A0A096NXW5_PAPAN Loading...

Serine/threonine-protein kinase receptor

AlphaFold DB (A0A2K6CVH7), UniProt , Accession A0A096NXW5, Species PAPAN (Papio anubis, Olive baboon), Gene ACVR1, Length 509 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.1	Very low	33.2	Very low	244 Å²	244	143.5 Å²	143.5	100%	1.202	82%	0.816	S	S	*	*				0	107.7	0	-65	178.5	-160.7	0	0	105.6
2	V	32.3	Very low	33	Very low	137 Å²	137	143.1 Å²	143.1	83%	0.83	81%	0.807	S	S	*	*			cis	-145.8	146.3	20.7	170.3	0	0	0	0	106.8
3	D	34.8	Very low	33	Very low	153 Å²	153	143.5 Å²	143.5	82%	0.818	80%	0.803	S	S	*	*			trans	-59.7	132.4	-176.6	-59.2	-63.8	0	0	0	113.9
4	G	31.4	Very low	32.8	Very low	77 Å²	77	143.4 Å²	143.4	79%	0.794	80%	0.798	S	S	*	*			trans	-113.3	90.6	170.1	0	0	0	0	0	110.1	M6	G4-M6 PolarHBondContact O-N 3.35Å
5	V	37	Very low	32.6	Very low	122 Å²	122	139 Å²	139	74%	0.739	79%	0.788	S	S	*	*			trans	-66.6	118.7	174.4	175.3	0	0	0	0	109.5	I7	V5-I7 HydrophobicContact CG1-CG1 4.27Å; V5-I7 PolarHBondContact O-N 3.31Å
6	M	32.4	Very low	32.4	Very low	177 Å²	177	140.3 Å²	140.3	87%	0.872	79%	0.791	S	S	*	*			trans	-70	107.8	167.3	-74.4	-103.1	-71.9	0	0	109.6	G4	G4-M6 PolarHBondContact O-N 3.35Å
7	I	35.3	Very low	32.3	Very low	156 Å²	156	139.1 Å²	139.1	80%	0.8	79%	0.79	S	S	*	*			trans	-89.1	106.1	169.9	-60	178.3	0	0	0	108.4	V5	V5-I7 HydrophobicContact CG1-CG1 4.27Å; V5-I7 PolarHBondContact O-N 3.31Å
8	L	31	Very low	32.1	Very low	133 Å²	133	136.8 Å²	136.8	70%	0.696	78%	0.784	S	S	*	*			trans	-70.8	129.9	171.2	-154.2	85.3	0	0	0	109.5	V10	L8-V10 HydrophobicContact CD2-CG2 4.4Å; L8-V10 PolarHBondContact O-N 2.96Å; L8-V10 VanDerWaalsContact O-N 3.14Å
9	P	33.8	Very low	32.1	Very low	115 Å²	115	136.6 Å²	136.6	75%	0.747	79%	0.788	S	S	*	*			trans	-78.6	99.7	167.7	30	-28.5	0	0	0	108.6	L11	P9-L11 PolarHBondContact O-N 3.14Å; P9-L11 VanDerWaalsContact O-N 3.12Å
10	V	31.8	Very low	31.9	Very low	111 Å²	111	134.9 Å²	134.9	67%	0.673	79%	0.785	S	S	*	*			trans	-70.3	100.2	167.3	177.3	0	0	0	0	107.9	L8 I12	L8-V10 HydrophobicContact CD2-CG2 4.4Å; L8-V10 PolarHBondContact O-N 2.96Å; L8-V10 VanDerWaalsContact O-N 3.14Å; V10-I12 HydrophobicContact CG1-CG1 4.14Å; V10-I12 PolarHBondContact O-N 3.31Å
11	L	29.8	Very low	32.1	Very low	153 Å²	153	137 Å²	137	80%	0.801	79%	0.789	S	S	*	*			trans	-73	101.7	163.3	-103	135.6	0	0	0	108	P9 I13	P9-L11 PolarHBondContact O-N 3.14Å; P9-L11 VanDerWaalsContact O-N 3.12Å; L11-I13 PolarHBondContact O-N 2.86Å; L11-I13 VanDerWaalsContact O-N 3.12Å
12	I	31.4	Very low	31.9	Very low	139 Å²	139	134.1 Å²	134.1	71%	0.713	77%	0.773	S	S	*	*			trans	-68.8	103.9	166.2	-64	177.6	0	0	0	107.2	V10 I14	V10-I12 HydrophobicContact CG1-CG1 4.14Å; V10-I12 PolarHBondContact O-N 3.31Å; I12-I14 HydrophobicContact CG2-CG1 4.11Å; I12-I14 PolarHBondContact O-N 3.23Å
13	I	33	Very low	32.1	Very low	148 Å²	148	135.3 Å²	135.3	76%	0.759	78%	0.775	S	S	*	*			trans	-71.2	102.6	166.4	-64.2	171.7	0	0	0	106.6	L11 A15	L11-I13 PolarHBondContact O-N 2.86Å; L11-I13 VanDerWaalsContact O-N 3.12Å; I13-A15 VanDerWaalsContact C-N 3.34Å; I13-A15 PolarHBondContact O-N 3.36Å; I13-A15 VanDerWaalsContact O-N 3.13Å
14	I	30.4	Very low	32.1	Very low	142 Å²	142	137.1 Å²	137.1	73%	0.728	78%	0.778	S	S	*	*			trans	-76.9	95.3	162.7	-61.1	178.1	0	0	0	106.2	I12 L16	I12-I14 HydrophobicContact CG2-CG1 4.11Å; I12-I14 PolarHBondContact O-N 3.23Å; I14-L16 PolarHBondContact O-N 2.82Å
15	A	29.4	Very low	32.3	Very low	78 Å²	78	142.1 Å²	142.1	65%	0.645	78%	0.778	S	S	*	*			trans	-64.8	117.1	166.9	0	0	0	0	0	108.4	I13 P17	I13-A15 VanDerWaalsContact C-N 3.34Å; I13-A15 PolarHBondContact O-N 3.36Å; I13-A15 VanDerWaalsContact O-N 3.13Å; A15-P17 WeakPolarHBondContact O-CD 3.44Å
16	L	29.3	Very low	32.5	Very low	160 Å²	160	142 Å²	142	84%	0.838	78%	0.78	S	S	*	*			trans	-81	115.8	166	-75.2	163.7	0	0	0	107.8	I14 S18	I14-L16 PolarHBondContact O-N 2.82Å; L16-S18 PolarHBondContact O-N 2.78Å
17	P	30.3	Very low	33.1	Very low	119 Å²	119	142.3 Å²	142.3	77%	0.773	78%	0.776	S	S	*	*			trans	-73.8	125.5	169.4	-7.6	25.3	0	0	0	109	A15	A15-P17 WeakPolarHBondContact O-CD 3.44Å
18	S	29.2	Very low	34	Very low	99 Å²	99	141 Å²	141	69%	0.692	78%	0.775	S	S	*	*			trans	-58	136.9	162.5	48.1	0	0	0	0	110.2	L16 S20	L16-S18 PolarHBondContact O-N 2.78Å; S18-S20 PolarHBondContact O-N 3.27Å; S18-S20 VanDerWaalsContact O-N 3.11Å
19	P	32.1	Very low	35.4	Very low	132 Å²	132	141.8 Å²	141.8	86%	0.857	78%	0.78	S	S	*	*			trans	-75.8	106.4	174.7	29.7	-29.5	0	0	0	109.1
20	S	29	Very low	37.1	Very low	102 Å²	102	139.5 Å²	139.5	71%	0.713	77%	0.765	S	S	*	*			trans	-69	134.6	160	46.5	0	0	0	0	109.1	S18 E22	S18-S20 PolarHBondContact O-N 3.27Å; S18-S20 VanDerWaalsContact O-N 3.11Å; S20-E22 PolarHBondContact O-N 3.39Å
21	M	35.1	Very low	39.4	Very low	179 Å²	179	141.3 Å²	141.3	88%	0.882	76%	0.764	S	S	*	*			trans	-58.4	126.8	162.3	-76.2	-175.9	66.9	0	0	109.1
22	E	31.7	Very low	42.1	Very low	185 Å²	185	137.3 Å²	137.3	86%	0.864	74%	0.743	S	S	*	*			trans	-155.1	122.5	151.5	-109.2	162.4	-155.2	0	0	108.6	S20	S20-E22 PolarHBondContact O-N 3.39Å
23	D	36.1	Very low	44.9	Very low	161 Å²	161	132.5 Å²	132.5	86%	0.861	72%	0.716	S	S	*	*			trans	-60	134.8	169.2	-92.2	-52.4	0	0	0	110.2
24	E	35.1	Very low	47.7	Very low	191 Å²	191	128 Å²	128	89%	0.893	69%	0.692	S	S	*	*			trans	-174.1	119	135.7	-106.8	175.7	-176.5	0	0	111.6
25	K	34.2	Very low	50.6	Low	183 Å²	183	121.2 Å²	121.2	80%	0.796	66%	0.658	S	S	*	*			trans	-83	149.9	166.4	-80.4	178.3	179.3	171.3	0	110.1
26	P	42.9	Very low	53.6	Low	119 Å²	119	118.1 Å²	118.1	77%	0.773	63%	0.631	S	S	*	*				-116.9	126.3	127	1.9	18	0	0	0	110.8	V28	P26-V28 PolarHBondContact O-N 3.44Å; P26-V28 VanDerWaalsContact O-N 3.14Å
27	K	44.2	Very low	56.5	Low	184 Å²	184	111.2 Å²	111.2	80%	0.8	60%	0.596	S	S	*	*			trans	-66.2	103.5	172.8	-73.9	174.1	174.9	176.5	0	110.1
28	V	54.8	Low	59.2	Low	129 Å²	129	110.5 Å²	110.5	78%	0.782	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-85.9	117.8	154.5	-178.4	0	0	0	0	106.2	P26 P30	P26-V28 PolarHBondContact O-N 3.44Å; P26-V28 VanDerWaalsContact O-N 3.14Å; V28-P30 WeakPolarHBondContact O-CD 3.34Å
29	N	59.3	Low	61.7	Low	148 Å²	148	107.8 Å²	107.8	79%	0.791	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-61	121.2	172.1	-85.6	-17.9	0	0	0	108.3	K31	N29-K31 PolarHBondContact O-N 2.73Å
30	P	70.8	Confident	63.4	Low	67 Å²	67	108.9 Å²	108.9	44%	0.435	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-66	133.2	179.6	26.2	-31.6	0	0	0	109.3	V28 L32 Q51	V28-P30 WeakPolarHBondContact O-CD 3.34Å; P30-L32 PolarHBondContact O-N 3.33Å; P30-Q51 HydrophobicContact CB-CG 4.14Å
31	K	79.6	Confident	65.2	Low	150 Å²	150	108.6 Å²	108.6	65%	0.652	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-66.6	119.6	175.3	-171.1	174.8	-179.5	-176.4	0	108.7	N29 Y33	N29-K31 PolarHBondContact O-N 2.73Å; K31-Y33 HydrophobicContact CD-CE1 3.98Å; K31-Y33 HydrophobicContact CG-CE1 4.14Å
32	L	87.1	Confident	66.9	Low	68 Å²	68	100.9 Å²	100.9	36%	0.356	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-92	149.1	175.2	-63.5	170.4	0	0	0	109.7	P30 E49 Q51	P30-L32 PolarHBondContact O-N 3.33Å; L32-E49 HydrophobicContact CB-CG 3.78Å; L32-E49 WeakPolarHBondContact CB-OE1 3.36Å; L32-E49 HydrophobicContact CD1-CG 4.14Å; L32-E49 WeakPolarHBondContact CD1-OE1 3.38Å; L32-E49 HydrophobicContact CG-CG 4.43Å; L32-Q51 HydrophobicContact CD2-CG 3.78Å
33	Y	89.6	Confident	68.7	Low	38 Å²	38	95.5 Å²	95.5	15%	0.149	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	144.6	178.1	-57.4	-68	0	0	0	109.9	K31 E49 G50 Q51 Q95 G96 D97	K31-Y33 HydrophobicContact CD-CE1 3.98Å; K31-Y33 HydrophobicContact CG-CE1 4.14Å; Y33-E49 WeakPolarHBondContact O-CA 3.42Å; Y33-G50 PolarHBondContact N-O 3.34Å; Y33-G50 PolarHBondContact O-N 2.77Å; Y33-Q51 WeakPolarHBondContact CD2-O 3.17Å; Y33-Q95 HydrophobicContact CE2-CB 4Å; Y33-Q95 HydrophobicContact CE2-CG 4.44Å; Y33-G96 VanDerWaalsContact CD1-CA 3.43Å; Y33-D97 VanDerWaalsContact CA-OD1 3.26Å; Y33-D97 WeakPolarHBondContact CA-OD1 3.49Å
34	M	91.4	Very high	70.1	Confident	53 Å²	53	96 Å²	96	26%	0.261	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	132.1	169.4	-64.1	-61.1	-68.9	0	0	109.7	H47 E49 D97 W98	M34-H47 HydrophobicContact CE-CB 4.44Å; M34-H47 WeakPolarHBondContact CE-CD2 3.2Å; M34-E49 HydrophobicContact SD-CB 3.94Å; M34-E49 HydrophobicContact SD-CG 4.16Å; M34-D97 PolarHBondContact N-OD1 3.34Å; M34-D97 CarbonylContact O-C 3.54Å; M34-D97 WeakPolarHBondContact O-CA 3.48Å; M34-W98 HydrophobicContact CB-CD2 4.41Å; M34-W98 HydrophobicContact CB-CZ2 3.99Å; M34-W98 HydrophobicContact CE-CZ2 4.38Å; M34-W98 PolarHBondContact O-N 3.21Å
35	C	92.1	Very high	72.2	Confident	0 Å²	0	93.2 Å²	93.2	0%	0	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	151	-178.4	-55.1	0	0	0	0	110.4	H47 C48 C53 C70	C35-H47 CarbonylContact O-C 3.59Å; C35-H47 VanDerWaalsContact O-CA 3.24Å; C35-H47 WeakPolarHBondContact O-CA 3.5Å; C35-C48 PolarHBondContact N-O 3.45Å; C35-C48 PolarHBondContact O-N 2.8Å; C35-C53 HydrophobicContact CB-CB 3.69Å; C35-C53 WeakPolarHBondContact CB-SG 3.43Å; C35-C53 WeakPolarHBondContact SG-CA 3.22Å; C35-C53 WeakPolarHBondContact SG-CB 3.21Å; C35-C53 CovalentContact SG-SG 2.02Å; C35-C53 PolarHBondContact SG-SG 3.44Å; C35-C70 HydrophobicContact CB-CB 3.9Å; C35-C70 VanDerWaalsContact SG-CB 3.52Å
36	V	91.4	Very high	74.6	Confident	14 Å²	14	90.8 Å²	90.8	9%	0.085	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	131.8	167.4	178.6	0	0	0	0	108.6	E38 K68 G69 W98 N100 R101	V36-E38 HydrophobicContact CG1-CG 3.88Å; V36-K68 HydrophobicContact CB-CD 4.47Å; V36-K68 HydrophobicContact CG1-CD 4.17Å; V36-K68 CarbonylContact O-C 3.58Å; V36-K68 WeakPolarHBondContact O-CB 3.36Å; V36-G69 PolarHBondContact O-N 3.49Å; V36-W98 HydrophobicContact CG2-CE3 3.74Å; V36-W98 HydrophobicContact CG2-CZ3 4.25Å; V36-N100 PolarHBondContact N-OD1 2.94Å; V36-N100 PolarHBondContact O-ND2 3.17Å; V36-R101 HydrophobicContact CG2-CB 3.9Å; V36-R101 HydrophobicContact CG2-CG 4.23Å
37	C	90.2	Very high	76.8	Confident	15 Å²	15	89 Å²	89	10%	0.101	49%	0.49	C	S	.	.			trans	-114.6	115.6	175.6	-148.1	0	0	0	0	109.4	C42 D46 C48 K68	C37-C42 WeakPolarHBondContact CA-SG 3.34Å; C37-C42 HydrophobicContact CB-CB 3.66Å; C37-C42 WeakPolarHBondContact CB-SG 3.43Å; C37-C42 WeakPolarHBondContact SG-CB 3.32Å; C37-C42 CovalentContact SG-SG 2.02Å; C37-C42 PolarHBondContact SG-SG 2.86Å; C37-D46 PolarHBondContact N-O 3.44Å; C37-D46 VanDerWaalsContact N-O 3.09Å; C37-C48 HydrophobicContact CB-CB 4.25Å; C37-K68 WeakPolarHBondContact CA-O 3.38Å
38	E	87.7	Confident	79	Confident	103 Å²	103	81.3 Å²	81.3	48%	0.481	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-136.2	128.9	179.8	-73.3	169.4	-179.7	0	0	108.8	V36 C42 Q67 K68	V36-E38 HydrophobicContact CG1-CG 3.88Å; E38-C42 PolarHBondContact N-SG 3.47Å; E38-Q67 CarbonylContact O-C 3.53Å; E38-Q67 VanDerWaalsContact O-CA 3.29Å; E38-Q67 WeakPolarHBondContact O-CA 3.29Å; E38-K68 HydrophobicContact CB-CB 4.21Å; E38-K68 PolarHBondContact N-O 3.23Å; E38-K68 PolarHBondContact O-N 2.85Å; E38-K68 WeakPolarHBondContact OE2-CD 3.43Å; E38-K68 WeakPolarHBondContact OE2-CE 3.32Å; E38-K68 IonicContact OE2-NZ 3.89Å; E38-K68 PolarHBondContact OE2-NZ 2.82Å
39	G	80.6	Confident	80.7	Confident	42 Å²	42	80.1 Å²	80.1	43%	0.433	45%	0.445	S	S	.	.	S	Bend	trans	117.1	-175.3	175.7	0	0	0	0	0	114.6	S41 C42	G39-S41 PolarHBondContact O-N 3.28Å; G39-C42 PolarHBondContact O-N 2.89Å; G39-C42 VanDerWaalsContact O-N 3.14Å
40	L	68.9	Low	82.1	Confident	156 Å²	156	73.1 Å²	73.1	82%	0.817	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.5	-171.2	-73.9	120.9	0	0	0	114.9	C42 V65	L40-C42 VanDerWaalsContact C-N 3.35Å; L40-V65 HydrophobicContact CD1-CG1 4.4Å
41	S	65.8	Low	83	Confident	96 Å²	96	71.9 Å²	71.9	67%	0.671	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-5	-177.3	-54.7	0	0	0	0	114	G39	G39-S41 PolarHBondContact O-N 3.28Å
42	C	70.9	Confident	83.5	Confident	17 Å²	17	65.7 Å²	65.7	12%	0.115	37%	0.369	C	S	.	.	S	Bend	trans	-103.7	-1.5	-168.7	-63.7	0	0	0	0	115.5	C37 E38 G39 L40 N44 E45 K68	C37-C42 WeakPolarHBondContact CA-SG 3.34Å; C37-C42 HydrophobicContact CB-CB 3.66Å; C37-C42 WeakPolarHBondContact CB-SG 3.43Å; C37-C42 WeakPolarHBondContact SG-CB 3.32Å; C37-C42 CovalentContact SG-SG 2.02Å; C37-C42 PolarHBondContact SG-SG 2.86Å; E38-C42 PolarHBondContact N-SG 3.47Å; G39-C42 PolarHBondContact O-N 2.89Å; G39-C42 VanDerWaalsContact O-N 3.14Å; L40-C42 VanDerWaalsContact C-N 3.35Å; C42-N44 PolarHBondContact O-N 3.08Å; C42-E45 PolarHBondContact O-N 3.33Å; C42-K68 PolarHBondContact SG-O 2.94Å; C42-K68 VanDerWaalsContact SG-O 3.34Å
43	G	69.3	Low	83.7	Confident	72 Å²	72	62.5 Å²	62.5	74%	0.742	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	-133.2	-179	0	0	0	0	0	112.8
44	N	67.1	Low	83.9	Confident	171 Å²	171	62.1 Å²	62.1	91%	0.914	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	8.4	176.9	-76.2	-9.1	0	0	0	113.4	C42	C42-N44 PolarHBondContact O-N 3.08Å
45	E	78.8	Confident	83.9	Confident	132 Å²	132	59.7 Å²	59.7	62%	0.617	34%	0.34	S	S	*	.			trans	-103.5	128.5	-176.9	-66.7	-176.4	175.2	0	0	110.8	C42 H47	C42-E45 PolarHBondContact O-N 3.33Å; E45-H47 PolarHBondContact O-N 3.36Å
46	D	84.3	Confident	83.9	Confident	133 Å²	133	60 Å²	60	71%	0.711	34%	0.343	S	S	*	.	S	Bend	trans	-79.9	0.3	-179.8	-60.1	-28.3	0	0	0	113	C37	C37-D46 PolarHBondContact N-O 3.44Å; C37-D46 VanDerWaalsContact N-O 3.09Å
47	H	89.6	Confident	83.8	Confident	82 Å²	82	59.7 Å²	59.7	38%	0.38	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	157.5	-175.1	62.7	-88.1	0	0	0	112.2	M34 C35 E45 W98	M34-H47 HydrophobicContact CE-CB 4.44Å; M34-H47 WeakPolarHBondContact CE-CD2 3.2Å; C35-H47 CarbonylContact O-C 3.59Å; C35-H47 VanDerWaalsContact O-CA 3.24Å; C35-H47 WeakPolarHBondContact O-CA 3.5Å; E45-H47 PolarHBondContact O-N 3.36Å; H47-W98 HydrophobicContact CB-CH2 3.41Å; H47-W98 VanDerWaalsContact CB-CH2 3.41Å; H47-W98 HydrophobicContact CB-CZ3 3.63Å
48	C	89.7	Confident	83.7	Confident	22 Å²	22	60.2 Å²	60.2	15%	0.149	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	154	173.9	75.9	0	0	0	0	111.6	C35 C37 C70	C35-C48 PolarHBondContact N-O 3.45Å; C35-C48 PolarHBondContact O-N 2.8Å; C37-C48 HydrophobicContact CB-CB 4.25Å; C48-C70 HydrophobicContact CB-CB 4.44Å; C48-C70 WeakPolarHBondContact CB-SG 3.21Å; C48-C70 WeakPolarHBondContact SG-CB 3.4Å; C48-C70 PolarHBondContact SG-N 2.84Å; C48-C70 CovalentContact SG-SG 2.04Å; C48-C70 PolarHBondContact SG-SG 3.44Å
49	E	90.4	Very high	83.5	Confident	104 Å²	104	58.7 Å²	58.7	49%	0.486	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	127.9	-179.5	-175.2	178.3	-165.7	0	0	110.7	L32 Y33 M34 Q72	L32-E49 HydrophobicContact CB-CG 3.78Å; L32-E49 WeakPolarHBondContact CB-OE1 3.36Å; L32-E49 HydrophobicContact CD1-CG 4.14Å; L32-E49 WeakPolarHBondContact CD1-OE1 3.38Å; L32-E49 HydrophobicContact CG-CG 4.43Å; Y33-E49 WeakPolarHBondContact O-CA 3.42Å; M34-E49 HydrophobicContact SD-CB 3.94Å; M34-E49 HydrophobicContact SD-CG 4.16Å; E49-Q72 PolarHBondContact O-NE2 3.34Å; E49-Q72 PolarHBondContact O-OE1 3.3Å
50	G	88.7	Confident	83.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	176.8	178.9	0	0	0	0	0	114	Y33 Q52 F71	Y33-G50 PolarHBondContact N-O 3.34Å; Y33-G50 PolarHBondContact O-N 2.77Å; G50-Q52 VanDerWaalsContact C-N 3.3Å; G50-Q52 PolarHBondContact O-N 3.29Å; G50-F71 CarbonylContact C-O 3.56Å
51	Q	89.6	Confident	83.8	Confident	42 Å²	42	61.3 Å²	61.3	20%	0.196	34%	0.343	C	S	.	.	S	Bend	trans	-77.6	-16	-177.6	-64.4	-176.4	47.4	0	0	113.3	P30 L32 Y33 F71 Q72	P30-Q51 HydrophobicContact CB-CG 4.14Å; L32-Q51 HydrophobicContact CD2-CG 3.78Å; Y33-Q51 WeakPolarHBondContact CD2-O 3.17Å; Q51-F71 PolarHBondContact N-O 3.04Å; Q51-Q72 PolarHBondContact NE2-O 3.48Å
52	Q	90.4	Very high	84.2	Confident	20 Å²	20	59.7 Å²	59.7	9%	0.093	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	138.2	-179.2	-167.7	171.6	8.5	0	0	110.5	G50 C70 F71 C93 C94 Q95	G50-Q52 VanDerWaalsContact C-N 3.3Å; G50-Q52 PolarHBondContact O-N 3.29Å; Q52-C70 CarbonylContact O-C 3.56Å; Q52-C70 VanDerWaalsContact O-CA 3.28Å; Q52-C70 WeakPolarHBondContact O-CA 3.43Å; Q52-F71 HydrophobicContact CB-CD2 4.49Å; Q52-F71 PolarHBondContact O-N 3.38Å; Q52-C93 HydrophobicContact CG-CB 4.29Å; Q52-C94 VanDerWaalsContact CG-O 3.29Å; Q52-C94 WeakPolarHBondContact CG-O 3.38Å; Q52-Q95 HydrophobicContact CG-CG 4.07Å
53	C	91.9	Very high	84.6	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	154	175.3	-47.9	0	0	0	0	111.1	C35 G69 C93 C94 N100	C35-C53 HydrophobicContact CB-CB 3.69Å; C35-C53 WeakPolarHBondContact CB-SG 3.43Å; C35-C53 WeakPolarHBondContact SG-CA 3.22Å; C35-C53 WeakPolarHBondContact SG-CB 3.21Å; C35-C53 CovalentContact SG-SG 2.02Å; C35-C53 PolarHBondContact SG-SG 3.44Å; C53-G69 CarbonylContact C-O 3.55Å; C53-G69 WeakPolarHBondContact CA-O 3.31Å; C53-C93 VanDerWaalsContact O-CA 3.26Å; C53-C93 WeakPolarHBondContact O-CA 3.49Å; C53-C93 WeakPolarHBondContact O-CB 3.47Å; C53-C94 PolarHBondContact N-O 3.12Å; C53-C94 PolarHBondContact O-N 3.07Å; C53-N100 HydrophobicContact CB-CB 3.79Å
54	F	92.4	Very high	85.3	Confident	30 Å²	30	68.2 Å²	68.2	13%	0.132	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	159	173.4	74.4	-92.1	0	0	0	113	Q67 K68 G69 F71 V91 E92 N100	F54-Q67 HydrophobicContact CE2-CB 4.43Å; F54-K68 WeakPolarHBondContact O-CA 3.47Å; F54-G69 VanDerWaalsContact CD1-C 3.41Å; F54-G69 WeakPolarHBondContact CD1-O 3.33Å; F54-G69 PolarHBondContact N-O 3.06Å; F54-G69 PolarHBondContact O-N 3.33Å; F54-F71 HydrophobicContact CB-CE2 3.79Å; F54-F71 HydrophobicContact CB-CZ 4.38Å; F54-F71 HydrophobicContact CD1-CD2 4.07Å; F54-F71 HydrophobicContact CD1-CE1 4.36Å; F54-F71 AromaticContact CD1-CE2 3.67Å; F54-F71 HydrophobicContact CD1-CE2 3.67Å; F54-F71 AromaticContact CD1-CZ 3.81Å; F54-F71 HydrophobicContact CD1-CZ 3.81Å; F54-F71 HydrophobicContact CE1-CZ 4.37Å; F54-F71 AromaticContact CG-CE2 3.97Å; F54-F71 HydrophobicContact CG-CE2 3.97Å; F54-F71 HydrophobicContact CG-CZ 4.17Å; F54-V91 HydrophobicContact CB-CG1 4.35Å; F54-E92 CarbonylContact C-O 3.54Å; F54-E92 VanDerWaalsContact CA-O 3.3Å; F54-E92 WeakPolarHBondContact CA-O 3.34Å; F54-N100 PolarHBondContact O-ND2 3.12Å
55	S	92.2	Very high	86.2	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.021	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	131.1	161.9	177.5	0	0	0	0	107.9	Q67 E92 I103 A105	S55-Q67 CarbonylContact C-O 3.53Å; S55-Q67 WeakPolarHBondContact CA-O 3.4Å; S55-E92 PolarHBondContact N-O 3.24Å; S55-E92 PolarHBondContact O-N 3.01Å; S55-I103 PolarHBondContact OG-O 3.44Å; S55-A105 PolarHBondContact OG-N 3.44Å
56	S	91.3	Very high	86.6	Confident	7 Å²	7	61.4 Å²	61.4	5%	0.049	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	151.3	179.7	62.9	0	0	0	0	112	Y66 Q67 A90	S56-Y66 WeakPolarHBondContact O-CA 3.35Å; S56-Q67 PolarHBondContact N-O 2.98Å; S56-Q67 PolarHBondContact O-N 3.42Å; S56-A90 VanDerWaalsContact CA-O 3.29Å; S56-A90 WeakPolarHBondContact CA-O 3.32Å
57	L	89.3	Confident	86.9	Confident	6 Å²	6	57.2 Å²	57.2	3%	0.031	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	120	171.9	172.1	56.5	0	0	0	107.7	H64 V65 Y66 Q89 A90 A105 L107	L57-H64 HydrophobicContact CD1-CB 3.94Å; L57-V65 WeakPolarHBondContact CA-O 3.29Å; L57-Y66 HydrophobicContact CB-CD1 4.35Å; L57-Y66 HydrophobicContact CB-CE1 4.26Å; L57-Y66 HydrophobicContact CD1-CD1 3.92Å; L57-Y66 HydrophobicContact CD1-CD2 4.13Å; L57-Y66 HydrophobicContact CD1-CE1 3.62Å; L57-Y66 HydrophobicContact CD1-CE2 3.84Å; L57-Y66 HydrophobicContact CD1-CG 4.16Å; L57-Y66 HydrophobicContact CD2-CE1 3.89Å; L57-Y66 HydrophobicContact CG-CE1 4.13Å; L57-Q89 CarbonylContact O-C 3.58Å; L57-Q89 VanDerWaalsContact O-CA 3.3Å; L57-Q89 WeakPolarHBondContact O-CA 3.46Å; L57-A90 PolarHBondContact N-O 3.49Å; L57-A90 PolarHBondContact O-N 3.43Å; L57-A105 HydrophobicContact CB-CB 4.05Å; L57-A105 WeakPolarHBondContact CD2-O 3.2Å; L57-L107 HydrophobicContact CD2-CD1 4.18Å; L57-L107 HydrophobicContact CD2-CG 3.85Å; L57-L107 HydrophobicContact CG-CD1 4.36Å; L57-L107 HydrophobicContact CG-CG 4.14Å
58	S	88.6	Confident	87	Confident	26 Å²	26	54.5 Å²	54.5	18%	0.182	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	155.8	174.6	60.3	0	0	0	0	111.5	V65 G88	S58-V65 PolarHBondContact N-O 3.03Å; S58-V65 PolarHBondContact O-N 2.96Å; S58-G88 WeakPolarHBondContact CA-O 3.45Å
59	I	84.9	Confident	87.1	Confident	71 Å²	71	53.6 Å²	53.6	36%	0.364	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	115.8	172.5	-57.6	177.8	0	0	0	107.9	F63 G88 L107	I59-F63 WeakPolarHBondContact CA-O 3.32Å; I59-G88 PolarHBondContact N-O 3.06Å; I59-L107 HydrophobicContact CD1-CD1 3.77Å; I59-L107 HydrophobicContact CG1-CD1 3.98Å
60	N	78.9	Confident	87.1	Confident	103 Å²	103	49.7 Å²	49.7	55%	0.551	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	123.9	174.6	-159	15.7	0	0	0	109.3	G62 F63 V65	N60-G62 PolarHBondContact O-N 3.28Å; N60-F63 PolarHBondContact N-O 3.43Å; N60-F63 PolarHBondContact O-N 2.99Å; N60-V65 HydrophobicContact CB-CG2 4.01Å
61	D	75.5	Confident	87.1	Confident	151 Å²	151	50.6 Å²	50.6	81%	0.807	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	33.9	-174.9	-62.6	-35.9	0	0	0	114.8	F63	D61-F63 VanDerWaalsContact C-N 3.34Å; D61-F63 WeakPolarHBondContact O-CD2 3.41Å
62	G	74.3	Confident	86.8	Confident	62 Å²	62	54.1 Å²	54.1	64%	0.639	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	-3.2	-179.5	0	0	0	0	0	115.4	N60	N60-G62 PolarHBondContact O-N 3.28Å
63	F	78.9	Confident	86.3	Confident	159 Å²	159	57 Å²	57	70%	0.697	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	141.5	176.5	-64.4	-84	0	0	0	111.9	I59 N60 D61 V65	I59-F63 WeakPolarHBondContact CA-O 3.32Å; N60-F63 PolarHBondContact N-O 3.43Å; N60-F63 PolarHBondContact O-N 2.99Å; D61-F63 VanDerWaalsContact C-N 3.34Å; D61-F63 WeakPolarHBondContact O-CD2 3.41Å; F63-V65 PolarHBondContact O-N 3.35Å
64	H	84.5	Confident	85.5	Confident	109 Å²	109	61.8 Å²	61.8	51%	0.505	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	121	174.7	-73.3	-157.2	0	0	0	109.7	L57 Y66	L57-H64 HydrophobicContact CD1-CB 3.94Å; H64-Y66 HydrophobicContact CB-CE2 3.97Å
65	V	86.3	Confident	84.7	Confident	33 Å²	33	65.4 Å²	65.4	20%	0.2	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	112.8	176.5	-174.5	0	0	0	0	108.3	L40 L57 S58 N60 F63 Q67	L40-V65 HydrophobicContact CD1-CG1 4.4Å; L57-V65 WeakPolarHBondContact CA-O 3.29Å; S58-V65 PolarHBondContact N-O 3.03Å; S58-V65 PolarHBondContact O-N 2.96Å; N60-V65 HydrophobicContact CB-CG2 4.01Å; F63-V65 PolarHBondContact O-N 3.35Å; V65-Q67 HydrophobicContact CG1-CG 4.09Å
66	Y	87.9	Confident	83.8	Confident	127 Å²	127	70.4 Å²	70.4	50%	0.498	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	132.9	173.9	-68.3	-90.3	0	0	0	109.5	S56 L57 H64 T104	S56-Y66 WeakPolarHBondContact O-CA 3.35Å; L57-Y66 HydrophobicContact CB-CD1 4.35Å; L57-Y66 HydrophobicContact CB-CE1 4.26Å; L57-Y66 HydrophobicContact CD1-CD1 3.92Å; L57-Y66 HydrophobicContact CD1-CD2 4.13Å; L57-Y66 HydrophobicContact CD1-CE1 3.62Å; L57-Y66 HydrophobicContact CD1-CE2 3.84Å; L57-Y66 HydrophobicContact CD1-CG 4.16Å; L57-Y66 HydrophobicContact CD2-CE1 3.89Å; L57-Y66 HydrophobicContact CG-CE1 4.13Å; H64-Y66 HydrophobicContact CB-CE2 3.97Å; Y66-T104 HydrophobicContact CD1-CG2 4.35Å; Y66-T104 HydrophobicContact CE1-CG2 4.05Å
67	Q	89.9	Confident	83.1	Confident	44 Å²	44	70 Å²	70	21%	0.206	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	147.7	175.6	-61.6	-177.3	-30.3	0	0	111.6	E38 F54 S55 S56 V65	E38-Q67 CarbonylContact O-C 3.53Å; E38-Q67 VanDerWaalsContact O-CA 3.29Å; E38-Q67 WeakPolarHBondContact O-CA 3.29Å; F54-Q67 HydrophobicContact CE2-CB 4.43Å; S55-Q67 CarbonylContact C-O 3.53Å; S55-Q67 WeakPolarHBondContact CA-O 3.4Å; S56-Q67 PolarHBondContact N-O 2.98Å; S56-Q67 PolarHBondContact O-N 3.42Å; V65-Q67 HydrophobicContact CG1-CG 4.09Å
68	K	91.8	Very high	82.5	Confident	26 Å²	26	73.2 Å²	73.2	11%	0.113	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145.8	170.2	-65	-176.9	-173.6	161.2	0	109.3	V36 C37 E38 C42 F54 R101 I103	V36-K68 HydrophobicContact CB-CD 4.47Å; V36-K68 HydrophobicContact CG1-CD 4.17Å; V36-K68 CarbonylContact O-C 3.58Å; V36-K68 WeakPolarHBondContact O-CB 3.36Å; C37-K68 WeakPolarHBondContact CA-O 3.38Å; E38-K68 HydrophobicContact CB-CB 4.21Å; E38-K68 PolarHBondContact N-O 3.23Å; E38-K68 PolarHBondContact O-N 2.85Å; E38-K68 WeakPolarHBondContact OE2-CD 3.43Å; E38-K68 WeakPolarHBondContact OE2-CE 3.32Å; E38-K68 IonicContact OE2-NZ 3.89Å; E38-K68 PolarHBondContact OE2-NZ 2.82Å; C42-K68 PolarHBondContact SG-O 2.94Å; C42-K68 VanDerWaalsContact SG-O 3.34Å; F54-K68 WeakPolarHBondContact O-CA 3.47Å; K68-R101 PolarHBondContact NZ-O 3.13Å; K68-I103 WeakPolarHBondContact CE-O 3.17Å
69	G	91.1	Very high	82	Confident	3 Å²	3	78.8 Å²	78.8	3%	0.031	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.4	-157.9	177.6	0	0	0	0	0	112.4	V36 C53 F54	V36-G69 PolarHBondContact O-N 3.49Å; C53-G69 CarbonylContact C-O 3.55Å; C53-G69 WeakPolarHBondContact CA-O 3.31Å; F54-G69 VanDerWaalsContact CD1-C 3.41Å; F54-G69 WeakPolarHBondContact CD1-O 3.33Å; F54-G69 PolarHBondContact N-O 3.06Å; F54-G69 PolarHBondContact O-N 3.33Å
70	C	90.3	Very high	81.8	Confident	22 Å²	22	77.6 Å²	77.6	15%	0.149	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	147.7	-174.7	54.6	0	0	0	0	112.1	C35 C48 Q52	C35-C70 HydrophobicContact CB-CB 3.9Å; C35-C70 VanDerWaalsContact SG-CB 3.52Å; C48-C70 HydrophobicContact CB-CB 4.44Å; C48-C70 WeakPolarHBondContact CB-SG 3.21Å; C48-C70 WeakPolarHBondContact SG-CB 3.4Å; C48-C70 PolarHBondContact SG-N 2.84Å; C48-C70 CovalentContact SG-SG 2.04Å; C48-C70 PolarHBondContact SG-SG 3.44Å; Q52-C70 CarbonylContact O-C 3.56Å; Q52-C70 VanDerWaalsContact O-CA 3.28Å; Q52-C70 WeakPolarHBondContact O-CA 3.43Å
71	F	89.4	Confident	81.9	Confident	19 Å²	19	74.3 Å²	74.3	8%	0.083	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	124.1	171.1	-65.3	-68.9	0	0	0	110.2	G50 Q51 Q52 F54 V73 Q76 G77 T80	G50-F71 CarbonylContact C-O 3.56Å; Q51-F71 PolarHBondContact N-O 3.04Å; Q52-F71 HydrophobicContact CB-CD2 4.49Å; Q52-F71 PolarHBondContact O-N 3.38Å; F54-F71 HydrophobicContact CB-CE2 3.79Å; F54-F71 HydrophobicContact CB-CZ 4.38Å; F54-F71 HydrophobicContact CD1-CD2 4.07Å; F54-F71 HydrophobicContact CD1-CE1 4.36Å; F54-F71 AromaticContact CD1-CE2 3.67Å; F54-F71 HydrophobicContact CD1-CE2 3.67Å; F54-F71 AromaticContact CD1-CZ 3.81Å; F54-F71 HydrophobicContact CD1-CZ 3.81Å; F54-F71 HydrophobicContact CE1-CZ 4.37Å; F54-F71 AromaticContact CG-CE2 3.97Å; F54-F71 HydrophobicContact CG-CE2 3.97Å; F54-F71 HydrophobicContact CG-CZ 4.17Å; F71-V73 VanDerWaalsContact C-N 3.29Å; F71-V73 PolarHBondContact O-N 2.92Å; F71-Q76 HydrophobicContact CD1-CB 4.41Å; F71-Q76 HydrophobicContact CD1-CG 4.01Å; F71-Q76 HydrophobicContact CE1-CG 4.33Å; F71-G77 VanDerWaalsContact CD2-CA 3.41Å; F71-T80 HydrophobicContact CZ-CG2 3.99Å
72	Q	83.4	Confident	82.1	Confident	115 Å²	115	74.6 Å²	74.6	54%	0.537	37%	0.369	S	S	.	.	S	Bend	trans	-68.1	-29.9	176.3	-66.9	-62.8	-21.6	0	0	112.4	E49 Q51	E49-Q72 PolarHBondContact O-NE2 3.34Å; E49-Q72 PolarHBondContact O-OE1 3.3Å; Q51-Q72 PolarHBondContact NE2-O 3.48Å
73	V	80.6	Confident	82.3	Confident	80 Å²	80	75.8 Å²	75.8	49%	0.485	36%	0.364	S	S	.	.	S	Bend	trans	-121.2	126.1	-177.2	-177.9	0	0	0	0	110.1	F71 E75 Q76 G77	F71-V73 VanDerWaalsContact C-N 3.29Å; F71-V73 PolarHBondContact O-N 2.92Å; V73-E75 VanDerWaalsContact C-N 3.34Å; V73-E75 PolarHBondContact O-N 3.34Å; V73-Q76 HydrophobicContact CB-CB 4.46Å; V73-Q76 WeakPolarHBondContact O-CB 3.37Å; V73-Q76 PolarHBondContact O-N 2.9Å; V73-Q76 VanDerWaalsContact O-N 3.12Å; V73-G77 PolarHBondContact O-N 3.46Å
74	Y	73.4	Confident	82.3	Confident	101 Å²	101	73.1 Å²	73.1	40%	0.396	36%	0.363	S	S	.	.	H	α-helix	trans	-56.1	-40.8	-178.1	179.7	-106.6	0	0	0	114.3	Q76 G77 K78	Y74-Q76 VanDerWaalsContact C-N 3.29Å; Y74-Q76 PolarHBondContact O-N 3.46Å; Y74-G77 PolarHBondContact O-N 3.27Å; Y74-K78 HydrophobicContact CE1-CD 4.25Å; Y74-K78 WeakPolarHBondContact O-CB 3.38Å; Y74-K78 PolarHBondContact O-N 2.93Å
75	E	75.9	Confident	82.2	Confident	106 Å²	106	71.8 Å²	71.8	50%	0.495	36%	0.364	S	S	.	.	H	α-helix	trans	-64.5	-31.8	179.4	-73.1	-64.2	153.2	0	0	112.7	V73 K78 M79	V73-E75 VanDerWaalsContact C-N 3.34Å; V73-E75 PolarHBondContact O-N 3.34Å; E75-K78 PolarHBondContact O-N 3.29Å; E75-K78 IonicContact OE1-NZ 3.56Å; E75-K78 PolarHBondContact OE1-NZ 2.96Å; E75-K78 WeakPolarHBondContact OE2-CD 3.31Å; E75-K78 IonicContact OE2-NZ 3.74Å; E75-M79 WeakPolarHBondContact O-CG 3.46Å; E75-M79 PolarHBondContact O-N 2.9Å; E75-M79 VanDerWaalsContact O-N 3.12Å
76	Q	74.1	Confident	81.9	Confident	108 Å²	108	72.6 Å²	72.6	51%	0.505	37%	0.371	S	S	.	.	H	α-helix	trans	-68.4	-40.7	174.8	-170.3	-180	4.6	0	0	111.5	F71 V73 Y74 T80	F71-Q76 HydrophobicContact CD1-CB 4.41Å; F71-Q76 HydrophobicContact CD1-CG 4.01Å; F71-Q76 HydrophobicContact CE1-CG 4.33Å; V73-Q76 HydrophobicContact CB-CB 4.46Å; V73-Q76 WeakPolarHBondContact O-CB 3.37Å; V73-Q76 PolarHBondContact O-N 2.9Å; V73-Q76 VanDerWaalsContact O-N 3.12Å; Y74-Q76 VanDerWaalsContact C-N 3.29Å; Y74-Q76 PolarHBondContact O-N 3.46Å; Q76-T80 PolarHBondContact O-N 3.39Å; Q76-T80 PolarHBondContact O-OG1 3.34Å
77	G	75.6	Confident	81.5	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-60.6	-48.6	170.9	0	0	0	0	0	111.1	F71 V73 Y74 M79 T80 C81	F71-G77 VanDerWaalsContact CD2-CA 3.41Å; V73-G77 PolarHBondContact O-N 3.46Å; Y74-G77 PolarHBondContact O-N 3.27Å; G77-M79 VanDerWaalsContact C-N 3.31Å; G77-M79 PolarHBondContact O-N 3.47Å; G77-T80 PolarHBondContact O-N 3.33Å; G77-T80 VanDerWaalsContact O-N 3.11Å; G77-C81 VanDerWaalsContact O-CB 3.23Å; G77-C81 WeakPolarHBondContact O-CB 3.19Å; G77-C81 PolarHBondContact O-N 2.88Å; G77-C81 PolarHBondContact O-SG 3.4Å
78	K	77.1	Confident	81	Confident	72 Å²	72	71.3 Å²	71.3	31%	0.313	39%	0.388	S	S	.	.	H	α-helix	trans	-58.6	-37	-178.6	-168.6	-177.6	175.2	-169.4	0	113.9	Y74 E75 K82	Y74-K78 HydrophobicContact CE1-CD 4.25Å; Y74-K78 WeakPolarHBondContact O-CB 3.38Å; Y74-K78 PolarHBondContact O-N 2.93Å; E75-K78 PolarHBondContact O-N 3.29Å; E75-K78 IonicContact OE1-NZ 3.56Å; E75-K78 PolarHBondContact OE1-NZ 2.96Å; E75-K78 WeakPolarHBondContact OE2-CD 3.31Å; E75-K78 IonicContact OE2-NZ 3.74Å; K78-K82 HydrophobicContact CG-CD 4.16Å; K78-K82 VanDerWaalsContact O-CB 3.25Å; K78-K82 WeakPolarHBondContact O-CB 3.23Å; K78-K82 WeakPolarHBondContact O-CG 3.29Å; K78-K82 PolarHBondContact O-N 2.83Å
79	M	78.1	Confident	80.8	Confident	144 Å²	144	75 Å²	75	71%	0.709	41%	0.405	S	S	*	.	H	α-helix	trans	-70.9	-43.1	175.5	-64.5	-142.8	-63.8	0	0	111.9	E75 G77 T83	E75-M79 WeakPolarHBondContact O-CG 3.46Å; E75-M79 PolarHBondContact O-N 2.9Å; E75-M79 VanDerWaalsContact O-N 3.12Å; G77-M79 VanDerWaalsContact C-N 3.31Å; G77-M79 PolarHBondContact O-N 3.47Å; M79-T83 PolarHBondContact O-OG1 2.83Å
80	T	80.3	Confident	80.6	Confident	46 Å²	46	75 Å²	75	28%	0.282	41%	0.405	S	S	.	.	H	α-helix	trans	-72.2	-46.7	-177.3	-44.3	0	0	0	0	111.6	F71 Q76 G77 K82 T83 V91	F71-T80 HydrophobicContact CZ-CG2 3.99Å; Q76-T80 PolarHBondContact O-N 3.39Å; Q76-T80 PolarHBondContact O-OG1 3.34Å; G77-T80 PolarHBondContact O-N 3.33Å; G77-T80 VanDerWaalsContact O-N 3.11Å; T80-K82 VanDerWaalsContact C-N 3.29Å; T80-K82 PolarHBondContact O-N 2.88Å; T80-T83 WeakPolarHBondContact O-CB 3.48Å; T80-T83 PolarHBondContact O-N 3.47Å; T80-T83 PolarHBondContact O-OG1 2.79Å; T80-V91 HydrophobicContact CG2-CG1 4.15Å; T80-V91 HydrophobicContact CG2-CG2 4.28Å
81	C	81.1	Confident	80.6	Confident	34 Å²	34	75.2 Å²	75.2	23%	0.23	41%	0.406	C	S	.	.	H	α-helix	trans	-72.9	-17.6	-176	-51.9	0	0	0	0	113.9	G77 C93	G77-C81 VanDerWaalsContact O-CB 3.23Å; G77-C81 WeakPolarHBondContact O-CB 3.19Å; G77-C81 PolarHBondContact O-N 2.88Å; G77-C81 PolarHBondContact O-SG 3.4Å; C81-C93 HydrophobicContact CB-CB 3.58Å; C81-C93 WeakPolarHBondContact CB-SG 3.29Å; C81-C93 WeakPolarHBondContact SG-CB 3.36Å; C81-C93 CovalentContact SG-SG 2Å; C81-C93 PolarHBondContact SG-SG 3.45Å
82	K	80.3	Confident	80.6	Confident	156 Å²	156	78.7 Å²	78.7	68%	0.678	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-2.8	173.8	-71.4	-172	176.3	-164.5	0	113.4	K78 T80 P84	K78-K82 HydrophobicContact CG-CD 4.16Å; K78-K82 VanDerWaalsContact O-CB 3.25Å; K78-K82 WeakPolarHBondContact O-CB 3.23Å; K78-K82 WeakPolarHBondContact O-CG 3.29Å; K78-K82 PolarHBondContact O-N 2.83Å; T80-K82 VanDerWaalsContact C-N 3.29Å; T80-K82 PolarHBondContact O-N 2.88Å; K82-P84 WeakPolarHBondContact O-CD 3.26Å
83	T	78.9	Confident	81	Confident	88 Å²	88	74.9 Å²	74.9	54%	0.54	41%	0.408	S	S	.	.	S	Bend	trans	-74.6	121.5	177.4	-59.6	0	0	0	0	108.6	M79 T80	M79-T83 PolarHBondContact O-OG1 2.83Å; T80-T83 WeakPolarHBondContact O-CB 3.48Å; T80-T83 PolarHBondContact O-N 3.47Å; T80-T83 PolarHBondContact O-OG1 2.79Å
84	P	78.4	Confident	81.4	Confident	103 Å²	103	72 Å²	72	67%	0.669	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-62.3	142.9	179.2	24.2	-32.4	0	0	0	110.6	K82 S86	K82-P84 WeakPolarHBondContact O-CD 3.26Å; P84-S86 PolarHBondContact O-N 2.92Å
85	P	82.8	Confident	82.2	Confident	81 Å²	81	72.1 Å²	72.1	53%	0.526	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-62.7	132.7	-177.4	25.9	-33.8	0	0	0	110.4	A90	P85-A90 HydrophobicContact CB-CB 3.93Å
86	S	80.5	Confident	82.7	Confident	49 Å²	49	68 Å²	68	34%	0.343	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-102.6	163.9	177.5	73.7	0	0	0	0	110.4	P84 G88 Q89 L107	P84-S86 PolarHBondContact O-N 2.92Å; S86-G88 PolarHBondContact O-N 3.23Å; S86-Q89 PolarHBondContact N-O 2.82Å; S86-Q89 PolarHBondContact O-N 2.78Å; S86-Q89 PolarHBondContact OG-N 3.32Å; S86-Q89 VanDerWaalsContact OG-N 3.08Å; S86-Q89 PolarHBondContact OG-O 3.43Å; S86-L107 WeakPolarHBondContact O-CD2 3.42Å
87	P	78.5	Confident	83.5	Confident	114 Å²	114	67.5 Å²	67.5	74%	0.74	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-17.8	176.2	-25.6	35.1	0	0	0	115
88	G	80.1	Confident	84.2	Confident	31 Å²	31	73 Å²	73	32%	0.32	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-5.2	-179.4	0	0	0	0	0	115.1	S58 I59 S86	S58-G88 WeakPolarHBondContact CA-O 3.45Å; I59-G88 PolarHBondContact N-O 3.06Å; S86-G88 PolarHBondContact O-N 3.23Å
89	Q	85.9	Confident	84.8	Confident	102 Å²	102	71.2 Å²	71.2	48%	0.477	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	129.7	-179	-171.8	177.5	27.1	0	0	111.8	L57 S86 V91	L57-Q89 CarbonylContact O-C 3.58Å; L57-Q89 VanDerWaalsContact O-CA 3.3Å; L57-Q89 WeakPolarHBondContact O-CA 3.46Å; S86-Q89 PolarHBondContact N-O 2.82Å; S86-Q89 PolarHBondContact O-N 2.78Å; S86-Q89 PolarHBondContact OG-N 3.32Å; S86-Q89 VanDerWaalsContact OG-N 3.08Å; S86-Q89 PolarHBondContact OG-O 3.43Å; Q89-V91 HydrophobicContact CG-CG2 4.35Å
90	A	88.4	Confident	85.5	Confident	4 Å²	4	64.4 Å²	64.4	3%	0.033	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	140.9	169.9	0	0	0	0	0	110	S56 L57 P85 A105 Q106 L107	S56-A90 VanDerWaalsContact CA-O 3.29Å; S56-A90 WeakPolarHBondContact CA-O 3.32Å; L57-A90 PolarHBondContact N-O 3.49Å; L57-A90 PolarHBondContact O-N 3.43Å; P85-A90 HydrophobicContact CB-CB 3.93Å; A90-A105 HydrophobicContact CB-CB 4.2Å; A90-A105 WeakPolarHBondContact O-CB 3.45Å; A90-Q106 WeakPolarHBondContact CB-O 3.47Å; A90-L107 HydrophobicContact CB-CD2 4.21Å
91	V	90.5	Very high	85.9	Confident	27 Å²	27	70.7 Å²	70.7	16%	0.164	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	128	178.7	-173.2	0	0	0	0	108.7	F54 T80 Q89	F54-V91 HydrophobicContact CB-CG1 4.35Å; T80-V91 HydrophobicContact CG2-CG1 4.15Å; T80-V91 HydrophobicContact CG2-CG2 4.28Å; Q89-V91 HydrophobicContact CG-CG2 4.35Å
92	E	89.5	Confident	86.1	Confident	92 Å²	92	76.3 Å²	76.3	43%	0.43	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	138.8	173.1	-70.3	-172	-163.6	0	0	109.9	F54 S55 I103 A105	F54-E92 CarbonylContact C-O 3.54Å; F54-E92 VanDerWaalsContact CA-O 3.3Å; F54-E92 WeakPolarHBondContact CA-O 3.34Å; S55-E92 PolarHBondContact N-O 3.24Å; S55-E92 PolarHBondContact O-N 3.01Å; E92-I103 HydrophobicContact CB-CG2 3.67Å; E92-I103 VanDerWaalsContact OE2-CG2 3.25Å; E92-I103 WeakPolarHBondContact OE2-CG2 3.48Å; E92-A105 HydrophobicContact CG-CB 4.45Å
