A0A096LP39_HUMAN Loading...

Ribonuclease P/MRP subunit p21

AlphaFold DB , UniProt , Accession A0A096LP39, Species HUMAN (Homo sapiens, Human), Gene TRIM39-RPP21, Length 503 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.4	Very low	38.4	Very low	215 Å²	215	109.2 Å²	109.2	100%	1.059	65%	0.646	S	S	*	*				0	-17.8	0	-66.9	-152.5	-70.3	0	0	113.7	T4	M1-T4 PolarHBondContact O-OG1 3.37Å
2	A	39.7	Very low	39.4	Very low	77 Å²	77	105.8 Å²	105.8	64%	0.636	63%	0.633	S	S	*	*	H	α-helix	trans	-83.1	-33.8	179.6	0	0	0	0	0	114.3	S5	A2-S5 PolarHBondContact O-N 3.33Å
3	E	33.3	Very low	40.5	Very low	167 Å²	167	102.5 Å²	102.5	78%	0.78	62%	0.624	S	S	*	*	H	α-helix	trans	-72	-32.2	-179.1	-71.9	177.5	149.9	0	0	113.7	S5	E3-S5 VanDerWaalsContact C-N 3.28Å; E3-S5 PolarHBondContact O-N 3.43Å
4	T	34.3	Very low	41.5	Very low	87 Å²	87	100.1 Å²	100.1	53%	0.534	62%	0.62	S	S	.	*	H	α-helix	trans	-65.7	-30.2	172.2	32.1	0	0	0	0	112.6	M1 E8	M1-T4 PolarHBondContact O-OG1 3.37Å; T4-E8 WeakPolarHBondContact O-CB 3.35Å; T4-E8 VanDerWaalsContact O-CG 3.3Å; T4-E8 WeakPolarHBondContact O-CG 3.42Å; T4-E8 PolarHBondContact O-N 3.01Å
5	S	39.9	Very low	42.8	Very low	71 Å²	71	99 Å²	99	50%	0.497	62%	0.617	S	S	.	*	H	α-helix	trans	-74.1	-26.3	-178.3	-175.5	0	0	0	0	113.5	A2 E3 A9	A2-S5 PolarHBondContact O-N 3.33Å; E3-S5 VanDerWaalsContact C-N 3.28Å; E3-S5 PolarHBondContact O-N 3.43Å; S5-A9 WeakPolarHBondContact O-CB 3.39Å; S5-A9 PolarHBondContact O-N 3.2Å; S5-A9 VanDerWaalsContact O-N 3.13Å
6	L	38.2	Very low	44.1	Very low	134 Å²	134	98.2 Å²	98.2	70%	0.702	61%	0.612	S	S	*	*	H	α-helix	trans	-79	-38.8	179.7	-81.7	155.3	0	0	0	112.2	A9 G10	L6-A9 PolarHBondContact O-N 3.01Å; L6-G10 PolarHBondContact O-N 3.33Å; L6-G10 VanDerWaalsContact O-N 3.14Å
7	L	37.5	Very low	45.5	Very low	141 Å²	141	94.6 Å²	94.6	74%	0.738	59%	0.594	S	S	*	*	H	α-helix	trans	-68.1	-36.9	173.1	-74.4	162.3	0	0	0	111.7	A11	L7-A11 WeakPolarHBondContact O-CB 3.31Å; L7-A11 PolarHBondContact O-N 3.06Å; L7-A11 VanDerWaalsContact O-N 3.15Å
8	E	36.4	Very low	46.9	Very low	137 Å²	137	92.1 Å²	92.1	64%	0.64	58%	0.583	S	S	*	*	H	α-helix	trans	-66.8	-38.2	174.2	-76	176	170	0	0	112.6	T4 S12	T4-E8 WeakPolarHBondContact O-CB 3.35Å; T4-E8 VanDerWaalsContact O-CG 3.3Å; T4-E8 WeakPolarHBondContact O-CG 3.42Å; T4-E8 PolarHBondContact O-N 3.01Å; E8-S12 WeakPolarHBondContact O-CB 3.23Å; E8-S12 PolarHBondContact O-N 2.88Å
9	A	41.8	Very low	48.3	Very low	56 Å²	56	90.3 Å²	90.3	46%	0.463	58%	0.578	S	S	.	*	H	α-helix	trans	-68.1	-40.4	176.9	0	0	0	0	0	112.8	S5 L6 S12 A13	S5-A9 WeakPolarHBondContact O-CB 3.39Å; S5-A9 PolarHBondContact O-N 3.2Å; S5-A9 VanDerWaalsContact O-N 3.13Å; L6-A9 PolarHBondContact O-N 3.01Å; A9-S12 PolarHBondContact O-N 3.4Å; A9-A13 PolarHBondContact O-N 3.35Å
10	G	39.3	Very low	49.7	Very low	49 Å²	49	87.3 Å²	87.3	51%	0.505	56%	0.557	S	S	.	*	H	α-helix	trans	-67.1	-39.7	176.8	0	0	0	0	0	113.5	L6 A14	L6-G10 PolarHBondContact O-N 3.33Å; L6-G10 VanDerWaalsContact O-N 3.14Å; G10-A14 PolarHBondContact O-N 3.24Å
