 Å²	131.8	72%	0.718	79%	0.785	S	S	*	*			trans	-110.6	151.1	178.2	49.4	0	0	0	0	111.9
402	C	27.3	Very low	30.2	Very low	108 Å²	108	132.6 Å²	132.6	73%	0.73	80%	0.796	S	S	*	*				170.2	150.7	118.2	-94.7	0	0	0	0	116.3
403	T	28.6	Very low	29.9	Very low	141 Å²	141	132.3 Å²	132.3	87%	0.865	79%	0.79	S	S	*	*			trans	64	139.8	148.9	47.5	0	0	0	0	122.5
404	S	34.2	Very low	29.7	Very low	112 Å²	112	133.9 Å²	133.9	78%	0.783	79%	0.79	S	S	*	*			trans	-115.5	171.7	173.2	53.5	0	0	0	0	110.9
405	V	31.1	Very low	29.5	Very low	120 Å²	120	131.2 Å²	131.2	73%	0.727	79%	0.786	S	S	*	*			trans	-171.4	133.7	149.7	133	0	0	0	0	110.8
406	Q	28.6	Very low	29.6	Very low	150 Å²	150	136.2 Å²	136.2	70%	0.701	79%	0.785	S	S	*	*			trans	38.2	164.5	154.6	-75.2	148.9	-104.5	0	0	122
407	E	27.4	Very low	29.4	Very low	153 Å²	153	138.2 Å²	138.2	72%	0.715	79%	0.786	S	S	*	*			cis	-140.1	-158.8	17.3	-156.9	120.9	-109.2	0	0	114.4
408	Q	27.3	Very low	29.4	Very low	179 Å²	179	140.5 Å²	140.5	84%	0.836	79%	0.788	S	S	*	*			trans	-107.5	161.8	-152.2	-64	167.3	0	0	0	115.3
409	G	27.1	Very low	29.1	Very low	75 Å²	75	138.5 Å²	138.5	77%	0.773	78%	0.78	S	S	*	*			trans	-162.5	65.5	176.8	0	0	0	0	0	116
410	L	30.6	Very low	28.8	Very low	181 Å²	181	139.2 Å²	139.2	95%	0.948	78%	0.781	S	S	*	*			trans	39.8	140.1	153.6	-70.7	160.4	0	0	0	122.5
411	K	39.2	Very low	28.9	Very low	210 Å²	210	139 Å²	139	91%	0.913	78%	0.784	S	S	*	*			trans	-113.1	140.6	171.3	-73.1	-176.7	176.1	-179.6	0	112.8
412	A	30.2	Very low	28.7	Very low	103 Å²	103	141.4 Å²	141.4	85%	0.851	79%	0.785	S	S	*	*			trans	-170.9	166.7	159.3	0	0	0	0	0	110.2
413	N	28.8	Very low	28.5	Very low	138 Å²	138	143 Å²	143	74%	0.738	79%	0.792	S	S	*	*			cis	-160	150.1	-46.9	-164.7	15.9	0	0	0	109.6
414	N	28.7	Very low	28.4	Very low	136 Å²	136	142.9 Å²	142.9	73%	0.727	78%	0.781	S	S	*	*			trans	27.1	119	162.3	-67.2	-18.4	0	0	0	124
415	S	31.1	Very low	27.9	Very low	115 Å²	115	146.2 Å²	146.2	80%	0.804	79%	0.789	S	S	*	*				57.9	119.2	125.4	-160.4	0	0	0	0	123.5
416	K	28.3	Very low	27.8	Very low	182 Å²	182	145.4 Å²	145.4	79%	0.791	79%	0.785	S	S	*	*			trans	-177.7	129.5	131.6	-97.5	172	177.2	-175.4	0	108.1
417	E	26.1	Very low	27.7	Very low	166 Å²	166	143.4 Å²	143.4	78%	0.776	78%	0.783	S	S	*	*				67.6	103.3	70.4	-172	-177.1	-138	0	0	113.8