93	C	91.3	Very high	86.3	Confident	34 Å²	34	70.6 Å²	70.6	23%	0.23	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	150.3	-176.3	-54.8	0	0	0	0	112	Q52 C53 C81	Q52-C93 HydrophobicContact CG-CB 4.29Å; C53-C93 VanDerWaalsContact O-CA 3.26Å; C53-C93 WeakPolarHBondContact O-CA 3.49Å; C53-C93 WeakPolarHBondContact O-CB 3.47Å; C81-C93 HydrophobicContact CB-CB 3.58Å; C81-C93 WeakPolarHBondContact CB-SG 3.29Å; C81-C93 WeakPolarHBondContact SG-CB 3.36Å; C81-C93 CovalentContact SG-SG 2Å; C81-C93 PolarHBondContact SG-SG 3.45Å
94	C	89.2	Confident	86.4	Confident	21 Å²	21	69.8 Å²	69.8	14%	0.142	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	165.6	-179.7	62	0	0	0	0	110.9	Q52 C53 C99 N100 I103	Q52-C94 VanDerWaalsContact CG-O 3.29Å; Q52-C94 WeakPolarHBondContact CG-O 3.38Å; C53-C94 PolarHBondContact N-O 3.12Å; C53-C94 PolarHBondContact O-N 3.07Å; C94-C99 HydrophobicContact CB-CB 3.82Å; C94-C99 WeakPolarHBondContact CB-SG 3.43Å; C94-C99 WeakPolarHBondContact SG-CB 3.5Å; C94-C99 CovalentContact SG-SG 2.04Å; C94-C99 PolarHBondContact SG-SG 3.25Å; C94-N100 PolarHBondContact SG-N 2.85Å; C94-I103 HydrophobicContact CB-CD1 3.54Å; C94-I103 WeakPolarHBondContact SG-CD1 3.42Å
95	Q	89.4	Confident	86.7	Confident	103 Å²	103	65 Å²	65	48%	0.481	35%	0.352	S	S	.	.			trans	-125	132.8	176.4	-68.5	177.8	-18.2	0	0	109.1	Y33 Q52	Y33-Q95 HydrophobicContact CE2-CB 4Å; Y33-Q95 HydrophobicContact CE2-CG 4.44Å; Q52-Q95 HydrophobicContact CG-CG 4.07Å
96	G	87.8	Confident	86.6	Confident	19 Å²	19	68.2 Å²	68.2	20%	0.196	36%	0.361	C	S	.	.	S	Bend	trans	131.7	152.8	-175.3	0	0	0	0	0	112	Y33 W98 C99	Y33-G96 VanDerWaalsContact CD1-CA 3.43Å; G96-W98 PolarHBondContact O-N 3.13Å; G96-C99 WeakPolarHBondContact O-CB 3.43Å; G96-C99 PolarHBondContact O-N 3.22Å; G96-C99 PolarHBondContact O-SG 3.38Å
97	D	90	Very high	86.6	Confident	97 Å²	97	67.7 Å²	67.7	52%	0.519	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	127.4	178	-62.6	-48.9	0	0	0	110.7	Y33 M34 C99	Y33-D97 VanDerWaalsContact CA-OD1 3.26Å; Y33-D97 WeakPolarHBondContact CA-OD1 3.49Å; M34-D97 PolarHBondContact N-OD1 3.34Å; M34-D97 CarbonylContact O-C 3.54Å; M34-D97 WeakPolarHBondContact O-CA 3.48Å; D97-C99 PolarHBondContact O-N 3.23Å; D97-C99 VanDerWaalsContact O-N 3.17Å
98	W	90	Very high	86.4	Confident	115 Å²	115	65.5 Å²	65.5	44%	0.436	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	23.1	-179.5	-49.8	96.3	0	0	0	114.4	M34 V36 H47 G96 N100 R101	M34-W98 HydrophobicContact CB-CD2 4.41Å; M34-W98 HydrophobicContact CB-CZ2 3.99Å; M34-W98 HydrophobicContact CE-CZ2 4.38Å; M34-W98 PolarHBondContact O-N 3.21Å; V36-W98 HydrophobicContact CG2-CE3 3.74Å; V36-W98 HydrophobicContact CG2-CZ3 4.25Å; H47-W98 HydrophobicContact CB-CH2 3.41Å; H47-W98 VanDerWaalsContact CB-CH2 3.41Å; H47-W98 HydrophobicContact CB-CZ3 3.63Å; G96-W98 PolarHBondContact O-N 3.13Å; W98-N100 PolarHBondContact O-N 2.99Å; W98-R101 VanDerWaalsContact O-CB 3.27Å; W98-R101 WeakPolarHBondContact O-CB 3.33Å; W98-R101 PolarHBondContact O-N 3.31Å; W98-R101 VanDerWaalsContact O-N 3.13Å
99	C	90.1	Very high	85.6	Confident	36 Å²	36	70.4 Å²	70.4	24%	0.243	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-64.1	-28	-173.1	70.3	0	0	0	0	113.4	C94 G96 D97 R101 I103	C94-C99 HydrophobicContact CB-CB 3.82Å; C94-C99 WeakPolarHBondContact CB-SG 3.43Å; C94-C99 WeakPolarHBondContact SG-CB 3.5Å; C94-C99 CovalentContact SG-SG 2.04Å; C94-C99 PolarHBondContact SG-SG 3.25Å; G96-C99 WeakPolarHBondContact O-CB 3.43Å; G96-C99 PolarHBondContact O-N 3.22Å; G96-C99 PolarHBondContact O-SG 3.38Å; D97-C99 PolarHBondContact O-N 3.23Å; D97-C99 VanDerWaalsContact O-N 3.17Å; C99-R101 VanDerWaalsContact C-N 3.26Å; C99-R101 PolarHBondContact O-N 2.98Å; C99-I103 WeakPolarHBondContact O-CD1 3.33Å
100	N	91.7	Very high	84	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-83.5	4.1	-179.7	67.7	-23.4	0	0	0	113.7	V36 C53 F54 C94 W98 N102 I103	V36-N100 PolarHBondContact N-OD1 2.94Å; V36-N100 PolarHBondContact O-ND2 3.17Å; C53-N100 HydrophobicContact CB-CB 3.79Å; F54-N100 PolarHBondContact O-ND2 3.12Å; C94-N100 PolarHBondContact SG-N 2.85Å; W98-N100 PolarHBondContact O-N 2.99Å; N100-N102 PolarHBondContact O-N 3.28Å; N100-I103 PolarHBondContact O-N 3.28Å
101	R	89.1	Confident	82.1	Confident	179 Å²	179	79.1 Å²	79.1	68%	0.675	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-59.9	-44.2	179.1	-171.8	174.4	-174.9	175.3	2.5	112.5	V36 K68 W98 C99	V36-R101 HydrophobicContact CG2-CB 3.9Å; V36-R101 HydrophobicContact CG2-CG 4.23Å; K68-R101 PolarHBondContact NZ-O 3.13Å; W98-R101 VanDerWaalsContact O-CB 3.27Å; W98-R101 WeakPolarHBondContact O-CB 3.33Å; W98-R101 PolarHBondContact O-N 3.31Å; W98-R101 VanDerWaalsContact O-N 3.13Å; C99-R101 VanDerWaalsContact C-N 3.26Å; C99-R101 PolarHBondContact O-N 2.98Å
102	N	84.9	Confident	79.4	Confident	151 Å²	151	87 Å²	87	81%	0.807	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-104.3	8.1	-176.3	-67.9	-10.7	0	0	0	113.7	N100	N100-N102 PolarHBondContact O-N 3.28Å
103	I	85	Confident	76.8	Confident	36 Å²	36	88.2 Å²	88.2	19%	0.185	47%	0.468	C	S	.	.			trans	-95.2	132.3	178.3	-59.9	-178.5	0	0	0	108.1	S55 K68 E92 C94 C99 N100	S55-I103 PolarHBondContact OG-O 3.44Å; K68-I103 WeakPolarHBondContact CE-O 3.17Å; E92-I103 HydrophobicContact CB-CG2 3.67Å; E92-I103 VanDerWaalsContact OE2-CG2 3.25Å; E92-I103 WeakPolarHBondContact OE2-CG2 3.48Å; C94-I103 HydrophobicContact CB-CD1 3.54Å; C94-I103 WeakPolarHBondContact SG-CD1 3.42Å; C99-I103 WeakPolarHBondContact O-CD1 3.33Å; N100-I103 PolarHBondContact O-N 3.28Å
104	T	81.7	Confident	74.1	Confident	72 Å²	72	95.2 Å²	95.2	44%	0.442	50%	0.495	S	S	.	.			trans	-137	113.2	175.5	-55.7	0	0	0	0	108.2	Y66 Q106	Y66-T104 HydrophobicContact CD1-CG2 4.35Å; Y66-T104 HydrophobicContact CE1-CG2 4.05Å; T104-Q106 PolarHBondContact O-N 3.09Å
105	A	83.4	Confident	71.7	Confident	1 Å²	1	100.5 Å²	100.5	1%	0.008	53%	0.529	C	S	.	.			trans	-61.5	134.3	178.3	0	0	0	0	0	111.3	S55 L57 A90 E92	S55-A105 PolarHBondContact OG-N 3.44Å; L57-A105 HydrophobicContact CB-CB 4.05Å; L57-A105 WeakPolarHBondContact CD2-O 3.2Å; A90-A105 HydrophobicContact CB-CB 4.2Å; A90-A105 WeakPolarHBondContact O-CB 3.45Å; E92-A105 HydrophobicContact CG-CB 4.45Å
106	Q	80.8	Confident	69.6	Low	150 Å²	150	98.6 Å²	98.6	70%	0.701	54%	0.536	S	S	*	.			trans	-115.7	135.4	178	-62.4	-173.9	1.7	0	0	110.8	A90 T104	A90-Q106 WeakPolarHBondContact CB-O 3.47Å; T104-Q106 PolarHBondContact O-N 3.09Å
107	L	81.7	Confident	67.5	Low	37 Å²	37	101.8 Å²	101.8	19%	0.194	55%	0.553	C	S	.	*	P	Polyproline II helix	trans	-71.4	143.4	171.9	-67.6	170.3	0	0	0	109.8	L57 I59 S86 A90 T109	L57-L107 HydrophobicContact CD2-CD1 4.18Å; L57-L107 HydrophobicContact CD2-CG 3.85Å; L57-L107 HydrophobicContact CG-CD1 4.36Å; L57-L107 HydrophobicContact CG-CG 4.14Å; I59-L107 HydrophobicContact CD1-CD1 3.77Å; I59-L107 HydrophobicContact CG1-CD1 3.98Å; S86-L107 WeakPolarHBondContact O-CD2 3.42Å; A90-L107 HydrophobicContact CB-CD2 4.21Å; L107-T109 PolarHBondContact O-N 3.18Å; L107-T109 VanDerWaalsContact O-N 3.15Å
108	P	74.3	Confident	65.6	Low	68 Å²	68	105.5 Å²	105.5	44%	0.442	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-61	120.3	178.5	21.9	-29.8	0	0	0	110.2	K110	P108-K110 PolarHBondContact O-N 2.92Å
109	T	62	Low	63.6	Low	134 Å²	134	106.2 Å²	106.2	82%	0.822	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-67	127.1	178.1	35	0	0	0	0	110.2	L107 G111	L107-T109 PolarHBondContact O-N 3.18Å; L107-T109 VanDerWaalsContact O-N 3.15Å; T109-G111 PolarHBondContact O-N 3.23Å
110	K	53.6	Low	61.9	Low	224 Å²	224	110.9 Å²	110.9	97%	0.974	60%	0.595	S	S	*	*	S	Bend	trans	-58.5	107.3	172.8	-95.8	-178.7	176	175.6	0	109.2	P108	P108-K110 PolarHBondContact O-N 2.92Å
111	G	47.8	Very low	60.3	Low	65 Å²	65	117.1 Å²	117.1	67%	0.67	62%	0.624	S	S	*	*			trans	130.3	89.6	165.5	0	0	0	0	0	113.8	T109	T109-G111 PolarHBondContact O-N 3.23Å
112	K	34.3	Very low	58.8	Low	194 Å²	194	114.6 Å²	114.6	84%	0.843	62%	0.624	S	S	*	*			trans	-161.7	103.7	135.8	-100.9	168.6	-164	-177.9	0	107.8	F114	K112-F114 PolarHBondContact O-N 2.97Å
113	S	34.8	Very low	57.8	Low	117 Å²	117	113.4 Å²	113.4	82%	0.818	61%	0.613	S	S	*	*			trans	-60	119.5	163.1	36.9	0	0	0	0	108.2
114	F	35	Very low	57.1	Low	181 Å²	181	114.3 Å²	114.3	79%	0.794	62%	0.62	S	S	*	*			trans	-71.4	124.6	166.3	-84.7	-92.9	0	0	0	108.1	K112 G116	K112-F114 PolarHBondContact O-N 2.97Å; F114-G116 PolarHBondContact O-N 3.34Å
115	P	37.7	Very low	56.8	Low	132 Å²	132	112.7 Å²	112.7	86%	0.857	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	109.3	175.4	30	-28.5	0	0	0	108.1
116	G	45.1	Very low	56.5	Low	62 Å²	62	117.8 Å²	117.8	64%	0.639	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	165.8	-5	175.8	0	0	0	0	0	117.3	F114 Q118	F114-G116 PolarHBondContact O-N 3.34Å; G116-Q118 PolarHBondContact O-N 2.74Å
117	T	44.4	Very low	56.5	Low	87 Å²	87	115.6 Å²	115.6	53%	0.534	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.6	39.7	-168.9	-14.8	0	0	0	0	114.7
118	Q	49.4	Very low	56.6	Low	174 Å²	174	118.7 Å²	118.7	81%	0.813	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	-29.4	165.5	-75.3	-158.1	-17.6	0	0	113.5	G116	G116-Q118 PolarHBondContact O-N 2.74Å
119	N	48.3	Very low	57.3	Low	131 Å²	131	121.1 Å²	121.1	70%	0.701	66%	0.661	S	S	*	*	H	α-helix	trans	-86.3	-25	-180	-66.1	-15.3	0	0	0	113.4	E123	N119-E123 PolarHBondContact O-N 2.83Å
120	F	54.1	Low	58.2	Low	133 Å²	133	118 Å²	118	58%	0.583	64%	0.644	S	S	*	*	H	α-helix	trans	-73	-37.1	-175.3	-162.5	-100.8	0	0	0	113.6	L122 V124	F120-L122 VanDerWaalsContact C-N 3.34Å; F120-L122 PolarHBondContact O-N 2.75Å; F120-V124 HydrophobicContact CD1-CG2 3.97Å; F120-V124 HydrophobicContact CE1-CG2 3.71Å; F120-V124 HydrophobicContact CZ-CG2 4.05Å; F120-V124 WeakPolarHBondContact O-CB 3.28Å; F120-V124 VanDerWaalsContact O-CG2 3.26Å; F120-V124 WeakPolarHBondContact O-CG2 3.31Å; F120-V124 PolarHBondContact O-N 3.4Å
121	H	58.6	Low	60	Low	132 Å²	132	111.2 Å²	111.2	61%	0.611	62%	0.621	S	S	*	*	H	α-helix	trans	-70.9	-30.9	-180	-74.8	-69.9	0	0	0	112.8	G125	H121-G125 PolarHBondContact O-N 3.22Å
122	L	58.9	Low	62.2	Low	126 Å²	126	111.8 Å²	111.8	66%	0.66	61%	0.612	S	S	*	*	H	α-helix	trans	-74	-42.9	177.5	-160.1	74.3	0	0	0	111.1	F120 G125 L126	F120-L122 VanDerWaalsContact C-N 3.34Å; F120-L122 PolarHBondContact O-N 2.75Å; L122-G125 PolarHBondContact O-N 2.87Å; L122-L126 WeakPolarHBondContact O-CG 3.49Å; L122-L126 PolarHBondContact O-N 3.36Å
123	E	62.3	Low	65	Low	126 Å²	126	109.1 Å²	109.1	59%	0.589	60%	0.6	S	S	*	*	H	α-helix	trans	-65.4	-44.3	176.9	-73.6	-168.7	169.2	0	0	112.3	N119 G125 L126 I127	N119-E123 PolarHBondContact O-N 2.83Å; E123-G125 VanDerWaalsContact C-N 3.32Å; E123-G125 PolarHBondContact O-N 3.39Å; E123-L126 PolarHBondContact O-N 3.47Å; E123-I127 WeakPolarHBondContact O-CG1 3.27Å; E123-I127 PolarHBondContact O-N 2.96Å
124	V	71.4	Confident	67.6	Low	55 Å²	55	105.9 Å²	105.9	33%	0.333	58%	0.58	S	S	.	*	H	α-helix	trans	-64.9	-37.8	176.5	174.5	0	0	0	0	111.3	F120 I127 I128	F120-V124 HydrophobicContact CD1-CG2 3.97Å; F120-V124 HydrophobicContact CE1-CG2 3.71Å; F120-V124 HydrophobicContact CZ-CG2 4.05Å; F120-V124 WeakPolarHBondContact O-CB 3.28Å; F120-V124 VanDerWaalsContact O-CG2 3.26Å; F120-V124 WeakPolarHBondContact O-CG2 3.31Å; F120-V124 PolarHBondContact O-N 3.4Å; V124-I127 PolarHBondContact O-N 3.03Å; V124-I128 HydrophobicContact CG1-CD1 3.88Å; V124-I128 HydrophobicContact CG1-CG1 4.46Å; V124-I128 WeakPolarHBondContact O-CG1 3.43Å; V124-I128 PolarHBondContact O-N 2.66Å
125	G	75.9	Confident	70.4	Confident	37 Å²	37	101.4 Å²	101.4	38%	0.381	57%	0.568	S	S	.	*	H	α-helix	trans	-61.3	-42.6	174.8	0	0	0	0	0	113.1	H121 L122 E123 I128 L129	H121-G125 PolarHBondContact O-N 3.22Å; L122-G125 PolarHBondContact O-N 2.87Å; E123-G125 VanDerWaalsContact C-N 3.32Å; E123-G125 PolarHBondContact O-N 3.39Å; G125-I128 PolarHBondContact O-N 2.96Å; G125-L129 WeakPolarHBondContact O-CB 3.06Å; G125-L129 PolarHBondContact O-N 3.35Å
126	L	75.1	Confident	73	Confident	109 Å²	109	98.5 Å²	98.5	57%	0.571	55%	0.55	S	S	*	.	H	α-helix	trans	-67	-35.8	177	-71.2	170.1	0	0	0	112.4	L122 E123 S130	L122-L126 WeakPolarHBondContact O-CG 3.49Å; L122-L126 PolarHBondContact O-N 3.36Å; E123-L126 PolarHBondContact O-N 3.47Å; L126-S130 WeakPolarHBondContact O-CB 3.4Å; L126-S130 PolarHBondContact O-N 3.29Å; L126-S130 PolarHBondContact O-OG 2.88Å
127	I	82.1	Confident	75.3	Confident	103 Å²	103	99.5 Å²	99.5	53%	0.528	54%	0.54	S	S	.	.	H	α-helix	trans	-66.6	-46.2	175.4	-66.4	165.5	0	0	0	110.4	E123 V124 L129 S130 V131	E123-I127 WeakPolarHBondContact O-CG1 3.27Å; E123-I127 PolarHBondContact O-N 2.96Å; V124-I127 PolarHBondContact O-N 3.03Å; I127-L129 VanDerWaalsContact C-N 3.34Å; I127-L129 PolarHBondContact O-N 2.77Å; I127-S130 PolarHBondContact O-N 2.89Å; I127-S130 PolarHBondContact O-OG 2.83Å; I127-V131 WeakPolarHBondContact O-CG2 3.24Å; I127-V131 PolarHBondContact O-N 3.22Å
128	I	84.3	Confident	77.7	Confident	102 Å²	102	100.5 Å²	100.5	52%	0.523	54%	0.541	S	S	.	.	H	α-helix	trans	-62	-43.7	178	-66.3	167.5	0	0	0	110.6	V124 G125 S130 V131 V132	V124-I128 HydrophobicContact CG1-CD1 3.88Å; V124-I128 HydrophobicContact CG1-CG1 4.46Å; V124-I128 WeakPolarHBondContact O-CG1 3.43Å; V124-I128 PolarHBondContact O-N 2.66Å; G125-I128 PolarHBondContact O-N 2.96Å; I128-S130 VanDerWaalsContact C-N 3.34Å; I128-S130 PolarHBondContact O-N 2.94Å; I128-V131 PolarHBondContact O-N 3.16Å; I128-V132 HydrophobicContact CG2-CG2 4.37Å; I128-V132 VanDerWaalsContact O-CG2 3.29Å; I128-V132 WeakPolarHBondContact O-CG2 3.3Å; I128-V132 PolarHBondContact O-N 2.98Å
129	L	87.4	Confident	79.7	Confident	120 Å²	120	95.1 Å²	95.1	63%	0.628	53%	0.527	S	S	*	.	H	α-helix	trans	-63	-40	178.9	-163.2	77.9	0	0	0	112	G125 I127 V132 F133	G125-L129 WeakPolarHBondContact O-CB 3.06Å; G125-L129 PolarHBondContact O-N 3.35Å; I127-L129 VanDerWaalsContact C-N 3.34Å; I127-L129 PolarHBondContact O-N 2.77Å; L129-V132 PolarHBondContact O-N 3.07Å; L129-F133 WeakPolarHBondContact O-CB 3.33Å; L129-F133 PolarHBondContact O-N 3.27Å
130	S	82.1	Confident	81.8	Confident	67 Å²	67	93 Å²	93	47%	0.469	52%	0.522	S	S	.	.	H	α-helix	trans	-69.4	-37.1	178.7	66.3	0	0	0	0	112.7	L126 I127 I128 F133 A134	L126-S130 WeakPolarHBondContact O-CB 3.4Å; L126-S130 PolarHBondContact O-N 3.29Å; L126-S130 PolarHBondContact O-OG 2.88Å; I127-S130 PolarHBondContact O-N 2.89Å; I127-S130 PolarHBondContact O-OG 2.83Å; I128-S130 VanDerWaalsContact C-N 3.34Å; I128-S130 PolarHBondContact O-N 2.94Å; S130-F133 PolarHBondContact O-N 3.5Å; S130-A134 WeakPolarHBondContact O-CB 3.48Å; S130-A134 PolarHBondContact O-N 3.13Å
131	V	91.6	Very high	83.7	Confident	83 Å²	83	91.7 Å²	91.7	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-66.4	-45	174	173.5	0	0	0	0	111	I127 I128 F133 A134 V135	I127-V131 WeakPolarHBondContact O-CG2 3.24Å; I127-V131 PolarHBondContact O-N 3.22Å; I128-V131 PolarHBondContact O-N 3.16Å; V131-F133 VanDerWaalsContact C-N 3.34Å; V131-F133 PolarHBondContact O-N 3.15Å; V131-A134 PolarHBondContact O-N 3.39Å; V131-V135 WeakPolarHBondContact O-CG2 3.47Å; V131-V135 PolarHBondContact O-N 2.77Å
132	V	92.6	Very high	85.4	Confident	77 Å²	77	90.3 Å²	90.3	47%	0.467	52%	0.516	S	S	.	.	H	α-helix	trans	-61.8	-44.4	176.9	171.8	0	0	0	0	110.6	I128 L129 A134 V135 C136	I128-V132 HydrophobicContact CG2-CG2 4.37Å; I128-V132 VanDerWaalsContact O-CG2 3.29Å; I128-V132 WeakPolarHBondContact O-CG2 3.3Å; I128-V132 PolarHBondContact O-N 2.98Å; L129-V132 PolarHBondContact O-N 3.07Å; V132-A134 PolarHBondContact O-N 2.9Å; V132-V135 PolarHBondContact O-N 2.73Å; V132-C136 PolarHBondContact O-N 2.82Å; V132-C136 PolarHBondContact O-SG 2.91Å; V132-C136 VanDerWaalsContact O-SG 3.33Å
133	F	93.1	Very high	87	Confident	138 Å²	138	85.8 Å²	85.8	61%	0.605	50%	0.5	S	S	*	.	H	α-helix	trans	-60.9	-44	176.3	-174.8	-100.8	0	0	0	111.9	L129 S130 V131 V135 C136 L137	L129-F133 WeakPolarHBondContact O-CB 3.33Å; L129-F133 PolarHBondContact O-N 3.27Å; S130-F133 PolarHBondContact O-N 3.5Å; V131-F133 VanDerWaalsContact C-N 3.34Å; V131-F133 PolarHBondContact O-N 3.15Å; F133-V135 PolarHBondContact O-N 2.95Å; F133-C136 PolarHBondContact O-N 2.82Å; F133-L137 HydrophobicContact CD1-CD1 4.27Å; F133-L137 HydrophobicContact CE1-CD1 3.49Å; F133-L137 VanDerWaalsContact CE1-CD1 3.49Å; F133-L137 HydrophobicContact CZ-CD1 3.73Å; F133-L137 VanDerWaalsContact O-CB 3.31Å; F133-L137 WeakPolarHBondContact O-CB 3.31Å; F133-L137 PolarHBondContact O-N 3.41Å
134	A	90.9	Very high	88.4	Confident	48 Å²	48	83.7 Å²	83.7	40%	0.397	50%	0.496	S	S	.	.	H	α-helix	trans	-62.2	-40.8	177	0	0	0	0	0	112.5	S130 V131 V132 L137 L138	S130-A134 WeakPolarHBondContact O-CB 3.48Å; S130-A134 PolarHBondContact O-N 3.13Å; V131-A134 PolarHBondContact O-N 3.39Å; V132-A134 PolarHBondContact O-N 2.9Å; A134-L137 PolarHBondContact O-N 3.31Å; A134-L138 WeakPolarHBondContact O-CB 3.38Å; A134-L138 PolarHBondContact O-N 3Å
135	V	93.3	Very high	89.3	Confident	88 Å²	88	83.7 Å²	83.7	53%	0.533	50%	0.502	S	S	.	.	H	α-helix	trans	-66.3	-43.7	176.4	172.1	0	0	0	0	111.3	V131 V132 F133 L137 L138 A139	V131-V135 WeakPolarHBondContact O-CG2 3.47Å; V131-V135 PolarHBondContact O-N 2.77Å; V132-V135 PolarHBondContact O-N 2.73Å; F133-V135 PolarHBondContact O-N 2.95Å; V135-L137 VanDerWaalsContact C-N 3.32Å; V135-L137 PolarHBondContact O-N 2.61Å; V135-L138 PolarHBondContact O-N 3.46Å; V135-A139 WeakPolarHBondContact O-CB 3.11Å; V135-A139 PolarHBondContact O-N 3.02Å
136	C	91.7	Very high	90	Very high	71 Å²	71	87.2 Å²	87.2	48%	0.48	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-40.5	175.3	-70.9	0	0	0	0	111.7	V132 F133 A139 C140	V132-C136 PolarHBondContact O-N 2.82Å; V132-C136 PolarHBondContact O-SG 2.91Å; V132-C136 VanDerWaalsContact O-SG 3.33Å; F133-C136 PolarHBondContact O-N 2.82Å; C136-A139 PolarHBondContact O-N 2.96Å; C136-C140 WeakPolarHBondContact O-CB 3.46Å; C136-C140 PolarHBondContact O-N 3.2Å
137	L	94.1	Very high	90.6	Very high	83 Å²	83	91.6 Å²	91.6	44%	0.435	52%	0.52	S	S	.	.	H	α-helix	trans	-69.1	-40.8	179.7	-151.4	147.3	0	0	0	111.1	F133 A134 V135 C140 L141	F133-L137 HydrophobicContact CD1-CD1 4.27Å; F133-L137 HydrophobicContact CE1-CD1 3.49Å; F133-L137 VanDerWaalsContact CE1-CD1 3.49Å; F133-L137 HydrophobicContact CZ-CD1 3.73Å; F133-L137 VanDerWaalsContact O-CB 3.31Å; F133-L137 WeakPolarHBondContact O-CB 3.31Å; F133-L137 PolarHBondContact O-N 3.41Å; A134-L137 PolarHBondContact O-N 3.31Å; V135-L137 VanDerWaalsContact C-N 3.32Å; V135-L137 PolarHBondContact O-N 2.61Å; L137-C140 PolarHBondContact O-N 2.93Å; L137-L141 HydrophobicContact CD2-CD1 3.72Å; L137-L141 HydrophobicContact CD2-CG 4.11Å; L137-L141 WeakPolarHBondContact O-CB 3.4Å; L137-L141 VanDerWaalsContact O-CG 3.29Å; L137-L141 WeakPolarHBondContact O-CG 3.07Å; L137-L141 PolarHBondContact O-N 3.19Å
138	L	93.8	Very high	90.7	Very high	107 Å²	107	93.5 Å²	93.5	56%	0.56	53%	0.525	S	S	*	.	H	α-helix	trans	-60.8	-43.8	170.7	-85.4	161.5	0	0	0	112.1	A134 V135 L141 L142	A134-L138 WeakPolarHBondContact O-CB 3.38Å; A134-L138 PolarHBondContact O-N 3Å; V135-L138 PolarHBondContact O-N 3.46Å; L138-L141 PolarHBondContact O-N 2.88Å; L138-L142 WeakPolarHBondContact O-CB 3.27Å; L138-L142 PolarHBondContact O-N 2.7Å
139	A	91.5	Very high	90.5	Very high	61 Å²	61	95.2 Å²	95.2	50%	0.504	53%	0.529	S	S	.	.	H	α-helix	trans	-64.4	-40.2	177	0	0	0	0	0	112	V135 C136 L142 G143	V135-A139 WeakPolarHBondContact O-CB 3.11Å; V135-A139 PolarHBondContact O-N 3.02Å; C136-A139 PolarHBondContact O-N 2.96Å; A139-L142 PolarHBondContact O-N 3.39Å; A139-G143 PolarHBondContact O-N 2.93Å
140	C	93.8	Very high	90.1	Very high	88 Å²	88	96.7 Å²	96.7	60%	0.595	53%	0.53	S	S	*	.	H	α-helix	trans	-64.4	-44.6	172.9	-86.8	0	0	0	0	111.9	C136 L137 G143 V144	C136-C140 WeakPolarHBondContact O-CB 3.46Å; C136-C140 PolarHBondContact O-N 3.2Å; L137-C140 PolarHBondContact O-N 2.93Å; C140-G143 PolarHBondContact O-N 3.45Å; C140-V144 WeakPolarHBondContact O-CB 3.44Å; C140-V144 VanDerWaalsContact O-CG2 3.32Å; C140-V144 WeakPolarHBondContact O-CG2 3.37Å; C140-V144 PolarHBondContact O-N 2.76Å
141	L	93.8	Very high	89.8	Confident	104 Å²	104	101.4 Å²	101.4	55%	0.545	54%	0.537	S	S	.	.	H	α-helix	trans	-63.5	-40.5	176.6	-73.3	176.2	0	0	0	111.7	L137 L138 V144 A145	L137-L141 HydrophobicContact CD2-CD1 3.72Å; L137-L141 HydrophobicContact CD2-CG 4.11Å; L137-L141 WeakPolarHBondContact O-CB 3.4Å; L137-L141 VanDerWaalsContact O-CG 3.29Å; L137-L141 WeakPolarHBondContact O-CG 3.07Å; L137-L141 PolarHBondContact O-N 3.19Å; L138-L141 PolarHBondContact O-N 2.88Å; L141-V144 PolarHBondContact O-N 3.41Å; L141-A145 WeakPolarHBondContact O-CB 3.48Å; L141-A145 PolarHBondContact O-N 3.02Å
142	L	93.1	Very high	89	Confident	103 Å²	103	105.7 Å²	105.7	54%	0.539	55%	0.545	S	S	.	.	H	α-helix	trans	-61.9	-45.5	171.5	-107	141.6	0	0	0	111.3	L138 A139 V144 A145 L146	L138-L142 WeakPolarHBondContact O-CB 3.27Å; L138-L142 PolarHBondContact O-N 2.7Å; A139-L142 PolarHBondContact O-N 3.39Å; L142-V144 VanDerWaalsContact C-N 3.35Å; L142-V144 PolarHBondContact O-N 3.18Å; L142-A145 PolarHBondContact O-N 3.35Å; L142-L146 HydrophobicContact CD2-CD1 4.41Å; L142-L146 VanDerWaalsContact O-CB 3.31Å; L142-L146 WeakPolarHBondContact O-CB 3.33Å; L142-L146 WeakPolarHBondContact O-CG 3.32Å; L142-L146 PolarHBondContact O-N 3.3Å
143	G	93	Very high	87.7	Confident	31 Å²	31	106 Å²	106	32%	0.32	54%	0.543	S	S	.	.	H	α-helix	trans	-60.6	-41.6	175.7	0	0	0	0	0	112.8	A139 C140 R147	A139-G143 PolarHBondContact O-N 2.93Å; C140-G143 PolarHBondContact O-N 3.45Å; G143-R147 WeakPolarHBondContact O-CB 3.43Å; G143-R147 VanDerWaalsContact O-CG 3.29Å; G143-R147 WeakPolarHBondContact O-CG 3.33Å; G143-R147 PolarHBondContact O-N 3.48Å
144	V	92.5	Very high	86.1	Confident	83 Å²	83	105.8 Å²	105.8	50%	0.503	54%	0.544	S	S	.	.	H	α-helix	trans	-69.5	-40.9	175.5	172.5	0	0	0	0	111.1	C140 L141 L142 R147 K148	C140-V144 WeakPolarHBondContact O-CB 3.44Å; C140-V144 VanDerWaalsContact O-CG2 3.32Å; C140-V144 WeakPolarHBondContact O-CG2 3.37Å; C140-V144 PolarHBondContact O-N 2.76Å; L141-V144 PolarHBondContact O-N 3.41Å; L142-V144 VanDerWaalsContact C-N 3.35Å; L142-V144 PolarHBondContact O-N 3.18Å; V144-R147 PolarHBondContact O-N 3.5Å; V144-K148 WeakPolarHBondContact O-CB 3.45Å; V144-K148 PolarHBondContact O-N 3.09Å
145	A	90.7	Very high	84.5	Confident	55 Å²	55	108.5 Å²	108.5	46%	0.455	55%	0.549	S	S	.	.	H	α-helix	trans	-64.5	-43.3	176.6	0	0	0	0	0	111.3	L141 L142 K148 F149	L141-A145 WeakPolarHBondContact O-CB 3.48Å; L141-A145 PolarHBondContact O-N 3.02Å; L142-A145 PolarHBondContact O-N 3.35Å; A145-K148 PolarHBondContact O-N 3.43Å; A145-F149 WeakPolarHBondContact O-CB 3.45Å; A145-F149 PolarHBondContact O-N 3.15Å
146	L	90.1	Very high	82.7	Confident	110 Å²	110	113.9 Å²	113.9	58%	0.576	56%	0.56	S	S	*	*	H	α-helix	trans	-65.2	-39.4	174.4	-70.2	172.2	0	0	0	111.5	L142 F149 K150	L142-L146 HydrophobicContact CD2-CD1 4.41Å; L142-L146 VanDerWaalsContact O-CB 3.31Å; L142-L146 WeakPolarHBondContact O-CB 3.33Å; L142-L146 WeakPolarHBondContact O-CG 3.32Å; L142-L146 PolarHBondContact O-N 3.3Å; L146-F149 PolarHBondContact O-N 3.45Å; L146-K150 VanDerWaalsContact O-CB 3.23Å; L146-K150 WeakPolarHBondContact O-CB 3.48Å; L146-K150 PolarHBondContact O-N 3.32Å
147	R	86.9	Confident	80.8	Confident	201 Å²	201	116.6 Å²	116.6	76%	0.758	57%	0.569	S	S	*	*	H	α-helix	trans	-65.4	-43.1	172.4	-78.6	179.8	178.7	175.9	0.8	112.2	G143 V144 R151	G143-R147 WeakPolarHBondContact O-CB 3.43Å; G143-R147 VanDerWaalsContact O-CG 3.29Å; G143-R147 WeakPolarHBondContact O-CG 3.33Å; G143-R147 PolarHBondContact O-N 3.48Å; V144-R147 PolarHBondContact O-N 3.5Å; R147-R151 WeakPolarHBondContact O-CB 3.15Å; R147-R151 PolarHBondContact O-N 3.21Å
148	K	85.5	Confident	78.7	Confident	144 Å²	144	119.1 Å²	119.1	63%	0.626	58%	0.583	S	S	*	*	H	α-helix	trans	-66.5	-36.9	175.1	-104.4	-172.6	172	178.3	0	111.8	V144 A145 R152	V144-K148 WeakPolarHBondContact O-CB 3.45Å; V144-K148 PolarHBondContact O-N 3.09Å; A145-K148 PolarHBondContact O-N 3.43Å; K148-R152 VanDerWaalsContact O-CB 3.22Å; K148-R152 WeakPolarHBondContact O-CB 3.49Å; K148-R152 WeakPolarHBondContact O-CG 3.26Å; K148-R152 PolarHBondContact O-N 2.84Å
149	F	80.2	Confident	76.1	Confident	138 Å²	138	118.9 Å²	118.9	61%	0.605	59%	0.587	S	S	*	*	H	α-helix	trans	-69	-47.2	176.2	-173.1	-96.5	0	0	0	110.4	A145 L146 R151 R152 N153	A145-F149 WeakPolarHBondContact O-CB 3.45Å; A145-F149 PolarHBondContact O-N 3.15Å; L146-F149 PolarHBondContact O-N 3.45Å; F149-R151 VanDerWaalsContact C-N 3.34Å; F149-R151 PolarHBondContact O-N 2.82Å; F149-R152 PolarHBondContact O-N 3.25Å; F149-N153 VanDerWaalsContact O-CB 3.29Å; F149-N153 WeakPolarHBondContact O-CB 3.39Å; F149-N153 PolarHBondContact O-N 2.85Å
150	K	78	Confident	73.6	Confident	150 Å²	150	126.8 Å²	126.8	65%	0.652	60%	0.604	S	S	*	*	H	α-helix	trans	-59.6	-43.3	174.4	-170.3	176	-178.4	178	0	111.7	L146 N153 Q154	L146-K150 VanDerWaalsContact O-CB 3.23Å; L146-K150 WeakPolarHBondContact O-CB 3.48Å; L146-K150 PolarHBondContact O-N 3.32Å; K150-N153 PolarHBondContact O-N 3.38Å; K150-Q154 WeakPolarHBondContact O-CB 3.48Å; K150-Q154 PolarHBondContact O-N 2.92Å
151	R	76.1	Confident	70.8	Confident	166 Å²	166	129.9 Å²	129.9	63%	0.626	62%	0.615	S	S	*	*	H	α-helix	trans	-67.3	-43.8	176.2	-174.2	174.7	168	172.9	1.3	112.5	R147 F149 N153 Q154 E155	R147-R151 WeakPolarHBondContact O-CB 3.15Å; R147-R151 PolarHBondContact O-N 3.21Å; F149-R151 VanDerWaalsContact C-N 3.34Å; F149-R151 PolarHBondContact O-N 2.82Å; R151-N153 VanDerWaalsContact C-N 3.3Å; R151-N153 PolarHBondContact O-N 3.41Å; R151-Q154 WeakPolarHBondContact O-CB 3.4Å; R151-Q154 PolarHBondContact O-N 3.44Å; R151-E155 WeakPolarHBondContact CG-OE1 3.34Å; R151-E155 IonicContact CZ-OE1 2.73Å; R151-E155 IonicContact NE-OE1 3.19Å; R151-E155 PolarHBondContact NE-OE1 3.04Å; R151-E155 IonicContact NH2-OE1 3.44Å; R151-E155 WeakPolarHBondContact O-CB 3.5Å; R151-E155 WeakPolarHBondContact O-CG 3.15Å; R151-E155 PolarHBondContact O-N 2.59Å
152	R	73.4	Confident	68.2	Low	174 Å²	174	131.4 Å²	131.4	66%	0.657	63%	0.628	S	S	*	*	H	α-helix	trans	-63.7	-33.8	172.6	-87.7	-179.2	162.4	172.5	-5.4	112.5	K148 F149 E155 R156	K148-R152 VanDerWaalsContact O-CB 3.22Å; K148-R152 WeakPolarHBondContact O-CB 3.49Å; K148-R152 WeakPolarHBondContact O-CG 3.26Å; K148-R152 PolarHBondContact O-N 2.84Å; F149-R152 PolarHBondContact O-N 3.25Å; R152-E155 PolarHBondContact O-N 3.2Å; R152-R156 WeakPolarHBondContact O-CB 3.48Å; R152-R156 WeakPolarHBondContact O-CG 3.42Å; R152-R156 PolarHBondContact O-N 3.35Å
153	N	67	Low	65.6	Low	82 Å²	82	135.2 Å²	135.2	44%	0.439	64%	0.643	S	S	.	*	H	α-helix	trans	-71.5	-40.4	176.2	-144.3	31.1	0	0	0	110.3	F149 K150 R151 R156 L157	F149-N153 VanDerWaalsContact O-CB 3.29Å; F149-N153 WeakPolarHBondContact O-CB 3.39Å; F149-N153 PolarHBondContact O-N 2.85Å; K150-N153 PolarHBondContact O-N 3.38Å; R151-N153 VanDerWaalsContact C-N 3.3Å; R151-N153 PolarHBondContact O-N 3.41Å; N153-R156 PolarHBondContact O-N 3.46Å; N153-L157 WeakPolarHBondContact O-CB 3.25Å; N153-L157 WeakPolarHBondContact O-CD1 3.34Å; N153-L157 PolarHBondContact O-N 3.44Å; N153-L157 VanDerWaalsContact O-N 3.08Å
154	Q	58.6	Low	62.6	Low	134 Å²	134	144.4 Å²	144.4	63%	0.626	67%	0.67	S	S	*	*	H	α-helix	trans	-61.5	-39.6	169.8	-104	179.2	-52.1	0	0	112.7	K150 R151 L157	K150-Q154 WeakPolarHBondContact O-CB 3.48Å; K150-Q154 PolarHBondContact O-N 2.92Å; R151-Q154 WeakPolarHBondContact O-CB 3.4Å; R151-Q154 PolarHBondContact O-N 3.44Å; Q154-L157 PolarHBondContact O-N 3.3Å
155	E	58.3	Low	59.7	Low	106 Å²	106	143.2 Å²	143.2	50%	0.495	67%	0.674	S	S	.	*	H	α-helix	trans	-76.4	-25	177.3	-71.7	168.6	-173.2	0	0	112.4	R151 R152 P159	R151-E155 WeakPolarHBondContact CG-OE1 3.34Å; R151-E155 IonicContact CZ-OE1 2.73Å; R151-E155 IonicContact NE-OE1 3.19Å; R151-E155 PolarHBondContact NE-OE1 3.04Å; R151-E155 IonicContact NH2-OE1 3.44Å; R151-E155 WeakPolarHBondContact O-CB 3.5Å; R151-E155 WeakPolarHBondContact O-CG 3.15Å; R151-E155 PolarHBondContact O-N 2.59Å; R152-E155 PolarHBondContact O-N 3.2Å; E155-P159 WeakPolarHBondContact O-CD 3.48Å
156	R	55.1	Low	56.7	Low	201 Å²	201	146.4 Å²	146.4	76%	0.758	69%	0.688	S	S	*	*	H	α-helix	trans	-78.2	-19.5	170.6	-83.1	-172.6	179.2	-171.9	-0.2	113.7	R152 N153 N158	R152-R156 WeakPolarHBondContact O-CB 3.48Å; R152-R156 WeakPolarHBondContact O-CG 3.42Å; R152-R156 PolarHBondContact O-N 3.35Å; N153-R156 PolarHBondContact O-N 3.46Å; R156-N158 VanDerWaalsContact C-N 3.3Å
157	L	51.5	Low	53.9	Low	127 Å²	127	148.5 Å²	148.5	67%	0.665	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	3.1	175	-89.5	152.2	0	0	0	113	N153 Q154	N153-L157 WeakPolarHBondContact O-CB 3.25Å; N153-L157 WeakPolarHBondContact O-CD1 3.34Å; N153-L157 PolarHBondContact O-N 3.44Å; N153-L157 VanDerWaalsContact O-N 3.08Å; Q154-L157 PolarHBondContact O-N 3.3Å
158	N	48.8	Very low	51.3	Low	137 Å²	137	147.9 Å²	147.9	73%	0.733	70%	0.704	S	S	*	*	S	Bend	trans	-137.3	23.4	-172.9	-142.3	17.1	0	0	0	117.3	R156	R156-N158 VanDerWaalsContact C-N 3.3Å
159	P	41	Very low	48.6	Very low	101 Å²	101	144.4 Å²	144.4	66%	0.656	71%	0.709	S	S	*	*	S	Bend	trans	-145	65	144.1	38.9	-24.5	0	0	0	112.7	E155	E155-P159 WeakPolarHBondContact O-CD 3.48Å
160	R	37.3	Very low	46.3	Very low	227 Å²	227	145.6 Å²	145.6	86%	0.857	72%	0.721	S	S	*	*			trans	-128.6	8.9	165.5	-84.9	-168.6	166.4	167	-5.1	115.4
161	D	36.4	Very low	44.3	Very low	153 Å²	153	145.2 Å²	145.2	82%	0.818	73%	0.725	S	S	*	*	S	Bend	trans	-95.1	19.5	178.2	-66.1	-23.2	0	0	0	114
162	V	38.8	Very low	42	Very low	136 Å²	136	143.3 Å²	143.3	82%	0.824	73%	0.732	S	S	*	*	S	Bend	trans	-131.9	67.8	174.8	-166.4	0	0	0	0	110.3
163	E	37.4	Very low	39.9	Very low	184 Å²	184	141 Å²	141	86%	0.86	74%	0.737	S	S	*	*	S	Bend	trans	170.5	86.2	147.4	-103.8	-179.6	146.1	0	0	109.6
164	Y	31.8	Very low	38.3	Very low	224 Å²	224	144.5 Å²	144.5	88%	0.878	76%	0.755	S	S	*	*			trans	-166.1	83.6	130.4	-138.3	-101.1	0	0	0	108.9
165	G	29.8	Very low	37.4	Very low	57 Å²	57	145.6 Å²	145.6	59%	0.588	77%	0.771	S	S	*	*			trans	-75.6	157.2	158.6	0	0	0	0	0	109.9
166	T	29.3	Very low	36.5	Very low	123 Å²	123	143.7 Å²	143.7	76%	0.755	78%	0.78	S	S	*	*			trans	77	97	169.1	56.9	0	0	0	0	117
167	I	31.4	Very low	35.6	Very low	153 Å²	153	140.6 Å²	140.6	79%	0.785	78%	0.779	S	S	*	*				-170.9	129.7	92.9	-84.3	154.7	0	0	0	110.3
168	E	31.4	Very low	35.4	Very low	189 Å²	189	137.6 Å²	137.6	88%	0.883	77%	0.768	S	S	*	*			trans	46.3	119.1	158.6	-71.5	179	148.5	0	0	122.9
169	G	29.8	Very low	35.6	Very low	71 Å²	71	135.4 Å²	135.4	73%	0.732	76%	0.76	S	S	*	*				125.7	74.3	129.7	0	0	0	0	0	118.9
170	L	30	Very low	35.9	Very low	162 Å²	162	132 Å²	132	85%	0.848	74%	0.736	S	S	*	*			trans	83.5	117.1	151.7	-88	95.6	0	0	0	121.7
171	I	36.9	Very low	36.7	Very low	143 Å²	143	122.8 Å²	122.8	73%	0.733	71%	0.708	S	S	*	*			trans	76.2	92.1	152	-48.1	176.4	0	0	0	116.9
172	T	27.5	Very low	37.4	Very low	126 Å²	126	119.4 Å²	119.4	77%	0.773	69%	0.69	S	S	*	*			trans	-65.4	126.3	155.1	55.3	0	0	0	0	111
173	T	29.9	Very low	38	Very low	125 Å²	125	117 Å²	117	77%	0.767	67%	0.673	S	S	*	*			trans	-129.2	137	145.5	47.3	0	0	0	0	108.9
174	N	32.8	Very low	38.9	Very low	155 Å²	155	109 Å²	109	83%	0.829	64%	0.636	S	S	*	*			trans	-68.5	153.4	-164.6	-70.7	-34.9	0	0	0	113.9	G176	N174-G176 PolarHBondContact O-N 2.8Å
175	V	39.1	Very low	40	Very low	157 Å²	157	102.9 Å²	102.9	95%	0.952	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.7	115.6	162.1	177.7	0	0	0	0	109.7
176	G	40.6	Very low	40.7	Very low	67 Å²	67	106.2 Å²	106.2	69%	0.691	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	168.4	-44.1	175.8	0	0	0	0	0	115.7	N174	N174-G176 PolarHBondContact O-N 2.8Å
177	D	36.6	Very low	41.5	Very low	136 Å²	136	103 Å²	103	73%	0.727	60%	0.6	S	S	*	*			trans	-131.3	121.2	-171.7	-65.2	-41.2	0	0	0	110.9	T179	D177-T179 PolarHBondContact O-N 3.09Å
178	S	46.5	Very low	42.2	Very low	64 Å²	64	96.4 Å²	96.4	45%	0.448	57%	0.567	S	S	.	*			trans	-70.3	80.2	174.8	52.6	0	0	0	0	109.7	L180 A181 D182	S178-L180 PolarHBondContact O-N 2.8Å; S178-A181 PolarHBondContact O-N 3.29Å; S178-A181 WeakPolarHBondContact OG-CB 3.36Å; S178-D182 PolarHBondContact O-N 3Å; S178-D182 VanDerWaalsContact O-N 3.17Å
179	T	52.3	Low	42.6	Very low	91 Å²	91	92.1 Å²	92.1	56%	0.558	55%	0.554	S	S	*	*	H	α-helix	trans	-51.6	-25.7	176.7	53.2	0	0	0	0	112.6	D177 L183	D177-T179 PolarHBondContact O-N 3.09Å; T179-L183 VanDerWaalsContact O-CB 3.31Å; T179-L183 WeakPolarHBondContact O-CB 3.42Å; T179-L183 WeakPolarHBondContact O-CD1 3.43Å; T179-L183 WeakPolarHBondContact O-CG 3.31Å; T179-L183 PolarHBondContact O-N 3.42Å
180	L	48.3	Very low	43.2	Very low	30 Å²	30	94.1 Å²	94.1	16%	0.157	56%	0.557	C	S	.	*	H	α-helix	trans	-77.8	-36.5	175.4	-173	64.4	0	0	0	114.2	S178 D182 L183 L184 Q228 E230	S178-L180 PolarHBondContact O-N 2.8Å; L180-D182 VanDerWaalsContact C-N 3.29Å; L180-L183 HydrophobicContact CD1-CB 4.41Å; L180-L183 CarbonylContact O-C 3.59Å; L180-L183 PolarHBondContact O-N 2.66Å; L180-L184 WeakPolarHBondContact O-CG 3.35Å; L180-L184 PolarHBondContact O-N 3.25Å; L180-Q228 VanDerWaalsContact CD1-OE1 3.31Å; L180-Q228 HydrophobicContact CD2-CB 3.35Å; L180-Q228 HydrophobicContact CD2-CG 4.38Å; L180-Q228 WeakPolarHBondContact CD2-O 3.23Å; L180-E230 HydrophobicContact CD2-CG 3.93Å; L180-E230 HydrophobicContact CG-CG 4.37Å
181	A	53.9	Low	44	Very low	33 Å²	33	89.6 Å²	89.6	27%	0.273	55%	0.55	S	S	.	.	H	α-helix	trans	-64.1	-41.8	172.4	0	0	0	0	0	109.8	S178 L183 L184 D185	S178-A181 PolarHBondContact O-N 3.29Å; S178-A181 WeakPolarHBondContact OG-CB 3.36Å; A181-L183 VanDerWaalsContact C-N 3.31Å; A181-L183 PolarHBondContact O-N 3.45Å; A181-L184 PolarHBondContact O-N 2.66Å; A181-D185 PolarHBondContact O-N 3.09Å
182	D	52.1	Low	44.5	Very low	81 Å²	81	87.4 Å²	87.4	43%	0.433	55%	0.547	S	S	.	.	H	α-helix	trans	-66.2	-31.8	172.8	-71.3	-18.3	0	0	0	112	S178 L180 D185 H186	S178-D182 PolarHBondContact O-N 3Å; S178-D182 VanDerWaalsContact O-N 3.17Å; L180-D182 VanDerWaalsContact C-N 3.29Å; D182-D185 CarbonylContact O-C 3.56Å; D182-D185 PolarHBondContact O-N 3.02Å; D182-H186 WeakPolarHBondContact O-CA 3.42Å; D182-H186 WeakPolarHBondContact O-CB 3.44Å; D182-H186 PolarHBondContact O-CD2 3.24Å; D182-H186 PolarHBondContact O-N 3.46Å
183	L	51.2	Low	45.6	Very low	87 Å²	87	82.9 Å²	82.9	46%	0.455	53%	0.526	S	S	.	.	H	α-helix	trans	-75.2	-31	171.5	-75.5	165.3	0	0	0	112.6	T179 L180 A181 S187	T179-L183 VanDerWaalsContact O-CB 3.31Å; T179-L183 WeakPolarHBondContact O-CB 3.42Å; T179-L183 WeakPolarHBondContact O-CD1 3.43Å; T179-L183 WeakPolarHBondContact O-CG 3.31Å; T179-L183 PolarHBondContact O-N 3.42Å; L180-L183 HydrophobicContact CD1-CB 4.41Å; L180-L183 CarbonylContact O-C 3.59Å; L180-L183 PolarHBondContact O-N 2.66Å; A181-L183 VanDerWaalsContact C-N 3.31Å; A181-L183 PolarHBondContact O-N 3.45Å; L183-S187 WeakPolarHBondContact CB-OG 3.22Å; L183-S187 WeakPolarHBondContact CD2-OG 3.4Å; L183-S187 WeakPolarHBondContact O-CA 3.08Å; L183-S187 WeakPolarHBondContact O-CB 3.49Å; L183-S187 PolarHBondContact O-N 3.03Å; L183-S187 PolarHBondContact O-OG 3.18Å
184	L	55.7	Low	47	Very low	16 Å²	16	77.3 Å²	77.3	8%	0.084	49%	0.492	C	S	.	.	H	α-helix	trans	-69.5	-29.4	170.4	-73.5	168.6	0	0	0	111.1	L180 A181 C188 W227 R258 I266	L180-L184 WeakPolarHBondContact O-CG 3.35Å; L180-L184 PolarHBondContact O-N 3.25Å; A181-L184 PolarHBondContact O-N 2.66Å; L184-C188 PolarHBondContact O-SG 3.31Å; L184-W227 HydrophobicContact CD2-CE3 4.4Å; L184-W227 HydrophobicContact CD2-CH2 4.37Å; L184-W227 HydrophobicContact CD2-CZ3 3.57Å; L184-R258 PolarHBondContact O-NH2 2.97Å; L184-I266 HydrophobicContact CD2-CG2 4.26Å