11	A	41	Very low	51.1	Low	67 Å²	67	88.6 Å²	88.6	55%	0.554	56%	0.556	S	S	*	*	H	α-helix	trans	-68.6	-36.7	173.4	0	0	0	0	0	112.3	L7 S15	L7-A11 WeakPolarHBondContact O-CB 3.31Å; L7-A11 PolarHBondContact O-N 3.06Å; L7-A11 VanDerWaalsContact O-N 3.15Å; A11-S15 WeakPolarHBondContact O-CB 3.44Å; A11-S15 PolarHBondContact O-N 3.31Å; A11-S15 VanDerWaalsContact O-N 3.14Å
12	S	50.3	Low	53	Low	69 Å²	69	83.6 Å²	83.6	48%	0.483	53%	0.534	S	S	.	.	H	α-helix	trans	-64	-43.3	176.9	-176.5	0	0	0	0	112.4	E8 A9 S15 T16	E8-S12 WeakPolarHBondContact O-CB 3.23Å; E8-S12 PolarHBondContact O-N 2.88Å; A9-S12 PolarHBondContact O-N 3.4Å; S12-S15 PolarHBondContact O-N 3.05Å; S12-T16 WeakPolarHBondContact O-CB 3.48Å; S12-T16 PolarHBondContact O-N 3.41Å; S12-T16 PolarHBondContact O-OG1 3.35Å
13	A	54	Low	55.1	Low	63 Å²	63	83.1 Å²	83.1	52%	0.521	52%	0.52	S	S	.	.	H	α-helix	trans	-65	-43.5	-179.2	0	0	0	0	0	112.9	A9 T16 A17	A9-A13 PolarHBondContact O-N 3.35Å; A13-T16 PolarHBondContact O-N 3.28Å; A13-A17 PolarHBondContact O-N 2.91Å; A13-A17 VanDerWaalsContact O-N 3.08Å
14	A	54.7	Low	57.4	Low	69 Å²	69	78.7 Å²	78.7	57%	0.57	50%	0.499	S	S	*	.	H	α-helix	trans	-65.9	-40.7	176.7	0	0	0	0	0	112.2	G10 T16 A17 A18	G10-A14 PolarHBondContact O-N 3.24Å; A14-T16 VanDerWaalsContact C-N 3.3Å; A14-T16 PolarHBondContact O-N 3.39Å; A14-A17 PolarHBondContact O-N 3.37Å; A14-A18 PolarHBondContact O-N 2.94Å
15	S	60.3	Low	59.8	Low	83 Å²	83	79.4 Å²	79.4	58%	0.58	50%	0.504	S	S	*	.	H	α-helix	trans	-63.1	-35.4	174.1	-174.1	0	0	0	0	112.5	A11 S12 A19	A11-S15 WeakPolarHBondContact O-CB 3.44Å; A11-S15 PolarHBondContact O-N 3.31Å; A11-S15 VanDerWaalsContact O-N 3.14Å; S12-S15 PolarHBondContact O-N 3.05Å; S15-A19 WeakPolarHBondContact O-CB 3.48Å; S15-A19 PolarHBondContact O-N 3.07Å
16	T	64.8	Low	62	Low	86 Å²	86	83.1 Å²	83.1	53%	0.528	51%	0.513	S	S	.	.	H	α-helix	trans	-73.8	-35.2	-179.8	-48.6	0	0	0	0	111.7	S12 A13 A14 A19 L20	S12-T16 WeakPolarHBondContact O-CB 3.48Å; S12-T16 PolarHBondContact O-N 3.41Å; S12-T16 PolarHBondContact O-OG1 3.35Å; A13-T16 PolarHBondContact O-N 3.28Å; A14-T16 VanDerWaalsContact C-N 3.3Å; A14-T16 PolarHBondContact O-N 3.39Å; T16-A19 PolarHBondContact O-N 3.05Å; T16-L20 PolarHBondContact O-N 3.5Å
17	A	66.6	Low	64.4	Low	37 Å²	37	77 Å²	77	31%	0.306	48%	0.481	S	S	.	.	H	α-helix	trans	-64.7	-45.4	176.2	0	0	0	0	0	112.3	A13 A14 L20 E21	A13-A17 PolarHBondContact O-N 2.91Å; A13-A17 VanDerWaalsContact O-N 3.08Å; A14-A17 PolarHBondContact O-N 3.37Å; A17-L20 PolarHBondContact O-N 3.4Å; A17-E21 PolarHBondContact O-N 3.37Å
18	A	71.2	Confident	66.9	Low	49 Å²	49	71.8 Å²	71.8	41%	0.405	46%	0.457	S	S	.	.	H	α-helix	trans	-65.3	-38.1	177.4	0	0	0	0	0	112.5	A14 L20 E21 N22	A14-A18 PolarHBondContact O-N 2.94Å; A18-L20 VanDerWaalsContact C-N 3.3Å; A18-L20 PolarHBondContact O-N 3.3Å; A18-E21 PolarHBondContact O-N 3.05Å; A18-N22 PolarHBondContact O-N 2.9Å; A18-N22 VanDerWaalsContact O-N 3.13Å; A18-N22 PolarHBondContact O-ND2 2.89Å