418	L	26.4	Very low	27.7	Very low	161 Å²	161	143 Å²	143	84%	0.843	79%	0.786	S	S	*	*				-164.8	149.7	125	-160.6	55.9	0	0	0	113.7
419	S	25.5	Very low	27.8	Very low	73 Å²	73	142.7 Å²	142.7	51%	0.51	79%	0.788	S	S	.	*			trans	-46.9	143.7	176.8	66.6	0	0	0	0	118.1
420	M	25.5	Very low	28.1	Very low	165 Å²	165	146.1 Å²	146.1	81%	0.813	79%	0.787	S	S	*	*				58.6	133.6	104	-53.9	-172.4	-66	0	0	118.7
421	C	25.5	Very low	28.1	Very low	133 Å²	133	143.1 Å²	143.1	90%	0.899	78%	0.778	S	S	*	*				-148.4	151	116.4	-143.5	0	0	0	0	110.8
422	F	24.5	Very low	27.6	Very low	168 Å²	168	137.3 Å²	137.3	74%	0.737	78%	0.778	S	S	*	*			trans	-104.9	162	-179.8	-110.8	-107.4	0	0	0	110.5	E424	F422-E424 HydrophobicContact CD1-CG 4.18Å
423	T	24.9	Very low	27.6	Very low	142 Å²	142	137.6 Å²	137.6	87%	0.871	77%	0.774	S	S	*	*			trans	-135.2	106.7	150.1	-43.4	0	0	0	0	109
424	E	25.9	Very low	27.6	Very low	138 Å²	138	138.1 Å²	138.1	65%	0.645	78%	0.777	S	S	*	*			trans	-83.1	157.4	162.7	-71.4	-160.6	149.4	0	0	110.6	F422	F422-E424 HydrophobicContact CD1-CG 4.18Å
425	L	24	Very low	27.5	Very low	182 Å²	182	141.8 Å²	141.8	95%	0.953	79%	0.786	S	S	*	*			trans	-141.1	126.3	147.2	-154.6	77.3	0	0	0	109.4
426	T	27.5	Very low	27.4	Very low	104 Å²	104	142 Å²	142	64%	0.638	78%	0.782	S	S	*	*			trans	-100.3	140.3	-163.4	-13.9	0	0	0	0	112.8
427	T	27.7	Very low	27.5	Very low	107 Å²	107	141.5 Å²	141.5	66%	0.656	79%	0.787	S	S	*	*			trans	8.4	131.8	155.3	55.2	0	0	0	0	120
428	N	27.3	Very low	27.7	Very low	145 Å²	145	142.6 Å²	142.6	78%	0.775	79%	0.789	S	S	*	*				170	113.1	110.3	-88.7	-43.5	0	0	0	114.2
429	I	28.4	Very low	28.6	Very low	173 Å²	173	139.8 Å²	139.8	89%	0.887	78%	0.78	S	S	*	*			trans	-141.2	139.7	144.9	-63.5	-171.4	0	0	0	107.8
430	I	33.1	Very low	28.8	Very low	147 Å²	147	143.9 Å²	143.9	75%	0.754	80%	0.796	S	S	*	*			trans	-95.5	143.8	-171.7	-70.1	172.5	0	0	0	111.4	G432	I430-G432 PolarHBondContact O-N 3.49Å
431	P	32.5	Very low	29	Very low	118 Å²	118	140.9 Å²	140.9	77%	0.766	79%	0.792	S	S	*	*			trans	-72.7	125.3	177.1	29	-35.3	0	0	0	112.8	S433	P431-S433 PolarHBondContact O-N 3.44Å
432	G	27.2	Very low	29.2	Very low	87 Å²	87	138.1 Å²	138.1	90%	0.897	79%	0.785	S	S	*	*			trans	-82.8	103.9	176.2	0	0	0	0	0	112.9	I430	I430-G432 PolarHBondContact O-N 3.49Å