185	D	55.1	Low	48.1	Very low	94 Å²	94	70.5 Å²	70.5	50%	0.503	46%	0.458	S	S	.	.	H	α-helix	trans	-79.5	-40.7	171.8	-106.1	-7.9	0	0	0	113.2	A181 D182 R258	A181-D185 PolarHBondContact O-N 3.09Å; D182-D185 CarbonylContact O-C 3.56Å; D182-D185 PolarHBondContact O-N 3.02Å; D185-R258 PolarHBondContact O-NH2 2.73Å; D185-R258 IonicContact OD1-NH2 2.81Å; D185-R258 PolarHBondContact OD1-NH2 3.29Å
186	H	43.9	Very low	48.9	Very low	128 Å²	128	63.9 Å²	63.9	59%	0.593	42%	0.417	S	S	*	.	H	α-helix	trans	-95.7	-36.9	-174.7	-75.9	-50.7	0	0	0	115.4	D182 C188 T189	D182-H186 WeakPolarHBondContact O-CA 3.42Å; D182-H186 WeakPolarHBondContact O-CB 3.44Å; D182-H186 PolarHBondContact O-CD2 3.24Å; D182-H186 PolarHBondContact O-N 3.46Å; H186-C188 PolarHBondContact O-N 3.04Å; H186-T189 WeakPolarHBondContact O-CB 3.29Å; H186-T189 PolarHBondContact O-N 3.49Å; H186-T189 PolarHBondContact O-OG1 2.88Å
187	S	45.6	Very low	49.8	Very low	54 Å²	54	64.7 Å²	64.7	38%	0.378	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-10.8	178.6	-41.3	0	0	0	0	112.8	L183	L183-S187 WeakPolarHBondContact CB-OG 3.22Å; L183-S187 WeakPolarHBondContact CD2-OG 3.4Å; L183-S187 WeakPolarHBondContact O-CA 3.08Å; L183-S187 WeakPolarHBondContact O-CB 3.49Å; L183-S187 PolarHBondContact O-N 3.03Å; L183-S187 PolarHBondContact O-OG 3.18Å
188	C	47.5	Very low	50.6	Low	15 Å²	15	64.2 Å²	64.2	10%	0.101	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	12.9	174.6	-58.4	0	0	0	0	113.4	L184 H186	L184-C188 PolarHBondContact O-SG 3.31Å; H186-C188 PolarHBondContact O-N 3.04Å
189	T	40	Very low	50.4	Low	99 Å²	99	68.2 Å²	68.2	61%	0.607	42%	0.417	S	S	*	.			trans	-99.2	-3.3	176.3	58	0	0	0	0	114.3	H186 G191	H186-T189 WeakPolarHBondContact O-CB 3.29Å; H186-T189 PolarHBondContact O-N 3.49Å; H186-T189 PolarHBondContact O-OG1 2.88Å; T189-G191 PolarHBondContact O-N 3.19Å
190	S	42	Very low	50.7	Low	113 Å²	113	66.9 Å²	66.9	79%	0.79	41%	0.409	S	S	*	.	S	Bend	trans	-89.7	104.4	175.1	-133.5	0	0	0	0	110.3
191	G	46.5	Very low	51.2	Low	67 Å²	67	65.9 Å²	65.9	69%	0.691	40%	0.404	S	S	*	.	S	Bend	trans	-55.8	129.7	-161.6	0	0	0	0	0	116.3	T189	T189-G191 PolarHBondContact O-N 3.19Å
192	S	47.7	Very low	51.5	Low	97 Å²	97	72.1 Å²	72.1	68%	0.678	42%	0.42	S	S	*	.	S	Bend	trans	172.4	-3.8	143.2	-75	0	0	0	0	111.9	V255	S192-V255 WeakPolarHBondContact O-CG2 3.3Å
193	G	51.3	Low	52.4	Low	32 Å²	32	71.1 Å²	71.1	33%	0.33	42%	0.417	S	S	.	.	S	Bend	trans	-166.1	164.6	174.5	0	0	0	0	0	112.8	G195	G193-G195 VanDerWaalsContact C-N 3.26Å; G193-G195 PolarHBondContact O-N 3.11Å
194	S	57.9	Low	53.8	Low	8 Å²	8	67 Å²	67	6%	0.056	40%	0.396	C	S	.	.	S	Bend	trans	-78.2	3.4	-171.9	-36.2	0	0	0	0	115.7	Y252 T254	S194-Y252 WeakPolarHBondContact CB-O 2.97Å; S194-Y252 PolarHBondContact OG-O 3.16Å; S194-T254 PolarHBondContact OG-O 3.19Å; S194-T254 VanDerWaalsContact OG-O 3.07Å
195	G	56.9	Low	55.1	Low	11 Å²	11	66.3 Å²	66.3	11%	0.113	39%	0.392	C	S	.	.	S	Bend	trans	-143.2	-170	-173.2	0	0	0	0	0	113.3	G193	G193-G195 VanDerWaalsContact C-N 3.26Å; G193-G195 PolarHBondContact O-N 3.11Å
196	L	55.8	Low	56.5	Low	18 Å²	18	71.9 Å²	71.9	9%	0.094	41%	0.406	C	S	.	.	S	Bend	trans	-63.4	156.1	-179.4	-68.1	164.8	0	0	0	111.9	V200 Q201 V204 W227 I266	L196-V200 HydrophobicContact CB-CB 4.29Å; L196-V200 HydrophobicContact CB-CG1 4.26Å; L196-V200 HydrophobicContact CD1-CG1 4.04Å; L196-Q201 HydrophobicContact CB-CG 4.27Å; L196-Q201 WeakPolarHBondContact O-CG 3.46Å; L196-Q201 PolarHBondContact O-NE2 3.42Å; L196-V204 HydrophobicContact CD1-CG2 4.43Å; L196-W227 HydrophobicContact CD1-CH2 3.54Å; L196-W227 HydrophobicContact CD1-CZ2 4.42Å; L196-W227 HydrophobicContact CD1-CZ3 4.14Å; L196-I266 HydrophobicContact CD1-CG2 3.89Å; L196-I266 PolarHBondContact N-O 3.25Å; L196-I266 VanDerWaalsContact N-O 3.11Å
197	P	59.2	Low	58.6	Low	84 Å²	84	70.5 Å²	70.5	55%	0.545	40%	0.4	S	S	.	.			trans	-52.6	142.5	173.7	-25.1	33.7	0	0	0	112.4	L199 V200 Q201	P197-L199 VanDerWaalsContact C-N 3.26Å; P197-L199 PolarHBondContact O-N 2.96Å; P197-V200 HydrophobicContact CB-CG2 4.41Å; P197-V200 WeakPolarHBondContact O-CA 3.33Å; P197-V200 WeakPolarHBondContact O-CB 3.45Å; P197-V200 PolarHBondContact O-N 2.78Å; P197-Q201 PolarHBondContact O-N 3.35Å
198	F	54.2	Low	60.8	Low	127 Å²	127	68.1 Å²	68.1	56%	0.557	38%	0.383	S	S	*	.	H	α-helix	trans	-51.5	-36.8	-171	-172.6	-98.5	0	0	0	115	Q201	F198-Q201 PolarHBondContact O-N 3.27Å
199	L	41.8	Very low	63	Low	147 Å²	147	71.7 Å²	71.7	77%	0.77	40%	0.404	S	S	*	.	H	α-helix	trans	-70.9	-29	178.1	-68.3	175.4	0	0	0	113.2	P197	P197-L199 VanDerWaalsContact C-N 3.26Å; P197-L199 PolarHBondContact O-N 2.96Å
200	V	58.5	Low	65.6	Low	64 Å²	64	68.8 Å²	68.8	39%	0.388	39%	0.385	S	S	.	.	H	α-helix	trans	-74	-39.1	174.2	-178	0	0	0	0	109.7	L196 P197 R202 T203 V204	L196-V200 HydrophobicContact CB-CB 4.29Å; L196-V200 HydrophobicContact CB-CG1 4.26Å; L196-V200 HydrophobicContact CD1-CG1 4.04Å; P197-V200 HydrophobicContact CB-CG2 4.41Å; P197-V200 WeakPolarHBondContact O-CA 3.33Å; P197-V200 WeakPolarHBondContact O-CB 3.45Å; P197-V200 PolarHBondContact O-N 2.78Å; V200-R202 VanDerWaalsContact C-N 3.32Å; V200-R202 PolarHBondContact O-N 2.97Å; V200-T203 PolarHBondContact O-N 3.06Å; V200-T203 PolarHBondContact O-OG1 3.44Å; V200-V204 VanDerWaalsContact O-CG2 3.27Å; V200-V204 WeakPolarHBondContact O-CG2 3.5Å
201	Q	59.4	Low	68.1	Low	8 Å²	8	67.2 Å²	67.2	4%	0.037	37%	0.367	C	S	.	.	H	α-helix	trans	-56	-39.7	-178.6	-64.7	-174.5	-0.6	0	0	113.5	L196 P197 F198 T203 V204 A267 D269	L196-Q201 HydrophobicContact CB-CG 4.27Å; L196-Q201 WeakPolarHBondContact O-CG 3.46Å; L196-Q201 PolarHBondContact O-NE2 3.42Å; P197-Q201 PolarHBondContact O-N 3.35Å; F198-Q201 PolarHBondContact O-N 3.27Å; Q201-T203 PolarHBondContact O-N 3.39Å; Q201-T203 VanDerWaalsContact O-N 3.08Å; Q201-V204 PolarHBondContact O-N 3.23Å; Q201-A267 HydrophobicContact CB-CB 4.09Å; Q201-A267 HydrophobicContact CG-CB 3.92Å; Q201-D269 VanDerWaalsContact O-CG 3.24Å
202	R	59.9	Low	70.4	Confident	164 Å²	164	68.2 Å²	68.2	62%	0.619	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	5.6	-177.3	-73	-169.6	172.5	-171.3	-3.2	116.2	V200 D269	V200-R202 VanDerWaalsContact C-N 3.32Å; V200-R202 PolarHBondContact O-N 2.97Å; R202-D269 VanDerWaalsContact C-OD2 3.32Å; R202-D269 WeakPolarHBondContact CA-OD1 3.45Å
203	T	69.8	Low	72.6	Confident	60 Å²	60	66.1 Å²	66.1	37%	0.368	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	-5.6	178	62.7	0	0	0	0	113.4	V200 Q201 A205 R206 D269	V200-T203 PolarHBondContact O-N 3.06Å; V200-T203 PolarHBondContact O-OG1 3.44Å; Q201-T203 PolarHBondContact O-N 3.39Å; Q201-T203 VanDerWaalsContact O-N 3.08Å; T203-A205 PolarHBondContact O-N 3.45Å; T203-R206 PolarHBondContact O-N 3.27Å; T203-D269 PolarHBondContact N-OD2 2.91Å
204	V	81.1	Confident	74.5	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.006	34%	0.342	C	S	.	.	H	α-helix	trans	-65.9	-39.6	-173.8	-173.7	0	0	0	0	110.7	L196 V200 Q201 R206 Q207 I208 W227 A267 D269 I282	L196-V204 HydrophobicContact CD1-CG2 4.43Å; V200-V204 VanDerWaalsContact O-CG2 3.27Å; V200-V204 WeakPolarHBondContact O-CG2 3.5Å; Q201-V204 PolarHBondContact O-N 3.23Å; V204-R206 PolarHBondContact O-N 2.86Å; V204-R206 VanDerWaalsContact O-N 3.15Å; V204-Q207 PolarHBondContact O-N 2.71Å; V204-I208 HydrophobicContact CG1-CD1 3.75Å; V204-I208 HydrophobicContact CG1-CG1 4.27Å; V204-I208 WeakPolarHBondContact O-CG1 3.48Å; V204-I208 PolarHBondContact O-N 2.89Å; V204-W227 HydrophobicContact CG1-CD2 4.03Å; V204-W227 HydrophobicContact CG1-CE3 4.43Å; V204-W227 HydrophobicContact CG1-CG 4.47Å; V204-W227 HydrophobicContact CG1-CZ2 4.09Å; V204-W227 HydrophobicContact CG2-CZ2 4.47Å; V204-A267 HydrophobicContact CB-CB 4.29Å; V204-A267 HydrophobicContact CG2-CB 3.94Å; V204-D269 PolarHBondContact N-OD2 2.9Å; V204-I282 HydrophobicContact CB-CD1 4.08Å; V204-I282 HydrophobicContact CG1-CD1 3.87Å
205	A	83.4	Confident	75.8	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.008	35%	0.354	C	S	.	.	H	α-helix	trans	-63	-26.1	-178.7	0	0	0	0	0	113.3	T203 Q207 D269 W280	T203-A205 PolarHBondContact O-N 3.45Å; A205-Q207 VanDerWaalsContact C-N 3.29Å; A205-D269 HydrophobicContact CB-CB 3.82Å; A205-D269 VanDerWaalsContact CB-OD2 3.28Å; A205-D269 WeakPolarHBondContact CB-OD2 3.47Å; A205-D269 PolarHBondContact N-OD2 2.93Å; A205-W280 HydrophobicContact CB-CD2 4.04Å; A205-W280 HydrophobicContact CB-CE3 3.58Å; A205-W280 HydrophobicContact CB-CZ3 4.02Å
206	R	84	Confident	77.2	Confident	211 Å²	211	75.9 Å²	75.9	80%	0.796	38%	0.382	S	S	*	.	H	α-helix	trans	-71.9	-25.1	176.3	-68.1	-177.5	175.5	175.7	-1.3	112.8	T203 V204	T203-R206 PolarHBondContact O-N 3.27Å; V204-R206 PolarHBondContact O-N 2.86Å; V204-R206 VanDerWaalsContact O-N 3.15Å
207	Q	87.9	Confident	77.8	Confident	99 Å²	99	77.4 Å²	77.4	46%	0.463	40%	0.401	S	S	.	.	H	α-helix	trans	-95.3	-8.8	-177.7	-60.7	-179.6	-4.1	0	0	112.8	V204 A205	V204-Q207 PolarHBondContact O-N 2.71Å; A205-Q207 VanDerWaalsContact C-N 3.29Å
208	I	92.3	Very high	78.3	Confident	4 Å²	4	81.8 Å²	81.8	2%	0.021	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-90.5	126.9	-179.7	-70.2	166.9	0	0	0	111	V204 L210 S226 W227 V232 V234 R273 W280 I282	V204-I208 HydrophobicContact CG1-CD1 3.75Å; V204-I208 HydrophobicContact CG1-CG1 4.27Å; V204-I208 WeakPolarHBondContact O-CG1 3.48Å; V204-I208 PolarHBondContact O-N 2.89Å; I208-L210 HydrophobicContact CG2-CD2 4.35Å; I208-S226 WeakPolarHBondContact CA-O 3.47Å; I208-W227 HydrophobicContact CG1-CB 3.85Å; I208-W227 HydrophobicContact CG1-CG 3.98Å; I208-V232 HydrophobicContact CD1-CG2 4.14Å; I208-V232 HydrophobicContact CG1-CG2 4.3Å; I208-V232 HydrophobicContact CG2-CG2 4.35Å; I208-V234 HydrophobicContact CD1-CG2 4.35Å; I208-V234 HydrophobicContact CG2-CG2 4.03Å; I208-R273 PolarHBondContact O-NH2 2.87Å; I208-W280 HydrophobicContact CB-CZ3 3.8Å; I208-W280 HydrophobicContact CD1-CE3 4.43Å; I208-W280 HydrophobicContact CD1-CZ3 4.25Å; I208-W280 HydrophobicContact CG2-CH2 4.31Å; I208-W280 HydrophobicContact CG2-CZ3 3.72Å; I208-I282 HydrophobicContact CD1-CD1 3.56Å; I208-I282 HydrophobicContact CD1-CG1 3.86Å; I208-I282 HydrophobicContact CD1-CG2 3.88Å
209	T	93.7	Very high	79.1	Confident	90 Å²	90	77 Å²	77	55%	0.552	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	120.3	167.6	-57.1	0	0	0	0	109.3	L211 G225 S226	T209-L211 HydrophobicContact CG2-CD2 4.31Å; T209-G225 CarbonylContact O-C 3.54Å; T209-G225 WeakPolarHBondContact O-CA 3.38Å; T209-S226 PolarHBondContact N-O 2.62Å; T209-S226 PolarHBondContact O-N 2.72Å
210	L	94.6	Very high	81	Confident	39 Å²	39	71 Å²	71	20%	0.204	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	132.5	173.3	-61.7	179	0	0	0	109.2	I208 W223 V234 I236 W280	I208-L210 HydrophobicContact CG2-CD2 4.35Å; L210-W223 HydrophobicContact CB-CE3 3.95Å; L210-W223 HydrophobicContact CB-CZ3 4.47Å; L210-W223 HydrophobicContact CD1-CD2 4.41Å; L210-W223 HydrophobicContact CD2-CB 3.88Å; L210-W223 HydrophobicContact CD2-CG 4.39Å; L210-V234 HydrophobicContact CD2-CB 4.06Å; L210-V234 HydrophobicContact CD2-CG1 4.23Å; L210-V234 HydrophobicContact CD2-CG2 4.07Å; L210-I236 HydrophobicContact CD1-CD1 3.67Å; L210-I236 HydrophobicContact CD2-CD1 4.31Å; L210-W280 HydrophobicContact CD1-CH2 4.02Å; L210-W280 HydrophobicContact CD1-CZ2 3.83Å; L210-W280 HydrophobicContact CD2-CH2 3.61Å; L210-W280 HydrophobicContact CD2-CZ2 4.09Å; L210-W280 HydrophobicContact CD2-CZ3 4.12Å; L210-W280 HydrophobicContact CG-CH2 3.74Å; L210-W280 HydrophobicContact CG-CZ2 4.1Å
211	L	94.8	Very high	82.5	Confident	79 Å²	79	71 Å²	71	41%	0.414	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-67.5	-177.3	-57.6	178.9	0	0	0	111.1	T209 R224	T209-L211 HydrophobicContact CG2-CD2 4.31Å; L211-R224 WeakPolarHBondContact CA-O 3.32Å; L211-R224 WeakPolarHBondContact CB-O 3.21Å; L211-R224 PolarHBondContact N-O 3.04Å
212	E	94.4	Very high	84.1	Confident	89 Å²	89	72.5 Å²	72.5	42%	0.416	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	148.2	-176.8	71.5	-166.6	142.2	0	0	112	V214 W223 R224	E212-V214 HydrophobicContact CG-CG1 3.98Å; E212-V214 PolarHBondContact O-N 3.42Å; E212-W223 CarbonylContact O-C 3.5Å; E212-W223 WeakPolarHBondContact O-CA 3.42Å; E212-R224 HydrophobicContact CG-CB 4.11Å; E212-R224 PolarHBondContact N-O 3.34Å; E212-R224 PolarHBondContact O-N 3.04Å; E212-R224 IonicContact OE1-CZ 3.49Å; E212-R224 IonicContact OE1-NE 3.48Å; E212-R224 PolarHBondContact OE1-NE 3.32Å; E212-R224 IonicContact OE1-NH2 2.67Å; E212-R224 PolarHBondContact OE1-NH2 3.48Å
213	C	94.1	Very high	85.8	Confident	53 Å²	53	67.8 Å²	67.8	36%	0.358	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	117.3	173.1	-170.6	0	0	0	0	108.7	W223	C213-W223 HydrophobicContact CB-CD2 4.06Å; C213-W223 HydrophobicContact CB-CE3 4.34Å; C213-W223 HydrophobicContact CB-CH2 4.21Å; C213-W223 HydrophobicContact CB-CZ2 3.91Å; C213-W223 HydrophobicContact CB-CZ3 4.41Å
214	V	91.6	Very high	87.1	Confident	67 Å²	67	67.8 Å²	67.8	41%	0.406	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-15.6	-177.5	-63.4	0	0	0	0	112.8	E212 V222 R224 Y285	E212-V214 HydrophobicContact CG-CG1 3.98Å; E212-V214 PolarHBondContact O-N 3.42Å; V214-V222 HydrophobicContact CG2-CB 4.06Å; V214-V222 HydrophobicContact CG2-CG1 3.71Å; V214-V222 VanDerWaalsContact CG2-O 3.28Å; V214-V222 WeakPolarHBondContact CG2-O 3.28Å; V214-V222 PolarHBondContact N-O 3Å; V214-R224 HydrophobicContact CG1-CB 3.87Å; V214-Y285 HydrophobicContact CG1-CE2 4.21Å
215	G	85.7	Confident	87.8	Confident	29 Å²	29	67.8 Å²	67.8	30%	0.299	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	156	175.8	0	0	0	0	0	113.3	V222	G215-V222 PolarHBondContact N-O 2.76Å; G215-V222 PolarHBondContact O-N 3.27Å
216	K	84.3	Confident	88.3	Confident	160 Å²	160	69.4 Å²	69.4	70%	0.696	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	119.2	168.9	-57.6	-163.6	-174.6	-146.2	0	108.3	E221	K216-E221 HydrophobicContact CD-CG 4.4Å; K216-E221 VanDerWaalsContact CE-OE1 3.28Å; K216-E221 WeakPolarHBondContact CE-OE1 3.33Å; K216-E221 HydrophobicContact CG-CG 4.19Å; K216-E221 IonicContact NZ-OE1 3.78Å; K216-E221 PolarHBondContact NZ-OE1 3.37Å
217	G	70	Confident	88.7	Confident	49 Å²	49	60 Å²	60	51%	0.505	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-174.8	179	0	0	0	0	0	112	Y219 G220	G217-Y219 VanDerWaalsContact C-N 3.32Å; G217-Y219 PolarHBondContact O-N 2.86Å; G217-G220 PolarHBondContact N-O 3.07Å
218	R	69.2	Low	88.6	Confident	177 Å²	177	60.8 Å²	60.8	67%	0.668	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-36.6	179.1	179.3	176.1	173.1	179.4	0	113.3
219	Y	71.3	Confident	88.2	Confident	26 Å²	26	63.6 Å²	63.6	10%	0.102	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	6.4	-169.9	-50.5	-66.9	0	0	0	113.5	G217 F237 L357	G217-Y219 VanDerWaalsContact C-N 3.32Å; G217-Y219 PolarHBondContact O-N 2.86Å; Y219-F237 HydrophobicContact CG-CE1 4.49Å; Y219-F237 VanDerWaalsContact O-CD1 3.32Å; Y219-F237 WeakPolarHBondContact O-CD1 3.46Å; Y219-L357 WeakPolarHBondContact OH-CD2 3.42Å
220	G	80.9	Confident	87.9	Confident	21 Å²	21	62.5 Å²	62.5	22%	0.216	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.3	-171.6	-175.5	0	0	0	0	0	114.8	G217 I236	G217-G220 PolarHBondContact N-O 3.07Å; G220-I236 VanDerWaalsContact CA-O 3.24Å; G220-I236 WeakPolarHBondContact CA-O 3.25Å
221	E	90.3	Very high	87.9	Confident	63 Å²	63	64 Å²	64	29%	0.294	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	142.6	178.6	-57.3	-172.3	152.8	0	0	110.1	K216 W223 K235 I236	K216-E221 HydrophobicContact CD-CG 4.4Å; K216-E221 VanDerWaalsContact CE-OE1 3.28Å; K216-E221 WeakPolarHBondContact CE-OE1 3.33Å; K216-E221 HydrophobicContact CG-CG 4.19Å; K216-E221 IonicContact NZ-OE1 3.78Å; K216-E221 PolarHBondContact NZ-OE1 3.37Å; E221-W223 PolarHBondContact OE2-NE1 2.83Å; E221-W223 VanDerWaalsContact OE2-NE1 3.09Å; E221-K235 WeakPolarHBondContact O-CA 3.28Å; E221-I236 PolarHBondContact N-O 3.43Å; E221-I236 PolarHBondContact O-N 2.83Å
222	V	94	Very high	88	Confident	41 Å²	41	60.3 Å²	60.3	25%	0.248	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	126	172.5	-174	0	0	0	0	107.9	V214 G215 A233 V234 K235	V214-V222 HydrophobicContact CG2-CB 4.06Å; V214-V222 HydrophobicContact CG2-CG1 3.71Å; V214-V222 VanDerWaalsContact CG2-O 3.28Å; V214-V222 WeakPolarHBondContact CG2-O 3.28Å; V214-V222 PolarHBondContact N-O 3Å; G215-V222 PolarHBondContact N-O 2.76Å; G215-V222 PolarHBondContact O-N 3.27Å; V222-A233 HydrophobicContact CG1-CB 4.42Å; V222-V234 WeakPolarHBondContact CA-O 3.28Å; V222-K235 HydrophobicContact CG2-CB 4.28Å; V222-K235 HydrophobicContact CG2-CG 4.1Å
223	W	95.6	Very high	88	Confident	64 Å²	64	56.6 Å²	56.6	24%	0.242	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	142.7	-179.1	-74.9	73.9	0	0	0	110.4	L210 E212 C213 E221 A233 V234 I236	L210-W223 HydrophobicContact CB-CE3 3.95Å; L210-W223 HydrophobicContact CB-CZ3 4.47Å; L210-W223 HydrophobicContact CD1-CD2 4.41Å; L210-W223 HydrophobicContact CD2-CB 3.88Å; L210-W223 HydrophobicContact CD2-CG 4.39Å; E212-W223 CarbonylContact O-C 3.5Å; E212-W223 WeakPolarHBondContact O-CA 3.42Å; C213-W223 HydrophobicContact CB-CD2 4.06Å; C213-W223 HydrophobicContact CB-CE3 4.34Å; C213-W223 HydrophobicContact CB-CH2 4.21Å; C213-W223 HydrophobicContact CB-CZ2 3.91Å; C213-W223 HydrophobicContact CB-CZ3 4.41Å; E221-W223 PolarHBondContact OE2-NE1 2.83Å; E221-W223 VanDerWaalsContact OE2-NE1 3.09Å; W223-A233 CarbonylContact O-C 3.58Å; W223-A233 WeakPolarHBondContact O-CA 3.47Å; W223-V234 HydrophobicContact CB-CB 4.49Å; W223-V234 PolarHBondContact N-O 3.33Å; W223-V234 PolarHBondContact O-N 2.65Å; W223-I236 HydrophobicContact CG-CD1 4.21Å
224	R	96.7	Very high	88.1	Confident	61 Å²	61	54 Å²	54	23%	0.23	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	125.4	159.5	-175.4	174	67	116.8	-9.5	107.7	L211 E212 V214 N231 Y285	L211-R224 WeakPolarHBondContact CA-O 3.32Å; L211-R224 WeakPolarHBondContact CB-O 3.21Å; L211-R224 PolarHBondContact N-O 3.04Å; E212-R224 HydrophobicContact CG-CB 4.11Å; E212-R224 PolarHBondContact N-O 3.34Å; E212-R224 PolarHBondContact O-N 3.04Å; E212-R224 IonicContact OE1-CZ 3.49Å; E212-R224 IonicContact OE1-NE 3.48Å; E212-R224 PolarHBondContact OE1-NE 3.32Å; E212-R224 IonicContact OE1-NH2 2.67Å; E212-R224 PolarHBondContact OE1-NH2 3.48Å; V214-R224 HydrophobicContact CG1-CB 3.87Å; R224-N231 WeakPolarHBondContact CD-OD1 3.42Å; R224-N231 PolarHBondContact NH1-OD1 3.45Å; R224-Y285 HydrophobicContact CB-CD2 4.31Å; R224-Y285 HydrophobicContact CB-CE2 3.99Å; R224-Y285 VanDerWaalsContact CD-CZ 3.49Å; R224-Y285 HydrophobicContact CG-CD1 4.36Å; R224-Y285 HydrophobicContact CG-CD2 4.09Å; R224-Y285 HydrophobicContact CG-CE1 4.22Å; R224-Y285 HydrophobicContact CG-CE2 3.97Å; R224-Y285 HydrophobicContact CG-CG 4.3Å
225	G	95.8	Very high	88.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	162	173	0	0	0	0	0	111.5	T209 N231 V232	T209-G225 CarbonylContact O-C 3.54Å; T209-G225 WeakPolarHBondContact O-CA 3.38Å; G225-N231 WeakPolarHBondContact O-CA 3.05Å; G225-V232 PolarHBondContact N-O 3.25Å; G225-V232 PolarHBondContact O-N 3.43Å
226	S	94.3	Very high	88.6	Confident	36 Å²	36	51.7 Å²	51.7	25%	0.252	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.8	167	-177.7	0	0	0	0	109.6	I208 T209 E230	I208-S226 WeakPolarHBondContact CA-O 3.47Å; T209-S226 PolarHBondContact N-O 2.62Å; T209-S226 PolarHBondContact O-N 2.72Å; S226-E230 CarbonylContact C-O 3.56Å; S226-E230 WeakPolarHBondContact CA-O 3.34Å
227	W	91.4	Very high	88.9	Confident	12 Å²	12	44.2 Å²	44.2	5%	0.045	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	114.9	172.8	-173	38.8	0	0	0	109	L184 L196 V204 I208 G229 E230 V232 I266	L184-W227 HydrophobicContact CD2-CE3 4.4Å; L184-W227 HydrophobicContact CD2-CH2 4.37Å; L184-W227 HydrophobicContact CD2-CZ3 3.57Å; L196-W227 HydrophobicContact CD1-CH2 3.54Å; L196-W227 HydrophobicContact CD1-CZ2 4.42Å; L196-W227 HydrophobicContact CD1-CZ3 4.14Å; V204-W227 HydrophobicContact CG1-CD2 4.03Å; V204-W227 HydrophobicContact CG1-CE3 4.43Å; V204-W227 HydrophobicContact CG1-CG 4.47Å; V204-W227 HydrophobicContact CG1-CZ2 4.09Å; V204-W227 HydrophobicContact CG2-CZ2 4.47Å; I208-W227 HydrophobicContact CG1-CB 3.85Å; I208-W227 HydrophobicContact CG1-CG 3.98Å; W227-G229 PolarHBondContact O-N 2.79Å; W227-G229 VanDerWaalsContact O-N 3.13Å; W227-E230 PolarHBondContact N-O 3.09Å; W227-E230 PolarHBondContact O-N 2.92Å; W227-V232 HydrophobicContact CB-CG1 4.05Å; W227-V232 HydrophobicContact CB-CG2 4.21Å; W227-V232 HydrophobicContact CE3-CG1 4.4Å; W227-I266 HydrophobicContact CE3-CG2 4.38Å; W227-I266 HydrophobicContact CH2-CG2 4.49Å; W227-I266 HydrophobicContact CZ3-CG2 3.76Å
228	Q	86.3	Confident	89.8	Confident	116 Å²	116	44.4 Å²	44.4	54%	0.542	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	37.5	-179.3	-60.7	-180	3.5	0	0	113.6	L180 E230	L180-Q228 VanDerWaalsContact CD1-OE1 3.31Å; L180-Q228 HydrophobicContact CD2-CB 3.35Å; L180-Q228 HydrophobicContact CD2-CG 4.38Å; L180-Q228 WeakPolarHBondContact CD2-O 3.23Å; Q228-E230 VanDerWaalsContact C-N 3.33Å; Q228-E230 PolarHBondContact O-N 3.49Å
229	G	83.8	Confident	90.6	Very high	64 Å²	64	39 Å²	39	66%	0.66	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.2	-14.1	-179.4	0	0	0	0	0	115	W227	W227-G229 PolarHBondContact O-N 2.79Å; W227-G229 VanDerWaalsContact O-N 3.13Å
230	E	88.1	Confident	91.3	Very high	67 Å²	67	48.8 Å²	48.8	31%	0.313	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	148.3	-179.5	-68.3	-59.9	148	0	0	112.5	L180 S226 W227 Q228	L180-E230 HydrophobicContact CD2-CG 3.93Å; L180-E230 HydrophobicContact CG-CG 4.37Å; S226-E230 CarbonylContact C-O 3.56Å; S226-E230 WeakPolarHBondContact CA-O 3.34Å; W227-E230 PolarHBondContact N-O 3.09Å; W227-E230 PolarHBondContact O-N 2.92Å; Q228-E230 VanDerWaalsContact C-N 3.33Å; Q228-E230 PolarHBondContact O-N 3.49Å
231	N	93.9	Very high	91.6	Very high	70 Å²	70	50.2 Å²	50.2	37%	0.374	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	128.7	176	-70.2	-70.7	0	0	0	110.7	R224 G225 Y285	R224-N231 WeakPolarHBondContact CD-OD1 3.42Å; R224-N231 PolarHBondContact NH1-OD1 3.45Å; G225-N231 WeakPolarHBondContact O-CA 3.05Å; N231-Y285 HydrophobicContact CB-CD1 3.68Å; N231-Y285 HydrophobicContact CB-CG 4.09Å; N231-Y285 WeakPolarHBondContact O-CB 3.28Å
232	V	95.9	Very high	91.4	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	152.6	173.8	-63.7	0	0	0	0	110.5	I208 G225 W227 V234 I266 I282	I208-V232 HydrophobicContact CD1-CG2 4.14Å; I208-V232 HydrophobicContact CG1-CG2 4.3Å; I208-V232 HydrophobicContact CG2-CG2 4.35Å; G225-V232 PolarHBondContact N-O 3.25Å; G225-V232 PolarHBondContact O-N 3.43Å; W227-V232 HydrophobicContact CB-CG1 4.05Å; W227-V232 HydrophobicContact CB-CG2 4.21Å; W227-V232 HydrophobicContact CE3-CG1 4.4Å; V232-V234 HydrophobicContact CG2-CG2 4.11Å; V232-I266 HydrophobicContact CB-CD1 4.44Å; V232-I266 HydrophobicContact CG1-CD1 3.73Å; V232-I282 HydrophobicContact CB-CG2 4.08Å; V232-I282 HydrophobicContact CG1-CG2 4.43Å; V232-I282 HydrophobicContact CG2-CG2 4.29Å
233	A	96.1	Very high	91	Very high	11 Å²	11	59.7 Å²	59.7	9%	0.091	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	131.3	169.4	0	0	0	0	0	108.8	V222 W223 I282 T283 Y285	V222-A233 HydrophobicContact CG1-CB 4.42Å; W223-A233 CarbonylContact O-C 3.58Å; W223-A233 WeakPolarHBondContact O-CA 3.47Å; A233-I282 WeakPolarHBondContact O-CA 3.46Å; A233-T283 PolarHBondContact N-O 3.31Å; A233-T283 PolarHBondContact O-N 3.1Å; A233-Y285 HydrophobicContact CB-CD2 4.24Å
234	V	95.3	Very high	90.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	107	-179.2	-173.7	0	0	0	0	108.5	I208 L210 V222 W223 V232 I236 W280 I282	I208-V234 HydrophobicContact CD1-CG2 4.35Å; I208-V234 HydrophobicContact CG2-CG2 4.03Å; L210-V234 HydrophobicContact CD2-CB 4.06Å; L210-V234 HydrophobicContact CD2-CG1 4.23Å; L210-V234 HydrophobicContact CD2-CG2 4.07Å; V222-V234 WeakPolarHBondContact CA-O 3.28Å; W223-V234 HydrophobicContact CB-CB 4.49Å; W223-V234 PolarHBondContact N-O 3.33Å; W223-V234 PolarHBondContact O-N 2.65Å; V232-V234 HydrophobicContact CG2-CG2 4.11Å; V234-I236 HydrophobicContact CG1-CD1 4.41Å; V234-I236 HydrophobicContact CG1-CG1 3.81Å; V234-W280 HydrophobicContact CG1-CB 4.13Å; V234-W280 HydrophobicContact CG1-CD2 3.44Å; V234-W280 VanDerWaalsContact CG1-CD2 3.44Å; V234-W280 HydrophobicContact CG1-CE3 3.34Å; V234-W280 HydrophobicContact CG1-CG 3.81Å; V234-W280 HydrophobicContact CG1-CH2 4.43Å; V234-W280 HydrophobicContact CG1-CZ3 3.85Å; V234-W280 HydrophobicContact CG2-CE3 4.4Å; V234-W280 HydrophobicContact CG2-CZ3 4.36Å; V234-I282 HydrophobicContact CG1-CG1 4.5Å; V234-I282 HydrophobicContact CG2-CG1 4.48Å
235	K	94.3	Very high	90.2	Very high	28 Å²	28	56.7 Å²	56.7	12%	0.122	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115.1	170.7	-171.3	179	-173.9	-173.1	0	108	E221 V222 F237 E248 L281 D354	E221-K235 WeakPolarHBondContact O-CA 3.28Å; V222-K235 HydrophobicContact CG2-CB 4.28Å; V222-K235 HydrophobicContact CG2-CG 4.1Å; K235-F237 HydrophobicContact CB-CE2 4.08Å; K235-F237 HydrophobicContact CD-CE1 4.39Å; K235-F237 HydrophobicContact CD-CE2 3.69Å; K235-F237 HydrophobicContact CD-CZ 3.46Å; K235-F237 VanDerWaalsContact CD-CZ 3.46Å; K235-F237 VanDerWaalsContact CE-CZ 3.46Å; K235-F237 HydrophobicContact CG-CD2 4.29Å; K235-F237 HydrophobicContact CG-CE2 3.58Å; K235-F237 HydrophobicContact CG-CZ 3.8Å; K235-E248 IonicContact NZ-OE1 2.66Å; K235-E248 PolarHBondContact NZ-OE1 2.99Å; K235-E248 IonicContact NZ-OE2 3.34Å; K235-E248 PolarHBondContact NZ-OE2 3.06Å; K235-L281 HydrophobicContact CB-CB 4.28Å; K235-L281 HydrophobicContact CD-CD2 4.42Å; K235-L281 PolarHBondContact N-O 3.31Å; K235-L281 PolarHBondContact O-N 3.17Å; K235-D354 IonicContact NZ-OD1 3.25Å; K235-D354 PolarHBondContact NZ-OD1 2.61Å
236	I	92.9	Very high	89.9	Confident	19 Å²	19	62.3 Å²	62.3	10%	0.097	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	116.6	-175.7	-55	179.3	0	0	0	108.6	L210 G220 E221 W223 V234 Q278 W280	L210-I236 HydrophobicContact CD1-CD1 3.67Å; L210-I236 HydrophobicContact CD2-CD1 4.31Å; G220-I236 VanDerWaalsContact CA-O 3.24Å; G220-I236 WeakPolarHBondContact CA-O 3.25Å; E221-I236 PolarHBondContact N-O 3.43Å; E221-I236 PolarHBondContact O-N 2.83Å; W223-I236 HydrophobicContact CG-CD1 4.21Å; V234-I236 HydrophobicContact CG1-CD1 4.41Å; V234-I236 HydrophobicContact CG1-CG1 3.81Å; I236-Q278 HydrophobicContact CG2-CB 3.96Å; I236-Q278 HydrophobicContact CG2-CG 4.13Å; I236-W280 HydrophobicContact CD1-CZ2 4.22Å; I236-W280 HydrophobicContact CG1-CG 4.49Å
237	F	91.5	Very high	89.5	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.009	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	147.1	175.6	-58.4	-106.4	0	0	0	110.5	Y219 K235 D241 W245 E248 L279 L281	Y219-F237 HydrophobicContact CG-CE1 4.49Å; Y219-F237 VanDerWaalsContact O-CD1 3.32Å; Y219-F237 WeakPolarHBondContact O-CD1 3.46Å; K235-F237 HydrophobicContact CB-CE2 4.08Å; K235-F237 HydrophobicContact CD-CE1 4.39Å; K235-F237 HydrophobicContact CD-CE2 3.69Å; K235-F237 HydrophobicContact CD-CZ 3.46Å; K235-F237 VanDerWaalsContact CD-CZ 3.46Å; K235-F237 VanDerWaalsContact CE-CZ 3.46Å; K235-F237 HydrophobicContact CG-CD2 4.29Å; K235-F237 HydrophobicContact CG-CE2 3.58Å; K235-F237 HydrophobicContact CG-CZ 3.8Å; F237-D241 HydrophobicContact CB-CB 4.46Å; F237-D241 HydrophobicContact CD1-CB 4.32Å; F237-W245 HydrophobicContact CB-CB 4.17Å; F237-W245 HydrophobicContact CD1-CB 4.09Å; F237-W245 HydrophobicContact CD2-CB 3.9Å; F237-W245 AromaticContact CD2-CD1 3.65Å; F237-W245 HydrophobicContact CD2-CG 4.15Å; F237-W245 HydrophobicContact CE1-CB 4.41Å; F237-W245 HydrophobicContact CE2-CB 4.25Å; F237-W245 AromaticContact CE2-CD1 3.87Å; F237-W245 HydrophobicContact CE2-CG 4.48Å; F237-W245 HydrophobicContact CG-CB 3.82Å; F237-W245 HydrophobicContact CG-CG 4.49Å; F237-W245 HydrophobicContact CZ-CB 4.47Å; F237-E248 WeakPolarHBondContact CZ-OE2 3.32Å; F237-L279 HydrophobicContact CB-CB 4.18Å; F237-L279 PolarHBondContact N-O 3.18Å; F237-L279 PolarHBondContact O-N 2.82Å; F237-L279 VanDerWaalsContact O-N 3.1Å; F237-L281 HydrophobicContact CE2-CB 3.96Å
238	S	88.8	Confident	89.4	Confident	54 Å²	54	62.1 Å²	62.1	38%	0.378	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	152.7	166.2	179	0	0	0	0	110.2	R240 D241	S238-R240 PolarHBondContact O-N 3.22Å; S238-R240 VanDerWaalsContact O-N 3.09Å; S238-R240 PolarHBondContact OG-N 3.25Å; S238-D241 PolarHBondContact O-N 3.07Å
239	S	86.3	Confident	89.6	Confident	64 Å²	64	57.1 Å²	57.1	45%	0.448	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-57.3	-22.1	170.3	57.7	0	0	0	0	113.3	D241	S239-D241 VanDerWaalsContact C-N 3.26Å; S239-D241 PolarHBondContact O-N 2.98Å
240	R	86.1	Confident	89.8	Confident	230 Å²	230	57.9 Å²	57.9	87%	0.868	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-68.9	-24.2	173.8	-61.6	-177.7	-177.4	177.1	-0.1	113.2	S238	S238-R240 PolarHBondContact O-N 3.22Å; S238-R240 VanDerWaalsContact O-N 3.09Å; S238-R240 PolarHBondContact OG-N 3.25Å
241	D	85.8	Confident	89.8	Confident	52 Å²	52	54.7 Å²	54.7	28%	0.278	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-104.1	22.2	-176.8	-63.5	-60.5	0	0	0	112.2	F237 S238 S239 K243 S244 W245	F237-D241 HydrophobicContact CB-CB 4.46Å; F237-D241 HydrophobicContact CD1-CB 4.32Å; S238-D241 PolarHBondContact O-N 3.07Å; S239-D241 VanDerWaalsContact C-N 3.26Å; S239-D241 PolarHBondContact O-N 2.98Å; D241-K243 VanDerWaalsContact C-N 3.26Å; D241-K243 PolarHBondContact O-N 3.03Å; D241-S244 WeakPolarHBondContact O-CB 3.39Å; D241-S244 PolarHBondContact O-N 3.16Å; D241-W245 PolarHBondContact O-N 3.17Å; D241-W245 VanDerWaalsContact O-N 3.09Å
242	E	87.6	Confident	89.6	Confident	114 Å²	114	51.5 Å²	51.5	53%	0.533	24%	0.243	S	C	.	.	H	α-helix	trans	-53.5	-40	-178.1	-176.8	-179.6	179.3	0	0	113	S244 W245 F246 L279	E242-S244 VanDerWaalsContact C-N 3.3Å; E242-S244 PolarHBondContact O-N 3.27Å; E242-W245 PolarHBondContact O-N 3.11Å; E242-F246 VanDerWaalsContact O-CB 3.27Å; E242-F246 WeakPolarHBondContact O-CB 3.44Å; E242-F246 PolarHBondContact O-N 3.39Å; E242-L279 HydrophobicContact CB-CD1 3.75Å; E242-L279 HydrophobicContact CG-CD1 3.91Å
243	K	85	Confident	89.2	Confident	188 Å²	188	53.8 Å²	53.8	82%	0.817	26%	0.256	S	S	*	.	H	α-helix	trans	-61.2	-38.9	177.3	-67.2	-176.6	179.5	-179.3	0	112.3	D241 R247	D241-K243 VanDerWaalsContact C-N 3.26Å; D241-K243 PolarHBondContact O-N 3.03Å; K243-R247 VanDerWaalsContact O-CB 3.29Å; K243-R247 WeakPolarHBondContact O-CB 3.32Å; K243-R247 PolarHBondContact O-N 3.08Å
244	S	85.5	Confident	88.6	Confident	26 Å²	26	54.1 Å²	54.1	18%	0.182	26%	0.257	C	S	.	.	H	α-helix	trans	-69.4	-44.6	178.1	-57.3	0	0	0	0	110.8	D241 E242 R247 E248	D241-S244 WeakPolarHBondContact O-CB 3.39Å; D241-S244 PolarHBondContact O-N 3.16Å; E242-S244 VanDerWaalsContact C-N 3.3Å; E242-S244 PolarHBondContact O-N 3.27Å; S244-R247 PolarHBondContact O-N 3.38Å; S244-E248 WeakPolarHBondContact O-CB 3.44Å; S244-E248 PolarHBondContact O-N 2.83Å
245	W	90.2	Very high	88	Confident	36 Å²	36	55.7 Å²	55.7	14%	0.136	27%	0.266	C	S	.	.	H	α-helix	trans	-61.6	-45.9	175	169.4	80.7	0	0	0	112	F237 D241 E242 E248 T249 L279 W280	F237-W245 HydrophobicContact CB-CB 4.17Å; F237-W245 HydrophobicContact CD1-CB 4.09Å; F237-W245 HydrophobicContact CD2-CB 3.9Å; F237-W245 AromaticContact CD2-CD1 3.65Å; F237-W245 HydrophobicContact CD2-CG 4.15Å; F237-W245 HydrophobicContact CE1-CB 4.41Å; F237-W245 HydrophobicContact CE2-CB 4.25Å; F237-W245 AromaticContact CE2-CD1 3.87Å; F237-W245 HydrophobicContact CE2-CG 4.48Å; F237-W245 HydrophobicContact CG-CB 3.82Å; F237-W245 HydrophobicContact CG-CG 4.49Å; F237-W245 HydrophobicContact CZ-CB 4.47Å; D241-W245 PolarHBondContact O-N 3.17Å; D241-W245 VanDerWaalsContact O-N 3.09Å; E242-W245 PolarHBondContact O-N 3.11Å; W245-E248 PolarHBondContact O-N 2.82Å; W245-T249 VanDerWaalsContact O-CB 3.22Å; W245-T249 WeakPolarHBondContact O-CB 3.29Å; W245-T249 PolarHBondContact O-N 2.71Å; W245-T249 PolarHBondContact O-OG1 3.27Å; W245-L279 HydrophobicContact CB-CB 4.23Å; W245-L279 HydrophobicContact CB-CD1 4.16Å; W245-L279 HydrophobicContact CD2-CB 3.79Å; W245-L279 HydrophobicContact CD2-CD1 4.16Å; W245-L279 HydrophobicContact CD2-CD2 4.47Å; W245-L279 HydrophobicContact CD2-CG 4.37Å; W245-L279 HydrophobicContact CE3-CB 4.4Å; W245-L279 HydrophobicContact CE3-CD1 4.05Å; W245-L279 HydrophobicContact CE3-CD2 4.33Å; W245-L279 HydrophobicContact CG-CB 3.68Å; W245-L279 HydrophobicContact CG-CD1 4.22Å; W245-L279 HydrophobicContact CZ3-CD2 4.41Å; W245-W280 PolarHBondContact NE1-O 2.73Å
246	F	88.3	Confident	87.5	Confident	119 Å²	119	60.1 Å²	60.1	52%	0.522	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-46.9	179.1	-179.2	-93.3	0	0	0	110.8	E242 E248 T249 E250	E242-F246 VanDerWaalsContact O-CB 3.27Å; E242-F246 WeakPolarHBondContact O-CB 3.44Å; E242-F246 PolarHBondContact O-N 3.39Å; F246-E248 PolarHBondContact O-N 2.63Å; F246-T249 PolarHBondContact O-N 3.33Å; F246-E250 WeakPolarHBondContact O-CB 3.46Å; F246-E250 PolarHBondContact O-N 3.09Å
247	R	85.9	Confident	87.4	Confident	39 Å²	39	59.3 Å²	59.3	15%	0.147	28%	0.284	C	S	.	.	H	α-helix	trans	-59.8	-48.2	178.4	179.2	52.5	173.2	-169	-8.6	112.3	K243 S244 T249 E250 L251 A358 D369	K243-R247 VanDerWaalsContact O-CB 3.29Å; K243-R247 WeakPolarHBondContact O-CB 3.32Å; K243-R247 PolarHBondContact O-N 3.08Å; S244-R247 PolarHBondContact O-N 3.38Å; R247-T249 VanDerWaalsContact C-N 3.32Å; R247-T249 PolarHBondContact O-N 3.35Å; R247-E250 IonicContact CZ-OE2 2.8Å; R247-E250 IonicContact NH1-OE2 3.45Å; R247-E250 PolarHBondContact NH1-OE2 2.84Å; R247-E250 PolarHBondContact O-N 3.19Å; R247-L251 HydrophobicContact CG-CD1 4.16Å; R247-L251 PolarHBondContact O-N 2.79Å; R247-A358 PolarHBondContact NE-O 3.44Å; R247-A358 PolarHBondContact NH2-O 3.05Å; R247-D369 IonicContact CZ-OD2 2.79Å; R247-D369 IonicContact NH1-OD2 3.74Å; R247-D369 PolarHBondContact NH1-OD2 2.98Å; R247-D369 PolarHBondContact NH2-O 3Å; R247-D369 IonicContact NH2-OD2 2.61Å; R247-D369 PolarHBondContact NH2-OD2 3.48Å
248	E	89.8	Confident	87.2	Confident	4 Å²	4	63 Å²	63	2%	0.019	30%	0.298	C	S	.	.	H	α-helix	trans	-66.2	-38.3	-179.6	-164.6	167.9	174.3	0	0	111.3	K235 F237 S244 W245 F246 L251 Y252 L281	K235-E248 IonicContact NZ-OE1 2.66Å; K235-E248 PolarHBondContact NZ-OE1 2.99Å; K235-E248 IonicContact NZ-OE2 3.34Å; K235-E248 PolarHBondContact NZ-OE2 3.06Å; F237-E248 WeakPolarHBondContact CZ-OE2 3.32Å; S244-E248 WeakPolarHBondContact O-CB 3.44Å; S244-E248 PolarHBondContact O-N 2.83Å; W245-E248 PolarHBondContact O-N 2.82Å; F246-E248 PolarHBondContact O-N 2.63Å; E248-L251 PolarHBondContact O-N 3.37Å; E248-Y252 HydrophobicContact CG-CD2 3.82Å; E248-Y252 HydrophobicContact CG-CE2 3.63Å; E248-Y252 WeakPolarHBondContact O-CB 3.48Å; E248-Y252 WeakPolarHBondContact O-CD2 3.42Å; E248-Y252 PolarHBondContact O-N 3.46Å; E248-L281 HydrophobicContact CB-CD2 4.48Å; E248-L281 HydrophobicContact CG-CD2 3.74Å
249	T	90.2	Very high	87.5	Confident	12 Å²	12	62.5 Å²	62.5	7%	0.074	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-44.7	174.3	-62.8	0	0	0	0	112.4	W245 F246 R247 Y252 N253 S268	W245-T249 VanDerWaalsContact O-CB 3.22Å; W245-T249 WeakPolarHBondContact O-CB 3.29Å; W245-T249 PolarHBondContact O-N 2.71Å; W245-T249 PolarHBondContact O-OG1 3.27Å; F246-T249 PolarHBondContact O-N 3.33Å; R247-T249 VanDerWaalsContact C-N 3.32Å; R247-T249 PolarHBondContact O-N 3.35Å; T249-Y252 PolarHBondContact O-N 2.98Å; T249-N253 WeakPolarHBondContact CG2-ND2 3.45Å; T249-N253 WeakPolarHBondContact O-CB 3.24Å; T249-N253 PolarHBondContact O-N 2.8Å; T249-N253 PolarHBondContact O-ND2 3.07Å; T249-S268 VanDerWaalsContact CG2-CB 3.46Å; T249-S268 WeakPolarHBondContact CG2-OG 3.48Å
250	E	89.3	Confident	87.9	Confident	80 Å²	80	64.5 Å²	64.5	37%	0.374	29%	0.292	S	S	.	.	H	α-helix	trans	-59.7	-47.4	176.4	176.7	-176.2	-135.3	0	0	111	F246 R247 N253 T254	F246-E250 WeakPolarHBondContact O-CB 3.46Å; F246-E250 PolarHBondContact O-N 3.09Å; R247-E250 IonicContact CZ-OE2 2.8Å; R247-E250 IonicContact NH1-OE2 3.45Å; R247-E250 PolarHBondContact NH1-OE2 2.84Å; R247-E250 PolarHBondContact O-N 3.19Å; E250-N253 PolarHBondContact O-N 3.44Å; E250-T254 PolarHBondContact O-N 3.12Å; E250-T254 PolarHBondContact O-OG1 2.87Å
251	L	88.4	Confident	88.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61	-50.5	176.6	-79.1	161.6	0	0	0	111.1	R247 E248 N253 T254 L257 I332 L355 A358 M360	R247-L251 HydrophobicContact CG-CD1 4.16Å; R247-L251 PolarHBondContact O-N 2.79Å; E248-L251 PolarHBondContact O-N 3.37Å; L251-N253 PolarHBondContact O-N 3.42Å; L251-T254 WeakPolarHBondContact O-CB 3.37Å; L251-T254 PolarHBondContact O-N 3.15Å; L251-T254 PolarHBondContact O-OG1 3.27Å; L251-L257 WeakPolarHBondContact O-CD2 3.27Å; L251-I332 HydrophobicContact CD2-CG2 4.44Å; L251-L355 HydrophobicContact CB-CB 4.36Å; L251-L355 HydrophobicContact CD1-CB 4.19Å; L251-L355 WeakPolarHBondContact CD1-O 3.37Å; L251-A358 HydrophobicContact CD1-CB 3.76Å; L251-A358 HydrophobicContact CD2-CB 4.37Å; L251-M360 HydrophobicContact CD2-CE 4.05Å; L251-M360 HydrophobicContact CD2-CG 3.7Å; L251-M360 HydrophobicContact CD2-SD 3.74Å
252	Y	89	Confident	89	Confident	3 Å²	3	51.5 Å²	51.5	1%	0.012	24%	0.24	C	C	.	.	H	α-helix	trans	-61	-33.3	178.9	-84	-60.2	0	0	0	113.1	S194 E248 T249 T254 L257 F265 L281 D354 L355	S194-Y252 WeakPolarHBondContact CB-O 2.97Å; S194-Y252 PolarHBondContact OG-O 3.16Å; E248-Y252 HydrophobicContact CG-CD2 3.82Å; E248-Y252 HydrophobicContact CG-CE2 3.63Å; E248-Y252 WeakPolarHBondContact O-CB 3.48Å; E248-Y252 WeakPolarHBondContact O-CD2 3.42Å; E248-Y252 PolarHBondContact O-N 3.46Å; T249-Y252 PolarHBondContact O-N 2.98Å; Y252-T254 PolarHBondContact O-N 3.44Å; Y252-L257 HydrophobicContact CD1-CD2 4.36Å; Y252-F265 HydrophobicContact CD1-CB 3.76Å; Y252-F265 HydrophobicContact CD1-CG 4.47Å; Y252-F265 HydrophobicContact CD2-CD2 4.38Å; Y252-F265 HydrophobicContact CG-CB 3.92Å; Y252-F265 HydrophobicContact CG-CD2 4.01Å; Y252-F265 HydrophobicContact CG-CG 4.14Å; Y252-L281 HydrophobicContact CD2-CD1 4.2Å; Y252-L281 HydrophobicContact CD2-CD2 4Å; Y252-L281 HydrophobicContact CE2-CD2 3.87Å; Y252-D354 PolarHBondContact OH-N 3.29Å; Y252-L355 HydrophobicContact CD1-CD1 4.04Å; Y252-L355 HydrophobicContact CE1-CD1 3.71Å; Y252-L355 HydrophobicContact CE1-CG 4.3Å; Y252-L355 HydrophobicContact CE2-CD1 4.46Å; Y252-L355 HydrophobicContact CE2-CG 4.5Å
253	N	86.3	Confident	89.4	Confident	49 Å²	49	46.8 Å²	46.8	26%	0.262	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-4.1	174.4	-77.7	-58.9	0	0	0	114.3	T249 E250 L251 V255 F265	T249-N253 WeakPolarHBondContact CG2-ND2 3.45Å; T249-N253 WeakPolarHBondContact O-CB 3.24Å; T249-N253 PolarHBondContact O-N 2.8Å; T249-N253 PolarHBondContact O-ND2 3.07Å; E250-N253 PolarHBondContact O-N 3.44Å; L251-N253 PolarHBondContact O-N 3.42Å; N253-V255 PolarHBondContact O-N 3.04Å; N253-F265 VanDerWaalsContact OD1-CE1 3.27Å; N253-F265 WeakPolarHBondContact OD1-CE1 3.27Å
254	T	85.2	Confident	89.7	Confident	18 Å²	18	38.5 Å²	38.5	11%	0.11	19%	0.186	C	C	.	.	S	Bend	trans	-57.1	131.9	178.4	-65.1	0	0	0	0	111.2	S194 E250 L251 Y252 L257 K329 P330	S194-T254 PolarHBondContact OG-O 3.19Å; S194-T254 VanDerWaalsContact OG-O 3.07Å; E250-T254 PolarHBondContact O-N 3.12Å; E250-T254 PolarHBondContact O-OG1 2.87Å; L251-T254 WeakPolarHBondContact O-CB 3.37Å; L251-T254 PolarHBondContact O-N 3.15Å; L251-T254 PolarHBondContact O-OG1 3.27Å; Y252-T254 PolarHBondContact O-N 3.44Å; T254-L257 VanDerWaalsContact O-CB 3.22Å; T254-L257 WeakPolarHBondContact O-CB 3.28Å; T254-L257 PolarHBondContact O-N 3.18Å; T254-K329 HydrophobicContact CG2-CG 4.15Å; T254-P330 HydrophobicContact CG2-CG 4.04Å
255	V	82.6	Confident	90	Very high	32 Å²	32	37.4 Å²	37.4	19%	0.194	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	139.7	-178.2	-169.5	0	0	0	0	110.7	S192 N253 L257 Q327 K329	S192-V255 WeakPolarHBondContact O-CG2 3.3Å; N253-V255 PolarHBondContact O-N 3.04Å; V255-L257 PolarHBondContact O-N 3.09Å; V255-L257 VanDerWaalsContact O-N 3.13Å; V255-Q327 HydrophobicContact CB-CB 4.36Å; V255-Q327 WeakPolarHBondContact CB-O 3.3Å; V255-Q327 HydrophobicContact CG1-CB 3.83Å; V255-Q327 VanDerWaalsContact CG1-O 3.29Å; V255-Q327 WeakPolarHBondContact CG1-O 3.35Å; V255-Q327 HydrophobicContact CG2-CB 4.38Å; V255-K329 WeakPolarHBondContact O-CG 3.47Å
256	M	83.8	Confident	90	Very high	122 Å²	122	35.8 Å²	35.8	60%	0.601	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	15.2	-176.2	-59.4	-64.5	-178.2	0	0	115.3	H318 I323 K329	M256-H318 PolarHBondContact O-CE1 2.75Å; M256-H318 PolarHBondContact O-NE2 2.92Å; M256-I323 HydrophobicContact CB-CD1 4.36Å; M256-K329 HydrophobicContact CB-CB 4.1Å; M256-K329 WeakPolarHBondContact O-CD 3.47Å
257	L	89.2	Confident	90	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.01	15%	0.147	C	C	.	.			trans	-70	-32.4	174.3	-179.4	62.1	0	0	0	112.7	L251 Y252 T254 V255 H259 I262 H318 L319 K329 I332 L355	L251-L257 WeakPolarHBondContact O-CD2 3.27Å; Y252-L257 HydrophobicContact CD1-CD2 4.36Å; T254-L257 VanDerWaalsContact O-CB 3.22Å; T254-L257 WeakPolarHBondContact O-CB 3.28Å; T254-L257 PolarHBondContact O-N 3.18Å; V255-L257 PolarHBondContact O-N 3.09Å; V255-L257 VanDerWaalsContact O-N 3.13Å; L257-H259 PolarHBondContact O-N 3.31Å; L257-I262 HydrophobicContact CG-CG2 4.44Å; L257-H318 PolarHBondContact O-CD2 2.86Å; L257-H318 PolarHBondContact O-NE2 2.9Å; L257-H318 VanDerWaalsContact O-NE2 3.12Å; L257-L319 HydrophobicContact CD1-CD2 3.65Å; L257-K329 HydrophobicContact CD1-CD 4.49Å; L257-I332 HydrophobicContact CD1-CD1 3.7Å; L257-L355 HydrophobicContact CD2-CD1 3.9Å
258	R	88.4	Confident	90.3	Very high	79 Å²	79	28.9 Å²	28.9	30%	0.298	15%	0.145	S	C	.	.			trans	-53.7	127.6	-179.1	-171	177.9	178.6	121.8	-10.8	111.1	L184 D185	L184-R258 PolarHBondContact O-NH2 2.97Å; D185-R258 PolarHBondContact O-NH2 2.73Å; D185-R258 IonicContact OD1-NH2 2.81Å; D185-R258 PolarHBondContact OD1-NH2 3.29Å
259	H	94	Very high	90.3	Very high	44 Å²	44	29.3 Å²	29.3	20%	0.204	15%	0.147	C	C	.	.			trans	-158.9	148.9	179.7	177.8	-94	0	0	0	108.7	L257 N261 I262 S314 H318	L257-H259 PolarHBondContact O-N 3.31Å; H259-N261 PolarHBondContact CE1-OD1 2.81Å; H259-N261 VanDerWaalsContact CE1-OD1 3.29Å; H259-N261 PolarHBondContact ND1-N 3.24Å; H259-N261 PolarHBondContact O-N 2.92Å; H259-I262 HydrophobicContact CB-CB 4.37Å; H259-I262 HydrophobicContact CB-CG1 4Å; H259-I262 PolarHBondContact O-N 2.95Å; H259-I262 VanDerWaalsContact O-O 3.09Å; H259-S314 PolarHBondContact CE1-OG 3.24Å; H259-H318 HydrophobicContact CB-CB 4.43Å; H259-H318 VanDerWaalsContact CB-CD2 3.43Å; H259-H318 WeakPolarHBondContact CB-CD2 3.43Å; H259-H318 AromaticContact CD2-CG 3.78Å; H259-H318 AromaticContact CD2-ND1 3.83Å; H259-H318 AromaticContact CG-CD2 3.92Å; H259-H318 AromaticContact CG-CG 3.76Å
260	E	94.9	Very high	90.2	Very high	106 Å²	106	34.6 Å²	34.6	50%	0.495	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-32.5	-176.6	52.2	161.7	166.4	0	0	113	K345 Q349	E260-K345 WeakPolarHBondContact O-CE 3.5Å; E260-K345 PolarHBondContact O-NZ 3.24Å; E260-Q349 PolarHBondContact OE2-NE2 3.27Å; E260-Q349 VanDerWaalsContact OE2-NE2 3.09Å; E260-Q349 PolarHBondContact OE2-OE1 3.08Å
261	N	98.3	Very high	90	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	21.4	-178.5	-48.1	121.4	0	0	0	113.9	H259 S311 S314 C350 C351 I352	H259-N261 PolarHBondContact CE1-OD1 2.81Å; H259-N261 VanDerWaalsContact CE1-OD1 3.29Å; H259-N261 PolarHBondContact ND1-N 3.24Å; H259-N261 PolarHBondContact O-N 2.92Å; N261-S311 WeakPolarHBondContact CB-O 3.5Å; N261-S311 WeakPolarHBondContact ND2-CB 3.13Å; N261-S311 PolarHBondContact OD1-O 2.96Å; N261-S314 VanDerWaalsContact OD1-CB 3.31Å; N261-S314 WeakPolarHBondContact OD1-CB 3.36Å; N261-S314 PolarHBondContact OD1-OG 2.83Å; N261-C350 WeakPolarHBondContact CA-O 3.32Å; N261-C350 WeakPolarHBondContact CB-O 3.5Å; N261-C350 PolarHBondContact ND2-O 3.16Å; N261-C351 CarbonylContact O-C 3.25Å; N261-C351 VanDerWaalsContact O-CA 3.27Å; N261-C351 WeakPolarHBondContact O-CA 3.37Å; N261-I352 PolarHBondContact O-N 3.39Å
262	I	97.5	Very high	89.7	Confident	8 Å²	8	36.3 Å²	36.3	4%	0.041	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-119.8	138.1	166.4	-58.8	-60.6	0	0	0	107.5	L257 H259 G264 L319 I352	L257-I262 HydrophobicContact CG-CG2 4.44Å; H259-I262 HydrophobicContact CB-CB 4.37Å; H259-I262 HydrophobicContact CB-CG1 4Å; H259-I262 PolarHBondContact O-N 2.95Å; H259-I262 VanDerWaalsContact O-O 3.09Å; I262-G264 PolarHBondContact O-N 3.4Å; I262-L319 HydrophobicContact CD1-CD1 3.84Å; I262-L319 HydrophobicContact CD1-CD2 3.88Å; I262-L319 HydrophobicContact CD1-CG 3.62Å; I262-I352 HydrophobicContact CD1-CB 4.02Å; I262-I352 HydrophobicContact CD1-CD1 4.37Å
263	L	96	Very high	89.1	Confident	14 Å²	14	39.6 Å²	39.6	7%	0.073	21%	0.205	C	C	.	.			trans	-56.2	127	-177.6	178.7	57.2	0	0	0	110.7	F265 T283 H284 L343 I352 A353	L263-F265 PolarHBondContact O-N 3.28Å; L263-T283 HydrophobicContact CD2-CG2 3.97Å; L263-T283 HydrophobicContact CG-CG2 4.2Å; L263-H284 HydrophobicContact CD1-CB 4.49Å; L263-L343 HydrophobicContact CD1-CD1 3.83Å; L263-L343 HydrophobicContact CD2-CD1 4Å; L263-L343 HydrophobicContact CG-CD1 4.46Å; L263-I352 WeakPolarHBondContact CB-O 3.42Å; L263-I352 PolarHBondContact N-O 3.43Å; L263-A353 HydrophobicContact CB-CB 4.06Å; L263-A353 HydrophobicContact CD2-CB 3.6Å; L263-A353 HydrophobicContact CG-CB 4.46Å
264	G	92.1	Very high	88.5	Confident	14 Å²	14	45.8 Å²	45.8	14%	0.144	23%	0.231	C	C	.	.			trans	-68	110.9	-179.2	0	0	0	0	0	111.5	I262 T283 H284	I262-G264 PolarHBondContact O-N 3.4Å; G264-T283 CarbonylContact O-C 3.56Å; G264-T283 VanDerWaalsContact O-CA 3.24Å; G264-T283 WeakPolarHBondContact O-CA 3.34Å; G264-T283 VanDerWaalsContact O-CB 3.29Å; G264-T283 WeakPolarHBondContact O-CB 3.41Å; G264-H284 PolarHBondContact O-N 3.35Å
265	F	91.3	Very high	88.3	Confident	4 Å²	4	51.5 Å²	51.5	2%	0.018	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	136.3	171.2	172.9	-105.7	0	0	0	110.4	Y252 N253 L263 A267 L281	Y252-F265 HydrophobicContact CD1-CB 3.76Å; Y252-F265 HydrophobicContact CD1-CG 4.47Å; Y252-F265 HydrophobicContact CD2-CD2 4.38Å; Y252-F265 HydrophobicContact CG-CB 3.92Å; Y252-F265 HydrophobicContact CG-CD2 4.01Å; Y252-F265 HydrophobicContact CG-CG 4.14Å; N253-F265 VanDerWaalsContact OD1-CE1 3.27Å; N253-F265 WeakPolarHBondContact OD1-CE1 3.27Å; L263-F265 PolarHBondContact O-N 3.28Å; F265-A267 VanDerWaalsContact CE2-O 3.25Å; F265-A267 WeakPolarHBondContact CE2-O 3.4Å; F265-L281 HydrophobicContact CD2-CD1 3.96Å; F265-L281 HydrophobicContact CE2-CD1 3.59Å
266	I	89.3	Confident	88.3	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-57.7	177.8	-57.9	175.3	0	0	0	109.3	L184 L196 W227 V232 I282	L184-I266 HydrophobicContact CD2-CG2 4.26Å; L196-I266 HydrophobicContact CD1-CG2 3.89Å; L196-I266 PolarHBondContact N-O 3.25Å; L196-I266 VanDerWaalsContact N-O 3.11Å; W227-I266 HydrophobicContact CE3-CG2 4.38Å; W227-I266 HydrophobicContact CH2-CG2 4.49Å; W227-I266 HydrophobicContact CZ3-CG2 3.76Å; V232-I266 HydrophobicContact CB-CD1 4.44Å; V232-I266 HydrophobicContact CG1-CD1 3.73Å; I266-I282 HydrophobicContact CB-CG2 4.19Å; I266-I282 WeakPolarHBondContact CB-O 3.36Å; I266-I282 HydrophobicContact CD1-CG2 4.23Å; I266-I282 PolarHBondContact N-O 3.09Å
267	A	89.7	Confident	88.5	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	161.7	-174.8	0	0	0	0	0	111.8	Q201 V204 F265 I282	Q201-A267 HydrophobicContact CB-CB 4.09Å; Q201-A267 HydrophobicContact CG-CB 3.92Å; V204-A267 HydrophobicContact CB-CB 4.29Å; V204-A267 HydrophobicContact CG2-CB 3.94Å; F265-A267 VanDerWaalsContact CE2-O 3.25Å; F265-A267 WeakPolarHBondContact CE2-O 3.4Å; A267-I282 HydrophobicContact CB-CD1 4.18Å; A267-I282 PolarHBondContact N-O 3.34Å; A267-I282 WeakPolarHBondContact O-CA 3.13Å; A267-I282 WeakPolarHBondContact O-CB 3.5Å; A267-I282 PolarHBondContact O-N 3.36Å
268	S	91.2	Very high	88.6	Confident	13 Å²	13	51.6 Å²	51.6	9%	0.091	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	136.2	165.3	57.3	0	0	0	0	108.1	T249 W280	T249-S268 VanDerWaalsContact CG2-CB 3.46Å; T249-S268 WeakPolarHBondContact CG2-OG 3.48Å; S268-W280 CarbonylContact C-O 3.44Å; S268-W280 VanDerWaalsContact CA-O 3.31Å; S268-W280 WeakPolarHBondContact CA-O 3.43Å
269	D	90.1	Very high	88.8	Confident	13 Å²	13	48.1 Å²	48.1	7%	0.07	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	161.2	-175.5	-156.6	-3.5	0	0	0	111.1	Q201 R202 T203 V204 A205 W280	Q201-D269 VanDerWaalsContact O-CG 3.24Å; R202-D269 VanDerWaalsContact C-OD2 3.32Å; R202-D269 WeakPolarHBondContact CA-OD1 3.45Å; T203-D269 PolarHBondContact N-OD2 2.91Å; V204-D269 PolarHBondContact N-OD2 2.9Å; A205-D269 HydrophobicContact CB-CB 3.82Å; A205-D269 VanDerWaalsContact CB-OD2 3.28Å; A205-D269 WeakPolarHBondContact CB-OD2 3.47Å; A205-D269 PolarHBondContact N-OD2 2.93Å; D269-W280 PolarHBondContact N-O 3.12Å; D269-W280 PolarHBondContact O-N 3.45Å
270	M	87.7	Confident	88.8	Confident	122 Å²	122	46 Å²	46	60%	0.601	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.4	177.1	172.8	175	48.4	0	0	108.8	T277 L279	M270-T277 HydrophobicContact CG-CG2 3.72Å; M270-T277 HydrophobicContact SD-CG2 3.77Å; M270-L279 HydrophobicContact CB-CD2 4.07Å; M270-L279 HydrophobicContact CG-CD2 3.88Å; M270-L279 HydrophobicContact SD-CD2 4.08Å
271	T	85.1	Confident	88.7	Confident	19 Å²	19	41.1 Å²	41.1	12%	0.117	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	146.5	-179.2	-168.4	0	0	0	0	111	R273 Q278 W280	T271-R273 HydrophobicContact CG2-CG 4.44Å; T271-Q278 HydrophobicContact CG2-CB 3.92Å; T271-Q278 PolarHBondContact N-O 3.47Å; T271-Q278 PolarHBondContact O-N 3.15Å; T271-W280 HydrophobicContact CG2-CD2 4.14Å; T271-W280 HydrophobicContact CG2-CG 4.32Å; T271-W280 HydrophobicContact CG2-CZ2 4.01Å
272	S	82.8	Confident	88.5	Confident	97 Å²	97	41 Å²	41	68%	0.678	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102.7	116.4	170.3	56.6	0	0	0	0	109.2	S276	S272-S276 WeakPolarHBondContact CA-O 3.38Å
273	R	75.3	Confident	88.3	Confident	73 Å²	73	41.2 Å²	41.2	28%	0.275	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.4	173.5	-68	-168.9	-174.9	-175	1.9	109.6	I208 T271 S275 S276 W280	I208-R273 PolarHBondContact O-NH2 2.87Å; T271-R273 HydrophobicContact CG2-CG 4.44Å; R273-S275 VanDerWaalsContact C-N 3.27Å; R273-S275 PolarHBondContact O-N 3.18Å; R273-S276 PolarHBondContact N-O 3.11Å; R273-S276 PolarHBondContact O-N 2.89Å; R273-S276 PolarHBondContact O-OG 3.26Å; R273-W280 VanDerWaalsContact NH2-CH2 3.34Å
274	H	74.4	Confident	88.2	Confident	178 Å²	178	42.6 Å²	42.6	82%	0.824	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	43.5	179.6	-53.4	-71.3	0	0	0	113.8	S276	H274-S276 PolarHBondContact O-N 3.24Å; H274-S276 VanDerWaalsContact O-N 3.13Å
275	S	80.6	Confident	88.4	Confident	139 Å²	139	44.7 Å²	44.7	97%	0.972	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	20.9	-178.2	-50.8	0	0	0	0	114.6	R273	R273-S275 VanDerWaalsContact C-N 3.27Å; R273-S275 PolarHBondContact O-N 3.18Å
276	S	82.1	Confident	88.6	Confident	55 Å²	55	46.2 Å²	46.2	39%	0.385	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.3	174.9	70.4	0	0	0	0	110.9	S272 R273 H274	S272-S276 WeakPolarHBondContact CA-O 3.38Å; R273-S276 PolarHBondContact N-O 3.11Å; R273-S276 PolarHBondContact O-N 2.89Å; R273-S276 PolarHBondContact O-OG 3.26Å; H274-S276 PolarHBondContact O-N 3.24Å; H274-S276 VanDerWaalsContact O-N 3.13Å
277	T	88.3	Confident	88.8	Confident	66 Å²	66	51.2 Å²	51.2	41%	0.405	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	124.6	171	-57	0	0	0	0	108.9	M270 L279	M270-T277 HydrophobicContact CG-CG2 3.72Å; M270-T277 HydrophobicContact SD-CG2 3.77Å; T277-L279 HydrophobicContact CG2-CD2 4.41Å
278	Q	91.1	Very high	89.1	Confident	37 Å²	37	55 Å²	55	17%	0.173	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132.1	176.7	-64.3	-177	-13	0	0	109	I236 T271	I236-Q278 HydrophobicContact CG2-CB 3.96Å; I236-Q278 HydrophobicContact CG2-CG 4.13Å; T271-Q278 HydrophobicContact CG2-CB 3.92Å; T271-Q278 PolarHBondContact N-O 3.47Å; T271-Q278 PolarHBondContact O-N 3.15Å
279	L	92.5	Very high	89.3	Confident	5 Å²	5	55.5 Å²	55.5	3%	0.026	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.9	177	-53.1	169	0	0	0	107.8	F237 E242 W245 M270 T277	F237-L279 HydrophobicContact CB-CB 4.18Å; F237-L279 PolarHBondContact N-O 3.18Å; F237-L279 PolarHBondContact O-N 2.82Å; F237-L279 VanDerWaalsContact O-N 3.1Å; E242-L279 HydrophobicContact CB-CD1 3.75Å; E242-L279 HydrophobicContact CG-CD1 3.91Å; W245-L279 HydrophobicContact CB-CB 4.23Å; W245-L279 HydrophobicContact CB-CD1 4.16Å; W245-L279 HydrophobicContact CD2-CB 3.79Å; W245-L279 HydrophobicContact CD2-CD1 4.16Å; W245-L279 HydrophobicContact CD2-CD2 4.47Å; W245-L279 HydrophobicContact CD2-CG 4.37Å; W245-L279 HydrophobicContact CE3-CB 4.4Å; W245-L279 HydrophobicContact CE3-CD1 4.05Å; W245-L279 HydrophobicContact CE3-CD2 4.33Å; W245-L279 HydrophobicContact CG-CB 3.68Å; W245-L279 HydrophobicContact CG-CD1 4.22Å; W245-L279 HydrophobicContact CZ3-CD2 4.41Å; M270-L279 HydrophobicContact CB-CD2 4.07Å; M270-L279 HydrophobicContact CG-CD2 3.88Å; M270-L279 HydrophobicContact SD-CD2 4.08Å; T277-L279 HydrophobicContact CG2-CD2 4.41Å
280	W	94	Very high	89.7	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	133.7	-172.7	-73.8	24	0	0	0	109.9	A205 I208 L210 V234 I236 W245 S268 D269 T271 R273 I282	A205-W280 HydrophobicContact CB-CD2 4.04Å; A205-W280 HydrophobicContact CB-CE3 3.58Å; A205-W280 HydrophobicContact CB-CZ3 4.02Å; I208-W280 HydrophobicContact CB-CZ3 3.8Å; I208-W280 HydrophobicContact CD1-CE3 4.43Å; I208-W280 HydrophobicContact CD1-CZ3 4.25Å; I208-W280 HydrophobicContact CG2-CH2 4.31Å; I208-W280 HydrophobicContact CG2-CZ3 3.72Å; L210-W280 HydrophobicContact CD1-CH2 4.02Å; L210-W280 HydrophobicContact CD1-CZ2 3.83Å; L210-W280 HydrophobicContact CD2-CH2 3.61Å; L210-W280 HydrophobicContact CD2-CZ2 4.09Å; L210-W280 HydrophobicContact CD2-CZ3 4.12Å; L210-W280 HydrophobicContact CG-CH2 3.74Å; L210-W280 HydrophobicContact CG-CZ2 4.1Å; V234-W280 HydrophobicContact CG1-CB 4.13Å; V234-W280 HydrophobicContact CG1-CD2 3.44Å; V234-W280 VanDerWaalsContact CG1-CD2 3.44Å; V234-W280 HydrophobicContact CG1-CE3 3.34Å; V234-W280 HydrophobicContact CG1-CG 3.81Å; V234-W280 HydrophobicContact CG1-CH2 4.43Å; V234-W280 HydrophobicContact CG1-CZ3 3.85Å; V234-W280 HydrophobicContact CG2-CE3 4.4Å; V234-W280 HydrophobicContact CG2-CZ3 4.36Å; I236-W280 HydrophobicContact CD1-CZ2 4.22Å; I236-W280 HydrophobicContact CG1-CG 4.49Å; W245-W280 PolarHBondContact NE1-O 2.73Å; S268-W280 CarbonylContact C-O 3.44Å; S268-W280 VanDerWaalsContact CA-O 3.31Å; S268-W280 WeakPolarHBondContact CA-O 3.43Å; D269-W280 PolarHBondContact N-O 3.12Å; D269-W280 PolarHBondContact O-N 3.45Å; T271-W280 HydrophobicContact CG2-CD2 4.14Å; T271-W280 HydrophobicContact CG2-CG 4.32Å; T271-W280 HydrophobicContact CG2-CZ2 4.01Å; R273-W280 VanDerWaalsContact NH2-CH2 3.34Å; W280-I282 HydrophobicContact CB-CG1 4.42Å; W280-I282 HydrophobicContact CE3-CD1 4.48Å; W280-I282 HydrophobicContact CE3-CG1 4.5Å
281	L	93.4	Very high	90.2	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.016	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	119.2	165.4	-175.3	80.9	0	0	0	107.4	K235 F237 E248 Y252 F265	K235-L281 HydrophobicContact CB-CB 4.28Å; K235-L281 HydrophobicContact CD-CD2 4.42Å; K235-L281 PolarHBondContact N-O 3.31Å; K235-L281 PolarHBondContact O-N 3.17Å; F237-L281 HydrophobicContact CE2-CB 3.96Å; E248-L281 HydrophobicContact CB-CD2 4.48Å; E248-L281 HydrophobicContact CG-CD2 3.74Å; Y252-L281 HydrophobicContact CD2-CD1 4.2Å; Y252-L281 HydrophobicContact CD2-CD2 4Å; Y252-L281 HydrophobicContact CE2-CD2 3.87Å; F265-L281 HydrophobicContact CD2-CD1 3.96Å; F265-L281 HydrophobicContact CE2-CD1 3.59Å
282	I	94.1	Very high	90.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	123.6	-170.4	-55.8	152.9	0	0	0	108.6	V204 I208 V232 A233 V234 I266 A267 W280	V204-I282 HydrophobicContact CB-CD1 4.08Å; V204-I282 HydrophobicContact CG1-CD1 3.87Å; I208-I282 HydrophobicContact CD1-CD1 3.56Å; I208-I282 HydrophobicContact CD1-CG1 3.86Å; I208-I282 HydrophobicContact CD1-CG2 3.88Å; V232-I282 HydrophobicContact CB-CG2 4.08Å; V232-I282 HydrophobicContact CG1-CG2 4.43Å; V232-I282 HydrophobicContact CG2-CG2 4.29Å; A233-I282 WeakPolarHBondContact O-CA 3.46Å; V234-I282 HydrophobicContact CG1-CG1 4.5Å; V234-I282 HydrophobicContact CG2-CG1 4.48Å; I266-I282 HydrophobicContact CB-CG2 4.19Å; I266-I282 WeakPolarHBondContact CB-O 3.36Å; I266-I282 HydrophobicContact CD1-CG2 4.23Å; I266-I282 PolarHBondContact N-O 3.09Å; A267-I282 HydrophobicContact CB-CD1 4.18Å; A267-I282 PolarHBondContact N-O 3.34Å; A267-I282 WeakPolarHBondContact O-CA 3.13Å; A267-I282 WeakPolarHBondContact O-CB 3.5Å; A267-I282 PolarHBondContact O-N 3.36Å; W280-I282 HydrophobicContact CB-CG1 4.42Å; W280-I282 HydrophobicContact CE3-CD1 4.48Å; W280-I282 HydrophobicContact CE3-CG1 4.5Å
283	T	94.2	Very high	91.5	Very high	11 Å²	11	51 Å²	51	7%	0.067	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	170.5	-177.5	68.3	0	0	0	0	111.2	A233 L263 G264 Y285	A233-T283 PolarHBondContact N-O 3.31Å; A233-T283 PolarHBondContact O-N 3.1Å; L263-T283 HydrophobicContact CD2-CG2 3.97Å; L263-T283 HydrophobicContact CG-CG2 4.2Å; G264-T283 CarbonylContact O-C 3.56Å; G264-T283 VanDerWaalsContact O-CA 3.24Å; G264-T283 WeakPolarHBondContact O-CA 3.34Å; G264-T283 VanDerWaalsContact O-CB 3.29Å; G264-T283 WeakPolarHBondContact O-CB 3.41Å; T283-Y285 PolarHBondContact O-N 2.98Å
284	H	93.1	Very high	92.6	Very high	43 Å²	43	49.8 Å²	49.8	20%	0.199	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	140.3	166.7	-68.6	157.5	0	0	0	110.9	L263 G264	L263-H284 HydrophobicContact CD1-CB 4.49Å; G264-H284 PolarHBondContact O-N 3.35Å
285	Y	95.6	Very high	93.8	Very high	59 Å²	59	41.3 Å²	41.3	23%	0.231	22%	0.224	C	C	.	.			trans	-89.9	137	171.9	-178.7	-107.9	0	0	0	110.4	V214 R224 N231 A233 T283 E287	V214-Y285 HydrophobicContact CG1-CE2 4.21Å; R224-Y285 HydrophobicContact CB-CD2 4.31Å; R224-Y285 HydrophobicContact CB-CE2 3.99Å; R224-Y285 VanDerWaalsContact CD-CZ 3.49Å; R224-Y285 HydrophobicContact CG-CD1 4.36Å; R224-Y285 HydrophobicContact CG-CD2 4.09Å; R224-Y285 HydrophobicContact CG-CE1 4.22Å; R224-Y285 HydrophobicContact CG-CE2 3.97Å; R224-Y285 HydrophobicContact CG-CG 4.3Å; N231-Y285 HydrophobicContact CB-CD1 3.68Å; N231-Y285 HydrophobicContact CB-CG 4.09Å; N231-Y285 WeakPolarHBondContact O-CB 3.28Å; A233-Y285 HydrophobicContact CB-CD2 4.24Å; T283-Y285 PolarHBondContact O-N 2.98Å; Y285-E287 HydrophobicContact CE1-CB 4.03Å
286	H	96.1	Very high	94.6	Very high	36 Å²	36	38.4 Å²	38.4	17%	0.167	20%	0.195	C	C	.	.			trans	-121.6	109.9	175	-68	-40.6	0	0	0	109.7	M288 G289 L343 C351	H286-M288 VanDerWaalsContact C-N 3.27Å; H286-M288 PolarHBondContact O-N 3.34Å; H286-G289 PolarHBondContact O-N 2.98Å; H286-L343 HydrophobicContact CB-CB 4.27Å; H286-C351 PolarHBondContact CD2-SG 2.88Å; H286-C351 PolarHBondContact NE2-SG 3.01Å; H286-C351 VanDerWaalsContact NE2-SG 3.35Å
287	E	94.5	Very high	95.2	Very high	107 Å²	107	43.2 Å²	43.2	50%	0.5	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-26.5	-173	56.2	176.6	179	0	0	114.5	Y285 G289	Y285-E287 HydrophobicContact CE1-CB 4.03Å; E287-G289 PolarHBondContact O-N 3.31Å
288	M	95.4	Very high	95.7	Very high	80 Å²	80	42.1 Å²	42.1	39%	0.394	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-3.7	177.1	-58.1	-66.9	133.6	0	0	112.4	H286 Y294 V344	H286-M288 VanDerWaalsContact C-N 3.27Å; H286-M288 PolarHBondContact O-N 3.34Å; M288-Y294 HydrophobicContact CB-CD2 4.21Å; M288-Y294 HydrophobicContact SD-CE2 4.38Å; M288-V344 HydrophobicContact CB-CB 3.88Å; M288-V344 HydrophobicContact CB-CG1 4.1Å; M288-V344 WeakPolarHBondContact CB-O 3.43Å; M288-V344 HydrophobicContact CG-CG1 4.49Å
289	G	95.7	Very high	96	Very high	22 Å²	22	43.8 Å²	43.8	23%	0.227	22%	0.222	C	C	.	.			trans	67.9	-152.3	176.9	0	0	0	0	0	113.1	H286 E287 L343 V344	H286-G289 PolarHBondContact O-N 2.98Å; E287-G289 PolarHBondContact O-N 3.31Å; G289-L343 WeakPolarHBondContact O-CA 3.43Å; G289-V344 PolarHBondContact O-N 3.19Å
290	S	97.8	Very high	96.3	Very high	9 Å²	9	43.7 Å²	43.7	6%	0.063	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-76.5	156.7	178.2	74.4	0	0	0	0	111.8	Y292 D293 Y294 I342	S290-Y292 PolarHBondContact O-N 2.91Å; S290-Y292 WeakPolarHBondContact OG-CB 3.31Å; S290-D293 WeakPolarHBondContact CB-OD2 3.41Å; S290-D293 PolarHBondContact N-OD2 3.38Å; S290-D293 PolarHBondContact O-N 3.27Å; S290-D293 PolarHBondContact OG-N 2.9Å; S290-D293 PolarHBondContact OG-OD2 3.01Å; S290-Y294 WeakPolarHBondContact O-CB 3.5Å; S290-Y294 PolarHBondContact O-N 2.86Å; S290-I342 CarbonylContact C-O 3.56Å; S290-I342 VanDerWaalsContact CA-O 3.26Å; S290-I342 WeakPolarHBondContact CA-O 3.36Å
291	L	98.8	Very high	96.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.1	-34.8	172.4	178.8	65.9	0	0	0	110.5	Y294 L295 I308 I312 S339 I342 V344 V410 V414	L291-Y294 PolarHBondContact O-N 3.45Å; L291-L295 HydrophobicContact CD1-CD1 3.94Å; L291-L295 HydrophobicContact CD1-CD2 4.17Å; L291-L295 HydrophobicContact CD1-CG 3.82Å; L291-L295 HydrophobicContact CD2-CD1 4.43Å; L291-L295 HydrophobicContact CG-CD1 3.78Å; L291-L295 HydrophobicContact CG-CG 4.1Å; L291-L295 WeakPolarHBondContact O-CB 3.25Å; L291-L295 WeakPolarHBondContact O-CG 3.26Å; L291-L295 PolarHBondContact O-N 3.45Å; L291-I308 HydrophobicContact CD1-CD1 4.34Å; L291-I308 HydrophobicContact CD1-CG2 3.83Å; L291-I308 HydrophobicContact CD2-CG2 4.37Å; L291-I312 HydrophobicContact CD2-CD1 3.77Å; L291-S339 WeakPolarHBondContact CB-O 3.4Å; L291-S339 PolarHBondContact N-O 3.04Å; L291-I342 HydrophobicContact CB-CB 4.1Å; L291-I342 HydrophobicContact CB-CG2 4.06Å; L291-I342 HydrophobicContact CD2-CB 4.41Å; L291-I342 HydrophobicContact CD2-CD1 4.38Å; L291-I342 HydrophobicContact CD2-CG2 4.14Å; L291-I342 PolarHBondContact N-O 3.07Å; L291-V344 HydrophobicContact CB-CG2 4.21Å; L291-V344 HydrophobicContact CD1-CG2 3.98Å; L291-V410 HydrophobicContact CD2-CG1 3.78Å; L291-V414 HydrophobicContact CD1-CG2 4.34Å; L291-V414 HydrophobicContact CD2-CG2 3.88Å; L291-V414 HydrophobicContact CG-CG2 4.49Å
292	Y	98.3	Very high	96.7	Very high	65 Å²	65	49 Å²	49	26%	0.255	25%	0.251	S	S	.	.	H	α-helix	trans	-54.6	-54.5	170.7	173.6	-88.5	0	0	0	111.2	S290 Y294 L295 Q296 S339 K340 Y427	S290-Y292 PolarHBondContact O-N 2.91Å; S290-Y292 WeakPolarHBondContact OG-CB 3.31Å; Y292-Y294 VanDerWaalsContact C-N 3.34Å; Y292-Y294 PolarHBondContact O-N 2.95Å; Y292-L295 PolarHBondContact O-N 3.13Å; Y292-Q296 HydrophobicContact CE1-CG 4.42Å; Y292-Q296 WeakPolarHBondContact O-CG 2.84Å; Y292-Q296 PolarHBondContact O-N 3.29Å; Y292-Q296 PolarHBondContact OH-NE2 3.39Å; Y292-S339 PolarHBondContact N-O 3.33Å; Y292-K340 HydrophobicContact CD1-CG 4.15Å; Y292-K340 HydrophobicContact CD2-CG 4.1Å; Y292-K340 HydrophobicContact CG-CD 4.43Å; Y292-K340 HydrophobicContact CG-CG 3.68Å; Y292-Y427 HydrophobicContact CD2-CE1 4.07Å; Y292-Y427 AromaticContact CD2-CZ 3.66Å; Y292-Y427 WeakPolarHBondContact CD2-OH 3.26Å; Y292-Y427 AromaticContact CE2-CE1 3.65Å; Y292-Y427 HydrophobicContact CE2-CE1 3.65Å; Y292-Y427 AromaticContact CE2-CZ 3.72Å; Y292-Y427 VanDerWaalsContact CE2-OH 3.28Å; Y292-Y427 WeakPolarHBondContact CE2-OH 3.47Å
293	D	96.8	Very high	96.8	Very high	82 Å²	82	50.6 Å²	50.6	44%	0.439	26%	0.261	S	S	.	.	H	α-helix	trans	-64.1	-41.5	-178.3	-55.3	-50.2	0	0	0	111.4	S290 L295 Q296	S290-D293 WeakPolarHBondContact CB-OD2 3.41Å; S290-D293 PolarHBondContact N-OD2 3.38Å; S290-D293 PolarHBondContact O-N 3.27Å; S290-D293 PolarHBondContact OG-N 2.9Å; S290-D293 PolarHBondContact OG-OD2 3.01Å; D293-L295 PolarHBondContact O-N 3.18Å; D293-Q296 WeakPolarHBondContact O-CB 3.46Å; D293-Q296 PolarHBondContact O-N 3.08Å
294	Y	98.4	Very high	97	Very high	49 Å²	49	52 Å²	52	19%	0.192	27%	0.271	C	S	.	.	H	α-helix	trans	-60.8	-45.2	179.6	-171.9	-102.3	0	0	0	112.5	M288 S290 L291 Y292 Q296 L297 T298 L300 I308 V344	M288-Y294 HydrophobicContact CB-CD2 4.21Å; M288-Y294 HydrophobicContact SD-CE2 4.38Å; S290-Y294 WeakPolarHBondContact O-CB 3.5Å; S290-Y294 PolarHBondContact O-N 2.86Å; L291-Y294 PolarHBondContact O-N 3.45Å; Y292-Y294 VanDerWaalsContact C-N 3.34Å; Y292-Y294 PolarHBondContact O-N 2.95Å; Y294-Q296 VanDerWaalsContact C-N 3.31Å; Y294-Q296 PolarHBondContact O-N 3.1Å; Y294-L297 PolarHBondContact O-N 3.47Å; Y294-T298 HydrophobicContact CE1-CG2 3.99Å; Y294-T298 HydrophobicContact CE2-CG2 4.35Å; Y294-T298 WeakPolarHBondContact O-CB 3.44Å; Y294-T298 PolarHBondContact O-N 3.47Å; Y294-T298 PolarHBondContact O-OG1 2.88Å; Y294-T298 VanDerWaalsContact O-OG1 3.07Å; Y294-L300 HydrophobicContact CE1-CD2 3.8Å; Y294-I308 HydrophobicContact CD1-CD1 4.42Å; Y294-I308 HydrophobicContact CE1-CD1 4.06Å; Y294-V344 HydrophobicContact CD1-CG1 4.48Å; Y294-V344 HydrophobicContact CD1-CG2 4.12Å; Y294-V344 HydrophobicContact CD2-CB 4.42Å; Y294-V344 HydrophobicContact CD2-CG1 4.17Å; Y294-V344 HydrophobicContact CD2-CG2 4.43Å; Y294-V344 HydrophobicContact CE2-CG1 4.23Å; Y294-V344 HydrophobicContact CG-CB 4.35Å; Y294-V344 HydrophobicContact CG-CG1 4.3Å; Y294-V344 HydrophobicContact CG-CG2 3.87Å
295	L	98.6	Very high	97.3	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-71.2	-22.3	-177.5	-69.8	176.9	0	0	0	113.6	L291 Y292 D293 L297 L300 E413 V414 R417 Y427	L291-L295 HydrophobicContact CD1-CD1 3.94Å; L291-L295 HydrophobicContact CD1-CD2 4.17Å; L291-L295 HydrophobicContact CD1-CG 3.82Å; L291-L295 HydrophobicContact CD2-CD1 4.43Å; L291-L295 HydrophobicContact CG-CD1 3.78Å; L291-L295 HydrophobicContact CG-CG 4.1Å; L291-L295 WeakPolarHBondContact O-CB 3.25Å; L291-L295 WeakPolarHBondContact O-CG 3.26Å; L291-L295 PolarHBondContact O-N 3.45Å; Y292-L295 PolarHBondContact O-N 3.13Å; D293-L295 PolarHBondContact O-N 3.18Å; L295-L297 VanDerWaalsContact C-N 3.33Å; L295-L300 HydrophobicContact CD2-CD1 3.88Å; L295-L300 HydrophobicContact CD2-CG 4.47Å; L295-E413 HydrophobicContact CD1-CB 4.13Å; L295-V414 HydrophobicContact CD1-CG2 4.03Å; L295-R417 HydrophobicContact CB-CG 4.07Å; L295-R417 HydrophobicContact CD2-CB 3.91Å; L295-R417 HydrophobicContact CD2-CG 3.84Å; L295-R417 HydrophobicContact CG-CG 4.43Å; L295-R417 PolarHBondContact O-NE 3.19Å; L295-Y427 HydrophobicContact CB-CD2 3.62Å; L295-Y427 HydrophobicContact CB-CE2 4.02Å; L295-Y427 HydrophobicContact CD1-CD2 4.45Å; L295-Y427 HydrophobicContact CD1-CE2 4.26Å
296	Q	97.4	Very high	97.4	Very high	77 Å²	77	47.2 Å²	47.2	36%	0.36	25%	0.251	S	S	.	.	H	α-helix	trans	-63.9	-41.1	173.8	-63.5	-74.7	-12.1	0	0	111.6	Y292 D293 Y294 Y427	Y292-Q296 HydrophobicContact CE1-CG 4.42Å; Y292-Q296 WeakPolarHBondContact O-CG 2.84Å; Y292-Q296 PolarHBondContact O-N 3.29Å; Y292-Q296 PolarHBondContact OH-NE2 3.39Å; D293-Q296 WeakPolarHBondContact O-CB 3.46Å; D293-Q296 PolarHBondContact O-N 3.08Å; Y294-Q296 VanDerWaalsContact C-N 3.31Å; Y294-Q296 PolarHBondContact O-N 3.1Å; Q296-Y427 HydrophobicContact CG-CD1 4.32Å; Q296-Y427 HydrophobicContact CG-CG 4.5Å
297	L	96.3	Very high	97.5	Very high	157 Å²	157	50.7 Å²	50.7	82%	0.822	26%	0.262	S	S	*	.	H	α-helix	trans	-101	-23.1	-169.8	-59.4	178.7	0	0	0	112.7	Y294 L295	Y294-L297 PolarHBondContact O-N 3.47Å; L295-L297 VanDerWaalsContact C-N 3.33Å
298	T	97.4	Very high	97.8	Very high	42 Å²	42	45.7 Å²	45.7	26%	0.258	24%	0.239	S	C	.	.			trans	-115.6	136.5	-168.8	-46.1	0	0	0	0	111.2	Y294 L300 R417	Y294-T298 HydrophobicContact CE1-CG2 3.99Å; Y294-T298 HydrophobicContact CE2-CG2 4.35Å; Y294-T298 WeakPolarHBondContact O-CB 3.44Å; Y294-T298 PolarHBondContact O-N 3.47Å; Y294-T298 PolarHBondContact O-OG1 2.88Å; Y294-T298 VanDerWaalsContact O-OG1 3.07Å; T298-L300 HydrophobicContact CG2-CD2 4.43Å; T298-R417 PolarHBondContact O-NE 2.87Å; T298-R417 PolarHBondContact O-NH2 3.33Å
299	T	98.1	Very high	97.9	Very high	72 Å²	72	41.9 Å²	41.9	44%	0.442	22%	0.221	S	C	.	.			trans	-98	150.7	164.6	56.4	0	0	0	0	109.2	R417 V419 V424	T299-R417 CarbonylContact C-O 3.47Å; T299-R417 WeakPolarHBondContact CA-O 3.42Å; T299-R417 VanDerWaalsContact CG2-NH2 3.28Å; T299-V419 HydrophobicContact CG2-CG2 4.47Å; T299-V424 HydrophobicContact CG2-CG1 3.97Å; T299-V424 HydrophobicContact CG2-CG2 4.11Å
300	L	98.5	Very high	98.1	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.016	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-111.7	143.8	-173.8	-50.6	176.4	0	0	0	110.2	Y294 L295 T298 C305 I308 V414 R417 M418 V419	Y294-L300 HydrophobicContact CE1-CD2 3.8Å; L295-L300 HydrophobicContact CD2-CD1 3.88Å; L295-L300 HydrophobicContact CD2-CG 4.47Å; T298-L300 HydrophobicContact CG2-CD2 4.43Å; L300-C305 HydrophobicContact CB-CB 4.24Å; L300-C305 HydrophobicContact CD1-CB 4.34Å; L300-I308 HydrophobicContact CD1-CD1 3.91Å; L300-I308 HydrophobicContact CD2-CD1 3.89Å; L300-V414 HydrophobicContact CD1-CG1 3.62Å; L300-R417 HydrophobicContact CD1-CB 4.37Å; L300-R417 HydrophobicContact CG-CB 4.3Å; L300-R417 PolarHBondContact N-O 3.17Å; L300-M418 CarbonylContact O-C 3.52Å; L300-M418 VanDerWaalsContact O-CA 3.31Å; L300-M418 WeakPolarHBondContact O-CA 3.28Å; L300-V419 PolarHBondContact O-N 2.88Å
301	D	97.7	Very high	98.1	Very high	82 Å²	82	42 Å²	42	44%	0.439	22%	0.216	S	C	.	.			trans	-84.7	175.7	158.2	71.1	-16.4	0	0	0	110.2	V303 S304 C305	D301-V303 VanDerWaalsContact C-N 3.27Å; D301-V303 PolarHBondContact O-N 2.93Å; D301-S304 PolarHBondContact O-N 3.11Å; D301-S304 WeakPolarHBondContact OD1-CB 3.02Å; D301-S304 PolarHBondContact OD1-N 3.23Å; D301-S304 PolarHBondContact OD1-OG 2.83Å; D301-C305 VanDerWaalsContact O-CB 3.25Å; D301-C305 WeakPolarHBondContact O-CB 3.37Å; D301-C305 PolarHBondContact O-N 2.97Å
302	T	97.8	Very high	98.1	Very high	34 Å²	34	42 Å²	42	21%	0.209	22%	0.216	C	C	.	.	H	α-helix	trans	-55.8	-42.1	179.8	-48.6	0	0	0	0	112.5	L306 M418 T466 L502	T302-L306 HydrophobicContact CG2-CD1 4.21Å; T302-L306 WeakPolarHBondContact O-CB 3.46Å; T302-L306 WeakPolarHBondContact O-CG 3.3Å; T302-L306 PolarHBondContact O-N 2.9Å; T302-M418 HydrophobicContact CG2-CE 3.94Å; T302-M418 VanDerWaalsContact OG1-CE 3.24Å; T302-M418 WeakPolarHBondContact OG1-CE 3.44Å; T302-T466 HydrophobicContact CG2-CG2 3.84Å; T302-T466 VanDerWaalsContact CG2-OG1 3.27Å; T302-T466 WeakPolarHBondContact CG2-OG1 3.29Å; T302-L502 HydrophobicContact CG2-CD1 3.82Å; T302-L502 HydrophobicContact CG2-CD2 4.2Å
303	V	97.4	Very high	98.1	Very high	33 Å²	33	39 Å²	39	20%	0.2	20%	0.203	C	C	.	.	H	α-helix	trans	-68.2	-48.1	-176.5	178.7	0	0	0	0	110.9	D301 C305 L306 R307 L502	D301-V303 VanDerWaalsContact C-N 3.27Å; D301-V303 PolarHBondContact O-N 2.93Å; V303-C305 VanDerWaalsContact C-N 3.33Å; V303-L306 PolarHBondContact O-N 2Å; V303-R307 VanDerWaalsContact O-CB 3.3Å; V303-R307 WeakPolarHBondContact O-CB 3.23Å; V303-R307 PolarHBondContact O-N 2.79Å; V303-L502 HydrophobicContact CG2-CD2 3.76Å
304	S	98.1	Very high	98.2	Very high	41 Å²	41	35.4 Å²	35.4	29%	0.287	19%	0.185	S	C	.	.	H	α-helix	trans	-66.7	-38.8	179.7	-52.9	0	0	0	0	111	D301 R307 I308	D301-S304 PolarHBondContact O-N 3.11Å; D301-S304 WeakPolarHBondContact OD1-CB 3.02Å; D301-S304 PolarHBondContact OD1-N 3.23Å; D301-S304 PolarHBondContact OD1-OG 2.83Å; S304-R307 PolarHBondContact O-N 3.12Å; S304-I308 WeakPolarHBondContact O-CB 3.34Å; S304-I308 WeakPolarHBondContact O-CG1 3.26Å; S304-I308 PolarHBondContact O-N 3.13Å
305	C	98.6	Very high	98.2	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-57.1	-53.8	173.1	-179.7	0	0	0	0	111.3	L300 D301 V303 R307 I308 V309 M418	L300-C305 HydrophobicContact CB-CB 4.24Å; L300-C305 HydrophobicContact CD1-CB 4.34Å; D301-C305 VanDerWaalsContact O-CB 3.25Å; D301-C305 WeakPolarHBondContact O-CB 3.37Å; D301-C305 PolarHBondContact O-N 2.97Å; V303-C305 VanDerWaalsContact C-N 3.33Å; C305-R307 PolarHBondContact O-N 3.47Å; C305-I308 PolarHBondContact O-N 2.92Å; C305-V309 WeakPolarHBondContact O-CG2 3.38Å; C305-V309 PolarHBondContact O-N 3.33Å; C305-M418 HydrophobicContact CB-CB 4.18Å; C305-M418 HydrophobicContact CB-CG 4.15Å; C305-M418 HydrophobicContact CB-SD 3.97Å