433	S	30	Very low	29.8	Very low	110 Å²	110	136.4 Å²	136.4	77%	0.769	79%	0.791	S	S	*	*			trans	-127.2	122	161.9	66.1	0	0	0	0	109.6	P431	P431-S433 PolarHBondContact O-N 3.44Å
434	N	29.6	Very low	30.1	Very low	149 Å²	149	135.9 Å²	135.9	80%	0.797	79%	0.793	S	S	*	*			trans	-161.4	102.8	174.6	-131.8	-22.7	0	0	0	112.7
435	K	27.5	Very low	30.4	Very low	213 Å²	213	140.7 Å²	140.7	93%	0.926	81%	0.806	S	S	*	*			trans	-151.5	105.3	145.8	-116.7	-180	-174.4	-178.9	0	109.5
436	V	28.4	Very low	30.6	Very low	120 Å²	120	136.4 Å²	136.4	73%	0.727	80%	0.796	S	S	*	*			trans	-84.6	126.4	-179.9	174.3	0	0	0	0	109.9
437	I	29.1	Very low	30.8	Very low	171 Å²	171	142.8 Å²	142.8	88%	0.877	81%	0.809	S	S	*	*			trans	-135.1	128.1	151	-61.7	174.4	0	0	0	108.9
438	K	30.5	Very low	32	Very low	189 Å²	189	143 Å²	143	82%	0.822	81%	0.812	S	S	*	*			trans	-163.3	163.5	171.9	-114.4	-164.9	178.2	-179.5	0	106.8
439	P	45.6	Very low	32.1	Very low	102 Å²	102	141.9 Å²	141.9	66%	0.662	82%	0.815	S	S	*	*			cis	-127.5	166	-30.8	38.5	-25.5	0	0	0	112
440	N	29.2	Very low	32.3	Very low	158 Å²	158	138.5 Å²	138.5	85%	0.845	81%	0.813	S	S	*	*			trans	173.8	152.1	151.1	-93.5	-20.4	0	0	0	108.7
441	S	30.4	Very low	32.3	Very low	103 Å²	103	135.7 Å²	135.7	72%	0.72	81%	0.812	S	S	*	*			cis	-168.4	138.8	-14	48.8	0	0	0	0	110.2
442	G	29.7	Very low	32.3	Very low	74 Å²	74	137.7 Å²	137.7	76%	0.763	82%	0.816	S	S	*	*			trans	79.7	131.4	156.7	0	0	0	0	0	118.5
443	P	36.6	Very low	32.6	Very low	132 Å²	132	139.4 Å²	139.4	86%	0.857	81%	0.809	S	S	*	*			trans	-93.5	139	165.9	35.1	-30.2	0	0	0	112
444	S	31.5	Very low	32.7	Very low	132 Å²	132	139.7 Å²	139.7	92%	0.923	81%	0.806	S	S	*	*			trans	-107.3	146.7	169.6	-73.8	0	0	0	0	111.5
445	R	32.1	Very low	32.8	Very low	239 Å²	239	140.1 Å²	140.1	90%	0.902	81%	0.807	S	S	*	*			trans	-142.9	138.9	-159.3	-175.4	-172.4	-168.5	-173.1	5.6	110.6
446	A	28.6	Very low	33	Very low	92 Å²	92	134.4 Å²	134.4	76%	0.76	79%	0.794	S	S	*	*			trans	66.1	158.1	173.1	0	0	0	0	0	115.1
447	R	32.4	Very low	33.3	Very low	238 Å²	238	134.9 Å²	134.9	90%	0.898	80%	0.797	S	S	*	*			cis	-154.7	170.8	-15.5	-119.5	-174.4	171.7	175.9	-2.9	108.2
448	P	53.3	Low	33.5	Very low	112 Å²	112	133.7 Å²	133.7	73%	0.727	79%	0.791	S	S	*	*			trans	-91.3	158.1	-178.3	37	-33.5	0	0	0	113.9