306	L	98.4	Very high	98.3	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.4	-41.9	179.6	-74.2	174.5	0	0	0	112.2	T302 V303 I308 V309 L310 T466 L495 I498 D499	T302-L306 HydrophobicContact CG2-CD1 4.21Å; T302-L306 WeakPolarHBondContact O-CB 3.46Å; T302-L306 WeakPolarHBondContact O-CG 3.3Å; T302-L306 PolarHBondContact O-N 2.9Å; V303-L306 PolarHBondContact O-N 2Å; L306-I308 VanDerWaalsContact C-N 3.34Å; L306-I308 PolarHBondContact O-N 2.85Å; L306-V309 HydrophobicContact CD2-CG2 4.42Å; L306-V309 WeakPolarHBondContact O-CG2 3.48Å; L306-V309 PolarHBondContact O-N 3.38Å; L306-L310 WeakPolarHBondContact O-CB 3.31Å; L306-L310 PolarHBondContact O-N 3.26Å; L306-T466 HydrophobicContact CD1-CG2 4.18Å; L306-T466 HydrophobicContact CD2-CG2 3.92Å; L306-T466 HydrophobicContact CG-CG2 4.01Å; L306-L495 HydrophobicContact CD2-CD2 4.26Å; L306-I498 HydrophobicContact CD1-CG2 4.01Å; L306-I498 HydrophobicContact CD2-CB 4.47Å; L306-I498 HydrophobicContact CD2-CG2 3.97Å; L306-D499 HydrophobicContact CD1-CB 4.49Å
307	R	98.6	Very high	98.3	Very high	109 Å²	109	29.5 Å²	29.5	41%	0.411	16%	0.16	S	C	.	.	H	α-helix	trans	-57.2	-46.2	175.8	-172.7	-177.9	-54.6	-157.7	1.5	112.2	V303 S304 C305 S311 N347 Q349	V303-R307 VanDerWaalsContact O-CB 3.3Å; V303-R307 WeakPolarHBondContact O-CB 3.23Å; V303-R307 PolarHBondContact O-N 2.79Å; S304-R307 PolarHBondContact O-N 3.12Å; C305-R307 PolarHBondContact O-N 3.47Å; R307-S311 VanDerWaalsContact O-CB 3.22Å; R307-S311 WeakPolarHBondContact O-CB 3.45Å; R307-S311 PolarHBondContact O-N 3.27Å; R307-S311 VanDerWaalsContact O-N 3.07Å; R307-S311 PolarHBondContact O-OG 3.42Å; R307-N347 WeakPolarHBondContact CD-O 3.44Å; R307-N347 PolarHBondContact NH1-O 3.29Å; R307-Q349 HydrophobicContact CG-CG 3.98Å
308	I	98.8	Very high	98.4	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.015	13%	0.127	C	C	.	.	H	α-helix	trans	-61.4	-57.9	176.7	-74.3	170.3	0	0	0	109.9	L291 Y294 L300 S304 C305 L306 L310 S311 I312 V414	L291-I308 HydrophobicContact CD1-CD1 4.34Å; L291-I308 HydrophobicContact CD1-CG2 3.83Å; L291-I308 HydrophobicContact CD2-CG2 4.37Å; Y294-I308 HydrophobicContact CD1-CD1 4.42Å; Y294-I308 HydrophobicContact CE1-CD1 4.06Å; L300-I308 HydrophobicContact CD1-CD1 3.91Å; L300-I308 HydrophobicContact CD2-CD1 3.89Å; S304-I308 WeakPolarHBondContact O-CB 3.34Å; S304-I308 WeakPolarHBondContact O-CG1 3.26Å; S304-I308 PolarHBondContact O-N 3.13Å; C305-I308 PolarHBondContact O-N 2.92Å; L306-I308 VanDerWaalsContact C-N 3.34Å; L306-I308 PolarHBondContact O-N 2.85Å; I308-L310 VanDerWaalsContact C-N 3.34Å; I308-L310 PolarHBondContact O-N 3.38Å; I308-S311 PolarHBondContact O-N 3Å; I308-S311 PolarHBondContact O-OG 3.07Å; I308-I312 HydrophobicContact CG2-CD1 3.79Å; I308-I312 VanDerWaalsContact O-CG1 3.28Å; I308-I312 WeakPolarHBondContact O-CG1 3.17Å; I308-I312 PolarHBondContact O-N 3.23Å; I308-I312 VanDerWaalsContact O-N 3.1Å; I308-V414 HydrophobicContact CB-CG1 4.44Å; I308-V414 HydrophobicContact CG2-CG1 3.96Å; I308-V414 HydrophobicContact CG2-CG2 3.86Å
309	V	98.8	Very high	98.4	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-67.5	-34.4	-173.6	-60.5	0	0	0	0	113.1	C305 L306 A313 L411 V414 L470 L495	C305-V309 WeakPolarHBondContact O-CG2 3.38Å; C305-V309 PolarHBondContact O-N 3.33Å; L306-V309 HydrophobicContact CD2-CG2 4.42Å; L306-V309 WeakPolarHBondContact O-CG2 3.48Å; L306-V309 PolarHBondContact O-N 3.38Å; V309-A313 WeakPolarHBondContact O-CB 3.24Å; V309-A313 PolarHBondContact O-N 2.68Å; V309-L411 HydrophobicContact CB-CD2 3.58Å; V309-L411 HydrophobicContact CG1-CD2 3.5Å; V309-L411 HydrophobicContact CG2-CD2 4.47Å; V309-V414 HydrophobicContact CG1-CB 4.03Å; V309-V414 HydrophobicContact CG1-CG1 3.78Å; V309-V414 HydrophobicContact CG1-CG2 4.33Å; V309-L470 HydrophobicContact CG2-CD2 4.16Å; V309-L495 HydrophobicContact CB-CD1 4.14Å; V309-L495 HydrophobicContact CG2-CD1 3.88Å; V309-L495 HydrophobicContact CG2-CD2 3.66Å; V309-L495 HydrophobicContact CG2-CG 4.38Å
310	L	98.8	Very high	98.4	Very high	31 Å²	31	18.8 Å²	18.8	16%	0.162	10%	0.097	C	C	.	.	H	α-helix	trans	-67.9	-43.2	177.7	178	58.4	0	0	0	111.3	L306 I308 A313 S314 K492 L495 T496	L306-L310 WeakPolarHBondContact O-CB 3.31Å; L306-L310 PolarHBondContact O-N 3.26Å; I308-L310 VanDerWaalsContact C-N 3.34Å; I308-L310 PolarHBondContact O-N 3.38Å; L310-A313 PolarHBondContact O-N 3.15Å; L310-S314 WeakPolarHBondContact O-CB 3.49Å; L310-S314 PolarHBondContact O-N 2.83Å; L310-K492 HydrophobicContact CD1-CG 4.07Å; L310-L495 HydrophobicContact CB-CB 4.35Å; L310-L495 HydrophobicContact CD1-CB 3.86Å; L310-T496 WeakPolarHBondContact CD1-OG1 3.48Å
311	S	98.8	Very high	98.3	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.021	11%	0.114	C	C	.	.	H	α-helix	trans	-64	-40.4	177.4	63.3	0	0	0	0	112.2	N261 R307 I308 S314 G315 C350	N261-S311 WeakPolarHBondContact CB-O 3.5Å; N261-S311 WeakPolarHBondContact ND2-CB 3.13Å; N261-S311 PolarHBondContact OD1-O 2.96Å; R307-S311 VanDerWaalsContact O-CB 3.22Å; R307-S311 WeakPolarHBondContact O-CB 3.45Å; R307-S311 PolarHBondContact O-N 3.27Å; R307-S311 VanDerWaalsContact O-N 3.07Å; R307-S311 PolarHBondContact O-OG 3.42Å; I308-S311 PolarHBondContact O-N 3Å; I308-S311 PolarHBondContact O-OG 3.07Å; S311-S314 WeakPolarHBondContact O-CB 3.39Å; S311-S314 PolarHBondContact O-N 3.24Å; S311-G315 PolarHBondContact O-N 3.18Å; S311-C350 PolarHBondContact OG-N 2.88Å
312	I	98.9	Very high	98	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-63.3	-47.7	173.8	-58.8	161.9	0	0	0	110.5	L291 I308 S314 G315 L316 I342 C350 F407 V410	L291-I312 HydrophobicContact CD2-CD1 3.77Å; I308-I312 HydrophobicContact CG2-CD1 3.79Å; I308-I312 VanDerWaalsContact O-CG1 3.28Å; I308-I312 WeakPolarHBondContact O-CG1 3.17Å; I308-I312 PolarHBondContact O-N 3.23Å; I308-I312 VanDerWaalsContact O-N 3.1Å; I312-S314 PolarHBondContact O-N 3.31Å; I312-G315 PolarHBondContact O-N 2.91Å; I312-L316 WeakPolarHBondContact O-CB 3.31Å; I312-L316 PolarHBondContact O-N 2.91Å; I312-I342 HydrophobicContact CD1-CD1 4.15Å; I312-I342 HydrophobicContact CD1-CG2 4.09Å; I312-I342 HydrophobicContact CG1-CD1 4.36Å; I312-I342 HydrophobicContact CG1-CG2 3.9Å; I312-I342 HydrophobicContact CG2-CD1 3.92Å; I312-C350 HydrophobicContact CD1-CB 4.37Å; I312-C350 HydrophobicContact CG1-CB 3.63Å; I312-F407 HydrophobicContact CB-CE2 3.74Å; I312-F407 HydrophobicContact CB-CZ 4.17Å; I312-F407 HydrophobicContact CG2-CD2 3.72Å; I312-F407 HydrophobicContact CG2-CE2 3.31Å; I312-F407 HydrophobicContact CG2-CZ 4.04Å; I312-V410 HydrophobicContact CD1-CG1 4.22Å
313	A	98.8	Very high	97.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.8	-36.6	177.4	0	0	0	0	0	112.1	V309 L310 A317 F407 I491 K492 L495	V309-A313 WeakPolarHBondContact O-CB 3.24Å; V309-A313 PolarHBondContact O-N 2.68Å; L310-A313 PolarHBondContact O-N 3.15Å; A313-A317 WeakPolarHBondContact O-CB 3.13Å; A313-A317 PolarHBondContact O-N 2.79Å; A313-F407 HydrophobicContact CB-CE1 3.76Å; A313-F407 HydrophobicContact CB-CZ 3.79Å; A313-I491 HydrophobicContact CB-CG2 4.26Å; A313-K492 HydrophobicContact CB-CB 4.19Å; A313-L495 HydrophobicContact CB-CD1 3.92Å
314	S	98.8	Very high	97.1	Very high	7 Å²	7	26.1 Å²	26.1	5%	0.049	13%	0.125	C	C	.	.	H	α-helix	trans	-65.7	-46.9	176.6	-166.8	0	0	0	0	111.8	H259 N261 L310 S311 I312 A317 H318 K492	H259-S314 PolarHBondContact CE1-OG 3.24Å; N261-S314 VanDerWaalsContact OD1-CB 3.31Å; N261-S314 WeakPolarHBondContact OD1-CB 3.36Å; N261-S314 PolarHBondContact OD1-OG 2.83Å; L310-S314 WeakPolarHBondContact O-CB 3.49Å; L310-S314 PolarHBondContact O-N 2.83Å; S311-S314 WeakPolarHBondContact O-CB 3.39Å; S311-S314 PolarHBondContact O-N 3.24Å; I312-S314 PolarHBondContact O-N 3.31Å; S314-A317 PolarHBondContact O-N 3.42Å; S314-H318 PolarHBondContact O-N 2.81Å; S314-K492 WeakPolarHBondContact OG-CE 3.43Å; S314-K492 PolarHBondContact OG-NZ 3.1Å
315	G	98.6	Very high	96.2	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.8	-45.3	174.8	0	0	0	0	0	112.5	S311 I312 A317 H318 L319	S311-G315 PolarHBondContact O-N 3.18Å; I312-G315 PolarHBondContact O-N 2.91Å; G315-A317 PolarHBondContact O-N 2.78Å; G315-H318 WeakPolarHBondContact O-CB 3.49Å; G315-H318 PolarHBondContact O-N 3.34Å; G315-L319 PolarHBondContact O-N 2.99Å
316	L	98.8	Very high	95	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.9	-39.6	180	-169.9	63	0	0	0	111.8	I312 H318 L319 H320 L337 I352 D403 I404 F407 A488	I312-L316 WeakPolarHBondContact O-CB 3.31Å; I312-L316 PolarHBondContact O-N 2.91Å; L316-H318 VanDerWaalsContact C-N 3.32Å; L316-H318 PolarHBondContact O-N 2.67Å; L316-L319 HydrophobicContact CD1-CD1 4.49Å; L316-L319 PolarHBondContact O-N 2.9Å; L316-H320 WeakPolarHBondContact O-CB 3.35Å; L316-H320 PolarHBondContact O-CD2 3.18Å; L316-H320 PolarHBondContact O-N 3.1Å; L316-L337 HydrophobicContact CD1-CD2 4.23Å; L316-L337 HydrophobicContact CD2-CD2 3.95Å; L316-I352 HydrophobicContact CB-CD1 3.94Å; L316-I352 HydrophobicContact CD1-CD1 4.37Å; L316-D403 HydrophobicContact CD1-CB 4.1Å; L316-D403 HydrophobicContact CD2-CB 4.45Å; L316-I404 HydrophobicContact CD2-CD1 4.23Å; L316-F407 HydrophobicContact CD2-CB 3.99Å; L316-F407 HydrophobicContact CD2-CD1 4.06Å; L316-F407 HydrophobicContact CD2-CG 4.12Å; L316-A488 HydrophobicContact CB-CB 4.21Å; L316-A488 HydrophobicContact CD2-CB 4.16Å; L316-A488 HydrophobicContact CG-CB 3.97Å
317	A	98.6	Very high	93.8	Very high	3 Å²	3	40 Å²	40	3%	0.025	21%	0.211	C	C	.	.	H	α-helix	trans	-61.7	-41.3	173.6	0	0	0	0	0	111.6	A313 S314 G315 H320 I321 A488 K492	A313-A317 WeakPolarHBondContact O-CB 3.13Å; A313-A317 PolarHBondContact O-N 2.79Å; S314-A317 PolarHBondContact O-N 3.42Å; G315-A317 PolarHBondContact O-N 2.78Å; A317-H320 PolarHBondContact O-N 3.2Å; A317-I321 HydrophobicContact CB-CD1 4.43Å; A317-I321 WeakPolarHBondContact O-CB 3.39Å; A317-I321 WeakPolarHBondContact O-CD1 3.25Å; A317-I321 WeakPolarHBondContact O-CG1 3.4Å; A317-I321 PolarHBondContact O-N 3.47Å; A317-A488 HydrophobicContact CB-CB 4.02Å; A317-K492 HydrophobicContact CB-CD 4.49Å
318	H	98.2	Very high	93	Very high	31 Å²	31	36.2 Å²	36.2	14%	0.144	21%	0.207	C	C	.	.	H	α-helix	trans	-61.5	-42.7	175.6	-174.2	72	0	0	0	112.4	M256 L257 H259 S314 G315 L316 K329	M256-H318 PolarHBondContact O-CE1 2.75Å; M256-H318 PolarHBondContact O-NE2 2.92Å; L257-H318 PolarHBondContact O-CD2 2.86Å; L257-H318 PolarHBondContact O-NE2 2.9Å; L257-H318 VanDerWaalsContact O-NE2 3.12Å; H259-H318 HydrophobicContact CB-CB 4.43Å; H259-H318 VanDerWaalsContact CB-CD2 3.43Å; H259-H318 WeakPolarHBondContact CB-CD2 3.43Å; H259-H318 AromaticContact CD2-CG 3.78Å; H259-H318 AromaticContact CD2-ND1 3.83Å; H259-H318 AromaticContact CG-CD2 3.92Å; H259-H318 AromaticContact CG-CG 3.76Å; S314-H318 PolarHBondContact O-N 2.81Å; G315-H318 WeakPolarHBondContact O-CB 3.49Å; G315-H318 PolarHBondContact O-N 3.34Å; L316-H318 VanDerWaalsContact C-N 3.32Å; L316-H318 PolarHBondContact O-N 2.67Å; H318-K329 WeakPolarHBondContact O-CE 3.47Å; H318-K329 PolarHBondContact O-NZ 3.01Å; H318-K329 VanDerWaalsContact O-NZ 3.1Å
319	L	97.8	Very high	92.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.2	-51.2	173.8	-70.3	173.8	0	0	0	111.3	L257 I262 G315 L316 I321 K329 I332 I352 L355	L257-L319 HydrophobicContact CD1-CD2 3.65Å; I262-L319 HydrophobicContact CD1-CD1 3.84Å; I262-L319 HydrophobicContact CD1-CD2 3.88Å; I262-L319 HydrophobicContact CD1-CG 3.62Å; G315-L319 PolarHBondContact O-N 2.99Å; L316-L319 HydrophobicContact CD1-CD1 4.49Å; L316-L319 PolarHBondContact O-N 2.9Å; L319-I321 VanDerWaalsContact C-N 3.34Å; L319-I321 PolarHBondContact O-N 2.77Å; L319-K329 PolarHBondContact O-NZ 3.47Å; L319-I332 CarbonylContact C-O 3.53Å; L319-I332 VanDerWaalsContact C-O 3.25Å; L319-I332 HydrophobicContact CB-CB 4.34Å; L319-I332 HydrophobicContact CD2-CB 4.25Å; L319-I332 HydrophobicContact CD2-CD1 4.31Å; L319-I332 HydrophobicContact CD2-CG2 4.13Å; L319-I332 PolarHBondContact O-N 3.1Å; L319-I352 HydrophobicContact CD1-CD1 4.2Å; L319-I352 HydrophobicContact CD1-CG2 4.35Å; L319-L355 HydrophobicContact CD1-CD2 4.33Å; L319-L355 HydrophobicContact CD2-CD2 4.4Å
320	H	97.9	Very high	92.3	Very high	15 Å²	15	37.3 Å²	37.3	7%	0.069	21%	0.214	C	C	.	.	H	α-helix	trans	-70.1	-25.1	-172.2	-75.1	-165.3	0	0	0	114.7	L316 A317 A331 I332 K400 D403	L316-H320 WeakPolarHBondContact O-CB 3.35Å; L316-H320 PolarHBondContact O-CD2 3.18Å; L316-H320 PolarHBondContact O-N 3.1Å; A317-H320 PolarHBondContact O-N 3.2Å; H320-A331 WeakPolarHBondContact O-CB 3.31Å; H320-I332 PolarHBondContact CD2-O 3.27Å; H320-I332 VanDerWaalsContact CD2-O 3.26Å; H320-K400 HydrophobicContact CB-CD 3.83Å; H320-K400 HydrophobicContact CB-CG 4.3Å; H320-K400 PolarHBondContact CE1-O 3.33Å; H320-D403 IonicContact CD2-OD2 3.85Å; H320-D403 IonicContact CE1-OD2 3.9Å; H320-D403 IonicContact NE2-OD2 2.8Å; H320-D403 PolarHBondContact NE2-OD2 3.36Å
321	I	95.7	Very high	92.1	Very high	72 Å²	72	36 Å²	36	37%	0.369	21%	0.208	S	C	.	.	S	Bend	trans	-84.5	131.5	-178.4	-69.8	166.1	0	0	0	109.7	A317 L319 K329 L489	A317-I321 HydrophobicContact CB-CD1 4.43Å; A317-I321 WeakPolarHBondContact O-CB 3.39Å; A317-I321 WeakPolarHBondContact O-CD1 3.25Å; A317-I321 WeakPolarHBondContact O-CG1 3.4Å; A317-I321 PolarHBondContact O-N 3.47Å; L319-I321 VanDerWaalsContact C-N 3.34Å; L319-I321 PolarHBondContact O-N 2.77Å; I321-K329 WeakPolarHBondContact O-CE 3.44Å; I321-K329 PolarHBondContact O-NZ 2.95Å; I321-L489 HydrophobicContact CD1-CD1 4.38Å; I321-L489 HydrophobicContact CD1-CD2 4.41Å
322	E	92.8	Very high	92	Very high	28 Å²	28	35.9 Å²	35.9	13%	0.131	21%	0.207	C	C	.	.			trans	-80.1	137.7	167.2	-167.7	170.1	-179.8	0	0	109.6	F324 K329 A331 Q363	E322-F324 HydrophobicContact CG-CE1 4.4Å; E322-F324 HydrophobicContact CG-CZ 4.5Å; E322-K329 WeakPolarHBondContact CA-O 3.42Å; E322-K329 VanDerWaalsContact CG-O 3.29Å; E322-K329 WeakPolarHBondContact CG-O 3.36Å; E322-A331 HydrophobicContact CB-CB 4.19Å; E322-Q363 PolarHBondContact OE1-N 3.31Å; E322-Q363 WeakPolarHBondContact OE2-CB 3.18Å; E322-Q363 VanDerWaalsContact OE2-CD 3.29Å; E322-Q363 WeakPolarHBondContact OE2-CG 3.49Å; E322-Q363 PolarHBondContact OE2-N 2.04Å; E322-Q363 PolarHBondContact OE2-NE2 3.42Å
323	I	89.8	Confident	91.9	Very high	60 Å²	60	35.9 Å²	35.9	31%	0.308	21%	0.207	S	C	.	.	B	Isolated β-bridge	trans	-113.6	114.9	177.7	-58.1	175	0	0	0	107.6	M256 G328 K329	M256-I323 HydrophobicContact CB-CD1 4.36Å; I323-G328 CarbonylContact O-C 3.59Å; I323-G328 VanDerWaalsContact O-C 3.29Å; I323-G328 WeakPolarHBondContact O-CA 3.27Å; I323-K329 HydrophobicContact CB-CB 3.88Å; I323-K329 HydrophobicContact CD1-CB 4.15Å; I323-K329 HydrophobicContact CD1-CD 4.35Å; I323-K329 HydrophobicContact CG1-CB 4.13Å; I323-K329 PolarHBondContact N-O 3.38Å; I323-K329 PolarHBondContact O-N 2.93Å
324	F	86.2	Confident	91.8	Very high	146 Å²	146	35.9 Å²	35.9	64%	0.64	21%	0.207	S	C	*	.			trans	-78.6	145.5	178.9	-58.1	-78.9	0	0	0	111.7	E322 Q363	E322-F324 HydrophobicContact CG-CE1 4.4Å; E322-F324 HydrophobicContact CG-CZ 4.5Å; F324-Q363 HydrophobicContact CE1-CB 4.48Å
325	G	79.4	Confident	91.6	Very high	58 Å²	58	36.8 Å²	36.8	60%	0.598	21%	0.209	S	C	*	.	S	Bend	trans	162.3	176.8	179.4	0	0	0	0	0	111.2	Q327 G328	G325-Q327 PolarHBondContact O-N 3.23Å; G325-G328 PolarHBondContact O-N 2.87Å
326	T	73.5	Confident	91.5	Very high	148 Å²	148	37.6 Å²	37.6	91%	0.908	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-30.3	178.7	45.2	0	0	0	0	113.4
327	Q	72.9	Confident	91.5	Very high	125 Å²	125	37.7 Å²	37.7	58%	0.584	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127.3	39	175.9	-61.3	-68.8	-12.9	0	0	110.4	V255 G325	V255-Q327 HydrophobicContact CB-CB 4.36Å; V255-Q327 WeakPolarHBondContact CB-O 3.3Å; V255-Q327 HydrophobicContact CG1-CB 3.83Å; V255-Q327 VanDerWaalsContact CG1-O 3.29Å; V255-Q327 WeakPolarHBondContact CG1-O 3.35Å; V255-Q327 HydrophobicContact CG2-CB 4.38Å; G325-Q327 PolarHBondContact O-N 3.23Å
328	G	81.3	Confident	91.5	Very high	31 Å²	31	38.9 Å²	38.9	32%	0.32	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-50.1	158.9	-170.8	0	0	0	0	0	115.5	I323 G325	I323-G328 CarbonylContact O-C 3.59Å; I323-G328 VanDerWaalsContact O-C 3.29Å; I323-G328 WeakPolarHBondContact O-CA 3.27Å; G325-G328 PolarHBondContact O-N 2.87Å
329	K	90.9	Very high	91.5	Very high	1 Å²	1	37.4 Å²	37.4	0%	0.004	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-88.4	123.6	175.2	-163.6	-171.2	69.8	63.6	0	109.7	T254 V255 M256 L257 H318 L319 I321 E322 I323	T254-K329 HydrophobicContact CG2-CG 4.15Å; V255-K329 WeakPolarHBondContact O-CG 3.47Å; M256-K329 HydrophobicContact CB-CB 4.1Å; M256-K329 WeakPolarHBondContact O-CD 3.47Å; L257-K329 HydrophobicContact CD1-CD 4.49Å; H318-K329 WeakPolarHBondContact O-CE 3.47Å; H318-K329 PolarHBondContact O-NZ 3.01Å; H318-K329 VanDerWaalsContact O-NZ 3.1Å; L319-K329 PolarHBondContact O-NZ 3.47Å; I321-K329 WeakPolarHBondContact O-CE 3.44Å; I321-K329 PolarHBondContact O-NZ 2.95Å; E322-K329 WeakPolarHBondContact CA-O 3.42Å; E322-K329 VanDerWaalsContact CG-O 3.29Å; E322-K329 WeakPolarHBondContact CG-O 3.36Å; I323-K329 HydrophobicContact CB-CB 3.88Å; I323-K329 HydrophobicContact CD1-CB 4.15Å; I323-K329 HydrophobicContact CD1-CD 4.35Å; I323-K329 HydrophobicContact CG1-CB 4.13Å; I323-K329 PolarHBondContact N-O 3.38Å; I323-K329 PolarHBondContact O-N 2.93Å
330	P	92.3	Very high	91.4	Very high	24 Å²	24	43 Å²	43	16%	0.156	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-62.5	156.9	169	28.2	-34.3	0	0	0	110.7	T254 M360 H361	T254-P330 HydrophobicContact CG2-CG 4.04Å; P330-M360 HydrophobicContact CB-CB 4.27Å; P330-M360 HydrophobicContact CG-CB 4.31Å; P330-M360 HydrophobicContact CG-CG 4.12Å; P330-M360 HydrophobicContact CG-SD 3.71Å; P330-H361 CarbonylContact C-O 3.29Å; P330-H361 WeakPolarHBondContact CA-O 3.02Å; P330-H361 VanDerWaalsContact CB-O 3.31Å; P330-H361 WeakPolarHBondContact CB-O 3.47Å
331	A	94.6	Very high	91.4	Very high	4 Å²	4	43 Å²	43	3%	0.033	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	138.1	167.4	0	0	0	0	0	109.5	H320 E322 M360 H361 F396	H320-A331 WeakPolarHBondContact O-CB 3.31Å; E322-A331 HydrophobicContact CB-CB 4.19Å; A331-M360 CarbonylContact O-C 3.56Å; A331-M360 WeakPolarHBondContact O-CA 3.21Å; A331-H361 PolarHBondContact N-O 3.42Å; A331-H361 PolarHBondContact O-N 3.08Å; A331-F396 VanDerWaalsContact C-CZ 3.47Å; A331-F396 HydrophobicContact CB-CD1 4.28Å; A331-F396 HydrophobicContact CB-CE1 3.38Å; A331-F396 HydrophobicContact CB-CZ 3.72Å; A331-F396 WeakPolarHBondContact O-CZ 3.43Å
332	I	95.6	Very high	91.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.4	-175.7	-61.3	161.6	0	0	0	109.1	L251 L257 L319 H320 A358 V359 M360	L251-I332 HydrophobicContact CD2-CG2 4.44Å; L257-I332 HydrophobicContact CD1-CD1 3.7Å; L319-I332 CarbonylContact C-O 3.53Å; L319-I332 VanDerWaalsContact C-O 3.25Å; L319-I332 HydrophobicContact CB-CB 4.34Å; L319-I332 HydrophobicContact CD2-CB 4.25Å; L319-I332 HydrophobicContact CD2-CD1 4.31Å; L319-I332 HydrophobicContact CD2-CG2 4.13Å; L319-I332 PolarHBondContact O-N 3.1Å; H320-I332 PolarHBondContact CD2-O 3.27Å; H320-I332 VanDerWaalsContact CD2-O 3.26Å; I332-A358 HydrophobicContact CG2-CB 3.83Å; I332-V359 WeakPolarHBondContact CA-O 3.33Å; I332-M360 HydrophobicContact CG1-CG 4Å
333	A	96.8	Very high	91.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	134.3	168.8	0	0	0	0	0	109.9	A358 V359 F396 Y399 K400 D403	A333-A358 CarbonylContact O-C 3.56Å; A333-A358 WeakPolarHBondContact O-CA 3.5Å; A333-A358 VanDerWaalsContact O-CB 3.24Å; A333-A358 WeakPolarHBondContact O-CB 3.04Å; A333-V359 HydrophobicContact CB-CG2 4Å; A333-V359 PolarHBondContact N-O 3.04Å; A333-V359 PolarHBondContact O-N 3.41Å; A333-F396 HydrophobicContact CB-CE2 3.94Å; A333-F396 HydrophobicContact CB-CZ 4.02Å; A333-Y399 VanDerWaalsContact CB-CB 3.44Å; A333-K400 HydrophobicContact CB-CG 4.42Å; A333-D403 WeakPolarHBondContact CA-OD2 3.29Å
334	H	97	Very high	92.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.207	C	C	.	.			trans	-78.1	-42.6	-167.1	-173.5	-76.2	0	0	0	113.6	D336 L337 I352 A353 D354 D403	H334-D336 VanDerWaalsContact CE1-C 3.41Å; H334-D336 PolarHBondContact CE1-O 2.92Å; H334-D336 VanDerWaalsContact CE1-O 3.28Å; H334-D336 PolarHBondContact ND1-N 3.12Å; H334-D336 PolarHBondContact O-N 2.83Å; H334-L337 PolarHBondContact ND1-N 2.79Å; H334-L337 VanDerWaalsContact ND1-N 3.11Å; H334-I352 VanDerWaalsContact CD2-CG2 3.42Å; H334-I352 WeakPolarHBondContact CD2-CG2 3.34Å; H334-I352 WeakPolarHBondContact NE2-CG2 3.41Å; H334-A353 PolarHBondContact NE2-O 3Å; H334-D354 PolarHBondContact CE1-O 3.25Å; H334-D354 PolarHBondContact NE2-O 3Å; H334-D403 PolarHBondContact N-OD1 2.81Å; H334-D403 PolarHBondContact N-OD2 3.14Å
335	R	95.3	Very high	92.8	Very high	27 Å²	27	31.4 Å²	31.4	10%	0.102	18%	0.182	C	C	.	.	S	Bend	trans	66.4	-12	177.2	-57.6	178.4	62	-159.2	9.4	117.6	L357 V359 N373 P374 V376 Y399 D403	R335-L357 WeakPolarHBondContact CD-O 3.49Å; R335-V359 HydrophobicContact CG-CG2 4.42Å; R335-N373 PolarHBondContact NH2-O 2.96Å; R335-P374 PolarHBondContact NH2-O 2.8Å; R335-P374 VanDerWaalsContact NH2-O 3.13Å; R335-V376 VanDerWaalsContact CZ-CG2 3.41Å; R335-Y399 HydrophobicContact CG-CD1 4.11Å; R335-D403 PolarHBondContact N-OD1 3.1Å
336	D	95.9	Very high	93.5	Very high	16 Å²	16	37 Å²	37	9%	0.086	19%	0.19	C	C	.	.			trans	-133.2	42.9	170.5	-164.4	30.2	0	0	0	113.4	H334 K338 N341 L357 G377 T378	H334-D336 VanDerWaalsContact CE1-C 3.41Å; H334-D336 PolarHBondContact CE1-O 2.92Å; H334-D336 VanDerWaalsContact CE1-O 3.28Å; H334-D336 PolarHBondContact ND1-N 3.12Å; H334-D336 PolarHBondContact O-N 2.83Å; D336-K338 PolarHBondContact O-N 3.38Å; D336-K338 IonicContact OD1-NZ 2.66Å; D336-K338 PolarHBondContact OD1-NZ 3.19Å; D336-K338 IonicContact OD2-NZ 3.68Å; D336-K338 PolarHBondContact OD2-NZ 2.86Å; D336-N341 PolarHBondContact O-ND2 3.18Å; D336-L357 HydrophobicContact CB-CD1 3.86Å; D336-G377 WeakPolarHBondContact OD1-CA 3.06Å; D336-T378 WeakPolarHBondContact OD1-CB 3.49Å; D336-T378 PolarHBondContact OD1-N 3.36Å; D336-T378 PolarHBondContact OD1-OG1 2.92Å
337	L	98.4	Very high	94.5	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	17%	0.168	C	C	.	.			trans	-70.8	126.4	179.6	-169.2	72.1	0	0	0	109.9	L316 H334 I342 I352 A406 F407	L316-L337 HydrophobicContact CD1-CD2 4.23Å; L316-L337 HydrophobicContact CD2-CD2 3.95Å; H334-L337 PolarHBondContact ND1-N 2.79Å; H334-L337 VanDerWaalsContact ND1-N 3.11Å; L337-I342 HydrophobicContact CD1-CD1 4.15Å; L337-I342 HydrophobicContact CD1-CG1 4.25Å; L337-I352 HydrophobicContact CD1-CD1 4.24Å; L337-I352 HydrophobicContact CD1-CG1 4.41Å; L337-I352 HydrophobicContact CD1-CG2 4.01Å; L337-A406 HydrophobicContact CB-CB 4.09Å; L337-A406 WeakPolarHBondContact O-CB 3.05Å; L337-F407 HydrophobicContact CD2-CB 3.73Å; L337-F407 HydrophobicContact CD2-CG 4.41Å
338	K	98.3	Very high	95.6	Very high	28 Å²	28	28.9 Å²	28.9	12%	0.122	15%	0.15	C	C	.	.			trans	-163.7	162.6	-180	61.3	-163.6	179.4	-156.2	0	109.9	D336 K340 N341 T378 Y381	D336-K338 PolarHBondContact O-N 3.38Å; D336-K338 IonicContact OD1-NZ 2.66Å; D336-K338 PolarHBondContact OD1-NZ 3.19Å; D336-K338 IonicContact OD2-NZ 3.68Å; D336-K338 PolarHBondContact OD2-NZ 2.86Å; K338-K340 HydrophobicContact CG-CB 4.26Å; K338-K340 PolarHBondContact O-N 3.41Å; K338-K340 VanDerWaalsContact O-N 3.12Å; K338-N341 WeakPolarHBondContact CE-ND2 3.38Å; K338-N341 WeakPolarHBondContact CE-OD1 3.36Å; K338-N341 HydrophobicContact CG-CB 4.04Å; K338-N341 PolarHBondContact O-N 3.38Å; K338-T378 HydrophobicContact CD-CG2 4.26Å; K338-T378 WeakPolarHBondContact CD-OG1 3.06Å; K338-T378 WeakPolarHBondContact CE-OG1 3.38Å; K338-T378 PolarHBondContact NZ-OG1 2.97Å; K338-Y381 HydrophobicContact CB-CD1 4.03Å; K338-Y381 HydrophobicContact CB-CD2 3.83Å; K338-Y381 HydrophobicContact CB-CE1 3.93Å; K338-Y381 HydrophobicContact CB-CE2 3.74Å; K338-Y381 HydrophobicContact CB-CG 3.99Å
339	S	98.6	Very high	96.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-57.4	-28.2	179.7	52.2	0	0	0	0	114.1	L291 Y292 Y381 E413	L291-S339 WeakPolarHBondContact CB-O 3.4Å; L291-S339 PolarHBondContact N-O 3.04Å; Y292-S339 PolarHBondContact N-O 3.33Å; S339-Y381 PolarHBondContact OG-OH 3.06Å; S339-E413 WeakPolarHBondContact CB-OE2 3.37Å; S339-E413 PolarHBondContact OG-OE1 3.04Å; S339-E413 PolarHBondContact OG-OE2 3.22Å
340	K	97	Very high	96.8	Very high	118 Å²	118	29.5 Å²	29.5	51%	0.513	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-72.5	-22.5	173.9	-71.2	-173	175.1	-174	0	114.8	Y292 K338	Y292-K340 HydrophobicContact CD1-CG 4.15Å; Y292-K340 HydrophobicContact CD2-CG 4.1Å; Y292-K340 HydrophobicContact CG-CD 4.43Å; Y292-K340 HydrophobicContact CG-CG 3.68Å; K338-K340 HydrophobicContact CG-CB 4.26Å; K338-K340 PolarHBondContact O-N 3.41Å; K338-K340 VanDerWaalsContact O-N 3.12Å
341	N	97.5	Very high	97.1	Very high	15 Å²	15	28.4 Å²	28.4	8%	0.08	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-101.8	15.8	179.8	-73.4	11.8	0	0	0	112.1	D336 K338 A353 D354	D336-N341 PolarHBondContact O-ND2 3.18Å; K338-N341 WeakPolarHBondContact CE-ND2 3.38Å; K338-N341 WeakPolarHBondContact CE-OD1 3.36Å; K338-N341 HydrophobicContact CG-CB 4.04Å; K338-N341 PolarHBondContact O-N 3.38Å; N341-A353 PolarHBondContact O-N 2.89Å; N341-D354 HydrophobicContact CB-CB 4.3Å; N341-D354 WeakPolarHBondContact ND2-CB 3.3Å; N341-D354 PolarHBondContact ND2-OD2 3.45Å
342	I	98.8	Very high	97.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	127.7	174.9	-63.8	167.1	0	0	0	106.1	S290 L291 I312 L337 C350 C351 V410	S290-I342 CarbonylContact C-O 3.56Å; S290-I342 VanDerWaalsContact CA-O 3.26Å; S290-I342 WeakPolarHBondContact CA-O 3.36Å; L291-I342 HydrophobicContact CB-CB 4.1Å; L291-I342 HydrophobicContact CB-CG2 4.06Å; L291-I342 HydrophobicContact CD2-CB 4.41Å; L291-I342 HydrophobicContact CD2-CD1 4.38Å; L291-I342 HydrophobicContact CD2-CG2 4.14Å; L291-I342 PolarHBondContact N-O 3.07Å; I312-I342 HydrophobicContact CD1-CD1 4.15Å; I312-I342 HydrophobicContact CD1-CG2 4.09Å; I312-I342 HydrophobicContact CG1-CD1 4.36Å; I312-I342 HydrophobicContact CG1-CG2 3.9Å; I312-I342 HydrophobicContact CG2-CD1 3.92Å; L337-I342 HydrophobicContact CD1-CD1 4.15Å; L337-I342 HydrophobicContact CD1-CG1 4.25Å; I342-C350 HydrophobicContact CG2-CB 3.62Å; I342-C351 WeakPolarHBondContact CA-O 3.29Å; I342-V410 HydrophobicContact CD1-CG1 3.9Å; I342-V410 HydrophobicContact CD1-CG2 4.31Å
343	L	98.5	Very high	97.3	Very high	34 Å²	34	28.6 Å²	28.6	18%	0.178	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	145	-179.8	-59.8	174.6	0	0	0	110.4	L263 H286 G289 C350 C351 A353	L263-L343 HydrophobicContact CD1-CD1 3.83Å; L263-L343 HydrophobicContact CD2-CD1 4Å; L263-L343 HydrophobicContact CG-CD1 4.46Å; H286-L343 HydrophobicContact CB-CB 4.27Å; G289-L343 WeakPolarHBondContact O-CA 3.43Å; L343-C350 CarbonylContact O-C 3.54Å; L343-C350 WeakPolarHBondContact O-CA 3.45Å; L343-C350 WeakPolarHBondContact O-CB 3.5Å; L343-C351 PolarHBondContact N-O 3.33Å; L343-C351 PolarHBondContact O-N 2.9Å; L343-A353 HydrophobicContact CD1-CB 4.14Å; L343-A353 HydrophobicContact CG-CB 4.23Å
344	V	98.6	Very high	97	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.012	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	127	175.7	-176.6	0	0	0	0	109.1	M288 G289 L291 Y294	M288-V344 HydrophobicContact CB-CB 3.88Å; M288-V344 HydrophobicContact CB-CG1 4.1Å; M288-V344 WeakPolarHBondContact CB-O 3.43Å; M288-V344 HydrophobicContact CG-CG1 4.49Å; G289-V344 PolarHBondContact O-N 3.19Å; L291-V344 HydrophobicContact CB-CG2 4.21Å; L291-V344 HydrophobicContact CD1-CG2 3.98Å; Y294-V344 HydrophobicContact CD1-CG1 4.48Å; Y294-V344 HydrophobicContact CD1-CG2 4.12Å; Y294-V344 HydrophobicContact CD2-CB 4.42Å; Y294-V344 HydrophobicContact CD2-CG1 4.17Å; Y294-V344 HydrophobicContact CD2-CG2 4.43Å; Y294-V344 HydrophobicContact CE2-CG1 4.23Å; Y294-V344 HydrophobicContact CG-CB 4.35Å; Y294-V344 HydrophobicContact CG-CG1 4.3Å; Y294-V344 HydrophobicContact CG-CG2 3.87Å
345	K	97.6	Very high	96.7	Very high	26 Å²	26	30.2 Å²	30.2	11%	0.113	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-87.8	160	178.4	-66	-176.4	-84.9	165	0	110.5	E260 N347 G348 Q349 C350 C351	E260-K345 WeakPolarHBondContact O-CE 3.5Å; E260-K345 PolarHBondContact O-NZ 3.24Å; K345-N347 WeakPolarHBondContact CB-OD1 3.49Å; K345-N347 PolarHBondContact O-N 3.46Å; K345-N347 VanDerWaalsContact O-N 3.15Å; K345-G348 PolarHBondContact O-N 3.01Å; K345-Q349 WeakPolarHBondContact CB-O 3.44Å; K345-Q349 PolarHBondContact N-O 2.66Å; K345-C350 VanDerWaalsContact CE-O 3.29Å; K345-C350 WeakPolarHBondContact CE-O 3.42Å; K345-C351 HydrophobicContact CD-CB 4.47Å
346	K	95.1	Very high	96.3	Very high	177 Å²	177	29.4 Å²	29.4	77%	0.77	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-29.3	178.3	-170.1	175.7	-177.2	177.9	0	113.7	G348	K346-G348 PolarHBondContact O-N 3.31Å
347	N	93.8	Very high	96	Very high	82 Å²	82	29.9 Å²	29.9	44%	0.439	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	2.2	176.6	71.8	-6.1	0	0	0	114.1	R307 K345 Q349	R307-N347 WeakPolarHBondContact CD-O 3.44Å; R307-N347 PolarHBondContact NH1-O 3.29Å; K345-N347 WeakPolarHBondContact CB-OD1 3.49Å; K345-N347 PolarHBondContact O-N 3.46Å; K345-N347 VanDerWaalsContact O-N 3.15Å; N347-Q349 VanDerWaalsContact C-N 3.31Å; N347-Q349 PolarHBondContact ND2-OE1 3.41Å; N347-Q349 PolarHBondContact O-N 3.12Å; N347-Q349 WeakPolarHBondContact OD1-CB 3.44Å; N347-Q349 PolarHBondContact OD1-N 3.07Å
348	G	96	Very high	95.7	Very high	20 Å²	20	29.9 Å²	29.9	21%	0.206	15%	0.15	C	C	.	.	S	Bend	trans	80.9	0.2	-179.3	0	0	0	0	0	115.1	K345 K346	K345-G348 PolarHBondContact O-N 3.01Å; K346-G348 PolarHBondContact O-N 3.31Å
349	Q	98.4	Very high	95.4	Very high	44 Å²	44	28.7 Å²	28.7	21%	0.206	15%	0.145	C	C	.	.			trans	-82.4	169.2	168.2	-64.5	178.6	-35.4	0	0	110.8	E260 R307 K345 N347	E260-Q349 PolarHBondContact OE2-NE2 3.27Å; E260-Q349 VanDerWaalsContact OE2-NE2 3.09Å; E260-Q349 PolarHBondContact OE2-OE1 3.08Å; R307-Q349 HydrophobicContact CG-CG 3.98Å; K345-Q349 WeakPolarHBondContact CB-O 3.44Å; K345-Q349 PolarHBondContact N-O 2.66Å; N347-Q349 VanDerWaalsContact C-N 3.31Å; N347-Q349 PolarHBondContact ND2-OE1 3.41Å; N347-Q349 PolarHBondContact O-N 3.12Å; N347-Q349 WeakPolarHBondContact OD1-CB 3.44Å; N347-Q349 PolarHBondContact OD1-N 3.07Å
350	C	98.8	Very high	95	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	161.9	174.5	-67.3	0	0	0	0	113.1	N261 S311 I312 I342 L343 K345	N261-C350 WeakPolarHBondContact CA-O 3.32Å; N261-C350 WeakPolarHBondContact CB-O 3.5Å; N261-C350 PolarHBondContact ND2-O 3.16Å; S311-C350 PolarHBondContact OG-N 2.88Å; I312-C350 HydrophobicContact CD1-CB 4.37Å; I312-C350 HydrophobicContact CG1-CB 3.63Å; I342-C350 HydrophobicContact CG2-CB 3.62Å; L343-C350 CarbonylContact O-C 3.54Å; L343-C350 WeakPolarHBondContact O-CA 3.45Å; L343-C350 WeakPolarHBondContact O-CB 3.5Å; K345-C350 VanDerWaalsContact CE-O 3.29Å; K345-C350 WeakPolarHBondContact CE-O 3.42Å
351	C	98.4	Very high	94.7	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.007	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	146.8	163.5	61.8	0	0	0	0	111	N261 H286 I342 L343 K345	N261-C351 CarbonylContact O-C 3.25Å; N261-C351 VanDerWaalsContact O-CA 3.27Å; N261-C351 WeakPolarHBondContact O-CA 3.37Å; H286-C351 PolarHBondContact CD2-SG 2.88Å; H286-C351 PolarHBondContact NE2-SG 3.01Å; H286-C351 VanDerWaalsContact NE2-SG 3.35Å; I342-C351 WeakPolarHBondContact CA-O 3.29Å; L343-C351 PolarHBondContact N-O 3.33Å; L343-C351 PolarHBondContact O-N 2.9Å; K345-C351 HydrophobicContact CD-CB 4.47Å
352	I	98.6	Very high	94	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	135.5	179.2	-56.7	173.6	0	0	0	109.3	N261 I262 L263 L316 L319 H334 L337	N261-I352 PolarHBondContact O-N 3.39Å; I262-I352 HydrophobicContact CD1-CB 4.02Å; I262-I352 HydrophobicContact CD1-CD1 4.37Å; L263-I352 WeakPolarHBondContact CB-O 3.42Å; L263-I352 PolarHBondContact N-O 3.43Å; L316-I352 HydrophobicContact CB-CD1 3.94Å; L316-I352 HydrophobicContact CD1-CD1 4.37Å; L319-I352 HydrophobicContact CD1-CD1 4.2Å; L319-I352 HydrophobicContact CD1-CG2 4.35Å; H334-I352 VanDerWaalsContact CD2-CG2 3.42Å; H334-I352 WeakPolarHBondContact CD2-CG2 3.34Å; H334-I352 WeakPolarHBondContact NE2-CG2 3.41Å; L337-I352 HydrophobicContact CD1-CD1 4.24Å; L337-I352 HydrophobicContact CD1-CG1 4.41Å; L337-I352 HydrophobicContact CD1-CG2 4.01Å
353	A	95.6	Very high	93.1	Very high	9 Å²	9	31.8 Å²	31.8	7%	0.074	16%	0.164	C	C	.	.			trans	-127.7	172.3	-177.2	0	0	0	0	0	111.5	L263 H334 N341 L343	L263-A353 HydrophobicContact CB-CB 4.06Å; L263-A353 HydrophobicContact CD2-CB 3.6Å; L263-A353 HydrophobicContact CG-CB 4.46Å; H334-A353 PolarHBondContact NE2-O 3Å; N341-A353 PolarHBondContact O-N 2.89Å; L343-A353 HydrophobicContact CD1-CB 4.14Å; L343-A353 HydrophobicContact CG-CB 4.23Å
354	D	91.4	Very high	92.1	Very high	34 Å²	34	35.1 Å²	35.1	18%	0.182	19%	0.191	C	C	.	.			trans	63.2	67.9	174.5	-167.2	27.9	0	0	0	113.6	K235 Y252 H334 N341 G356	K235-D354 IonicContact NZ-OD1 3.25Å; K235-D354 PolarHBondContact NZ-OD1 2.61Å; Y252-D354 PolarHBondContact OH-N 3.29Å; H334-D354 PolarHBondContact CE1-O 3.25Å; H334-D354 PolarHBondContact NE2-O 3Å; N341-D354 HydrophobicContact CB-CB 4.3Å; N341-D354 WeakPolarHBondContact ND2-CB 3.3Å; N341-D354 PolarHBondContact ND2-OD2 3.45Å; D354-G356 PolarHBondContact O-N 3.34Å
355	L	90.8	Very high	91.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.			trans	-82.5	8.3	179.2	-59.1	177.9	0	0	0	113.2	L251 Y252 L257 L319 L357 A358	L251-L355 HydrophobicContact CB-CB 4.36Å; L251-L355 HydrophobicContact CD1-CB 4.19Å; L251-L355 WeakPolarHBondContact CD1-O 3.37Å; Y252-L355 HydrophobicContact CD1-CD1 4.04Å; Y252-L355 HydrophobicContact CE1-CD1 3.71Å; Y252-L355 HydrophobicContact CE1-CG 4.3Å; Y252-L355 HydrophobicContact CE2-CD1 4.46Å; Y252-L355 HydrophobicContact CE2-CG 4.5Å; L257-L355 HydrophobicContact CD2-CD1 3.9Å; L319-L355 HydrophobicContact CD1-CD2 4.33Å; L319-L355 HydrophobicContact CD2-CD2 4.4Å; L355-L357 PolarHBondContact O-N 2.92Å; L355-A358 HydrophobicContact CB-CB 4.35Å; L355-A358 WeakPolarHBondContact O-CB 3.35Å; L355-A358 PolarHBondContact O-N 3.01Å
356	G	87.2	Confident	90.2	Very high	10 Å²	10	43.7 Å²	43.7	10%	0.103	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-14.7	-172.4	0	0	0	0	0	115.7	D354	D354-G356 PolarHBondContact O-N 3.34Å
357	L	88.8	Confident	89.3	Confident	26 Å²	26	41.9 Å²	41.9	14%	0.136	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	1.7	175.5	-69.5	177	0	0	0	113.9	Y219 R335 D336 L355 V376	Y219-L357 WeakPolarHBondContact OH-CD2 3.42Å; R335-L357 WeakPolarHBondContact CD-O 3.49Å; D336-L357 HydrophobicContact CB-CD1 3.86Å; L355-L357 PolarHBondContact O-N 2.92Å; L357-V376 HydrophobicContact CB-CG2 4.42Å; L357-V376 HydrophobicContact CD1-CB 4.16Å; L357-V376 HydrophobicContact CD1-CG2 4.18Å; L357-V376 HydrophobicContact CD2-CB 4.01Å; L357-V376 HydrophobicContact CD2-CG1 4.46Å; L357-V376 HydrophobicContact CD2-CG2 4.01Å; L357-V376 HydrophobicContact CG-CG2 4.44Å
358	A	92	Very high	88.7	Confident	2 Å²	2	40.1 Å²	40.1	2%	0.017	23%	0.225	C	C	.	.			trans	-71.7	152.9	-174	0	0	0	0	0	112.4	R247 L251 I332 A333 L355	R247-A358 PolarHBondContact NE-O 3.44Å; R247-A358 PolarHBondContact NH2-O 3.05Å; L251-A358 HydrophobicContact CD1-CB 3.76Å; L251-A358 HydrophobicContact CD2-CB 4.37Å; I332-A358 HydrophobicContact CG2-CB 3.83Å; A333-A358 CarbonylContact O-C 3.56Å; A333-A358 WeakPolarHBondContact O-CA 3.5Å; A333-A358 VanDerWaalsContact O-CB 3.24Å; A333-A358 WeakPolarHBondContact O-CB 3.04Å; L355-A358 HydrophobicContact CB-CB 4.35Å; L355-A358 WeakPolarHBondContact O-CB 3.35Å; L355-A358 PolarHBondContact O-N 3.01Å
359	V	91.5	Very high	87.8	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.012	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	145.7	-179.8	-63.5	0	0	0	0	109.9	I332 A333 R335 V370 F396 Y399	I332-V359 WeakPolarHBondContact CA-O 3.33Å; A333-V359 HydrophobicContact CB-CG2 4Å; A333-V359 PolarHBondContact N-O 3.04Å; A333-V359 PolarHBondContact O-N 3.41Å; R335-V359 HydrophobicContact CG-CG2 4.42Å; V359-V370 HydrophobicContact CB-CG2 4.06Å; V359-V370 HydrophobicContact CG1-CG2 3.89Å; V359-V370 HydrophobicContact CG2-CG2 4.39Å; V359-F396 HydrophobicContact CG2-CD2 4.46Å; V359-F396 HydrophobicContact CG2-CE2 4.14Å; V359-Y399 HydrophobicContact CG2-CD1 4.44Å; V359-Y399 HydrophobicContact CG2-CD2 4.12Å; V359-Y399 HydrophobicContact CG2-CG 3.99Å
360	M	90.9	Very high	86.3	Confident	25 Å²	25	42.5 Å²	42.5	12%	0.123	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	147.4	-177.5	-70.4	-174.4	-74.7	0	0	111.1	L251 P330 A331 I332 D369	L251-M360 HydrophobicContact CD2-CE 4.05Å; L251-M360 HydrophobicContact CD2-CG 3.7Å; L251-M360 HydrophobicContact CD2-SD 3.74Å; P330-M360 HydrophobicContact CB-CB 4.27Å; P330-M360 HydrophobicContact CG-CB 4.31Å; P330-M360 HydrophobicContact CG-CG 4.12Å; P330-M360 HydrophobicContact CG-SD 3.71Å; A331-M360 CarbonylContact O-C 3.56Å; A331-M360 WeakPolarHBondContact O-CA 3.21Å; I332-M360 HydrophobicContact CG1-CG 4Å; M360-D369 PolarHBondContact O-N 2.84Å; M360-D369 VanDerWaalsContact O-N 3.07Å
361	H	90.5	Very high	84.7	Confident	27 Å²	27	44.6 Å²	44.6	13%	0.125	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	134.3	170.3	175.2	-90.1	0	0	0	110.4	P330 A331 L368 F396	P330-H361 CarbonylContact C-O 3.29Å; P330-H361 WeakPolarHBondContact CA-O 3.02Å; P330-H361 VanDerWaalsContact CB-O 3.31Å; P330-H361 WeakPolarHBondContact CB-O 3.47Å; A331-H361 PolarHBondContact N-O 3.42Å; A331-H361 PolarHBondContact O-N 3.08Å; H361-L368 HydrophobicContact CB-CD1 4.4Å; H361-F396 HydrophobicContact CB-CB 3.82Å; H361-F396 HydrophobicContact CB-CD1 3.71Å; H361-F396 HydrophobicContact CB-CD2 3.34Å; H361-F396 HydrophobicContact CB-CE1 4.09Å; H361-F396 HydrophobicContact CB-CE2 3.73Å; H361-F396 HydrophobicContact CB-CG 3.31Å; H361-F396 HydrophobicContact CB-CZ 4.1Å; H361-F396 AromaticContact CG-CG 3.76Å
362	S	83.8	Confident	82.8	Confident	28 Å²	28	52.9 Å²	52.9	20%	0.196	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.1	175.7	169.5	0	0	0	0	109.5	S364 T365 N366 Q367	S362-S364 PolarHBondContact O-N 3.28Å; S362-S364 PolarHBondContact OG-OG 3.39Å; S362-T365 WeakPolarHBondContact CB-OG1 3.22Å; S362-T365 PolarHBondContact O-N 3.5Å; S362-T365 PolarHBondContact O-OG1 3.43Å; S362-N366 WeakPolarHBondContact O-CA 3.14Å; S362-N366 PolarHBondContact O-N 3.3Å; S362-Q367 PolarHBondContact N-O 3.19Å
363	Q	79.8	Confident	81.6	Confident	118 Å²	118	57 Å²	57	55%	0.551	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-29.2	180	-83.7	175.1	74.7	0	0	112.5	E322 F324 T365	E322-Q363 PolarHBondContact OE1-N 3.31Å; E322-Q363 WeakPolarHBondContact OE2-CB 3.18Å; E322-Q363 VanDerWaalsContact OE2-CD 3.29Å; E322-Q363 WeakPolarHBondContact OE2-CG 3.49Å; E322-Q363 PolarHBondContact OE2-N 2.04Å; E322-Q363 PolarHBondContact OE2-NE2 3.42Å; F324-Q363 HydrophobicContact CE1-CB 4.48Å; Q363-T365 VanDerWaalsContact C-N 3.35Å; Q363-T365 PolarHBondContact O-N 3.31Å
364	S	76.3	Confident	80.6	Confident	105 Å²	105	58.9 Å²	58.9	73%	0.734	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-30.8	-178.3	58.8	0	0	0	0	113.3	S362	S362-S364 PolarHBondContact O-N 3.28Å; S362-S364 PolarHBondContact OG-OG 3.39Å
365	T	78.2	Confident	80.1	Confident	77 Å²	77	62 Å²	62	47%	0.472	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-14.1	179.5	58.1	0	0	0	0	112.5	S362 Q363 Q367	S362-T365 WeakPolarHBondContact CB-OG1 3.22Å; S362-T365 PolarHBondContact O-N 3.5Å; S362-T365 PolarHBondContact O-OG1 3.43Å; Q363-T365 VanDerWaalsContact C-N 3.35Å; Q363-T365 PolarHBondContact O-N 3.31Å; T365-Q367 PolarHBondContact O-N 2.81Å; T365-Q367 PolarHBondContact OG1-N 3.07Å
366	N	78.3	Confident	79.8	Confident	130 Å²	130	63.1 Å²	63.1	70%	0.695	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	27.2	-167.8	-160.9	50.8	0	0	0	112.4	S362	S362-N366 WeakPolarHBondContact O-CA 3.14Å; S362-N366 PolarHBondContact O-N 3.3Å
367	Q	76.9	Confident	79.9	Confident	140 Å²	140	63.4 Å²	63.4	65%	0.654	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	130.6	178.4	-72	-174.9	5.5	0	0	109.5	S362 T365	S362-Q367 PolarHBondContact N-O 3.19Å; T365-Q367 PolarHBondContact O-N 2.81Å; T365-Q367 PolarHBondContact OG1-N 3.07Å
368	L	81.3	Confident	80.2	Confident	45 Å²	45	64.3 Å²	64.3	24%	0.236	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	111.1	173.6	176.3	60.5	0	0	0	107.9	H361 V370 V393 F396 Y399	H361-L368 HydrophobicContact CB-CD1 4.4Å; L368-V370 VanDerWaalsContact C-N 3.32Å; L368-V370 HydrophobicContact CD1-CG2 3.56Å; L368-V370 HydrophobicContact CD2-CG2 3.79Å; L368-V370 HydrophobicContact CG-CB 4.15Å; L368-V370 HydrophobicContact CG-CG2 3.41Å; L368-V370 VanDerWaalsContact CG-CG2 3.41Å; L368-V370 PolarHBondContact O-N 2.81Å; L368-V370 VanDerWaalsContact O-N 3.09Å; L368-V393 VanDerWaalsContact CD2-O 3.23Å; L368-V393 WeakPolarHBondContact CD2-O 3.35Å; L368-F396 HydrophobicContact CD1-CB 4.04Å; L368-F396 HydrophobicContact CD1-CD2 3.63Å; L368-F396 HydrophobicContact CD1-CG 4.29Å; L368-Y399 HydrophobicContact CD1-CE2 4.46Å; L368-Y399 HydrophobicContact CD2-CE2 4.17Å
369	D	75.6	Confident	80.4	Confident	73 Å²	73	68 Å²	68	39%	0.39	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	76	-178.8	-179.8	22	0	0	0	110.3	R247 M360	R247-D369 IonicContact CZ-OD2 2.79Å; R247-D369 IonicContact NH1-OD2 3.74Å; R247-D369 PolarHBondContact NH1-OD2 2.98Å; R247-D369 PolarHBondContact NH2-O 3Å; R247-D369 IonicContact NH2-OD2 2.61Å; R247-D369 PolarHBondContact NH2-OD2 3.48Å; M360-D369 PolarHBondContact O-N 2.84Å; M360-D369 VanDerWaalsContact O-N 3.07Å
370	V	68.7	Low	80.8	Confident	40 Å²	40	68.6 Å²	68.6	24%	0.242	38%	0.379	C	S	.	.			trans	-108.2	121.3	179.5	166.2	0	0	0	0	108.8	V359 L368 Y399	V359-V370 HydrophobicContact CB-CG2 4.06Å; V359-V370 HydrophobicContact CG1-CG2 3.89Å; V359-V370 HydrophobicContact CG2-CG2 4.39Å; L368-V370 VanDerWaalsContact C-N 3.32Å; L368-V370 HydrophobicContact CD1-CG2 3.56Å; L368-V370 HydrophobicContact CD2-CG2 3.79Å; L368-V370 HydrophobicContact CG-CB 4.15Å; L368-V370 HydrophobicContact CG-CG2 3.41Å; L368-V370 VanDerWaalsContact CG-CG2 3.41Å; L368-V370 PolarHBondContact O-N 2.81Å; L368-V370 VanDerWaalsContact O-N 3.09Å; V370-Y399 WeakPolarHBondContact CG1-OH 3.4Å; V370-Y399 HydrophobicContact CG2-CE2 3.71Å
371	G	63.9	Low	81.1	Confident	45 Å²	45	68.3 Å²	68.3	46%	0.464	38%	0.376	S	S	.	.			trans	-67.5	166.1	167.8	0	0	0	0	0	112.3	N373	G371-N373 PolarHBondContact O-N 3.03Å
372	N	58.4	Low	81.5	Confident	174 Å²	174	67.6 Å²	67.6	93%	0.93	37%	0.373	S	S	*	.	S	Bend	trans	-66.8	5	-166.8	-62	1.5	0	0	0	117.4
373	N	73.9	Confident	82.2	Confident	86 Å²	86	66.3 Å²	66.3	46%	0.46	36%	0.364	S	S	.	.			trans	-130.7	112.1	-177.3	-169.3	-3.3	0	0	0	112.2	R335 G371 R375 V376	R335-N373 PolarHBondContact NH2-O 2.96Å; G371-N373 PolarHBondContact O-N 3.03Å; N373-R375 VanDerWaalsContact C-N 3.32Å; N373-R375 WeakPolarHBondContact OD1-CB 3.48Å; N373-R375 PolarHBondContact OD1-N 3.37Å; N373-V376 HydrophobicContact CB-CG1 4.25Å
374	P	74.3	Confident	83.1	Confident	50 Å²	50	60.7 Å²	60.7	33%	0.325	34%	0.338	S	S	.	.	S	Bend	trans	-71.7	-27.3	175.2	28.1	-32.7	0	0	0	112.5	R335 V376 I391 V393	R335-P374 PolarHBondContact NH2-O 2.8Å; R335-P374 VanDerWaalsContact NH2-O 3.13Å; P374-V376 VanDerWaalsContact C-N 3.34Å; P374-V376 PolarHBondContact O-N 2.89Å; P374-V376 VanDerWaalsContact O-N 3.07Å; P374-I391 HydrophobicContact CB-CG2 4.09Å; P374-V393 HydrophobicContact CB-CG1 3.72Å; P374-V393 HydrophobicContact CG-CG1 4.08Å
375	R	80.4	Confident	84.1	Confident	100 Å²	100	56 Å²	56	38%	0.377	30%	0.304	S	S	.	.			trans	-88.3	64.6	-173.3	-169.7	172.2	162.3	-177.9	-5.8	112.1	N373 M382 E389 F441	N373-R375 VanDerWaalsContact C-N 3.32Å; N373-R375 WeakPolarHBondContact OD1-CB 3.48Å; N373-R375 PolarHBondContact OD1-N 3.37Å; R375-M382 HydrophobicContact CG-CE 4.23Å; R375-E389 IonicContact CZ-OE1 2.9Å; R375-E389 IonicContact NH1-OE1 2.81Å; R375-E389 PolarHBondContact NH1-OE1 3.09Å; R375-F441 VanDerWaalsContact CD-CE2 3.42Å; R375-F441 HydrophobicContact CG-CD2 4.24Å; R375-F441 HydrophobicContact CG-CE2 3.69Å; R375-F441 HydrophobicContact CG-CZ 4.32Å; R375-F441 VanDerWaalsContact CZ-CD2 3.46Å; R375-F441 VanDerWaalsContact NE-CZ 3.28Å
376	V	85.1	Confident	85	Confident	23 Å²	23	52.9 Å²	52.9	14%	0.139	29%	0.285	C	S	.	.			trans	-119.5	165.6	175	-56.2	0	0	0	0	110.7	R335 L357 N373 P374 M382	R335-V376 VanDerWaalsContact CZ-CG2 3.41Å; L357-V376 HydrophobicContact CB-CG2 4.42Å; L357-V376 HydrophobicContact CD1-CB 4.16Å; L357-V376 HydrophobicContact CD1-CG2 4.18Å; L357-V376 HydrophobicContact CD2-CB 4.01Å; L357-V376 HydrophobicContact CD2-CG1 4.46Å; L357-V376 HydrophobicContact CD2-CG2 4.01Å; L357-V376 HydrophobicContact CG-CG2 4.44Å; N373-V376 HydrophobicContact CB-CG1 4.25Å; P374-V376 VanDerWaalsContact C-N 3.34Å; P374-V376 PolarHBondContact O-N 2.89Å; P374-V376 VanDerWaalsContact O-N 3.07Å; V376-M382 VanDerWaalsContact O-CE 3.26Å; V376-M382 WeakPolarHBondContact O-CE 3.38Å
377	G	89.7	Confident	85.9	Confident	15 Å²	15	46.7 Å²	46.7	16%	0.155	25%	0.252	C	S	.	.	S	Bend	trans	96.4	-174.9	-176.8	0	0	0	0	0	113	D336	D336-G377 WeakPolarHBondContact OD1-CA 3.06Å
378	T	94.6	Very high	86.8	Confident	45 Å²	45	42.5 Å²	42.5	28%	0.276	23%	0.234	S	C	.	.			trans	-83.9	117.4	-173.8	-55.4	0	0	0	0	110.4	D336 K338 R380 Y381 M382	D336-T378 WeakPolarHBondContact OD1-CB 3.49Å; D336-T378 PolarHBondContact OD1-N 3.36Å; D336-T378 PolarHBondContact OD1-OG1 2.92Å; K338-T378 HydrophobicContact CD-CG2 4.26Å; K338-T378 WeakPolarHBondContact CD-OG1 3.06Å; K338-T378 WeakPolarHBondContact CE-OG1 3.38Å; K338-T378 PolarHBondContact NZ-OG1 2.97Å; T378-R380 PolarHBondContact O-N 2.89Å; T378-R380 VanDerWaalsContact O-N 3.08Å; T378-Y381 HydrophobicContact CG2-CD2 3.91Å; T378-Y381 HydrophobicContact CG2-CE2 4.4Å; T378-Y381 PolarHBondContact O-N 3.12Å; T378-M382 PolarHBondContact O-N 3.21Å
379	K	97	Very high	87.4	Confident	80 Å²	80	46.5 Å²	46.5	35%	0.348	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-50.1	-41.6	-172	-52.7	-169.8	-158	77.6	0	113.8	Y381 M382 P439 F441 M444	K379-Y381 PolarHBondContact O-N 3.3Å; K379-M382 HydrophobicContact CB-SD 4.44Å; K379-M382 HydrophobicContact CG-SD 4.48Å; K379-M382 WeakPolarHBondContact O-CB 3.16Å; K379-M382 PolarHBondContact O-N 3.06Å; K379-M382 VanDerWaalsContact O-N 3.16Å; K379-P439 WeakPolarHBondContact CD-O 3.21Å; K379-F441 HydrophobicContact CD-CB 4.21Å; K379-M444 HydrophobicContact CB-CG 4.33Å
380	R	98.4	Very high	88.3	Confident	15 Å²	15	47.4 Å²	47.4	6%	0.057	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-57.6	-28.5	178.2	-174.3	-178.5	-68	-75	-3.3	114.4	T378 P430 P436 N437 P439 M444	T378-R380 PolarHBondContact O-N 2.89Å; T378-R380 VanDerWaalsContact O-N 3.08Å; R380-P430 VanDerWaalsContact CD-O 3.26Å; R380-P430 WeakPolarHBondContact CD-O 3.32Å; R380-P430 HydrophobicContact CG-CG 4.16Å; R380-P430 WeakPolarHBondContact CG-O 3.41Å; R380-P430 PolarHBondContact NH1-O 3.35Å; R380-P436 PolarHBondContact NH2-O 2.81Å; R380-N437 PolarHBondContact NH2-O 3.39Å; R380-P439 HydrophobicContact CB-CG 4.08Å; R380-M444 HydrophobicContact CB-SD 4.49Å; R380-M444 WeakPolarHBondContact O-CE 3.45Å
381	Y	98.6	Very high	89.5	Confident	19 Å²	19	46.3 Å²	46.3	8%	0.075	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-104.5	1	-177.2	-65.2	-97.7	0	0	0	112.8	K338 S339 T378 K379 A383 W405 L409 V410 E413 P430	K338-Y381 HydrophobicContact CB-CD1 4.03Å; K338-Y381 HydrophobicContact CB-CD2 3.83Å; K338-Y381 HydrophobicContact CB-CE1 3.93Å; K338-Y381 HydrophobicContact CB-CE2 3.74Å; K338-Y381 HydrophobicContact CB-CG 3.99Å; S339-Y381 PolarHBondContact OG-OH 3.06Å; T378-Y381 HydrophobicContact CG2-CD2 3.91Å; T378-Y381 HydrophobicContact CG2-CE2 4.4Å; T378-Y381 PolarHBondContact O-N 3.12Å; K379-Y381 PolarHBondContact O-N 3.3Å; Y381-A383 PolarHBondContact O-N 3.35Å; Y381-W405 VanDerWaalsContact O-CD1 3.27Å; Y381-L409 HydrophobicContact CD1-CB 4.09Å; Y381-L409 HydrophobicContact CD1-CD1 3.95Å; Y381-L409 HydrophobicContact CE1-CB 4.24Å; Y381-L409 HydrophobicContact CG-CD1 4.41Å; Y381-V410 HydrophobicContact CE1-CG2 4.3Å; Y381-E413 WeakPolarHBondContact CE1-OE1 3.47Å; Y381-E413 PolarHBondContact OH-OE1 3.08Å; Y381-E413 PolarHBondContact OH-OE2 2.98Å; Y381-P430 HydrophobicContact CD1-CG 4.34Å; Y381-P430 HydrophobicContact CE1-CG 3.72Å; Y381-P430 HydrophobicContact CE2-CG 4.41Å
382	M	98.3	Very high	90.9	Very high	12 Å²	12	50.6 Å²	50.6	6%	0.059	26%	0.26	C	S	.	.			trans	-64.8	136.5	179.5	-74.1	178.3	166.9	0	0	110.8	R375 V376 T378 K379 V386 L387 W405 F441	R375-M382 HydrophobicContact CG-CE 4.23Å; V376-M382 VanDerWaalsContact O-CE 3.26Å; V376-M382 WeakPolarHBondContact O-CE 3.38Å; T378-M382 PolarHBondContact O-N 3.21Å; K379-M382 HydrophobicContact CB-SD 4.44Å; K379-M382 HydrophobicContact CG-SD 4.48Å; K379-M382 WeakPolarHBondContact O-CB 3.16Å; K379-M382 PolarHBondContact O-N 3.06Å; K379-M382 VanDerWaalsContact O-N 3.16Å; M382-V386 HydrophobicContact CB-CB 4.37Å; M382-V386 HydrophobicContact CB-CG1 4.28Å; M382-V386 HydrophobicContact CE-CG1 4.39Å; M382-V386 HydrophobicContact CG-CG1 4.08Å; M382-V386 HydrophobicContact SD-CG1 4.06Å; M382-L387 HydrophobicContact CB-CD1 4.33Å; M382-L387 HydrophobicContact CB-CD2 3.73Å; M382-L387 HydrophobicContact CB-CG 3.75Å; M382-L387 HydrophobicContact CG-CD2 4.48Å; M382-L387 HydrophobicContact SD-CD2 4Å; M382-W405 PolarHBondContact O-NE1 2.91Å; M382-W405 VanDerWaalsContact O-NE1 3.1Å; M382-F441 HydrophobicContact SD-CD2 4.01Å; M382-F441 HydrophobicContact SD-CE2 4.03Å
383	A	98.3	Very high	92.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.231	C	C	.	.			trans	-71.3	156.8	174.6	0	0	0	0	0	111	Y381 E385 V386 L387 V402 W405	Y381-A383 PolarHBondContact O-N 3.35Å; A383-E385 VanDerWaalsContact C-N 3.28Å; A383-E385 VanDerWaalsContact CB-OE2 3.32Å; A383-E385 WeakPolarHBondContact CB-OE2 3.29Å; A383-E385 PolarHBondContact O-N 2.88Å; A383-V386 HydrophobicContact CB-CG2 4.4Å; A383-V386 WeakPolarHBondContact O-CB 3.46Å; A383-V386 PolarHBondContact O-N 2.76Å; A383-L387 PolarHBondContact O-N 2.71Å; A383-L387 VanDerWaalsContact O-N 3.09Å; A383-V402 HydrophobicContact CB-CB 4.36Å; A383-V402 HydrophobicContact CB-CG1 4.2Å; A383-V402 HydrophobicContact CB-CG2 4.07Å; A383-W405 VanDerWaalsContact CA-CD1 3.46Å; A383-W405 HydrophobicContact CB-CB 3.79Å; A383-W405 HydrophobicContact CB-CD2 4.15Å; A383-W405 HydrophobicContact CB-CG 3.63Å
384	P	98.4	Very high	93	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-53.6	-43.6	-177.6	-19.9	24.3	0	0	0	113.5	V386 L387 D388 W405 V448 C449	P384-V386 PolarHBondContact O-N 3.09Å; P384-L387 CarbonylContact O-C 3.58Å; P384-L387 WeakPolarHBondContact O-CA 3.29Å; P384-L387 WeakPolarHBondContact O-CB 3.45Å; P384-L387 PolarHBondContact O-N 2.76Å; P384-D388 PolarHBondContact O-N 2.73Å; P384-D388 VanDerWaalsContact O-OD1 3.13Å; P384-W405 VanDerWaalsContact CD-CE3 3.42Å; P384-W405 VanDerWaalsContact CD-CZ3 3.44Å; P384-W405 HydrophobicContact CG-CE3 3.99Å; P384-W405 HydrophobicContact CG-CH2 3.68Å; P384-W405 HydrophobicContact CG-CZ2 4.28Å; P384-W405 HydrophobicContact CG-CZ3 3.49Å; P384-W405 VanDerWaalsContact CG-CZ3 3.49Å; P384-V448 HydrophobicContact CB-CG1 4.06Å; P384-V448 HydrophobicContact CG-CG1 3.68Å; P384-C449 PolarHBondContact O-SG 3.38Å; P384-C449 VanDerWaalsContact O-SG 3.39Å
385	E	97.8	Very high	93.8	Very high	8 Å²	8	47.6 Å²	47.6	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-66.8	-19.7	179.9	69.3	-85.3	-155.3	0	0	113.9	A383 D388 E389 T390 I391 V402 P482 R485	A383-E385 VanDerWaalsContact C-N 3.28Å; A383-E385 VanDerWaalsContact CB-OE2 3.32Å; A383-E385 WeakPolarHBondContact CB-OE2 3.29Å; A383-E385 PolarHBondContact O-N 2.88Å; E385-D388 WeakPolarHBondContact CA-OD1 3.31Å; E385-E389 PolarHBondContact O-N 3.31Å; E385-T390 PolarHBondContact O-N 3.01Å; E385-I391 HydrophobicContact CB-CB 4.23Å; E385-I391 HydrophobicContact CG-CB 3.93Å; E385-I391 HydrophobicContact CG-CG1 4.18Å; E385-I391 WeakPolarHBondContact O-CB 3.36Å; E385-I391 PolarHBondContact O-N 3.2Å; E385-V402 HydrophobicContact CG-CG2 4.4Å; E385-P482 HydrophobicContact CB-CG 4.26Å; E385-P482 HydrophobicContact CG-CG 4Å; E385-R485 IonicContact OE1-CZ 3.33Å; E385-R485 IonicContact OE1-NH1 3.57Å; E385-R485 PolarHBondContact OE1-NH1 2.97Å; E385-R485 IonicContact OE1-NH2 2.73Å; E385-R485 PolarHBondContact OE1-NH2 3.37Å; E385-R485 IonicContact OE2-CZ 2.72Å; E385-R485 IonicContact OE2-NH1 3.11Å; E385-R485 PolarHBondContact OE2-NH1 3.18Å; E385-R485 IonicContact OE2-NH2 3.37Å; E385-R485 PolarHBondContact OE2-NH2 3.38Å
386	V	96.9	Very high	94.4	Very high	10 Å²	10	43.4 Å²	43.4	6%	0.061	23%	0.231	C	C	.	.	H	α-helix	trans	-84.7	-33.3	172.2	-179.5	0	0	0	0	110.3	M382 A383 P384 I391 V402	M382-V386 HydrophobicContact CB-CB 4.37Å; M382-V386 HydrophobicContact CB-CG1 4.28Å; M382-V386 HydrophobicContact CE-CG1 4.39Å; M382-V386 HydrophobicContact CG-CG1 4.08Å; M382-V386 HydrophobicContact SD-CG1 4.06Å; A383-V386 HydrophobicContact CB-CG2 4.4Å; A383-V386 WeakPolarHBondContact O-CB 3.46Å; A383-V386 PolarHBondContact O-N 2.76Å; P384-V386 PolarHBondContact O-N 3.09Å; V386-I391 HydrophobicContact CG2-CD1 4Å; V386-V402 HydrophobicContact CG2-CG1 4.06Å; V386-V402 HydrophobicContact CG2-CG2 3.56Å
387	L	97.2	Very high	94.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-78.3	-30.5	-179.5	-70.5	171	0	0	0	113.5	M382 A383 P384 F441 M444 R445 V448 C449	M382-L387 HydrophobicContact CB-CD1 4.33Å; M382-L387 HydrophobicContact CB-CD2 3.73Å; M382-L387 HydrophobicContact CB-CG 3.75Å; M382-L387 HydrophobicContact CG-CD2 4.48Å; M382-L387 HydrophobicContact SD-CD2 4Å; A383-L387 PolarHBondContact O-N 2.71Å; A383-L387 VanDerWaalsContact O-N 3.09Å; P384-L387 CarbonylContact O-C 3.58Å; P384-L387 WeakPolarHBondContact O-CA 3.29Å; P384-L387 WeakPolarHBondContact O-CB 3.45Å; P384-L387 PolarHBondContact O-N 2.76Å; L387-F441 VanDerWaalsContact C-CZ 3.44Å; L387-F441 VanDerWaalsContact CA-CZ 3.42Å; L387-F441 HydrophobicContact CB-CE2 4.47Å; L387-F441 HydrophobicContact CB-CZ 4.45Å; L387-F441 HydrophobicContact CD2-CD2 3.69Å; L387-F441 HydrophobicContact CD2-CE2 3.68Å; L387-F441 HydrophobicContact CD2-CG 4.37Å; L387-F441 HydrophobicContact CD2-CZ 4.37Å; L387-F441 WeakPolarHBondContact O-CE1 3.32Å; L387-F441 WeakPolarHBondContact O-CZ 3.41Å; L387-M444 HydrophobicContact CD1-CB 3.98Å; L387-M444 HydrophobicContact CD2-CB 3.7Å; L387-R445 HydrophobicContact CB-CB 4.32Å; L387-R445 WeakPolarHBondContact O-CD 3.13Å; L387-V448 HydrophobicContact CD1-CB 3.73Å; L387-V448 HydrophobicContact CD1-CG1 3.9Å; L387-V448 HydrophobicContact CD1-CG2 4.1Å; L387-C449 VanDerWaalsContact CB-SG 3.6Å
388	D	94.9	Very high	95.1	Very high	53 Å²	53	44.9 Å²	44.9	28%	0.283	24%	0.235	S	C	.	.	S	Bend	trans	-101.5	4.5	175.8	65.1	19.2	0	0	0	113.3	P384 E385 T390	P384-D388 PolarHBondContact O-N 2.73Å; P384-D388 VanDerWaalsContact O-OD1 3.13Å; E385-D388 WeakPolarHBondContact CA-OD1 3.31Å; D388-T390 HydrophobicContact CB-CG2 4.43Å; D388-T390 PolarHBondContact O-N 3.44Å; D388-T390 VanDerWaalsContact OD1-CB 3.27Å; D388-T390 WeakPolarHBondContact OD1-CB 2.99Å; D388-T390 VanDerWaalsContact OD1-CG2 3.26Å; D388-T390 WeakPolarHBondContact OD1-CG2 3.22Å; D388-T390 PolarHBondContact OD1-N 3.5Å; D388-T390 PolarHBondContact OD1-OG1 3.28Å
389	E	94	Very high	95.2	Very high	128 Å²	128	42.9 Å²	42.9	60%	0.598	22%	0.222	S	C	*	.	S	Bend	trans	62.3	24.3	176.6	-53.6	-179	175.8	0	0	113.6	R375 E385 F441	R375-E389 IonicContact CZ-OE1 2.9Å; R375-E389 IonicContact NH1-OE1 2.81Å; R375-E389 PolarHBondContact NH1-OE1 3.09Å; E385-E389 PolarHBondContact O-N 3.31Å; E389-F441 HydrophobicContact CG-CZ 4.38Å
390	T	95.3	Very high	95.3	Very high	92 Å²	92	41.4 Å²	41.4	56%	0.564	22%	0.216	S	C	*	.			trans	-92.2	0.5	176.9	65.1	0	0	0	0	114.6	E385 D388 Q392	E385-T390 PolarHBondContact O-N 3.01Å; D388-T390 HydrophobicContact CB-CG2 4.43Å; D388-T390 PolarHBondContact O-N 3.44Å; D388-T390 VanDerWaalsContact OD1-CB 3.27Å; D388-T390 WeakPolarHBondContact OD1-CB 2.99Å; D388-T390 VanDerWaalsContact OD1-CG2 3.26Å; D388-T390 WeakPolarHBondContact OD1-CG2 3.22Å; D388-T390 PolarHBondContact OD1-N 3.5Å; D388-T390 PolarHBondContact OD1-OG1 3.28Å; T390-Q392 PolarHBondContact O-N 3.11Å
391	I	94.7	Very high	95.3	Very high	17 Å²	17	43.6 Å²	43.6	9%	0.087	22%	0.224	C	C	.	.			trans	-57.5	131.2	178.3	-173.3	172.8	0	0	0	111.8	P374 E385 V386 V393 Y399 V402	P374-I391 HydrophobicContact CB-CG2 4.09Å; E385-I391 HydrophobicContact CB-CB 4.23Å; E385-I391 HydrophobicContact CG-CB 3.93Å; E385-I391 HydrophobicContact CG-CG1 4.18Å; E385-I391 WeakPolarHBondContact O-CB 3.36Å; E385-I391 PolarHBondContact O-N 3.2Å; V386-I391 HydrophobicContact CG2-CD1 4Å; I391-V393 HydrophobicContact CG2-CG1 4.01Å; I391-V393 PolarHBondContact O-N 3Å; I391-Y399 HydrophobicContact CD1-CD1 4.16Å; I391-Y399 HydrophobicContact CD1-CE1 4.09Å; I391-V402 HydrophobicContact CD1-CG2 3.77Å
392	Q	92	Very high	95.2	Very high	136 Å²	136	43.3 Å²	43.3	64%	0.636	22%	0.224	S	C	*	.			trans	-76.8	93.8	173.2	-62.4	173.9	26.2	0	0	109.5	T390 D394 C395 S398	T390-Q392 PolarHBondContact O-N 3.11Å; Q392-D394 VanDerWaalsContact C-N 3.28Å; Q392-D394 PolarHBondContact O-N 3.46Å; Q392-C395 HydrophobicContact CB-CB 4Å; Q392-C395 PolarHBondContact O-N 3.39Å; Q392-C395 VanDerWaalsContact O-N 3.16Å; Q392-S398 WeakPolarHBondContact O-CB 3.41Å; Q392-S398 PolarHBondContact O-OG 3.3Å
393	V	89.1	Confident	95.3	Very high	51 Å²	51	42.8 Å²	42.8	31%	0.309	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-25.9	-172.6	-63.3	0	0	0	0	114.2	L368 P374 I391 C395 Y399	L368-V393 VanDerWaalsContact CD2-O 3.23Å; L368-V393 WeakPolarHBondContact CD2-O 3.35Å; P374-V393 HydrophobicContact CB-CG1 3.72Å; P374-V393 HydrophobicContact CG-CG1 4.08Å; I391-V393 HydrophobicContact CG2-CG1 4.01Å; I391-V393 PolarHBondContact O-N 3Å; V393-C395 VanDerWaalsContact C-N 3.3Å; V393-Y399 WeakPolarHBondContact CA-OH 3.38Å; V393-Y399 WeakPolarHBondContact CB-OH 3.07Å; V393-Y399 WeakPolarHBondContact O-CE2 3.17Å; V393-Y399 PolarHBondContact O-OH 3.17Å
394	D	87.6	Confident	95.3	Very high	153 Å²	153	42.9 Å²	42.9	82%	0.818	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-8.5	178.2	-55.3	-47.8	0	0	0	112.7	Q392	Q392-D394 VanDerWaalsContact C-N 3.28Å; Q392-D394 PolarHBondContact O-N 3.46Å
395	C	91.1	Very high	95.3	Very high	43 Å²	43	42.9 Å²	42.9	29%	0.291	22%	0.222	S	C	.	.			trans	-103	110	178.9	-175.5	0	0	0	0	110	Q392 V393 D397 S398	Q392-C395 HydrophobicContact CB-CB 4Å; Q392-C395 PolarHBondContact O-N 3.39Å; Q392-C395 VanDerWaalsContact O-N 3.16Å; V393-C395 VanDerWaalsContact C-N 3.3Å; C395-D397 PolarHBondContact O-N 3.34Å; C395-S398 WeakPolarHBondContact O-CB 3.46Å; C395-S398 PolarHBondContact O-N 2.97Å; C395-S398 PolarHBondContact O-OG 3.43Å
396	F	92.8	Very high	95.4	Very high	11 Å²	11	42.8 Å²	42.8	5%	0.048	22%	0.223	C	C	.	.	H	α-helix	trans	-57.2	-36	179.9	178.7	-105.6	0	0	0	113.2	A331 A333 V359 H361 L368 S398 Y399 K400	A331-F396 VanDerWaalsContact C-CZ 3.47Å; A331-F396 HydrophobicContact CB-CD1 4.28Å; A331-F396 HydrophobicContact CB-CE1 3.38Å; A331-F396 HydrophobicContact CB-CZ 3.72Å; A331-F396 WeakPolarHBondContact O-CZ 3.43Å; A333-F396 HydrophobicContact CB-CE2 3.94Å; A333-F396 HydrophobicContact CB-CZ 4.02Å; V359-F396 HydrophobicContact CG2-CD2 4.46Å; V359-F396 HydrophobicContact CG2-CE2 4.14Å; H361-F396 HydrophobicContact CB-CB 3.82Å; H361-F396 HydrophobicContact CB-CD1 3.71Å; H361-F396 HydrophobicContact CB-CD2 3.34Å; H361-F396 HydrophobicContact CB-CE1 4.09Å; H361-F396 HydrophobicContact CB-CE2 3.73Å; H361-F396 HydrophobicContact CB-CG 3.31Å; H361-F396 HydrophobicContact CB-CZ 4.1Å; H361-F396 AromaticContact CG-CG 3.76Å; L368-F396 HydrophobicContact CD1-CB 4.04Å; L368-F396 HydrophobicContact CD1-CD2 3.63Å; L368-F396 HydrophobicContact CD1-CG 4.29Å; F396-S398 PolarHBondContact O-N 2.76Å; F396-S398 VanDerWaalsContact O-N 3.16Å; F396-Y399 HydrophobicContact CD2-CD2 4.48Å; F396-Y399 PolarHBondContact O-N 3.48Å; F396-K400 HydrophobicContact CD1-CD 4.29Å; F396-K400 HydrophobicContact CD1-CG 4.38Å; F396-K400 HydrophobicContact CE1-CD 3.69Å; F396-K400 HydrophobicContact CE1-CG 3.76Å; F396-K400 HydrophobicContact CZ-CG 4.2Å; F396-K400 PolarHBondContact O-N 2.99Å
397	D	95.3	Very high	95.5	Very high	63 Å²	63	42.3 Å²	42.3	34%	0.337	22%	0.22	S	C	.	.	H	α-helix	trans	-58.2	-27.7	177.8	-89.3	15.5	0	0	0	113.1	C395 Y399 K400 R401	C395-D397 PolarHBondContact O-N 3.34Å; D397-Y399 VanDerWaalsContact C-N 3.34Å; D397-Y399 PolarHBondContact O-N 3.08Å; D397-K400 PolarHBondContact O-N 3.3Å; D397-K400 WeakPolarHBondContact OD1-CE 3.36Å; D397-K400 IonicContact OD1-NZ 2.66Å; D397-K400 PolarHBondContact OD1-NZ 2.93Å; D397-R401 VanDerWaalsContact O-CD 3.29Å; D397-R401 WeakPolarHBondContact O-CD 3.16Å; D397-R401 VanDerWaalsContact O-CG 3.22Å; D397-R401 WeakPolarHBondContact O-CG 3.06Å; D397-R401 PolarHBondContact O-N 3.49Å; D397-R401 IonicContact OD2-NH2 2.75Å
398	S	95.6	Very high	95.5	Very high	7 Å²	7	42.3 Å²	42.3	5%	0.049	22%	0.22	C	C	.	.	H	α-helix	trans	-57.9	-46.4	173.2	-58	0	0	0	0	111.4	Q392 C395 F396 K400 R401 V402	Q392-S398 WeakPolarHBondContact O-CB 3.41Å; Q392-S398 PolarHBondContact O-OG 3.3Å; C395-S398 WeakPolarHBondContact O-CB 3.46Å; C395-S398 PolarHBondContact O-N 2.97Å; C395-S398 PolarHBondContact O-OG 3.43Å; F396-S398 PolarHBondContact O-N 2.76Å; F396-S398 VanDerWaalsContact O-N 3.16Å; S398-K400 PolarHBondContact O-N 2.89Å; S398-R401 PolarHBondContact O-N 3.49Å; S398-R401 VanDerWaalsContact O-N 3.14Å; S398-V402 WeakPolarHBondContact O-CG2 3.46Å; S398-V402 PolarHBondContact O-N 3.3Å
399	Y	96.1	Very high	95.7	Very high	3 Å²	3	39.8 Å²	39.8	1%	0.012	21%	0.206	C	C	.	.	H	α-helix	trans	-67.7	-37.1	-179.5	-57.7	-75.6	0	0	0	112.3	A333 R335 V359 L368 V370 I391 V393 F396 D397 R401 V402 D403	A333-Y399 VanDerWaalsContact CB-CB 3.44Å; R335-Y399 HydrophobicContact CG-CD1 4.11Å; V359-Y399 HydrophobicContact CG2-CD1 4.44Å; V359-Y399 HydrophobicContact CG2-CD2 4.12Å; V359-Y399 HydrophobicContact CG2-CG 3.99Å; L368-Y399 HydrophobicContact CD1-CE2 4.46Å; L368-Y399 HydrophobicContact CD2-CE2 4.17Å; V370-Y399 WeakPolarHBondContact CG1-OH 3.4Å; V370-Y399 HydrophobicContact CG2-CE2 3.71Å; I391-Y399 HydrophobicContact CD1-CD1 4.16Å; I391-Y399 HydrophobicContact CD1-CE1 4.09Å; V393-Y399 WeakPolarHBondContact CA-OH 3.38Å; V393-Y399 WeakPolarHBondContact CB-OH 3.07Å; V393-Y399 WeakPolarHBondContact O-CE2 3.17Å; V393-Y399 PolarHBondContact O-OH 3.17Å; F396-Y399 HydrophobicContact CD2-CD2 4.48Å; F396-Y399 PolarHBondContact O-N 3.48Å; D397-Y399 VanDerWaalsContact C-N 3.34Å; D397-Y399 PolarHBondContact O-N 3.08Å; Y399-R401 VanDerWaalsContact C-N 3.28Å; Y399-R401 PolarHBondContact O-N 3.43Å; Y399-V402 WeakPolarHBondContact O-CB 3.5Å; Y399-V402 PolarHBondContact O-N 3.39Å; Y399-D403 PolarHBondContact O-N 3.27Å; Y399-D403 VanDerWaalsContact O-N 3.1Å
400	K	98	Very high	96	Very high	48 Å²	48	33.7 Å²	33.7	21%	0.209	18%	0.178	C	C	.	.	H	α-helix	trans	-59.8	-41.5	171.8	-72.2	-172.2	-68	-171.9	0	111.2	H320 A333 F396 D397 S398 V402 D403 I404	H320-K400 HydrophobicContact CB-CD 3.83Å; H320-K400 HydrophobicContact CB-CG 4.3Å; H320-K400 PolarHBondContact CE1-O 3.33Å; A333-K400 HydrophobicContact CB-CG 4.42Å; F396-K400 HydrophobicContact CD1-CD 4.29Å; F396-K400 HydrophobicContact CD1-CG 4.38Å; F396-K400 HydrophobicContact CE1-CD 3.69Å; F396-K400 HydrophobicContact CE1-CG 3.76Å; F396-K400 HydrophobicContact CZ-CG 4.2Å; F396-K400 PolarHBondContact O-N 2.99Å; D397-K400 PolarHBondContact O-N 3.3Å; D397-K400 WeakPolarHBondContact OD1-CE 3.36Å; D397-K400 IonicContact OD1-NZ 2.66Å; D397-K400 PolarHBondContact OD1-NZ 2.93Å; S398-K400 PolarHBondContact O-N 2.89Å; K400-V402 VanDerWaalsContact C-N 3.33Å; K400-V402 PolarHBondContact O-N 3.18Å; K400-D403 WeakPolarHBondContact O-CB 3.48Å; K400-D403 PolarHBondContact O-N 3.31Å; K400-I404 WeakPolarHBondContact O-CG1 3.36Å; K400-I404 PolarHBondContact O-N 3.43Å; K400-I404 VanDerWaalsContact O-N 3.14Å
401	R	98.6	Very high	96.1	Very high	61 Å²	61	29.3 Å²	29.3	23%	0.23	15%	0.151	C	C	.	.	H	α-helix	trans	-70.2	-29.2	179.4	-65.9	158	-174.2	-177.6	4.3	112.6	D397 S398 Y399 I404 W405 P482 S483 R485	D397-R401 VanDerWaalsContact O-CD 3.29Å; D397-R401 WeakPolarHBondContact O-CD 3.16Å; D397-R401 VanDerWaalsContact O-CG 3.22Å; D397-R401 WeakPolarHBondContact O-CG 3.06Å; D397-R401 PolarHBondContact O-N 3.49Å; D397-R401 IonicContact OD2-NH2 2.75Å; S398-R401 PolarHBondContact O-N 3.49Å; S398-R401 VanDerWaalsContact O-N 3.14Å; Y399-R401 VanDerWaalsContact C-N 3.28Å; Y399-R401 PolarHBondContact O-N 3.43Å; R401-I404 PolarHBondContact O-N 2.94Å; R401-W405 PolarHBondContact O-N 3.42Å; R401-P482 HydrophobicContact CB-CB 3.94Å; R401-P482 WeakPolarHBondContact CD-O 3.35Å; R401-P482 HydrophobicContact CG-CB 4.41Å; R401-P482 WeakPolarHBondContact CG-O 3.43Å; R401-S483 PolarHBondContact NH1-OG 3.15Å; R401-R485 WeakPolarHBondContact O-CD 3.5Å; R401-R485 PolarHBondContact O-NH1 2.72Å
402	V	98.2	Very high	96.3	Very high	13 Å²	13	28.6 Å²	28.6	8%	0.079	15%	0.147	C	C	.	.	H	α-helix	trans	-63.6	-44.4	169.3	171.7	0	0	0	0	110.8	A383 E385 V386 I391 S398 Y399 K400 I404 W405 A406	A383-V402 HydrophobicContact CB-CB 4.36Å; A383-V402 HydrophobicContact CB-CG1 4.2Å; A383-V402 HydrophobicContact CB-CG2 4.07Å; E385-V402 HydrophobicContact CG-CG2 4.4Å; V386-V402 HydrophobicContact CG2-CG1 4.06Å; V386-V402 HydrophobicContact CG2-CG2 3.56Å; I391-V402 HydrophobicContact CD1-CG2 3.77Å; S398-V402 WeakPolarHBondContact O-CG2 3.46Å; S398-V402 PolarHBondContact O-N 3.3Å; Y399-V402 WeakPolarHBondContact O-CB 3.5Å; Y399-V402 PolarHBondContact O-N 3.39Å; K400-V402 VanDerWaalsContact C-N 3.33Å; K400-V402 PolarHBondContact O-N 3.18Å; V402-I404 VanDerWaalsContact C-N 3.28Å; V402-I404 PolarHBondContact O-N 3.28Å; V402-W405 WeakPolarHBondContact O-CB 3.37Å; V402-W405 PolarHBondContact O-N 2.93Å; V402-A406 PolarHBondContact O-N 3.47Å; V402-A406 VanDerWaalsContact O-N 3.15Å
403	D	98.7	Very high	96.7	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-62.4	-36.8	176.7	-69.4	-21.7	0	0	0	112.2	L316 H320 A333 H334 R335 Y399 K400 A406 F407	L316-D403 HydrophobicContact CD1-CB 4.1Å; L316-D403 HydrophobicContact CD2-CB 4.45Å; H320-D403 IonicContact CD2-OD2 3.85Å; H320-D403 IonicContact CE1-OD2 3.9Å; H320-D403 IonicContact NE2-OD2 2.8Å; H320-D403 PolarHBondContact NE2-OD2 3.36Å; A333-D403 WeakPolarHBondContact CA-OD2 3.29Å; H334-D403 PolarHBondContact N-OD1 2.81Å; H334-D403 PolarHBondContact N-OD2 3.14Å; R335-D403 PolarHBondContact N-OD1 3.1Å; Y399-D403 PolarHBondContact O-N 3.27Å; Y399-D403 VanDerWaalsContact O-N 3.1Å; K400-D403 WeakPolarHBondContact O-CB 3.48Å; K400-D403 PolarHBondContact O-N 3.31Å; D403-A406 PolarHBondContact O-N 2.95Å; D403-F407 WeakPolarHBondContact O-CB 3.26Å; D403-F407 PolarHBondContact O-N 3.07Å
404	I	98.9	Very high	97.1	Very high	3 Å²	3	19.7 Å²	19.7	2%	0.015	10%	0.102	C	C	.	.	H	α-helix	trans	-65.3	-41	178.1	-63.4	-66.1	0	0	0	111.5	L316 K400 R401 V402 A406 F407 G408 C477 R485 L486 A488 I491	L316-I404 HydrophobicContact CD2-CD1 4.23Å; K400-I404 WeakPolarHBondContact O-CG1 3.36Å; K400-I404 PolarHBondContact O-N 3.43Å; K400-I404 VanDerWaalsContact O-N 3.14Å; R401-I404 PolarHBondContact O-N 2.94Å; V402-I404 VanDerWaalsContact C-N 3.28Å; V402-I404 PolarHBondContact O-N 3.28Å; I404-A406 VanDerWaalsContact C-N 3.34Å; I404-A406 PolarHBondContact O-N 3.21Å; I404-F407 PolarHBondContact O-N 3.26Å; I404-G408 PolarHBondContact O-N 3.37Å; I404-C477 HydrophobicContact CG2-CB 3.96Å; I404-R485 HydrophobicContact CG2-CB 4Å; I404-L486 VanDerWaalsContact CG1-O 3.29Å; I404-L486 WeakPolarHBondContact CG1-O 3.27Å; I404-L486 VanDerWaalsContact CG2-O 3.31Å; I404-L486 WeakPolarHBondContact CG2-O 3.44Å; I404-A488 HydrophobicContact CD1-CB 3.9Å; I404-A488 VanDerWaalsContact CD1-N 3.3Å; I404-I491 HydrophobicContact CD1-CD1 3.93Å; I404-I491 HydrophobicContact CG2-CD1 4.27Å
405	W	98.9	Very high	97.7	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-55.5	-52.1	172.5	167.3	-85.4	0	0	0	110.8	Y381 M382 A383 P384 R401 V402 F407 G408 L409 F431 V448 R454 W478	Y381-W405 VanDerWaalsContact O-CD1 3.27Å; M382-W405 PolarHBondContact O-NE1 2.91Å; M382-W405 VanDerWaalsContact O-NE1 3.1Å; A383-W405 VanDerWaalsContact CA-CD1 3.46Å; A383-W405 HydrophobicContact CB-CB 3.79Å; A383-W405 HydrophobicContact CB-CD2 4.15Å; A383-W405 HydrophobicContact CB-CG 3.63Å; P384-W405 VanDerWaalsContact CD-CE3 3.42Å; P384-W405 VanDerWaalsContact CD-CZ3 3.44Å; P384-W405 HydrophobicContact CG-CE3 3.99Å; P384-W405 HydrophobicContact CG-CH2 3.68Å; P384-W405 HydrophobicContact CG-CZ2 4.28Å; P384-W405 HydrophobicContact CG-CZ3 3.49Å; P384-W405 VanDerWaalsContact CG-CZ3 3.49Å; R401-W405 PolarHBondContact O-N 3.42Å; V402-W405 WeakPolarHBondContact O-CB 3.37Å; V402-W405 PolarHBondContact O-N 2.93Å; W405-F407 VanDerWaalsContact C-N 3.31Å; W405-F407 PolarHBondContact O-N 2.9Å; W405-G408 PolarHBondContact O-N 3.46Å; W405-G408 VanDerWaalsContact O-N 3.12Å; W405-L409 PolarHBondContact O-N 3.26Å; W405-F431 HydrophobicContact CZ2-CZ 4.25Å; W405-V448 HydrophobicContact CH2-CG1 3.63Å; W405-V448 HydrophobicContact CZ2-CG1 3.59Å; W405-V448 HydrophobicContact CZ2-CG2 4.46Å; W405-R454 VanDerWaalsContact CH2-NE 3.31Å; W405-W478 HydrophobicContact CD2-CB 4.32Å; W405-W478 VanDerWaalsContact CE3-CA 3.45Å; W405-W478 HydrophobicContact CE3-CB 3.68Å; W405-W478 HydrophobicContact CH2-CB 4.2Å; W405-W478 HydrophobicContact CZ3-CB 3.62Å; W405-W478 WeakPolarHBondContact CZ3-O 3.45Å
406	A	98.8	Very high	98	Very high	5 Å²	5	11.1 Å²	11.1	4%	0.041	5%	0.052	C	C	.	.	H	α-helix	trans	-62.5	-38.6	-179.9	0	0	0	0	0	112	L337 V402 D403 I404 G408 L409 V410	L337-A406 HydrophobicContact CB-CB 4.09Å; L337-A406 WeakPolarHBondContact O-CB 3.05Å; V402-A406 PolarHBondContact O-N 3.47Å; V402-A406 VanDerWaalsContact O-N 3.15Å; D403-A406 PolarHBondContact O-N 2.95Å; I404-A406 VanDerWaalsContact C-N 3.34Å; I404-A406 PolarHBondContact O-N 3.21Å; A406-G408 VanDerWaalsContact C-N 3.33Å; A406-G408 PolarHBondContact O-N 3.18Å; A406-L409 WeakPolarHBondContact O-CB 3.46Å; A406-L409 PolarHBondContact O-N 3.01Å; A406-V410 PolarHBondContact O-N 3.32Å; A406-V410 VanDerWaalsContact O-N 3.1Å
407	F	98.9	Very high	98.3	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-64.1	-38.1	175.1	-174.6	-143.4	0	0	0	112	I312 A313 L316 L337 D403 I404 W405 L409 V410 L411 I491	I312-F407 HydrophobicContact CB-CE2 3.74Å; I312-F407 HydrophobicContact CB-CZ 4.17Å; I312-F407 HydrophobicContact CG2-CD2 3.72Å; I312-F407 HydrophobicContact CG2-CE2 3.31Å; I312-F407 HydrophobicContact CG2-CZ 4.04Å; A313-F407 HydrophobicContact CB-CE1 3.76Å; A313-F407 HydrophobicContact CB-CZ 3.79Å; L316-F407 HydrophobicContact CD2-CB 3.99Å; L316-F407 HydrophobicContact CD2-CD1 4.06Å; L316-F407 HydrophobicContact CD2-CG 4.12Å; L337-F407 HydrophobicContact CD2-CB 3.73Å; L337-F407 HydrophobicContact CD2-CG 4.41Å; D403-F407 WeakPolarHBondContact O-CB 3.26Å; D403-F407 PolarHBondContact O-N 3.07Å; I404-F407 PolarHBondContact O-N 3.26Å; W405-F407 VanDerWaalsContact C-N 3.31Å; W405-F407 PolarHBondContact O-N 2.9Å; F407-L409 VanDerWaalsContact C-N 3.25Å; F407-L409 PolarHBondContact O-N 3.33Å; F407-V410 HydrophobicContact CD2-CB 4.37Å; F407-V410 PolarHBondContact O-N 2.81Å; F407-V410 VanDerWaalsContact O-N 3.1Å; F407-L411 HydrophobicContact CD2-CG 4.32Å; F407-L411 HydrophobicContact CE1-CD2 4.38Å; F407-L411 HydrophobicContact CE1-CG 4.49Å; F407-L411 HydrophobicContact CE2-CD2 3.82Å; F407-L411 HydrophobicContact CE2-CG 4.06Å; F407-L411 HydrophobicContact CZ-CD2 3.72Å; F407-L411 HydrophobicContact CZ-CG 4.15Å; F407-L411 WeakPolarHBondContact O-CG 3.48Å; F407-L411 PolarHBondContact O-N 3.37Å; F407-I491 HydrophobicContact CD1-CD1 3.88Å; F407-I491 HydrophobicContact CE1-CB 4.42Å; F407-I491 HydrophobicContact CE1-CD1 4.13Å; F407-I491 HydrophobicContact CE1-CG2 3.72Å