449	S	29.6	Very low	33.7	Very low	120 Å²	120	132.7 Å²	132.7	84%	0.839	79%	0.792	S	S	*	*			trans	-137.9	133.7	155.7	-65.1	0	0	0	0	107.2
450	A	32.2	Very low	33.1	Very low	102 Å²	102	134.1 Å²	134.1	84%	0.843	79%	0.793	S	S	*	*			cis	101.5	93.9	26.4	0	0	0	0	0	113.9
451	A	32.9	Very low	33.3	Very low	89 Å²	89	134.9 Å²	134.9	74%	0.736	79%	0.789	S	S	*	*			trans	-177.4	126.7	154.7	0	0	0	0	0	105.7
452	L	31.7	Very low	33.3	Very low	160 Å²	160	137.3 Å²	137.3	84%	0.838	79%	0.793	S	S	*	*				59	119.4	65.9	-62.1	165	0	0	0	110.3
453	T	34.1	Very low	33.6	Very low	123 Å²	123	137.8 Å²	137.8	76%	0.755	79%	0.79	S	S	*	*			cis	-153.9	147.2	47.3	44.3	0	0	0	0	115.6
454	V	31.4	Very low	33.7	Very low	116 Å²	116	143.3 Å²	143.3	70%	0.703	81%	0.811	S	S	*	*				42.6	111.3	123.3	-172.1	0	0	0	0	117.7
455	L	31.8	Very low	33.8	Very low	158 Å²	158	143.9 Å²	143.9	83%	0.827	81%	0.805	S	S	*	*				58.2	122.9	98.4	-117.7	90.2	0	0	0	113.7
456	S	32.7	Very low	33.9	Very low	93 Å²	93	138.8 Å²	138.8	65%	0.65	80%	0.8	S	S	*	*				176.9	160.8	74.6	-63.4	0	0	0	0	112.5
457	V	33.3	Very low	34.2	Very low	130 Å²	130	141.4 Å²	141.4	79%	0.788	80%	0.802	S	S	*	*			trans	58.6	126.2	151.8	173.3	0	0	0	0	117.9
458	L	34.6	Very low	34.3	Very low	145 Å²	145	135.8 Å²	135.8	76%	0.759	80%	0.796	S	S	*	*			cis	84.2	70.4	27.4	-152.5	153.2	0	0	0	116.2
459	M	35	Very low	33.1	Very low	169 Å²	169	137.3 Å²	137.3	83%	0.833	80%	0.801	S	S	*	*			trans	-141.5	137.1	146.6	-75.6	-62.7	-166.3	0	0	107.2
460	L	32.2	Very low	33.4	Very low	131 Å²	131	138.4 Å²	138.4	69%	0.686	80%	0.798	S	S	*	*			cis	103.5	117.4	14.8	-163.9	122.5	0	0	0	114.5
461	K	32.7	Very low	33.4	Very low	175 Å²	175	141 Å²	141	76%	0.761	80%	0.795	S	S	*	*			trans	83.5	118.8	163.9	-78.5	-170.4	170.4	-171.7	0	122.4
462	L	30.2	Very low	33.5	Very low	154 Å²	154	145 Å²	145	81%	0.806	80%	0.799	S	S	*	*			trans	76.6	147.9	132.3	-95.5	86.8	0	0	0	123.3
463	A	36.2	Very low	33.6	Very low	84 Å²	84	143.8 Å²	143.8	69%	0.694	80%	0.796	S	S	*	*			trans	66.4	90	150.3	0	0	0	0	0	118.8
464	L	39.3	Very low	33.6	Very low	247 Å²	247	145.6 Å²	145.6	100%	1.293	80%	0.8	S	S	*	*				-139.3	0	91	-131.9	74.7	0	0	0	110.4

Retrieved 464 of 464 residues in 388.7 ms (Link to these results)

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