408	G	98.9	Very high	98.4	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-56.5	-38.4	172.5	0	0	0	0	0	113.2	I404 W405 A406 W412	I404-G408 PolarHBondContact O-N 3.37Å; W405-G408 PolarHBondContact O-N 3.46Å; W405-G408 VanDerWaalsContact O-N 3.12Å; A406-G408 VanDerWaalsContact C-N 3.33Å; A406-G408 PolarHBondContact O-N 3.18Å; G408-W412 PolarHBondContact O-N 2.93Å
409	L	98.9	Very high	98.6	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-68.9	-39.9	174.4	-57.6	177.5	0	0	0	112	Y381 W405 A406 F407 W412 E413 P430 F431 P455 W478	Y381-L409 HydrophobicContact CD1-CB 4.09Å; Y381-L409 HydrophobicContact CD1-CD1 3.95Å; Y381-L409 HydrophobicContact CE1-CB 4.24Å; Y381-L409 HydrophobicContact CG-CD1 4.41Å; W405-L409 PolarHBondContact O-N 3.26Å; A406-L409 WeakPolarHBondContact O-CB 3.46Å; A406-L409 PolarHBondContact O-N 3.01Å; F407-L409 VanDerWaalsContact C-N 3.25Å; F407-L409 PolarHBondContact O-N 3.33Å; L409-W412 WeakPolarHBondContact O-CB 3.29Å; L409-W412 PolarHBondContact O-N 3.48Å; L409-E413 PolarHBondContact O-N 3.38Å; L409-E413 VanDerWaalsContact O-N 3.09Å; L409-P430 HydrophobicContact CB-CB 4.12Å; L409-P430 HydrophobicContact CB-CG 4.13Å; L409-P430 HydrophobicContact CD1-CB 4.43Å; L409-P430 HydrophobicContact CD1-CG 4.39Å; L409-P430 HydrophobicContact CD2-CB 4.11Å; L409-P430 HydrophobicContact CG-CB 4.45Å; L409-F431 HydrophobicContact CD1-CE2 4Å; L409-F431 HydrophobicContact CD2-CE2 3.81Å; L409-F431 HydrophobicContact CD2-CZ 4.15Å; L409-P455 HydrophobicContact CD2-CG 3.72Å; L409-W478 HydrophobicContact CD2-CE3 4.07Å; L409-W478 HydrophobicContact CD2-CZ3 4.49Å
410	V	98.9	Very high	98.6	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-65.5	-39.6	175.2	174.5	0	0	0	0	111.5	L291 I312 I342 Y381 A406 F407 W412 E413 V414	L291-V410 HydrophobicContact CD2-CG1 3.78Å; I312-V410 HydrophobicContact CD1-CG1 4.22Å; I342-V410 HydrophobicContact CD1-CG1 3.9Å; I342-V410 HydrophobicContact CD1-CG2 4.31Å; Y381-V410 HydrophobicContact CE1-CG2 4.3Å; A406-V410 PolarHBondContact O-N 3.32Å; A406-V410 VanDerWaalsContact O-N 3.1Å; F407-V410 HydrophobicContact CD2-CB 4.37Å; F407-V410 PolarHBondContact O-N 2.81Å; F407-V410 VanDerWaalsContact O-N 3.1Å; V410-W412 PolarHBondContact O-N 2.94Å; V410-E413 PolarHBondContact O-N 3.38Å; V410-V414 HydrophobicContact CG1-CG2 4.43Å; V410-V414 WeakPolarHBondContact O-CG2 3.42Å; V410-V414 PolarHBondContact O-N 3.24Å
411	L	98.9	Very high	98.3	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-55.6	-41.8	173	-70.8	178	0	0	0	110.8	V309 F407 V414 A415 L473 M474	V309-L411 HydrophobicContact CB-CD2 3.58Å; V309-L411 HydrophobicContact CG1-CD2 3.5Å; V309-L411 HydrophobicContact CG2-CD2 4.47Å; F407-L411 HydrophobicContact CD2-CG 4.32Å; F407-L411 HydrophobicContact CE1-CD2 4.38Å; F407-L411 HydrophobicContact CE1-CG 4.49Å; F407-L411 HydrophobicContact CE2-CD2 3.82Å; F407-L411 HydrophobicContact CE2-CG 4.06Å; F407-L411 HydrophobicContact CZ-CD2 3.72Å; F407-L411 HydrophobicContact CZ-CG 4.15Å; F407-L411 WeakPolarHBondContact O-CG 3.48Å; F407-L411 PolarHBondContact O-N 3.37Å; L411-V414 PolarHBondContact O-N 3.02Å; L411-A415 VanDerWaalsContact O-CB 3.3Å; L411-A415 WeakPolarHBondContact O-CB 3.02Å; L411-A415 PolarHBondContact O-N 3.1Å; L411-L473 HydrophobicContact CD1-CB 4.25Å; L411-M474 HydrophobicContact CB-CE 4.07Å; L411-M474 HydrophobicContact CB-CG 3.84Å; L411-M474 HydrophobicContact CD1-CG 4.48Å; L411-M474 WeakPolarHBondContact O-CE 2.91Å
412	W	98.9	Very high	98.1	Very high	3 Å²	3	15.2 Å²	15.2	1%	0.011	10%	0.099	C	C	.	.	H	α-helix	trans	-64.5	-44	177.1	-179.2	91.1	0	0	0	112.4	G408 L409 V410 V414 A415 R416 K428 P430 Y432 P455 N456 W461 M474	G408-W412 PolarHBondContact O-N 2.93Å; L409-W412 WeakPolarHBondContact O-CB 3.29Å; L409-W412 PolarHBondContact O-N 3.48Å; V410-W412 PolarHBondContact O-N 2.94Å; W412-V414 VanDerWaalsContact C-N 3.33Å; W412-V414 PolarHBondContact O-N 2.93Å; W412-A415 PolarHBondContact O-N 3.17Å; W412-R416 HydrophobicContact CD2-CG 4.33Å; W412-R416 VanDerWaalsContact CZ2-CD 3.47Å; W412-R416 HydrophobicContact CZ2-CG 4.39Å; W412-R416 WeakPolarHBondContact O-CG 2.99Å; W412-R416 PolarHBondContact O-N 2.79Å; W412-K428 HydrophobicContact CH2-CB 4.43Å; W412-K428 WeakPolarHBondContact CZ3-O 3.35Å; W412-P430 HydrophobicContact CE3-CB 4.48Å; W412-Y432 AromaticContact CH2-CD1 3.99Å; W412-Y432 HydrophobicContact CH2-CD1 3.99Å; W412-Y432 AromaticContact CH2-CE1 3.97Å; W412-Y432 HydrophobicContact CH2-CE1 3.97Å; W412-P455 HydrophobicContact CD2-CB 3.69Å; W412-P455 HydrophobicContact CD2-CG 4.49Å; W412-P455 VanDerWaalsContact CE2-CB 3.44Å; W412-P455 HydrophobicContact CE3-CB 4.29Å; W412-P455 HydrophobicContact CG-CB 3.93Å; W412-P455 HydrophobicContact CH2-CB 4.42Å; W412-P455 HydrophobicContact CZ2-CB 3.83Å; W412-N456 PolarHBondContact NE1-O 3.03Å; W412-W461 AromaticContact CD1-CH2 3.72Å; W412-W461 HydrophobicContact CG-CH2 4.33Å; W412-M474 HydrophobicContact CB-CE 4.38Å; W412-M474 HydrophobicContact CB-SD 3.67Å; W412-M474 HydrophobicContact CG-SD 4.27Å
413	E	98.9	Very high	98.1	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-58	-44.7	175.5	-69.7	176.9	-93.3	0	0	112	L295 S339 Y381 L409 V410 Y427	L295-E413 HydrophobicContact CD1-CB 4.13Å; S339-E413 WeakPolarHBondContact CB-OE2 3.37Å; S339-E413 PolarHBondContact OG-OE1 3.04Å; S339-E413 PolarHBondContact OG-OE2 3.22Å; Y381-E413 WeakPolarHBondContact CE1-OE1 3.47Å; Y381-E413 PolarHBondContact OH-OE1 3.08Å; Y381-E413 PolarHBondContact OH-OE2 2.98Å; L409-E413 PolarHBondContact O-N 3.38Å; L409-E413 VanDerWaalsContact O-N 3.09Å; V410-E413 PolarHBondContact O-N 3.38Å; E413-Y427 HydrophobicContact CB-CE2 4.39Å; E413-Y427 HydrophobicContact CG-CE2 4.44Å; E413-Y427 PolarHBondContact OE2-OH 3.26Å
414	V	98.9	Very high	98	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-67.6	-47.3	-179.8	178.8	0	0	0	0	111.1	L291 L295 L300 I308 V309 V410 L411 W412 R416 R417 M418	L291-V414 HydrophobicContact CD1-CG2 4.34Å; L291-V414 HydrophobicContact CD2-CG2 3.88Å; L291-V414 HydrophobicContact CG-CG2 4.49Å; L295-V414 HydrophobicContact CD1-CG2 4.03Å; L300-V414 HydrophobicContact CD1-CG1 3.62Å; I308-V414 HydrophobicContact CB-CG1 4.44Å; I308-V414 HydrophobicContact CG2-CG1 3.96Å; I308-V414 HydrophobicContact CG2-CG2 3.86Å; V309-V414 HydrophobicContact CG1-CB 4.03Å; V309-V414 HydrophobicContact CG1-CG1 3.78Å; V309-V414 HydrophobicContact CG1-CG2 4.33Å; V410-V414 HydrophobicContact CG1-CG2 4.43Å; V410-V414 WeakPolarHBondContact O-CG2 3.42Å; V410-V414 PolarHBondContact O-N 3.24Å; L411-V414 PolarHBondContact O-N 3.02Å; W412-V414 VanDerWaalsContact C-N 3.33Å; W412-V414 PolarHBondContact O-N 2.93Å; V414-R416 VanDerWaalsContact C-N 3.3Å; V414-R416 PolarHBondContact O-N 3.13Å; V414-R417 PolarHBondContact O-N 3.13Å; V414-M418 PolarHBondContact O-N 2.69Å
415	A	98.8	Very high	98	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.4	-33.7	-176.8	0	0	0	0	0	113.2	L411 W412 R417 M418 W461 L467 L470 M474	L411-A415 VanDerWaalsContact O-CB 3.3Å; L411-A415 WeakPolarHBondContact O-CB 3.02Å; L411-A415 PolarHBondContact O-N 3.1Å; W412-A415 PolarHBondContact O-N 3.17Å; A415-R417 PolarHBondContact O-N 3.21Å; A415-M418 WeakPolarHBondContact O-CB 3.4Å; A415-M418 PolarHBondContact O-N 2.02Å; A415-M418 VanDerWaalsContact O-N 3.09Å; A415-W461 HydrophobicContact CB-CE3 4.47Å; A415-W461 HydrophobicContact CB-CH2 3.46Å; A415-W461 VanDerWaalsContact CB-CH2 3.46Å; A415-W461 HydrophobicContact CB-CZ2 3.82Å; A415-W461 HydrophobicContact CB-CZ3 3.83Å; A415-L467 HydrophobicContact CB-CD2 3.9Å; A415-L470 HydrophobicContact CB-CD1 4.15Å; A415-M474 HydrophobicContact CB-CE 3.52Å
416	R	98.6	Very high	97.9	Very high	16 Å²	16	28.6 Å²	28.6	6%	0.06	17%	0.17	C	C	.	.	H	α-helix	trans	-58.2	-32	173.4	-75.2	176.3	67.2	75.9	4.2	113.6	W412 V414 M418 V424 E425 D426 W461	W412-R416 HydrophobicContact CD2-CG 4.33Å; W412-R416 VanDerWaalsContact CZ2-CD 3.47Å; W412-R416 HydrophobicContact CZ2-CG 4.39Å; W412-R416 WeakPolarHBondContact O-CG 2.99Å; W412-R416 PolarHBondContact O-N 2.79Å; V414-R416 VanDerWaalsContact C-N 3.3Å; V414-R416 PolarHBondContact O-N 3.13Å; R416-M418 VanDerWaalsContact C-N 3.33Å; R416-V424 WeakPolarHBondContact O-CG2 3.4Å; R416-E425 WeakPolarHBondContact CA-OE2 3.46Å; R416-E425 HydrophobicContact CB-CB 4.31Å; R416-E425 PolarHBondContact O-N 3.45Å; R416-E425 VanDerWaalsContact O-N 3.16Å; R416-D426 PolarHBondContact NE-O 2.82Å; R416-D426 PolarHBondContact NH2-O 3.46Å; R416-W461 HydrophobicContact CB-CZ2 4.38Å; R416-W461 HydrophobicContact CG-CH2 4.2Å; R416-W461 HydrophobicContact CG-CZ2 3.72Å
417	R	98.6	Very high	97.9	Very high	18 Å²	18	29.1 Å²	29.1	7%	0.068	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-4.1	-178.6	-56.8	-55	-67.1	137.1	1	112.9	L295 T298 T299 L300 V414 A415 V424 E425	L295-R417 HydrophobicContact CB-CG 4.07Å; L295-R417 HydrophobicContact CD2-CB 3.91Å; L295-R417 HydrophobicContact CD2-CG 3.84Å; L295-R417 HydrophobicContact CG-CG 4.43Å; L295-R417 PolarHBondContact O-NE 3.19Å; T298-R417 PolarHBondContact O-NE 2.87Å; T298-R417 PolarHBondContact O-NH2 3.33Å; T299-R417 CarbonylContact C-O 3.47Å; T299-R417 WeakPolarHBondContact CA-O 3.42Å; T299-R417 VanDerWaalsContact CG2-NH2 3.28Å; L300-R417 HydrophobicContact CD1-CB 4.37Å; L300-R417 HydrophobicContact CG-CB 4.3Å; L300-R417 PolarHBondContact N-O 3.17Å; V414-R417 PolarHBondContact O-N 3.13Å; A415-R417 PolarHBondContact O-N 3.21Å; R417-V424 WeakPolarHBondContact O-CG2 3.23Å; R417-E425 PolarHBondContact NH1-O 3.3Å
418	M	98.4	Very high	97.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-77.8	122.1	172.6	180	-177.4	153.7	0	0	110.6	L300 T302 C305 V414 A415 R416 R460 T466 L467	L300-M418 CarbonylContact O-C 3.52Å; L300-M418 VanDerWaalsContact O-CA 3.31Å; L300-M418 WeakPolarHBondContact O-CA 3.28Å; T302-M418 HydrophobicContact CG2-CE 3.94Å; T302-M418 VanDerWaalsContact OG1-CE 3.24Å; T302-M418 WeakPolarHBondContact OG1-CE 3.44Å; C305-M418 HydrophobicContact CB-CB 4.18Å; C305-M418 HydrophobicContact CB-CG 4.15Å; C305-M418 HydrophobicContact CB-SD 3.97Å; V414-M418 PolarHBondContact O-N 2.69Å; A415-M418 WeakPolarHBondContact O-CB 3.4Å; A415-M418 PolarHBondContact O-N 2.02Å; A415-M418 VanDerWaalsContact O-N 3.09Å; R416-M418 VanDerWaalsContact C-N 3.33Å; M418-R460 PolarHBondContact O-NH2 2.67Å; M418-T466 HydrophobicContact CE-CG2 4.37Å; M418-T466 HydrophobicContact SD-CG2 4.21Å; M418-L467 HydrophobicContact CB-CD2 4.12Å; M418-L467 HydrophobicContact CE-CD1 4.47Å; M418-L467 HydrophobicContact CE-CG 4.07Å; M418-L467 HydrophobicContact CG-CD2 4.35Å; M418-L467 HydrophobicContact SD-CD2 3.76Å; M418-L467 HydrophobicContact SD-CG 3.87Å
419	V	98	Very high	97.9	Very high	52 Å²	52	34.2 Å²	34.2	32%	0.315	20%	0.196	S	C	.	.			trans	-70.7	127.1	172.3	-174.7	0	0	0	0	108.4	T299 L300 I423 V424	T299-V419 HydrophobicContact CG2-CG2 4.47Å; L300-V419 PolarHBondContact O-N 2.88Å; V419-I423 WeakPolarHBondContact CA-O 3.44Å; V419-V424 HydrophobicContact CG2-CB 4.08Å; V419-V424 HydrophobicContact CG2-CG1 4.48Å; V419-V424 HydrophobicContact CG2-CG2 4.31Å
420	S	96.6	Very high	97.9	Very high	8 Å²	8	34.2 Å²	34.2	6%	0.056	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-138	131.4	169.6	179.9	0	0	0	0	109.2	G422 I423 D464	S420-G422 PolarHBondContact O-N 3.04Å; S420-I423 PolarHBondContact N-O 2.86Å; S420-I423 PolarHBondContact O-N 3.34Å; S420-D464 WeakPolarHBondContact CB-OD2 3.27Å; S420-D464 VanDerWaalsContact OG-CB 3.28Å; S420-D464 WeakPolarHBondContact OG-CB 3.32Å; S420-D464 PolarHBondContact OG-OD2 2.78Å
421	N	93.1	Very high	97.8	Very high	127 Å²	127	34.3 Å²	34.3	68%	0.679	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	38.3	-175.2	-57.8	-22.3	0	0	0	113	I423	N421-I423 PolarHBondContact O-N 2.86Å
422	G	94.2	Very high	97.8	Very high	73 Å²	73	38.9 Å²	38.9	75%	0.753	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.8	5.7	-179.1	0	0	0	0	0	115.3	S420	S420-G422 PolarHBondContact O-N 3.04Å
423	I	96.9	Very high	97.8	Very high	99 Å²	99	42.9 Å²	42.9	51%	0.508	24%	0.236	S	C	.	.	B	Isolated β-bridge	trans	-115.7	140.7	-176.9	-56.2	169.2	0	0	0	109.9	V419 S420 N421 R460	V419-I423 WeakPolarHBondContact CA-O 3.44Å; S420-I423 PolarHBondContact N-O 2.86Å; S420-I423 PolarHBondContact O-N 3.34Å; N421-I423 PolarHBondContact O-N 2.86Å; I423-R460 PolarHBondContact O-NH1 2.9Å
424	V	97.8	Very high	97.7	Very high	50 Å²	50	45.5 Å²	45.5	30%	0.303	25%	0.252	S	S	.	.			trans	-147	147.2	177.4	66.2	0	0	0	0	110.2	T299 R416 R417 V419	T299-V424 HydrophobicContact CG2-CG1 3.97Å; T299-V424 HydrophobicContact CG2-CG2 4.11Å; R416-V424 WeakPolarHBondContact O-CG2 3.4Å; R417-V424 WeakPolarHBondContact O-CG2 3.23Å; V419-V424 HydrophobicContact CG2-CB 4.08Å; V419-V424 HydrophobicContact CG2-CG1 4.48Å; V419-V424 HydrophobicContact CG2-CG2 4.31Å
425	E	98.1	Very high	97.7	Very high	33 Å²	33	46.2 Å²	46.2	15%	0.154	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-89.9	151.3	173.3	-68.1	85.8	-161.7	0	0	112.1	R416 R417 P458 R460 W461	R416-E425 WeakPolarHBondContact CA-OE2 3.46Å; R416-E425 HydrophobicContact CB-CB 4.31Å; R416-E425 PolarHBondContact O-N 3.45Å; R416-E425 VanDerWaalsContact O-N 3.16Å; R417-E425 PolarHBondContact NH1-O 3.3Å; E425-P458 WeakPolarHBondContact OE1-CG 3.41Å; E425-R460 IonicContact OE1-CZ 3.7Å; E425-R460 IonicContact OE1-NE 2.75Å; E425-R460 PolarHBondContact OE1-NE 3.4Å; E425-R460 IonicContact OE1-NH2 3.13Å; E425-R460 PolarHBondContact OE1-NH2 3.1Å; E425-R460 IonicContact OE2-CZ 3.78Å; E425-R460 IonicContact OE2-NE 2.74Å; E425-R460 IonicContact OE2-NH2 2.96Å; E425-R460 PolarHBondContact OE2-NH2 3.24Å; E425-W461 PolarHBondContact OE2-NE1 3.41Å
426	D	97.8	Very high	97.7	Very high	117 Å²	117	49.7 Å²	49.7	63%	0.626	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-57.3	148.9	166.9	-63.6	-33.2	0	0	0	112	R416 K428	R416-D426 PolarHBondContact NE-O 2.82Å; R416-D426 PolarHBondContact NH2-O 3.46Å; D426-K428 PolarHBondContact O-N 2.84Å
427	Y	98.4	Very high	97.5	Very high	16 Å²	16	56.4 Å²	56.4	6%	0.063	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-58.8	133	169.2	177	-87.4	0	0	0	110.1	Y292 L295 Q296 E413	Y292-Y427 HydrophobicContact CD2-CE1 4.07Å; Y292-Y427 AromaticContact CD2-CZ 3.66Å; Y292-Y427 WeakPolarHBondContact CD2-OH 3.26Å; Y292-Y427 AromaticContact CE2-CE1 3.65Å; Y292-Y427 HydrophobicContact CE2-CE1 3.65Å; Y292-Y427 AromaticContact CE2-CZ 3.72Å; Y292-Y427 VanDerWaalsContact CE2-OH 3.28Å; Y292-Y427 WeakPolarHBondContact CE2-OH 3.47Å; L295-Y427 HydrophobicContact CB-CD2 3.62Å; L295-Y427 HydrophobicContact CB-CE2 4.02Å; L295-Y427 HydrophobicContact CD1-CD2 4.45Å; L295-Y427 HydrophobicContact CD1-CE2 4.26Å; Q296-Y427 HydrophobicContact CG-CD1 4.32Å; Q296-Y427 HydrophobicContact CG-CG 4.5Å; E413-Y427 HydrophobicContact CB-CE2 4.39Å; E413-Y427 HydrophobicContact CG-CE2 4.44Å; E413-Y427 PolarHBondContact OE2-OH 3.26Å
428	K	98.4	Very high	97.3	Very high	76 Å²	76	61.9 Å²	61.9	33%	0.33	35%	0.347	S	S	.	.			trans	-143.7	142.8	169.9	-63.8	-64.6	175	-171.8	0	108.8	W412 D426 Y432	W412-K428 HydrophobicContact CH2-CB 4.43Å; W412-K428 WeakPolarHBondContact CZ3-O 3.35Å; D426-K428 PolarHBondContact O-N 2.84Å; K428-Y432 HydrophobicContact CB-CD1 3.42Å; K428-Y432 VanDerWaalsContact CB-CD1 3.42Å; K428-Y432 HydrophobicContact CB-CD2 4.09Å; K428-Y432 HydrophobicContact CB-CE1 3.79Å; K428-Y432 HydrophobicContact CB-CE2 4.38Å; K428-Y432 HydrophobicContact CB-CG 3.58Å; K428-Y432 HydrophobicContact CD-CD2 3.61Å; K428-Y432 HydrophobicContact CD-CE2 3.83Å; K428-Y432 HydrophobicContact CD-CG 3.97Å; K428-Y432 HydrophobicContact CG-CD1 3.91Å; K428-Y432 HydrophobicContact CG-CD2 3.82Å; K428-Y432 HydrophobicContact CG-CE1 3.9Å; K428-Y432 HydrophobicContact CG-CE2 3.78Å; K428-Y432 HydrophobicContact CG-CG 3.86Å
429	P	98.3	Very high	97.2	Very high	30 Å²	30	62.1 Å²	62.1	20%	0.195	35%	0.349	C	S	.	.			trans	-66.9	157.3	169.1	29.8	-33.7	0	0	0	110.3	Y432	P429-Y432 WeakPolarHBondContact O-CB 3.43Å; P429-Y432 PolarHBondContact O-N 3.47Å
430	P	98.6	Very high	97.2	Very high	0 Å²	0	62 Å²	62	0%	0	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	141.6	176.5	24.6	-33	0	0	0	110.6	R380 Y381 L409 W412 Y432 P455	R380-P430 VanDerWaalsContact CD-O 3.26Å; R380-P430 WeakPolarHBondContact CD-O 3.32Å; R380-P430 HydrophobicContact CG-CG 4.16Å; R380-P430 WeakPolarHBondContact CG-O 3.41Å; R380-P430 PolarHBondContact NH1-O 3.35Å; Y381-P430 HydrophobicContact CD1-CG 4.34Å; Y381-P430 HydrophobicContact CE1-CG 3.72Å; Y381-P430 HydrophobicContact CE2-CG 4.41Å; L409-P430 HydrophobicContact CB-CB 4.12Å; L409-P430 HydrophobicContact CB-CG 4.13Å; L409-P430 HydrophobicContact CD1-CB 4.43Å; L409-P430 HydrophobicContact CD1-CG 4.39Å; L409-P430 HydrophobicContact CD2-CB 4.11Å; L409-P430 HydrophobicContact CG-CB 4.45Å; W412-P430 HydrophobicContact CE3-CB 4.48Å; P430-Y432 PolarHBondContact O-N 2.89Å; P430-P455 HydrophobicContact CB-CG 4.05Å
431	F	98.6	Very high	97.1	Very high	2 Å²	2	62.4 Å²	62.4	1%	0.009	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	63	19.3	-176.6	-49.2	-81.5	0	0	0	115.3	W405 L409 D433 V434 V435 M444 V447 V448 P455	W405-F431 HydrophobicContact CZ2-CZ 4.25Å; L409-F431 HydrophobicContact CD1-CE2 4Å; L409-F431 HydrophobicContact CD2-CE2 3.81Å; L409-F431 HydrophobicContact CD2-CZ 4.15Å; F431-D433 PolarHBondContact O-N 3.14Å; F431-D433 VanDerWaalsContact O-N 3.07Å; F431-V434 HydrophobicContact CB-CG2 3.87Å; F431-V434 HydrophobicContact CD1-CG2 4.16Å; F431-V434 PolarHBondContact O-N 2.68Å; F431-V435 HydrophobicContact CB-CG2 3.98Å; F431-V435 WeakPolarHBondContact O-CG2 3.39Å; F431-V435 PolarHBondContact O-N 3.43Å; F431-V435 VanDerWaalsContact O-N 3.15Å; F431-M444 HydrophobicContact CD2-CE 3.8Å; F431-M444 HydrophobicContact CE2-CE 4.02Å; F431-M444 HydrophobicContact CG-CE 4.31Å; F431-V447 HydrophobicContact CD1-CG1 3.9Å; F431-V447 HydrophobicContact CE1-CG1 4.25Å; F431-V448 HydrophobicContact CE1-CG2 3.95Å; F431-V448 HydrophobicContact CE2-CG2 4.26Å; F431-V448 HydrophobicContact CZ-CG2 3.71Å; F431-P455 HydrophobicContact CD1-CG 4.49Å; F431-P455 HydrophobicContact CE1-CG 4.31Å; F431-P455 HydrophobicContact CE2-CG 4.36Å; F431-P455 HydrophobicContact CZ-CG 4.23Å
432	Y	98.4	Very high	97.3	Very high	97 Å²	97	61.3 Å²	61.3	38%	0.38	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.3	-179.9	76.1	-77.5	0	0	0	114.8	W412 K428 P429 P430	W412-Y432 AromaticContact CH2-CD1 3.99Å; W412-Y432 HydrophobicContact CH2-CD1 3.99Å; W412-Y432 AromaticContact CH2-CE1 3.97Å; W412-Y432 HydrophobicContact CH2-CE1 3.97Å; K428-Y432 HydrophobicContact CB-CD1 3.42Å; K428-Y432 VanDerWaalsContact CB-CD1 3.42Å; K428-Y432 HydrophobicContact CB-CD2 4.09Å; K428-Y432 HydrophobicContact CB-CE1 3.79Å; K428-Y432 HydrophobicContact CB-CE2 4.38Å; K428-Y432 HydrophobicContact CB-CG 3.58Å; K428-Y432 HydrophobicContact CD-CD2 3.61Å; K428-Y432 HydrophobicContact CD-CE2 3.83Å; K428-Y432 HydrophobicContact CD-CG 3.97Å; K428-Y432 HydrophobicContact CG-CD1 3.91Å; K428-Y432 HydrophobicContact CG-CD2 3.82Å; K428-Y432 HydrophobicContact CG-CE1 3.9Å; K428-Y432 HydrophobicContact CG-CE2 3.78Å; K428-Y432 HydrophobicContact CG-CG 3.86Å; P429-Y432 WeakPolarHBondContact O-CB 3.43Å; P429-Y432 PolarHBondContact O-N 3.47Å; P430-Y432 PolarHBondContact O-N 2.89Å
433	D	98.1	Very high	97.5	Very high	86 Å²	86	60.7 Å²	60.7	46%	0.46	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-14.4	-175.1	51.7	-25	0	0	0	113.4	F431	F431-D433 PolarHBondContact O-N 3.14Å; F431-D433 VanDerWaalsContact O-N 3.07Å
434	V	98.2	Very high	97.6	Very high	56 Å²	56	56 Å²	56	34%	0.339	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131	-7.8	-171	-64.5	0	0	0	0	114.6	F431 V447	F431-V434 HydrophobicContact CB-CG2 3.87Å; F431-V434 HydrophobicContact CD1-CG2 4.16Å; F431-V434 PolarHBondContact O-N 2.68Å; V434-V447 HydrophobicContact CB-CG1 4.42Å; V434-V447 HydrophobicContact CB-CG2 4.35Å; V434-V447 HydrophobicContact CG2-CG1 3.63Å; V434-V447 HydrophobicContact CG2-CG2 4.27Å
435	V	98.3	Very high	97.6	Very high	14 Å²	14	57.9 Å²	57.9	9%	0.085	30%	0.299	C	S	.	.	S	Bend	trans	-137.1	152.7	174.5	-55.7	0	0	0	0	111.8	F431 P439 D443 M444 V447	F431-V435 HydrophobicContact CB-CG2 3.98Å; F431-V435 WeakPolarHBondContact O-CG2 3.39Å; F431-V435 PolarHBondContact O-N 3.43Å; F431-V435 VanDerWaalsContact O-N 3.15Å; V435-P439 HydrophobicContact CB-CB 3.97Å; V435-P439 HydrophobicContact CG2-CB 3.89Å; V435-P439 HydrophobicContact CG2-CG 4.14Å; V435-D443 HydrophobicContact CG1-CB 4.31Å; V435-M444 HydrophobicContact CB-SD 4.39Å; V435-M444 HydrophobicContact CG1-SD 3.97Å; V435-M444 HydrophobicContact CG2-SD 3.91Å; V435-V447 HydrophobicContact CG1-CB 4.24Å; V435-V447 HydrophobicContact CG1-CG2 3.67Å
436	P	97.7	Very high	97.6	Very high	74 Å²	74	61.6 Å²	61.6	48%	0.481	31%	0.314	S	S	.	.			trans	-65.5	169.9	177.2	28.4	-36.3	0	0	0	112.5	R380 D438 P439	R380-P436 PolarHBondContact NH2-O 2.81Å; P436-D438 PolarHBondContact O-N 3.16Å; P436-P439 WeakPolarHBondContact O-CD 3.29Å
437	N	94.4	Very high	97.7	Very high	156 Å²	156	56.4 Å²	56.4	83%	0.834	29%	0.286	S	S	*	.	S	Bend	trans	-56.6	-46	-174.8	-76.3	-27.5	0	0	0	114	R380 P439	R380-N437 PolarHBondContact NH2-O 3.39Å; N437-P439 VanDerWaalsContact O-CD 3.31Å; N437-P439 WeakPolarHBondContact O-CD 3.27Å
438	D	94.6	Very high	97.7	Very high	133 Å²	133	55.6 Å²	55.6	71%	0.711	28%	0.283	S	S	*	.	S	Bend	trans	-110.1	84.3	171	-175.4	29.6	0	0	0	109.1	P436	P436-D438 PolarHBondContact O-N 3.16Å
439	P	97.6	Very high	97.7	Very high	6 Å²	6	52.9 Å²	52.9	4%	0.039	27%	0.274	C	S	.	.			trans	-71	142.5	-173.2	31.2	-34.9	0	0	0	110.3	K379 R380 V435 P436 N437 D443 M444	K379-P439 WeakPolarHBondContact CD-O 3.21Å; R380-P439 HydrophobicContact CB-CG 4.08Å; V435-P439 HydrophobicContact CB-CB 3.97Å; V435-P439 HydrophobicContact CG2-CB 3.89Å; V435-P439 HydrophobicContact CG2-CG 4.14Å; P436-P439 WeakPolarHBondContact O-CD 3.29Å; N437-P439 VanDerWaalsContact O-CD 3.31Å; N437-P439 WeakPolarHBondContact O-CD 3.27Å; P439-D443 HydrophobicContact CB-CB 4.18Å; P439-M444 HydrophobicContact CB-CG 3.94Å; P439-M444 HydrophobicContact CB-SD 3.93Å; P439-M444 HydrophobicContact CG-CG 3.95Å; P439-M444 HydrophobicContact CG-SD 3.8Å
440	S	97.4	Very high	97.7	Very high	49 Å²	49	55.6 Å²	55.6	34%	0.343	29%	0.289	S	S	.	.			trans	-69.9	170	168.2	76.3	0	0	0	0	110.1	E442 D443 M444	S440-E442 VanDerWaalsContact C-N 3.28Å; S440-E442 PolarHBondContact OG-N 2.85Å; S440-D443 VanDerWaalsContact CB-OD2 3.27Å; S440-D443 WeakPolarHBondContact CB-OD2 3.34Å; S440-D443 PolarHBondContact N-OD2 2.85Å; S440-D443 PolarHBondContact OG-N 3.09Å; S440-D443 VanDerWaalsContact OG-N 3.16Å; S440-D443 PolarHBondContact OG-OD2 3.47Å; S440-M444 PolarHBondContact O-N 2.84Å
441	F	95.4	Very high	97.6	Very high	17 Å²	17	59 Å²	59	8%	0.075	31%	0.307	C	S	.	.	H	α-helix	trans	-66.1	-35.8	174.2	-176	-96.4	0	0	0	112	R375 K379 M382 L387 E389 M444 R445	R375-F441 VanDerWaalsContact CD-CE2 3.42Å; R375-F441 HydrophobicContact CG-CD2 4.24Å; R375-F441 HydrophobicContact CG-CE2 3.69Å; R375-F441 HydrophobicContact CG-CZ 4.32Å; R375-F441 VanDerWaalsContact CZ-CD2 3.46Å; R375-F441 VanDerWaalsContact NE-CZ 3.28Å; K379-F441 HydrophobicContact CD-CB 4.21Å; M382-F441 HydrophobicContact SD-CD2 4.01Å; M382-F441 HydrophobicContact SD-CE2 4.03Å; L387-F441 VanDerWaalsContact C-CZ 3.44Å; L387-F441 VanDerWaalsContact CA-CZ 3.42Å; L387-F441 HydrophobicContact CB-CE2 4.47Å; L387-F441 HydrophobicContact CB-CZ 4.45Å; L387-F441 HydrophobicContact CD2-CD2 3.69Å; L387-F441 HydrophobicContact CD2-CE2 3.68Å; L387-F441 HydrophobicContact CD2-CG 4.37Å; L387-F441 HydrophobicContact CD2-CZ 4.37Å; L387-F441 WeakPolarHBondContact O-CE1 3.32Å; L387-F441 WeakPolarHBondContact O-CZ 3.41Å; E389-F441 HydrophobicContact CG-CZ 4.38Å; F441-M444 PolarHBondContact O-N 3.49Å; F441-R445 VanDerWaalsContact O-CB 3.28Å; F441-R445 WeakPolarHBondContact O-CB 3.4Å; F441-R445 PolarHBondContact O-N 3.44Å
442	E	97.3	Very high	97.6	Very high	103 Å²	103	64.5 Å²	64.5	48%	0.481	33%	0.334	S	S	.	.	H	α-helix	trans	-69.6	-37	-179.4	-167.9	57.8	-154	0	0	111.4	S440 M444 R445 K446	S440-E442 VanDerWaalsContact C-N 3.28Å; S440-E442 PolarHBondContact OG-N 2.85Å; E442-M444 VanDerWaalsContact C-N 3.34Å; E442-M444 PolarHBondContact O-N 3.34Å; E442-R445 PolarHBondContact O-N 3.09Å; E442-R445 IonicContact OE1-NH1 3.85Å; E442-R445 PolarHBondContact OE1-NH1 3.22Å; E442-R445 IonicContact OE2-NH1 3.49Å; E442-R445 PolarHBondContact OE2-NH1 3.35Å; E442-K446 VanDerWaalsContact O-CB 3.29Å; E442-K446 WeakPolarHBondContact O-CB 3.33Å; E442-K446 PolarHBondContact O-N 3.45Å
443	D	98.3	Very high	97.6	Very high	60 Å²	60	63.4 Å²	63.4	32%	0.321	33%	0.332	S	S	.	.	H	α-helix	trans	-57.7	-49.4	173.5	-59.5	-43	0	0	0	110.7	V435 P439 S440 K446 V447	V435-D443 HydrophobicContact CG1-CB 4.31Å; P439-D443 HydrophobicContact CB-CB 4.18Å; S440-D443 VanDerWaalsContact CB-OD2 3.27Å; S440-D443 WeakPolarHBondContact CB-OD2 3.34Å; S440-D443 PolarHBondContact N-OD2 2.85Å; S440-D443 PolarHBondContact OG-N 3.09Å; S440-D443 VanDerWaalsContact OG-N 3.16Å; S440-D443 PolarHBondContact OG-OD2 3.47Å; D443-K446 PolarHBondContact O-N 3.4Å; D443-V447 WeakPolarHBondContact O-CG2 3.37Å; D443-V447 PolarHBondContact O-N 3.16Å; D443-V447 VanDerWaalsContact O-N 3.09Å
444	M	98.6	Very high	97.6	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-67.7	-43.2	-179.7	-68.1	-56.3	-51.4	0	0	112	K379 R380 L387 F431 V435 P439 S440 F441 E442 K446 V447 V448	K379-M444 HydrophobicContact CB-CG 4.33Å; R380-M444 HydrophobicContact CB-SD 4.49Å; R380-M444 WeakPolarHBondContact O-CE 3.45Å; L387-M444 HydrophobicContact CD1-CB 3.98Å; L387-M444 HydrophobicContact CD2-CB 3.7Å; F431-M444 HydrophobicContact CD2-CE 3.8Å; F431-M444 HydrophobicContact CE2-CE 4.02Å; F431-M444 HydrophobicContact CG-CE 4.31Å; V435-M444 HydrophobicContact CB-SD 4.39Å; V435-M444 HydrophobicContact CG1-SD 3.97Å; V435-M444 HydrophobicContact CG2-SD 3.91Å; P439-M444 HydrophobicContact CB-CG 3.94Å; P439-M444 HydrophobicContact CB-SD 3.93Å; P439-M444 HydrophobicContact CG-CG 3.95Å; P439-M444 HydrophobicContact CG-SD 3.8Å; S440-M444 PolarHBondContact O-N 2.84Å; F441-M444 PolarHBondContact O-N 3.49Å; E442-M444 VanDerWaalsContact C-N 3.34Å; E442-M444 PolarHBondContact O-N 3.34Å; M444-K446 VanDerWaalsContact C-N 3.34Å; M444-K446 PolarHBondContact O-N 3.37Å; M444-V447 PolarHBondContact O-N 3.47Å; M444-V448 HydrophobicContact CE-CG2 3.74Å; M444-V448 VanDerWaalsContact O-CB 3.23Å; M444-V448 WeakPolarHBondContact O-CB 3.5Å; M444-V448 WeakPolarHBondContact O-CG2 3.4Å; M444-V448 PolarHBondContact O-N 3.45Å
445	R	98.2	Very high	97.6	Very high	91 Å²	91	59.3 Å²	59.3	34%	0.343	30%	0.304	S	S	.	.	H	α-helix	trans	-60.4	-43.9	177.2	179.2	-177.5	166	-95.6	-4.8	111.3	L387 F441 E442 C449 V450	L387-R445 HydrophobicContact CB-CB 4.32Å; L387-R445 WeakPolarHBondContact O-CD 3.13Å; F441-R445 VanDerWaalsContact O-CB 3.28Å; F441-R445 WeakPolarHBondContact O-CB 3.4Å; F441-R445 PolarHBondContact O-N 3.44Å; E442-R445 PolarHBondContact O-N 3.09Å; E442-R445 IonicContact OE1-NH1 3.85Å; E442-R445 PolarHBondContact OE1-NH1 3.22Å; E442-R445 IonicContact OE2-NH1 3.49Å; E442-R445 PolarHBondContact OE2-NH1 3.35Å; R445-C449 HydrophobicContact CG-CB 4.39Å; R445-C449 WeakPolarHBondContact O-CA 3.34Å; R445-C449 WeakPolarHBondContact O-CB 3.24Å; R445-C449 PolarHBondContact O-N 2.88Å; R445-V450 PolarHBondContact O-N 3.28Å
446	K	98.3	Very high	97.6	Very high	110 Å²	110	64 Å²	64	48%	0.478	33%	0.329	S	S	.	.	I	π-helix	trans	-58.4	-54.8	175.2	-179.8	179.5	169.7	56.3	0	110.8	E442 D443 M444 V450 D451	E442-K446 VanDerWaalsContact O-CB 3.29Å; E442-K446 WeakPolarHBondContact O-CB 3.33Å; E442-K446 PolarHBondContact O-N 3.45Å; D443-K446 PolarHBondContact O-N 3.4Å; M444-K446 VanDerWaalsContact C-N 3.34Å; M444-K446 PolarHBondContact O-N 3.37Å; K446-V450 VanDerWaalsContact O-CB 3.32Å; K446-V450 WeakPolarHBondContact O-CB 3.43Å; K446-V450 PolarHBondContact O-N 3.36Å; K446-D451 IonicContact NZ-OD1 3.27Å; K446-D451 IonicContact NZ-OD2 2.67Å; K446-D451 PolarHBondContact O-N 3.1Å
447	V	98.6	Very high	97.6	Very high	8 Å²	8	61.3 Å²	61.3	5%	0.048	31%	0.31	C	S	.	.	I	π-helix	trans	-66.9	-43.8	-175.2	170.3	0	0	0	0	112.4	F431 V434 V435 D443 M444 Q452 Q453	F431-V447 HydrophobicContact CD1-CG1 3.9Å; F431-V447 HydrophobicContact CE1-CG1 4.25Å; V434-V447 HydrophobicContact CB-CG1 4.42Å; V434-V447 HydrophobicContact CB-CG2 4.35Å; V434-V447 HydrophobicContact CG2-CG1 3.63Å; V434-V447 HydrophobicContact CG2-CG2 4.27Å; V435-V447 HydrophobicContact CG1-CB 4.24Å; V435-V447 HydrophobicContact CG1-CG2 3.67Å; D443-V447 WeakPolarHBondContact O-CG2 3.37Å; D443-V447 PolarHBondContact O-N 3.16Å; D443-V447 VanDerWaalsContact O-N 3.09Å; M444-V447 PolarHBondContact O-N 3.47Å; V447-Q452 PolarHBondContact O-N 2.98Å; V447-Q453 HydrophobicContact CG1-CB 3.87Å; V447-Q453 HydrophobicContact CG1-CG 4.43Å; V447-Q453 WeakPolarHBondContact O-CB 3.41Å; V447-Q453 PolarHBondContact O-N 3.21Å
448	V	98.5	Very high	97.8	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.	I	π-helix	trans	-88.5	-38.1	-170.1	174.9	0	0	0	0	112.9	P384 L387 W405 F431 M444 Q452 R454	P384-V448 HydrophobicContact CB-CG1 4.06Å; P384-V448 HydrophobicContact CG-CG1 3.68Å; L387-V448 HydrophobicContact CD1-CB 3.73Å; L387-V448 HydrophobicContact CD1-CG1 3.9Å; L387-V448 HydrophobicContact CD1-CG2 4.1Å; W405-V448 HydrophobicContact CH2-CG1 3.63Å; W405-V448 HydrophobicContact CZ2-CG1 3.59Å; W405-V448 HydrophobicContact CZ2-CG2 4.46Å; F431-V448 HydrophobicContact CE1-CG2 3.95Å; F431-V448 HydrophobicContact CE2-CG2 4.26Å; F431-V448 HydrophobicContact CZ-CG2 3.71Å; M444-V448 HydrophobicContact CE-CG2 3.74Å; M444-V448 VanDerWaalsContact O-CB 3.23Å; M444-V448 WeakPolarHBondContact O-CB 3.5Å; M444-V448 WeakPolarHBondContact O-CG2 3.4Å; M444-V448 PolarHBondContact O-N 3.45Å; V448-Q452 WeakPolarHBondContact O-CA 3.47Å; V448-R454 PolarHBondContact O-NH1 3.04Å
449	C	98.1	Very high	97.9	Very high	18 Å²	18	55.4 Å²	55.4	12%	0.122	28%	0.28	C	S	.	.	I	π-helix	trans	-99.3	-44.5	-174.7	-51.7	0	0	0	0	112.5	P384 L387 R445 Q452	P384-C449 PolarHBondContact O-SG 3.38Å; P384-C449 VanDerWaalsContact O-SG 3.39Å; L387-C449 VanDerWaalsContact CB-SG 3.6Å; R445-C449 HydrophobicContact CG-CB 4.39Å; R445-C449 WeakPolarHBondContact O-CA 3.34Å; R445-C449 WeakPolarHBondContact O-CB 3.24Å; R445-C449 PolarHBondContact O-N 2.88Å; C449-Q452 WeakPolarHBondContact O-CG 3.36Å
450	V	97.9	Very high	97.8	Very high	87 Å²	87	57.3 Å²	57.3	53%	0.527	29%	0.286	S	S	.	.	I	π-helix	trans	-81.2	-57	-177.2	-177.5	0	0	0	0	110.6	R445 K446 Q452	R445-V450 PolarHBondContact O-N 3.28Å; K446-V450 VanDerWaalsContact O-CB 3.32Å; K446-V450 WeakPolarHBondContact O-CB 3.43Å; K446-V450 PolarHBondContact O-N 3.36Å; V450-Q452 VanDerWaalsContact C-N 3.26Å; V450-Q452 PolarHBondContact O-N 2.99Å
451	D	98.2	Very high	97.8	Very high	71 Å²	71	55 Å²	55	38%	0.38	27%	0.27	S	S	.	.	S	Bend	trans	-82.1	-9.6	-177.4	-56.4	-16.6	0	0	0	111.8	K446 Q453	K446-D451 IonicContact NZ-OD1 3.27Å; K446-D451 IonicContact NZ-OD2 2.67Å; K446-D451 PolarHBondContact O-N 3.1Å; D451-Q453 HydrophobicContact CB-CG 3.83Å; D451-Q453 PolarHBondContact O-N 2.8Å; D451-Q453 VanDerWaalsContact O-N 3.09Å
452	Q	98.1	Very high	97.8	Very high	119 Å²	119	58.8 Å²	58.8	56%	0.556	29%	0.287	S	S	*	.			trans	50.2	32.6	179.6	-61.2	-172.5	33.4	0	0	114.5	V447 V448 C449 V450 R454	V447-Q452 PolarHBondContact O-N 2.98Å; V448-Q452 WeakPolarHBondContact O-CA 3.47Å; C449-Q452 WeakPolarHBondContact O-CG 3.36Å; V450-Q452 VanDerWaalsContact C-N 3.26Å; V450-Q452 PolarHBondContact O-N 2.99Å; Q452-R454 PolarHBondContact O-NH1 3.22Å
453	Q	98.3	Very high	97.8	Very high	73 Å²	73	57.5 Å²	57.5	34%	0.341	29%	0.289	S	S	.	.			trans	-74.1	155.7	-179	-58.6	-170.2	50.7	0	0	111.4	V447 D451	V447-Q453 HydrophobicContact CG1-CB 3.87Å; V447-Q453 HydrophobicContact CG1-CG 4.43Å; V447-Q453 WeakPolarHBondContact O-CB 3.41Å; V447-Q453 PolarHBondContact O-N 3.21Å; D451-Q453 HydrophobicContact CB-CG 3.83Å; D451-Q453 PolarHBondContact O-N 2.8Å; D451-Q453 VanDerWaalsContact O-N 3.09Å
454	R	98.4	Very high	97.7	Very high	53 Å²	53	55.5 Å²	55.5	20%	0.2	28%	0.279	C	S	.	.			trans	-135.8	154.7	173.2	-59.1	-63.4	-178.9	-92.5	2.7	108.4	W405 V448 Q452 N456 W478	W405-R454 VanDerWaalsContact CH2-NE 3.31Å; V448-R454 PolarHBondContact O-NH1 3.04Å; Q452-R454 PolarHBondContact O-NH1 3.22Å; R454-N456 PolarHBondContact O-N 2.78Å; R454-W478 HydrophobicContact CB-CD2 3.92Å; R454-W478 HydrophobicContact CB-CE3 4.01Å; R454-W478 HydrophobicContact CB-CH2 3.95Å; R454-W478 HydrophobicContact CB-CZ2 3.8Å; R454-W478 HydrophobicContact CB-CZ3 4.05Å; R454-W478 HydrophobicContact CG-CD2 3.94Å; R454-W478 HydrophobicContact CG-CE3 4.43Å; R454-W478 HydrophobicContact CG-CG 4.17Å; R454-W478 HydrophobicContact CG-CZ2 4.4Å; R454-W478 PolarHBondContact NE-O 3.32Å; R454-W478 PolarHBondContact NH2-O 2.85Å
455	P	98.5	Very high	97.6	Very high	4 Å²	4	60.4 Å²	60.4	3%	0.026	31%	0.31	C	S	.	.			trans	-50.1	133	172.7	-27.3	30.5	0	0	0	112.3	L409 W412 P430 F431 I457 W478	L409-P455 HydrophobicContact CD2-CG 3.72Å; W412-P455 HydrophobicContact CD2-CB 3.69Å; W412-P455 HydrophobicContact CD2-CG 4.49Å; W412-P455 VanDerWaalsContact CE2-CB 3.44Å; W412-P455 HydrophobicContact CE3-CB 4.29Å; W412-P455 HydrophobicContact CG-CB 3.93Å; W412-P455 HydrophobicContact CH2-CB 4.42Å; W412-P455 HydrophobicContact CZ2-CB 3.83Å; P430-P455 HydrophobicContact CB-CG 4.05Å; F431-P455 HydrophobicContact CD1-CG 4.49Å; F431-P455 HydrophobicContact CE1-CG 4.31Å; F431-P455 HydrophobicContact CE2-CG 4.36Å; F431-P455 HydrophobicContact CZ-CG 4.23Å; P455-I457 PolarHBondContact O-N 3.39Å; P455-W478 HydrophobicContact CB-CH2 4.22Å; P455-W478 HydrophobicContact CB-CZ3 3.8Å; P455-W478 HydrophobicContact CG-CE3 4.31Å; P455-W478 HydrophobicContact CG-CH2 4.5Å; P455-W478 HydrophobicContact CG-CZ3 3.65Å; P455-W478 WeakPolarHBondContact O-CH2 3.22Å
456	N	97.8	Very high	97.5	Very high	112 Å²	112	56.7 Å²	56.7	60%	0.599	30%	0.298	S	S	*	.			trans	-65.1	135	-177.2	-173.6	18	0	0	0	111.5	W412 R454 P458	W412-N456 PolarHBondContact NE1-O 3.03Å; R454-N456 PolarHBondContact O-N 2.78Å; N456-P458 WeakPolarHBondContact O-CD 3.45Å
457	I	98.1	Very high	97.5	Very high	17 Å²	17	51.4 Å²	51.4	9%	0.087	28%	0.275	C	S	.	.			trans	-97	111.8	174.8	-66.5	172.1	0	0	0	108.1	P455 N459 W461 F462 A471 K475 W478	P455-I457 PolarHBondContact O-N 3.39Å; I457-N459 PolarHBondContact O-N 3.03Å; I457-W461 HydrophobicContact CG1-CZ3 4.46Å; I457-W461 HydrophobicContact CG2-CB 4.41Å; I457-W461 HydrophobicContact CG2-CD2 4.25Å; I457-W461 HydrophobicContact CG2-CE3 3.68Å; I457-W461 HydrophobicContact CG2-CZ3 4.23Å; I457-F462 HydrophobicContact CG2-CE2 4.04Å; I457-F462 HydrophobicContact CG2-CZ 3.8Å; I457-A471 HydrophobicContact CD1-CB 4.17Å; I457-A471 HydrophobicContact CG2-CB 4.01Å; I457-K475 HydrophobicContact CD1-CD 4.47Å; I457-K475 HydrophobicContact CD1-CG 4.12Å; I457-W478 HydrophobicContact CD1-CH2 4.14Å; I457-W478 HydrophobicContact CD1-CZ2 3.87Å; I457-W478 HydrophobicContact CG1-CH2 4.16Å; I457-W478 HydrophobicContact CG1-CZ2 4.35Å
458	P	97.2	Very high	97.5	Very high	24 Å²	24	52.2 Å²	52.2	16%	0.156	28%	0.28	C	S	.	.			trans	-58.4	135.4	-179.8	-24.4	34.3	0	0	0	112.5	E425 N456 R460 W461	E425-P458 WeakPolarHBondContact OE1-CG 3.41Å; N456-P458 WeakPolarHBondContact O-CD 3.45Å; P458-R460 HydrophobicContact CB-CG 4.26Å; P458-R460 PolarHBondContact O-N 2.91Å; P458-R460 VanDerWaalsContact O-N 3.09Å; P458-W461 HydrophobicContact CB-CG 4.45Å; P458-W461 HydrophobicContact CG-CZ2 4.28Å; P458-W461 WeakPolarHBondContact O-CB 3.31Å; P458-W461 PolarHBondContact O-N 2.83Å
459	N	96.6	Very high	97.5	Very high	141 Å²	141	54 Å²	54	75%	0.754	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-56.5	-31.2	-178.6	-71.1	-25.1	0	0	0	113.4	I457 W461 F462	I457-N459 PolarHBondContact O-N 3.03Å; N459-W461 PolarHBondContact O-N 3.25Å; N459-F462 WeakPolarHBondContact O-CD2 3.29Å; N459-F462 PolarHBondContact O-N 2.76Å; N459-F462 VanDerWaalsContact O-N 3.16Å
460	R	95.3	Very high	97.5	Very high	46 Å²	46	53.1 Å²	53.1	17%	0.174	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-60.6	-25.7	177.8	79.3	174	-174.7	87.2	4.2	113.2	M418 I423 E425 P458 F462 S463	M418-R460 PolarHBondContact O-NH2 2.67Å; I423-R460 PolarHBondContact O-NH1 2.9Å; E425-R460 IonicContact OE1-CZ 3.7Å; E425-R460 IonicContact OE1-NE 2.75Å; E425-R460 PolarHBondContact OE1-NE 3.4Å; E425-R460 IonicContact OE1-NH2 3.13Å; E425-R460 PolarHBondContact OE1-NH2 3.1Å; E425-R460 IonicContact OE2-CZ 3.78Å; E425-R460 IonicContact OE2-NE 2.74Å; E425-R460 IonicContact OE2-NH2 2.96Å; E425-R460 PolarHBondContact OE2-NH2 3.24Å; P458-R460 HydrophobicContact CB-CG 4.26Å; P458-R460 PolarHBondContact O-N 2.91Å; P458-R460 VanDerWaalsContact O-N 3.09Å; R460-F462 PolarHBondContact O-N 2.81Å; R460-S463 PolarHBondContact O-N 3.48Å; R460-S463 VanDerWaalsContact O-N 3.11Å; R460-S463 PolarHBondContact O-OG 3Å
461	W	97.8	Very high	97.5	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-62.3	-26.6	179.9	-72.7	16.6	0	0	0	111.6	W412 A415 R416 E425 I457 P458 N459 S463 D464 L467 T468 A471 M474	W412-W461 AromaticContact CD1-CH2 3.72Å; W412-W461 HydrophobicContact CG-CH2 4.33Å; A415-W461 HydrophobicContact CB-CE3 4.47Å; A415-W461 HydrophobicContact CB-CH2 3.46Å; A415-W461 VanDerWaalsContact CB-CH2 3.46Å; A415-W461 HydrophobicContact CB-CZ2 3.82Å; A415-W461 HydrophobicContact CB-CZ3 3.83Å; R416-W461 HydrophobicContact CB-CZ2 4.38Å; R416-W461 HydrophobicContact CG-CH2 4.2Å; R416-W461 HydrophobicContact CG-CZ2 3.72Å; E425-W461 PolarHBondContact OE2-NE1 3.41Å; I457-W461 HydrophobicContact CG1-CZ3 4.46Å; I457-W461 HydrophobicContact CG2-CB 4.41Å; I457-W461 HydrophobicContact CG2-CD2 4.25Å; I457-W461 HydrophobicContact CG2-CE3 3.68Å; I457-W461 HydrophobicContact CG2-CZ3 4.23Å; P458-W461 HydrophobicContact CB-CG 4.45Å; P458-W461 HydrophobicContact CG-CZ2 4.28Å; P458-W461 WeakPolarHBondContact O-CB 3.31Å; P458-W461 PolarHBondContact O-N 2.83Å; N459-W461 PolarHBondContact O-N 3.25Å; W461-S463 VanDerWaalsContact C-N 3.27Å; W461-S463 PolarHBondContact O-N 3.01Å; W461-D464 PolarHBondContact O-N 3.3Å; W461-D464 VanDerWaalsContact O-O 3.05Å; W461-L467 HydrophobicContact CB-CB 3.78Å; W461-L467 HydrophobicContact CB-CD1 4.48Å; W461-L467 HydrophobicContact CD2-CB 4.41Å; W461-L467 HydrophobicContact CD2-CD2 4.28Å; W461-L467 HydrophobicContact CG-CB 3.98Å; W461-L467 HydrophobicContact CG-CD1 4.12Å; W461-L467 HydrophobicContact CG-CD2 4.42Å; W461-L467 HydrophobicContact CG-CG 4.42Å; W461-L467 WeakPolarHBondContact O-CB 2.98Å; W461-T468 PolarHBondContact O-N 2.98Å; W461-T468 PolarHBondContact O-OG1 3.5Å; W461-T468 VanDerWaalsContact O-OG1 3.06Å; W461-A471 HydrophobicContact CE3-CB 4.27Å; W461-M474 HydrophobicContact CE3-CE 4.45Å; W461-M474 HydrophobicContact CH2-CE 4.01Å; W461-M474 HydrophobicContact CH2-SD 4.3Å; W461-M474 HydrophobicContact CZ3-CE 3.51Å; W461-M474 HydrophobicContact CZ3-SD 3.7Å
462	F	97	Very high	97.5	Very high	97 Å²	97	51.5 Å²	51.5	43%	0.425	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-76.1	-10.4	179.1	-59.2	-66.5	0	0	0	114.3	I457 N459 R460 T468 A471	I457-F462 HydrophobicContact CG2-CE2 4.04Å; I457-F462 HydrophobicContact CG2-CZ 3.8Å; N459-F462 WeakPolarHBondContact O-CD2 3.29Å; N459-F462 PolarHBondContact O-N 2.76Å; N459-F462 VanDerWaalsContact O-N 3.16Å; R460-F462 PolarHBondContact O-N 2.81Å; F462-T468 VanDerWaalsContact CA-OG1 3.31Å; F462-T468 WeakPolarHBondContact CA-OG1 2.97Å; F462-T468 HydrophobicContact CD1-CG2 4.38Å; F462-T468 PolarHBondContact O-OG1 3.4Å; F462-A471 HydrophobicContact CE1-CB 4.23Å
463	S	95.3	Very high	97.5	Very high	76 Å²	76	46 Å²	46	53%	0.531	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-87.5	-7.3	170.9	60.5	0	0	0	0	113.7	R460 W461	R460-S463 PolarHBondContact O-N 3.48Å; R460-S463 VanDerWaalsContact O-N 3.11Å; R460-S463 PolarHBondContact O-OG 3Å; W461-S463 VanDerWaalsContact C-N 3.27Å; W461-S463 PolarHBondContact O-N 3.01Å
464	D	96.5	Very high	97.6	Very high	19 Å²	19	42.6 Å²	42.6	10%	0.102	23%	0.227	C	C	.	.	S	Bend	trans	-114.2	124.2	180	-178.5	-75.1	0	0	0	109.9	S420 W461 T466 L467 T468	S420-D464 WeakPolarHBondContact CB-OD2 3.27Å; S420-D464 VanDerWaalsContact OG-CB 3.28Å; S420-D464 WeakPolarHBondContact OG-CB 3.32Å; S420-D464 PolarHBondContact OG-OD2 2.78Å; W461-D464 PolarHBondContact O-N 3.3Å; W461-D464 VanDerWaalsContact O-O 3.05Å; D464-T466 VanDerWaalsContact C-N 3.27Å; D464-T466 PolarHBondContact O-N 3.18Å; D464-T466 WeakPolarHBondContact OD1-CA 3.41Å; D464-T466 WeakPolarHBondContact OD1-CB 3.45Å; D464-T466 PolarHBondContact OD1-N 3.2Å; D464-L467 HydrophobicContact CB-CB 4.02Å; D464-L467 HydrophobicContact CB-CD1 3.97Å; D464-L467 HydrophobicContact CB-CG 4.2Å; D464-L467 PolarHBondContact O-N 2.87Å; D464-L467 PolarHBondContact OD1-N 2.85Å; D464-T468 VanDerWaalsContact O-CB 3.23Å; D464-T468 WeakPolarHBondContact O-CB 3.24Å; D464-T468 PolarHBondContact O-N 3.38Å; D464-T468 PolarHBondContact O-OG1 2.8Å
465	P	96.1	Very high	97.6	Very high	103 Å²	103	44.7 Å²	44.7	67%	0.669	24%	0.238	S	C	*	.	H	α-helix	trans	-59.4	-35.6	-176.1	-25.7	34.5	0	0	0	113.9	S469	P465-S469 WeakPolarHBondContact O-CB 3.42Å; P465-S469 PolarHBondContact O-N 3.19Å; P465-S469 VanDerWaalsContact O-N 3.12Å; P465-S469 PolarHBondContact O-OG 3.3Å
466	T	97.1	Very high	97.6	Very high	12 Å²	12	48 Å²	48	7%	0.074	25%	0.253	C	S	.	.	H	α-helix	trans	-74.4	-51.6	-178.5	-59.7	0	0	0	0	110.2	T302 L306 M418 D464 T468 S469 L470 I498	T302-T466 HydrophobicContact CG2-CG2 3.84Å; T302-T466 VanDerWaalsContact CG2-OG1 3.27Å; T302-T466 WeakPolarHBondContact CG2-OG1 3.29Å; L306-T466 HydrophobicContact CD1-CG2 4.18Å; L306-T466 HydrophobicContact CD2-CG2 3.92Å; L306-T466 HydrophobicContact CG-CG2 4.01Å; M418-T466 HydrophobicContact CE-CG2 4.37Å; M418-T466 HydrophobicContact SD-CG2 4.21Å; D464-T466 VanDerWaalsContact C-N 3.27Å; D464-T466 PolarHBondContact O-N 3.18Å; D464-T466 WeakPolarHBondContact OD1-CA 3.41Å; D464-T466 WeakPolarHBondContact OD1-CB 3.45Å; D464-T466 PolarHBondContact OD1-N 3.2Å; T466-T468 VanDerWaalsContact C-N 3.27Å; T466-T468 PolarHBondContact O-N 3.04Å; T466-S469 WeakPolarHBondContact O-CB 3.38Å; T466-S469 PolarHBondContact O-N 3.36Å; T466-L470 HydrophobicContact CG2-CD1 4.34Å; T466-L470 WeakPolarHBondContact O-CG 2.98Å; T466-L470 PolarHBondContact O-N 3.42Å; T466-I498 HydrophobicContact CG2-CG2 4.47Å
467	L	98.2	Very high	97.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.7	-35.7	176.8	-68.2	171.8	0	0	0	112	A415 M418 W461 D464 S469 L470 A471	A415-L467 HydrophobicContact CB-CD2 3.9Å; M418-L467 HydrophobicContact CB-CD2 4.12Å; M418-L467 HydrophobicContact CE-CD1 4.47Å; M418-L467 HydrophobicContact CE-CG 4.07Å; M418-L467 HydrophobicContact CG-CD2 4.35Å; M418-L467 HydrophobicContact SD-CD2 3.76Å; M418-L467 HydrophobicContact SD-CG 3.87Å; W461-L467 HydrophobicContact CB-CB 3.78Å; W461-L467 HydrophobicContact CB-CD1 4.48Å; W461-L467 HydrophobicContact CD2-CB 4.41Å; W461-L467 HydrophobicContact CD2-CD2 4.28Å; W461-L467 HydrophobicContact CG-CB 3.98Å; W461-L467 HydrophobicContact CG-CD1 4.12Å; W461-L467 HydrophobicContact CG-CD2 4.42Å; W461-L467 HydrophobicContact CG-CG 4.42Å; W461-L467 WeakPolarHBondContact O-CB 2.98Å; D464-L467 HydrophobicContact CB-CB 4.02Å; D464-L467 HydrophobicContact CB-CD1 3.97Å; D464-L467 HydrophobicContact CB-CG 4.2Å; D464-L467 PolarHBondContact O-N 2.87Å; D464-L467 PolarHBondContact OD1-N 2.85Å; L467-S469 VanDerWaalsContact C-N 3.31Å; L467-S469 PolarHBondContact O-N 3.2Å; L467-L470 PolarHBondContact O-N 2.9Å; L467-A471 VanDerWaalsContact O-CB 3.3Å; L467-A471 WeakPolarHBondContact O-CB 3.29Å; L467-A471 PolarHBondContact O-N 2.79Å
468	T	98.3	Very high	97.6	Very high	25 Å²	25	42.8 Å²	42.8	15%	0.153	22%	0.224	C	C	.	.	H	α-helix	trans	-59.9	-43.3	172.5	-62.5	0	0	0	0	111.4	W461 F462 D464 T466 A471 K472	W461-T468 PolarHBondContact O-N 2.98Å; W461-T468 PolarHBondContact O-OG1 3.5Å; W461-T468 VanDerWaalsContact O-OG1 3.06Å; F462-T468 VanDerWaalsContact CA-OG1 3.31Å; F462-T468 WeakPolarHBondContact CA-OG1 2.97Å; F462-T468 HydrophobicContact CD1-CG2 4.38Å; F462-T468 PolarHBondContact O-OG1 3.4Å; D464-T468 VanDerWaalsContact O-CB 3.23Å; D464-T468 WeakPolarHBondContact O-CB 3.24Å; D464-T468 PolarHBondContact O-N 3.38Å; D464-T468 PolarHBondContact O-OG1 2.8Å; T466-T468 VanDerWaalsContact C-N 3.27Å; T466-T468 PolarHBondContact O-N 3.04Å; T468-A471 PolarHBondContact O-N 2.98Å; T468-K472 WeakPolarHBondContact O-CG 3.04Å; T468-K472 PolarHBondContact O-N 2.85Å; T468-K472 VanDerWaalsContact O-N 3.17Å
469	S	98.1	Very high	97.6	Very high	37 Å²	37	46.8 Å²	46.8	26%	0.259	24%	0.237	S	C	.	.	H	α-helix	trans	-69.3	-40.6	179.1	-59.2	0	0	0	0	111.8	P465 T466 L467 K472 L473	P465-S469 WeakPolarHBondContact O-CB 3.42Å; P465-S469 PolarHBondContact O-N 3.19Å; P465-S469 VanDerWaalsContact O-N 3.12Å; P465-S469 PolarHBondContact O-OG 3.3Å; T466-S469 WeakPolarHBondContact O-CB 3.38Å; T466-S469 PolarHBondContact O-N 3.36Å; L467-S469 VanDerWaalsContact C-N 3.31Å; L467-S469 PolarHBondContact O-N 3.2Å; S469-K472 PolarHBondContact O-N 3.09Å; S469-L473 PolarHBondContact O-N 2.98Å; S469-L473 VanDerWaalsContact O-N 3.09Å
470	L	98.4	Very high	97.7	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-40.9	173.6	-65	179.3	0	0	0	111.7	V309 A415 T466 L467 K472 L473 M474 L495	V309-L470 HydrophobicContact CG2-CD2 4.16Å; A415-L470 HydrophobicContact CB-CD1 4.15Å; T466-L470 HydrophobicContact CG2-CD1 4.34Å; T466-L470 WeakPolarHBondContact O-CG 2.98Å; T466-L470 PolarHBondContact O-N 3.42Å; L467-L470 PolarHBondContact O-N 2.9Å; L470-K472 VanDerWaalsContact C-N 3.31Å; L470-K472 PolarHBondContact O-N 3.14Å; L470-L473 HydrophobicContact CD2-CD1 4.35Å; L470-L473 WeakPolarHBondContact O-CB 3.42Å; L470-L473 PolarHBondContact O-N 2.77Å; L470-M474 HydrophobicContact CB-CE 3.87Å; L470-M474 VanDerWaalsContact O-CG 3.31Å; L470-M474 WeakPolarHBondContact O-CG 2.99Å; L470-M474 PolarHBondContact O-N 3.14Å; L470-L495 HydrophobicContact CD2-CD2 3.63Å
471	A	98.6	Very high	97.8	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-59.8	-39.3	175.8	0	0	0	0	0	112.4	I457 W461 F462 L467 T468 K475	I457-A471 HydrophobicContact CD1-CB 4.17Å; I457-A471 HydrophobicContact CG2-CB 4.01Å; W461-A471 HydrophobicContact CE3-CB 4.27Å; F462-A471 HydrophobicContact CE1-CB 4.23Å; L467-A471 VanDerWaalsContact O-CB 3.3Å; L467-A471 WeakPolarHBondContact O-CB 3.29Å; L467-A471 PolarHBondContact O-N 2.79Å; T468-A471 PolarHBondContact O-N 2.98Å; A471-K475 WeakPolarHBondContact O-CG 3.21Å; A471-K475 PolarHBondContact O-N 3.28Å; A471-K475 VanDerWaalsContact O-N 3.1Å
472	K	98.4	Very high	97.8	Very high	122 Å²	122	46.7 Å²	46.7	53%	0.53	24%	0.239	S	C	.	.	H	α-helix	trans	-65	-46.4	173.8	-69.9	173.5	-176.5	176.8	0	111.3	T468 S469 L470 M474 K475 E476	T468-K472 WeakPolarHBondContact O-CG 3.04Å; T468-K472 PolarHBondContact O-N 2.85Å; T468-K472 VanDerWaalsContact O-N 3.17Å; S469-K472 PolarHBondContact O-N 3.09Å; L470-K472 VanDerWaalsContact C-N 3.31Å; L470-K472 PolarHBondContact O-N 3.14Å; K472-M474 PolarHBondContact O-N 2.04Å; K472-K475 WeakPolarHBondContact O-CB 3.4Å; K472-K475 PolarHBondContact O-N 3.45Å; K472-E476 WeakPolarHBondContact O-CG 3.41Å; K472-E476 PolarHBondContact O-N 2.02Å
473	L	98.5	Very high	97.8	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-57.6	-45.8	175.9	-74.7	172.6	0	0	0	112	L411 S469 L470 K475 E476 C477 L486 I491 T494 L495	L411-L473 HydrophobicContact CD1-CB 4.25Å; S469-L473 PolarHBondContact O-N 2.98Å; S469-L473 VanDerWaalsContact O-N 3.09Å; L470-L473 HydrophobicContact CD2-CD1 4.35Å; L470-L473 WeakPolarHBondContact O-CB 3.42Å; L470-L473 PolarHBondContact O-N 2.77Å; L473-K475 VanDerWaalsContact C-N 3.33Å; L473-K475 PolarHBondContact O-N 2.87Å; L473-E476 CarbonylContact O-C 3.54Å; L473-E476 PolarHBondContact O-N 2.91Å; L473-C477 PolarHBondContact O-N 3.39Å; L473-C477 PolarHBondContact O-SG 3.47Å; L473-L486 HydrophobicContact CD2-CD1 3.59Å; L473-I491 HydrophobicContact CD1-CG2 4.42Å; L473-I491 HydrophobicContact CD2-CG1 4.48Å; L473-I491 HydrophobicContact CD2-CG2 4.4Å; L473-T494 HydrophobicContact CD1-CG2 4.22Å; L473-T494 HydrophobicContact CD2-CG2 3.92Å; L473-T494 HydrophobicContact CG-CG2 4.32Å; L473-L495 HydrophobicContact CD1-CD2 3.65Å; L473-L495 HydrophobicContact CD1-CG 3.99Å
474	M	98.7	Very high	98	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-57.7	-46.6	176.1	-67.4	170.7	-148.8	0	0	111.4	L411 W412 A415 W461 L470 K472 E476 C477 W478	L411-M474 HydrophobicContact CB-CE 4.07Å; L411-M474 HydrophobicContact CB-CG 3.84Å; L411-M474 HydrophobicContact CD1-CG 4.48Å; L411-M474 WeakPolarHBondContact O-CE 2.91Å; W412-M474 HydrophobicContact CB-CE 4.38Å; W412-M474 HydrophobicContact CB-SD 3.67Å; W412-M474 HydrophobicContact CG-SD 4.27Å; A415-M474 HydrophobicContact CB-CE 3.52Å; W461-M474 HydrophobicContact CE3-CE 4.45Å; W461-M474 HydrophobicContact CH2-CE 4.01Å; W461-M474 HydrophobicContact CH2-SD 4.3Å; W461-M474 HydrophobicContact CZ3-CE 3.51Å; W461-M474 HydrophobicContact CZ3-SD 3.7Å; L470-M474 HydrophobicContact CB-CE 3.87Å; L470-M474 VanDerWaalsContact O-CG 3.31Å; L470-M474 WeakPolarHBondContact O-CG 2.99Å; L470-M474 PolarHBondContact O-N 3.14Å; K472-M474 PolarHBondContact O-N 2.04Å; M474-E476 PolarHBondContact O-N 3.05Å; M474-C477 WeakPolarHBondContact O-CB 3.28Å; M474-C477 PolarHBondContact O-N 2.8Å; M474-W478 HydrophobicContact CB-CH2 4.47Å; M474-W478 HydrophobicContact CB-CZ2 4.46Å; M474-W478 VanDerWaalsContact O-CG 3.27Å; M474-W478 PolarHBondContact O-N 2.88Å; M474-W478 VanDerWaalsContact O-N 3.08Å
475	K	98.4	Very high	98.1	Very high	97 Å²	97	44.2 Å²	44.2	42%	0.422	24%	0.236	S	C	.	.	H	α-helix	trans	-55.9	-40.5	176.8	-73.9	179.1	-176.7	-174.3	0	113.1	I457 A471 K472 L473 W478	I457-K475 HydrophobicContact CD1-CD 4.47Å; I457-K475 HydrophobicContact CD1-CG 4.12Å; A471-K475 WeakPolarHBondContact O-CG 3.21Å; A471-K475 PolarHBondContact O-N 3.28Å; A471-K475 VanDerWaalsContact O-N 3.1Å; K472-K475 WeakPolarHBondContact O-CB 3.4Å; K472-K475 PolarHBondContact O-N 3.45Å; L473-K475 VanDerWaalsContact C-N 3.33Å; L473-K475 PolarHBondContact O-N 2.87Å; K475-W478 VanDerWaalsContact CA-NE1 3.32Å; K475-W478 HydrophobicContact CG-CZ2 4.42Å; K475-W478 VanDerWaalsContact O-CD1 3.28Å
476	E	98.6	Very high	98.2	Very high	74 Å²	74	40.4 Å²	40.4	35%	0.346	21%	0.21	S	C	.	.	H	α-helix	trans	-82.2	-11.2	178.4	-60.4	172.6	-140.6	0	0	113.7	K472 L473 M474 Y479 R485 L486	K472-E476 WeakPolarHBondContact O-CG 3.41Å; K472-E476 PolarHBondContact O-N 2.02Å; L473-E476 CarbonylContact O-C 3.54Å; L473-E476 PolarHBondContact O-N 2.91Å; M474-E476 PolarHBondContact O-N 3.05Å; E476-Y479 HydrophobicContact CB-CE2 4.07Å; E476-Y479 HydrophobicContact CG-CE2 4.15Å; E476-R485 VanDerWaalsContact O-CA 3.29Å; E476-R485 WeakPolarHBondContact O-CA 3.47Å; E476-L486 HydrophobicContact CB-CD1 3.69Å; E476-L486 HydrophobicContact CB-CD2 4.36Å; E476-L486 HydrophobicContact CB-CG 3.67Å; E476-L486 PolarHBondContact O-N 3.23Å; E476-L486 WeakPolarHBondContact OE2-CD2 3.34Å
477	C	98.8	Very high	98.3	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-87.2	-34.6	173.8	-68.3	0	0	0	0	112.6	I404 L473 M474 R485 I491	I404-C477 HydrophobicContact CG2-CB 3.96Å; L473-C477 PolarHBondContact O-N 3.39Å; L473-C477 PolarHBondContact O-SG 3.47Å; M474-C477 WeakPolarHBondContact O-CB 3.28Å; M474-C477 PolarHBondContact O-N 2.8Å; C477-R485 WeakPolarHBondContact O-CD 3.45Å; C477-R485 WeakPolarHBondContact O-CG 3.49Å; C477-I491 VanDerWaalsContact SG-CD1 3.53Å
478	W	97.4	Very high	98.3	Very high	19 Å²	19	44.1 Å²	44.1	7%	0.072	23%	0.233	C	C	.	.	S	Bend	trans	-105.1	31.1	-172.7	65.9	16.5	0	0	0	114.2	W405 L409 R454 P455 I457 M474 K475	W405-W478 HydrophobicContact CD2-CB 4.32Å; W405-W478 VanDerWaalsContact CE3-CA 3.45Å; W405-W478 HydrophobicContact CE3-CB 3.68Å; W405-W478 HydrophobicContact CH2-CB 4.2Å; W405-W478 HydrophobicContact CZ3-CB 3.62Å; W405-W478 WeakPolarHBondContact CZ3-O 3.45Å; L409-W478 HydrophobicContact CD2-CE3 4.07Å; L409-W478 HydrophobicContact CD2-CZ3 4.49Å; R454-W478 HydrophobicContact CB-CD2 3.92Å; R454-W478 HydrophobicContact CB-CE3 4.01Å; R454-W478 HydrophobicContact CB-CH2 3.95Å; R454-W478 HydrophobicContact CB-CZ2 3.8Å; R454-W478 HydrophobicContact CB-CZ3 4.05Å; R454-W478 HydrophobicContact CG-CD2 3.94Å; R454-W478 HydrophobicContact CG-CE3 4.43Å; R454-W478 HydrophobicContact CG-CG 4.17Å; R454-W478 HydrophobicContact CG-CZ2 4.4Å; R454-W478 PolarHBondContact NE-O 3.32Å; R454-W478 PolarHBondContact NH2-O 2.85Å; P455-W478 HydrophobicContact CB-CH2 4.22Å; P455-W478 HydrophobicContact CB-CZ3 3.8Å; P455-W478 HydrophobicContact CG-CE3 4.31Å; P455-W478 HydrophobicContact CG-CH2 4.5Å; P455-W478 HydrophobicContact CG-CZ3 3.65Å; P455-W478 WeakPolarHBondContact O-CH2 3.22Å; I457-W478 HydrophobicContact CD1-CH2 4.14Å; I457-W478 HydrophobicContact CD1-CZ2 3.87Å; I457-W478 HydrophobicContact CG1-CH2 4.16Å; I457-W478 HydrophobicContact CG1-CZ2 4.35Å; M474-W478 HydrophobicContact CB-CH2 4.47Å; M474-W478 HydrophobicContact CB-CZ2 4.46Å; M474-W478 VanDerWaalsContact O-CG 3.27Å; M474-W478 PolarHBondContact O-N 2.88Å; M474-W478 VanDerWaalsContact O-N 3.08Å; K475-W478 VanDerWaalsContact CA-NE1 3.32Å; K475-W478 HydrophobicContact CG-CZ2 4.42Å; K475-W478 VanDerWaalsContact O-CD1 3.28Å
479	Y	98.5	Very high	98.3	Very high	109 Å²	109	46.3 Å²	46.3	43%	0.427	24%	0.243	S	C	.	.			trans	-59.9	143.8	169.9	-79.5	-58.9	0	0	0	111.1	E476 A484 R485	E476-Y479 HydrophobicContact CB-CE2 4.07Å; E476-Y479 HydrophobicContact CG-CE2 4.15Å; Y479-A484 HydrophobicContact CD2-CB 3.85Å; Y479-A484 WeakPolarHBondContact CD2-O 3.19Å; Y479-A484 HydrophobicContact CE2-CB 4.48Å; Y479-A484 HydrophobicContact CG-CB 4.03Å; Y479-R485 PolarHBondContact O-NE 3Å; Y479-R485 PolarHBondContact O-NH2 3.09Å
480	Q	97.6	Very high	98.3	Very high	60 Å²	60	51.7 Å²	51.7	28%	0.28	26%	0.258	S	S	.	.	S	Bend	trans	-60.9	-48.5	173.8	-168.9	68.6	17.1	0	0	110.4	P482 R485	Q480-P482 VanDerWaalsContact O-CD 3.26Å; Q480-P482 WeakPolarHBondContact O-CD 3.44Å; Q480-R485 PolarHBondContact O-NH2 3.24Å
481	N	98	Very high	98.4	Very high	94 Å²	94	51.7 Å²	51.7	50%	0.503	26%	0.258	S	S	.	.	S	Bend	trans	-70.6	116.4	174	-178.6	-7.8	0	0	0	110.2	S483 A484	N481-S483 VanDerWaalsContact C-N 3.28Å; N481-S483 PolarHBondContact O-N 3.23Å; N481-S483 WeakPolarHBondContact OD1-CB 3.26Å; N481-S483 PolarHBondContact OD1-N 2.92Å; N481-A484 HydrophobicContact CB-CB 4.27Å; N481-A484 PolarHBondContact O-N 3.07Å
482	P	98.1	Very high	98.4	Very high	30 Å²	30	54.7 Å²	54.7	20%	0.195	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-61.2	-34.6	-178.6	-23.3	35.2	0	0	0	113.2	E385 R401 Q480 A484 R485	E385-P482 HydrophobicContact CB-CG 4.26Å; E385-P482 HydrophobicContact CG-CG 4Å; R401-P482 HydrophobicContact CB-CB 3.94Å; R401-P482 WeakPolarHBondContact CD-O 3.35Å; R401-P482 HydrophobicContact CG-CB 4.41Å; R401-P482 WeakPolarHBondContact CG-O 3.43Å; Q480-P482 VanDerWaalsContact O-CD 3.26Å; Q480-P482 WeakPolarHBondContact O-CD 3.44Å; P482-A484 PolarHBondContact O-N 3.13Å; P482-R485 WeakPolarHBondContact O-CB 3.35Å; P482-R485 PolarHBondContact O-N 2.91Å
483	S	97.4	Very high	98.4	Very high	77 Å²	77	55.2 Å²	55.2	54%	0.538	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-69.4	-18.1	-178.4	-58.4	0	0	0	0	113.5	R401 N481 R485	R401-S483 PolarHBondContact NH1-OG 3.15Å; N481-S483 VanDerWaalsContact C-N 3.28Å; N481-S483 PolarHBondContact O-N 3.23Å; N481-S483 WeakPolarHBondContact OD1-CB 3.26Å; N481-S483 PolarHBondContact OD1-N 2.92Å; S483-R485 VanDerWaalsContact C-N 3.33Å
484	A	98.2	Very high	98.3	Very high	48 Å²	48	57 Å²	57	40%	0.397	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-84.5	-10	177.3	0	0	0	0	0	112.8	Y479 N481 P482	Y479-A484 HydrophobicContact CD2-CB 3.85Å; Y479-A484 WeakPolarHBondContact CD2-O 3.19Å; Y479-A484 HydrophobicContact CE2-CB 4.48Å; Y479-A484 HydrophobicContact CG-CB 4.03Å; N481-A484 HydrophobicContact CB-CB 4.27Å; N481-A484 PolarHBondContact O-N 3.07Å; P482-A484 PolarHBondContact O-N 3.13Å
485	R	98.7	Very high	98.3	Very high	15 Å²	15	57 Å²	57	6%	0.057	29%	0.285	C	S	.	.	S	Bend	trans	-73.7	147.7	-177.3	-60.5	176.8	-170.4	147.7	13.2	111.4	E385 R401 I404 E476 C477 Y479 Q480 P482 S483	E385-R485 IonicContact OE1-CZ 3.33Å; E385-R485 IonicContact OE1-NH1 3.57Å; E385-R485 PolarHBondContact OE1-NH1 2.97Å; E385-R485 IonicContact OE1-NH2 2.73Å; E385-R485 PolarHBondContact OE1-NH2 3.37Å; E385-R485 IonicContact OE2-CZ 2.72Å; E385-R485 IonicContact OE2-NH1 3.11Å; E385-R485 PolarHBondContact OE2-NH1 3.18Å; E385-R485 IonicContact OE2-NH2 3.37Å; E385-R485 PolarHBondContact OE2-NH2 3.38Å; R401-R485 WeakPolarHBondContact O-CD 3.5Å; R401-R485 PolarHBondContact O-NH1 2.72Å; I404-R485 HydrophobicContact CG2-CB 4Å; E476-R485 VanDerWaalsContact O-CA 3.29Å; E476-R485 WeakPolarHBondContact O-CA 3.47Å; C477-R485 WeakPolarHBondContact O-CD 3.45Å; C477-R485 WeakPolarHBondContact O-CG 3.49Å; Y479-R485 PolarHBondContact O-NE 3Å; Y479-R485 PolarHBondContact O-NH2 3.09Å; Q480-R485 PolarHBondContact O-NH2 3.24Å; P482-R485 WeakPolarHBondContact O-CB 3.35Å; P482-R485 PolarHBondContact O-N 2.91Å; S483-R485 VanDerWaalsContact C-N 3.33Å
486	L	98.5	Very high	98.3	Very high	24 Å²	24	54.7 Å²	54.7	13%	0.126	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-60.3	157.3	173.2	-66.5	178.3	0	0	0	112.1	I404 L473 E476 R490 I491	I404-L486 VanDerWaalsContact CG1-O 3.29Å; I404-L486 WeakPolarHBondContact CG1-O 3.27Å; I404-L486 VanDerWaalsContact CG2-O 3.31Å; I404-L486 WeakPolarHBondContact CG2-O 3.44Å; L473-L486 HydrophobicContact CD2-CD1 3.59Å; E476-L486 HydrophobicContact CB-CD1 3.69Å; E476-L486 HydrophobicContact CB-CD2 4.36Å; E476-L486 HydrophobicContact CB-CG 3.67Å; E476-L486 PolarHBondContact O-N 3.23Å; E476-L486 WeakPolarHBondContact OE2-CD2 3.34Å; L486-R490 HydrophobicContact CD2-CG 3.81Å; L486-I491 HydrophobicContact CB-CD1 4.1Å; L486-I491 HydrophobicContact CB-CG1 3.77Å; L486-I491 HydrophobicContact CD1-CG1 3.85Å; L486-I491 HydrophobicContact CG-CG1 4.48Å
487	T	98.7	Very high	98.2	Very high	87 Å²	87	58.4 Å²	58.4	53%	0.534	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-88.5	154.2	166.2	65.1	0	0	0	0	110.5	L489 R490 I491	T487-L489 PolarHBondContact O-N 3.18Å; T487-R490 WeakPolarHBondContact O-CB 3.43Å; T487-R490 PolarHBondContact O-N 3.48Å; T487-R490 WeakPolarHBondContact OG1-CB 3.29Å; T487-R490 PolarHBondContact OG1-N 3.03Å; T487-I491 WeakPolarHBondContact O-CG1 3.22Å; T487-I491 PolarHBondContact O-N 3.46Å
488	A	98.7	Very high	98	Very high	2 Å²	2	59.6 Å²	59.6	2%	0.017	30%	0.3	C	S	.	.	H	α-helix	trans	-56.9	-39	177.3	0	0	0	0	0	111.6	L316 A317 I404 R490 I491 K492	L316-A488 HydrophobicContact CB-CB 4.21Å; L316-A488 HydrophobicContact CD2-CB 4.16Å; L316-A488 HydrophobicContact CG-CB 3.97Å; A317-A488 HydrophobicContact CB-CB 4.02Å; I404-A488 HydrophobicContact CD1-CB 3.9Å; I404-A488 VanDerWaalsContact CD1-N 3.3Å; A488-R490 PolarHBondContact O-N 3.29Å; A488-I491 PolarHBondContact O-N 2.79Å; A488-K492 WeakPolarHBondContact O-CB 2.87Å; A488-K492 PolarHBondContact O-N 3.02Å
489	L	98.5	Very high	97.8	Very high	72 Å²	72	60.5 Å²	60.5	38%	0.377	31%	0.306	S	S	.	.	H	α-helix	trans	-62.3	-39.6	175.1	-178.6	60.7	0	0	0	112.6	I321 T487 K493	I321-L489 HydrophobicContact CD1-CD1 4.38Å; I321-L489 HydrophobicContact CD1-CD2 4.41Å; T487-L489 PolarHBondContact O-N 3.18Å; L489-K493 WeakPolarHBondContact O-CG 3.11Å; L489-K493 PolarHBondContact O-N 3.16Å
490	R	98.6	Very high	97.4	Very high	149 Å²	149	59.4 Å²	59.4	56%	0.562	31%	0.307	S	S	*	.	H	α-helix	trans	-67	-42.6	176.4	-179.6	56.2	174.7	-164.5	-0.6	111	L486 T487 A488 K493 T494	L486-R490 HydrophobicContact CD2-CG 3.81Å; T487-R490 WeakPolarHBondContact O-CB 3.43Å; T487-R490 PolarHBondContact O-N 3.48Å; T487-R490 WeakPolarHBondContact OG1-CB 3.29Å; T487-R490 PolarHBondContact OG1-N 3.03Å; A488-R490 PolarHBondContact O-N 3.29Å; R490-K493 PolarHBondContact O-N 3.14Å; R490-T494 PolarHBondContact O-N 3.47Å; R490-T494 PolarHBondContact O-OG1 3.39Å; R490-T494 VanDerWaalsContact O-OG1 3.08Å
491	I	98.8	Very high	97	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.4	-47.6	176.3	-59.7	165.3	0	0	0	110.3	A313 I404 F407 L473 C477 L486 T487 A488 K493 T494 L495	A313-I491 HydrophobicContact CB-CG2 4.26Å; I404-I491 HydrophobicContact CD1-CD1 3.93Å; I404-I491 HydrophobicContact CG2-CD1 4.27Å; F407-I491 HydrophobicContact CD1-CD1 3.88Å; F407-I491 HydrophobicContact CE1-CB 4.42Å; F407-I491 HydrophobicContact CE1-CD1 4.13Å; F407-I491 HydrophobicContact CE1-CG2 3.72Å; L473-I491 HydrophobicContact CD1-CG2 4.42Å; L473-I491 HydrophobicContact CD2-CG1 4.48Å; L473-I491 HydrophobicContact CD2-CG2 4.4Å; C477-I491 VanDerWaalsContact SG-CD1 3.53Å; L486-I491 HydrophobicContact CB-CD1 4.1Å; L486-I491 HydrophobicContact CB-CG1 3.77Å; L486-I491 HydrophobicContact CD1-CG1 3.85Å; L486-I491 HydrophobicContact CG-CG1 4.48Å; T487-I491 WeakPolarHBondContact O-CG1 3.22Å; T487-I491 PolarHBondContact O-N 3.46Å; A488-I491 PolarHBondContact O-N 2.79Å; I491-K493 PolarHBondContact O-N 2.61Å; I491-T494 PolarHBondContact O-N 3.29Å; I491-T494 VanDerWaalsContact O-N 3.16Å; I491-L495 HydrophobicContact CG2-CD1 3.75Å; I491-L495 HydrophobicContact CG2-CG 4.22Å; I491-L495 WeakPolarHBondContact O-CG 3.48Å; I491-L495 PolarHBondContact O-N 2.9Å
492	K	98.7	Very high	96.4	Very high	65 Å²	65	56.7 Å²	56.7	28%	0.283	30%	0.3	S	S	.	.	H	α-helix	trans	-51.8	-52.9	174.5	-176	-173.1	-178.1	165.4	0	111.2	L310 A313 S314 A317 A488 T494 L495 T496	L310-K492 HydrophobicContact CD1-CG 4.07Å; A313-K492 HydrophobicContact CB-CB 4.19Å; S314-K492 WeakPolarHBondContact OG-CE 3.43Å; S314-K492 PolarHBondContact OG-NZ 3.1Å; A317-K492 HydrophobicContact CB-CD 4.49Å; A488-K492 WeakPolarHBondContact O-CB 2.87Å; A488-K492 PolarHBondContact O-N 3.02Å; K492-T494 VanDerWaalsContact C-N 3.33Å; K492-T494 PolarHBondContact O-N 2.91Å; K492-L495 PolarHBondContact O-N 2.72Å; K492-T496 PolarHBondContact O-N 3.21Å; K492-T496 PolarHBondContact O-OG1 3.02Å
493	K	98.4	Very high	95.4	Very high	133 Å²	133	59 Å²	59	58%	0.578	31%	0.31	S	S	*	.	H	α-helix	trans	-59.4	-41.4	179.3	-75.2	-178.1	176.2	-175.7	0	112.7	L489 R490 I491 K497	L489-K493 WeakPolarHBondContact O-CG 3.11Å; L489-K493 PolarHBondContact O-N 3.16Å; R490-K493 PolarHBondContact O-N 3.14Å; I491-K493 PolarHBondContact O-N 2.61Å; K493-K497 PolarHBondContact O-N 2.81Å; K493-K497 VanDerWaalsContact O-N 3.1Å
494	T	98.3	Very high	94.3	Very high	42 Å²	42	62.1 Å²	62.1	26%	0.258	31%	0.314	S	S	.	.	H	α-helix	trans	-65.8	-45.4	177.7	-58.3	0	0	0	0	111.3	L473 R490 I491 K492 K497 I498	L473-T494 HydrophobicContact CD1-CG2 4.22Å; L473-T494 HydrophobicContact CD2-CG2 3.92Å; L473-T494 HydrophobicContact CG-CG2 4.32Å; R490-T494 PolarHBondContact O-N 3.47Å; R490-T494 PolarHBondContact O-OG1 3.39Å; R490-T494 VanDerWaalsContact O-OG1 3.08Å; I491-T494 PolarHBondContact O-N 3.29Å; I491-T494 VanDerWaalsContact O-N 3.16Å; K492-T494 VanDerWaalsContact C-N 3.33Å; K492-T494 PolarHBondContact O-N 2.91Å; T494-K497 WeakPolarHBondContact O-CB 3.38Å; T494-K497 PolarHBondContact O-N 3.2Å; T494-I498 HydrophobicContact CG2-CD1 4.09Å; T494-I498 WeakPolarHBondContact O-CG1 3.28Å; T494-I498 PolarHBondContact O-N 2.66Å; T494-I498 VanDerWaalsContact O-N 3.08Å
495	L	98.2	Very high	93	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-63.1	-43.3	177.7	-70.4	171.6	0	0	0	112.1	L306 V309 L310 A313 L470 L473 I491 K492 K497 I498 D499	L306-L495 HydrophobicContact CD2-CD2 4.26Å; V309-L495 HydrophobicContact CB-CD1 4.14Å; V309-L495 HydrophobicContact CG2-CD1 3.88Å; V309-L495 HydrophobicContact CG2-CD2 3.66Å; V309-L495 HydrophobicContact CG2-CG 4.38Å; L310-L495 HydrophobicContact CB-CB 4.35Å; L310-L495 HydrophobicContact CD1-CB 3.86Å; A313-L495 HydrophobicContact CB-CD1 3.92Å; L470-L495 HydrophobicContact CD2-CD2 3.63Å; L473-L495 HydrophobicContact CD1-CD2 3.65Å; L473-L495 HydrophobicContact CD1-CG 3.99Å; I491-L495 HydrophobicContact CG2-CD1 3.75Å; I491-L495 HydrophobicContact CG2-CG 4.22Å; I491-L495 WeakPolarHBondContact O-CG 3.48Å; I491-L495 PolarHBondContact O-N 2.9Å; K492-L495 PolarHBondContact O-N 2.72Å; L495-K497 VanDerWaalsContact C-N 3.26Å; L495-K497 PolarHBondContact O-N 2.96Å; L495-I498 HydrophobicContact CD2-CD1 4.34Å; L495-I498 PolarHBondContact O-N 3.3Å; L495-I498 VanDerWaalsContact O-N 3.13Å; L495-D499 WeakPolarHBondContact O-CB 3.26Å; L495-D499 PolarHBondContact O-N 3.46Å
496	T	97.6	Very high	91.4	Very high	47 Å²	47	70 Å²	70	29%	0.288	35%	0.345	S	S	.	.	H	α-helix	trans	-58.7	-38.6	173.5	-57.2	0	0	0	0	111.8	L310 K492 D499 N500	L310-T496 WeakPolarHBondContact CD1-OG1 3.48Å; K492-T496 PolarHBondContact O-N 3.21Å; K492-T496 PolarHBondContact O-OG1 3.02Å; T496-D499 PolarHBondContact O-N 3.27Å; T496-N500 WeakPolarHBondContact O-CB 3.27Å; T496-N500 PolarHBondContact O-N 2.86Å; T496-N500 PolarHBondContact O-ND2 3.38Å
497	K	96.8	Very high	89.6	Confident	153 Å²	153	73.9 Å²	73.9	67%	0.665	37%	0.37	S	S	*	.	H	α-helix	trans	-64.8	-41.4	176.5	-173.3	-179.8	177.7	-177.5	0	111.8	K493 T494 L495 S501	K493-K497 PolarHBondContact O-N 2.81Å; K493-K497 VanDerWaalsContact O-N 3.1Å; T494-K497 WeakPolarHBondContact O-CB 3.38Å; T494-K497 PolarHBondContact O-N 3.2Å; L495-K497 VanDerWaalsContact C-N 3.26Å; L495-K497 PolarHBondContact O-N 2.96Å; K497-S501 WeakPolarHBondContact O-CB 3.4Å; K497-S501 PolarHBondContact O-N 2.58Å; K497-S501 VanDerWaalsContact O-N 3.07Å; K497-S501 PolarHBondContact O-OG 3.06Å
498	I	94.4	Very high	87.2	Confident	25 Å²	25	76.2 Å²	76.2	13%	0.128	38%	0.379	C	S	.	.	H	α-helix	trans	-65.4	-44.8	178.4	-62.3	159.5	0	0	0	110.3	L306 T466 T494 L495 S501 L502	L306-I498 HydrophobicContact CD1-CG2 4.01Å; L306-I498 HydrophobicContact CD2-CB 4.47Å; L306-I498 HydrophobicContact CD2-CG2 3.97Å; T466-I498 HydrophobicContact CG2-CG2 4.47Å; T494-I498 HydrophobicContact CG2-CD1 4.09Å; T494-I498 WeakPolarHBondContact O-CG1 3.28Å; T494-I498 PolarHBondContact O-N 2.66Å; T494-I498 VanDerWaalsContact O-N 3.08Å; L495-I498 HydrophobicContact CD2-CD1 4.34Å; L495-I498 PolarHBondContact O-N 3.3Å; L495-I498 VanDerWaalsContact O-N 3.13Å; I498-S501 WeakPolarHBondContact O-CB 3.49Å; I498-S501 PolarHBondContact O-N 3.4Å; I498-L502 PolarHBondContact O-N 3.04Å; I498-L502 VanDerWaalsContact O-N 3.09Å
499	D	92.9	Very high	84.6	Confident	38 Å²	38	83.9 Å²	83.9	20%	0.203	43%	0.431	C	S	.	.	H	α-helix	trans	-60.1	-49.7	178.1	-160.3	52.1	0	0	0	111.4	L306 L495 T496 S501 L502 D503	L306-D499 HydrophobicContact CD1-CB 4.49Å; L495-D499 WeakPolarHBondContact O-CB 3.26Å; L495-D499 PolarHBondContact O-N 3.46Å; T496-D499 PolarHBondContact O-N 3.27Å; D499-S501 VanDerWaalsContact C-N 3.27Å; D499-S501 PolarHBondContact O-N 3.05Å; D499-L502 VanDerWaalsContact O-CB 3.27Å; D499-L502 WeakPolarHBondContact O-CB 3.45Å; D499-L502 PolarHBondContact O-N 2.91Å; D499-D503 PolarHBondContact O-N 3.16Å
500	N	91.4	Very high	83.9	Confident	86 Å²	86	84.5 Å²	84.5	46%	0.46	43%	0.433	S	S	.	.	H	α-helix	trans	-62.2	-31.9	176.4	-69	-12.2	0	0	0	113.4	T496 L502 K504	T496-N500 WeakPolarHBondContact O-CB 3.27Å; T496-N500 PolarHBondContact O-N 2.86Å; T496-N500 PolarHBondContact O-ND2 3.38Å; N500-L502 VanDerWaalsContact C-N 3.34Å; N500-K504 PolarHBondContact O-N 2.9Å
501	S	88.6	Confident	83.1	Confident	64 Å²	64	81.1 Å²	81.1	45%	0.448	43%	0.427	S	S	.	.	H	α-helix	trans	-69.7	-32.8	175	-75.6	0	0	0	0	112.1	K497 I498 D499 L505	K497-S501 WeakPolarHBondContact O-CB 3.4Å; K497-S501 PolarHBondContact O-N 2.58Å; K497-S501 VanDerWaalsContact O-N 3.07Å; K497-S501 PolarHBondContact O-OG 3.06Å; I498-S501 WeakPolarHBondContact O-CB 3.49Å; I498-S501 PolarHBondContact O-N 3.4Å; D499-S501 VanDerWaalsContact C-N 3.27Å; D499-S501 PolarHBondContact O-N 3.05Å; S501-L505 WeakPolarHBondContact O-CG 3.33Å; S501-L505 PolarHBondContact O-N 3.07Å
502	L	84.8	Confident	82.3	Confident	33 Å²	33	85.6 Å²	85.6	17%	0.173	45%	0.45	C	S	.	.	H	α-helix	trans	-67.2	-41.8	175.5	-165.6	85.9	0	0	0	111.3	T302 V303 I498 D499 N500 K504 L505 K506	T302-L502 HydrophobicContact CG2-CD1 3.82Å; T302-L502 HydrophobicContact CG2-CD2 4.2Å; V303-L502 HydrophobicContact CG2-CD2 3.76Å; I498-L502 PolarHBondContact O-N 3.04Å; I498-L502 VanDerWaalsContact O-N 3.09Å; D499-L502 VanDerWaalsContact O-CB 3.27Å; D499-L502 WeakPolarHBondContact O-CB 3.45Å; D499-L502 PolarHBondContact O-N 2.91Å; N500-L502 VanDerWaalsContact C-N 3.34Å; L502-K504 PolarHBondContact O-N 3.2Å; L502-L505 PolarHBondContact O-N 3.47Å; L502-K506 PolarHBondContact O-N 3.06Å
503	D	78.3	Confident	81.3	Confident	78 Å²	78	86.8 Å²	86.8	42%	0.417	46%	0.46	S	S	.	.	H	α-helix	trans	-66.2	-38.3	-179.1	-74.5	-18	0	0	0	112.4	D499 L505 K506 T507	D499-D503 PolarHBondContact O-N 3.16Å; D503-L505 VanDerWaalsContact C-N 3.34Å; D503-L505 PolarHBondContact O-N 3.35Å; D503-K506 WeakPolarHBondContact O-CB 3.23Å; D503-K506 PolarHBondContact O-N 3.37Å; D503-K506 VanDerWaalsContact O-N 3.13Å; D503-T507 PolarHBondContact O-N 2.9Å; D503-T507 VanDerWaalsContact O-N 3.09Å; D503-T507 PolarHBondContact O-OG1 3.09Å
504	K	73.7	Confident	80.2	Confident	142 Å²	142	83.9 Å²	83.9	62%	0.617	45%	0.453	S	S	*	.	H	α-helix	trans	-60.8	-41.8	174.2	-72.2	-178.3	179.5	-170.3	0	112.6	N500 L502 K506 T507 D508	N500-K504 PolarHBondContact O-N 2.9Å; L502-K504 PolarHBondContact O-N 3.2Å; K504-K506 PolarHBondContact O-N 3.3Å; K504-T507 WeakPolarHBondContact CA-OG1 3.37Å; K504-T507 PolarHBondContact O-N 2.89Å; K504-T507 PolarHBondContact O-OG1 3.43Å; K504-D508 VanDerWaalsContact O-CG 3.3Å; K504-D508 PolarHBondContact O-N 3.35Å
505	L	70.8	Confident	79	Confident	119 Å²	119	86.7 Å²	86.7	62%	0.623	47%	0.466	S	S	*	.	H	α-helix	trans	-63.8	-27.9	177.2	-71.4	167.2	0	0	0	112.4	S501 L502 D503 C509	S501-L505 WeakPolarHBondContact O-CG 3.33Å; S501-L505 PolarHBondContact O-N 3.07Å; L502-L505 PolarHBondContact O-N 3.47Å; D503-L505 VanDerWaalsContact C-N 3.34Å; D503-L505 PolarHBondContact O-N 3.35Å; L505-C509 PolarHBondContact O-SG 3.5Å
506	K	64.1	Low	77.7	Confident	109 Å²	109	92.9 Å²	92.9	47%	0.474	50%	0.499	S	S	.	.	H	α-helix	trans	-80.1	-30	175.8	-70.1	177.4	-177.8	170.3	0	113.6	L502 D503 K504	L502-K506 PolarHBondContact O-N 3.06Å; D503-K506 WeakPolarHBondContact O-CB 3.23Å; D503-K506 PolarHBondContact O-N 3.37Å; D503-K506 VanDerWaalsContact O-N 3.13Å; K504-K506 PolarHBondContact O-N 3.3Å
507	T	61.3	Low	76.1	Confident	106 Å²	106	96.4 Å²	96.4	65%	0.65	52%	0.515	S	S	*	.	H	α-helix	trans	-79.1	-21.9	177.6	50.2	0	0	0	0	113.1	D503 K504	D503-T507 PolarHBondContact O-N 2.9Å; D503-T507 VanDerWaalsContact O-N 3.09Å; D503-T507 PolarHBondContact O-OG1 3.09Å; K504-T507 WeakPolarHBondContact CA-OG1 3.37Å; K504-T507 PolarHBondContact O-N 2.89Å; K504-T507 PolarHBondContact O-OG1 3.43Å
508	D	48.9	Very low	74.4	Confident	136 Å²	136	91.7 Å²	91.7	73%	0.727	50%	0.502	S	S	*	.			trans	-91.5	-3	180	-63.9	-16.5	0	0	0	113.2	K504	K504-D508 VanDerWaalsContact O-CG 3.3Å; K504-D508 PolarHBondContact O-N 3.35Å
509	C	43.9	Very low	72.6	Confident	164 Å²	164	97.7 Å²	97.7	100%	1.108	54%	0.536	S	S	*	.			trans	-107.1	0	171.9	-64.2	0	0	0	0	110.1	L505	L505-C509 PolarHBondContact O-SG 3.5Å

Retrieved 509 of 509 residues in 143.4 ms (Link to these results)

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