19	A	73.8	Confident	69.6	Low	58 Å²	58	65.3 Å²	65.3	48%	0.479	43%	0.427	S	S	.	.	H	α-helix	trans	-62.6	-36.8	175.7	0	0	0	0	0	112.6	S15 T16 L23	S15-A19 WeakPolarHBondContact O-CB 3.48Å; S15-A19 PolarHBondContact O-N 3.07Å; T16-A19 PolarHBondContact O-N 3.05Å; A19-L23 PolarHBondContact O-N 2.9Å
20	L	76.8	Confident	72	Confident	30 Å²	30	65.6 Å²	65.6	16%	0.157	43%	0.425	C	S	.	.	H	α-helix	trans	-73.7	-31.7	179.5	-167.1	67.8	0	0	0	112.9	T16 A17 A18 L23 Q24 L94 K98	T16-L20 PolarHBondContact O-N 3.5Å; A17-L20 PolarHBondContact O-N 3.4Å; A18-L20 VanDerWaalsContact C-N 3.3Å; A18-L20 PolarHBondContact O-N 3.3Å; L20-L23 HydrophobicContact CD1-CD2 4.34Å; L20-Q24 PolarHBondContact O-N 3.26Å; L20-Q24 VanDerWaalsContact O-N 3.13Å; L20-L94 HydrophobicContact CD1-CB 3.95Å; L20-L94 HydrophobicContact CD1-CD1 4.38Å; L20-K98 HydrophobicContact CD2-CB 4.38Å; L20-K98 HydrophobicContact CD2-CD 3.54Å
21	E	78.6	Confident	74.5	Confident	115 Å²	115	66.1 Å²	66.1	54%	0.537	42%	0.418	S	S	.	.	H	α-helix	trans	-67.9	-43.5	172.9	-75	175.9	-171.9	0	0	111.4	A17 A18 L23 Q24 V25	A17-E21 PolarHBondContact O-N 3.37Å; A18-E21 PolarHBondContact O-N 3.05Å; E21-L23 VanDerWaalsContact C-N 3.32Å; E21-L23 PolarHBondContact O-N 3.13Å; E21-Q24 WeakPolarHBondContact O-CB 3.46Å; E21-Q24 PolarHBondContact O-N 3.38Å; E21-Q24 VanDerWaalsContact O-N 3.16Å; E21-V25 PolarHBondContact O-N 3.3Å
22	N	81.1	Confident	76.9	Confident	111 Å²	111	65.3 Å²	65.3	59%	0.594	41%	0.408	S	S	*	.	H	α-helix	trans	-61.5	-40.7	174.2	-70.6	-26	0	0	0	111.9	A18 Q24 V25 E26	A18-N22 PolarHBondContact O-N 2.9Å; A18-N22 VanDerWaalsContact O-N 3.13Å; A18-N22 PolarHBondContact O-ND2 2.89Å; N22-Q24 VanDerWaalsContact C-N 3.3Å; N22-Q24 PolarHBondContact O-N 3.49Å; N22-V25 PolarHBondContact O-N 3.03Å; N22-E26 WeakPolarHBondContact O-CG 3.4Å; N22-E26 PolarHBondContact O-N 3.48Å; N22-E26 VanDerWaalsContact O-N 3.11Å
23	L	82.5	Confident	78.8	Confident	67 Å²	67	68.7 Å²	68.7	35%	0.351	42%	0.42	S	S	.	.	H	α-helix	trans	-63.2	-35	175.8	-175.9	64.2	0	0	0	112.6	A19 L20 E21 A27 A91 L94	A19-L23 PolarHBondContact O-N 2.9Å; L20-L23 HydrophobicContact CD1-CD2 4.34Å; E21-L23 VanDerWaalsContact C-N 3.32Å; E21-L23 PolarHBondContact O-N 3.13Å; L23-A27 VanDerWaalsContact O-CB 3.24Å; L23-A27 WeakPolarHBondContact O-CB 3.29Å; L23-A27 PolarHBondContact O-N 3.2Å; L23-A91 HydrophobicContact CD2-CB 4.06Å; L23-A91 HydrophobicContact CG-CB 4.07Å; L23-L94 HydrophobicContact CD2-CD1 4.48Å
24	Q	83	Confident	80.5	Confident	73 Å²	73	70.6 Å²	70.6	34%	0.341	42%	0.418	S	S	.	.	H	α-helix	trans	-64.3	-42.8	175.7	-178.6	178.1	1.6	0	0	111.6	L20 E21 N22 A27 S28 Y35	L20-Q24 PolarHBondContact O-N 3.26Å; L20-Q24 VanDerWaalsContact O-N 3.13Å; E21-Q24 WeakPolarHBondContact O-CB 3.46Å; E21-Q24 PolarHBondContact O-N 3.38Å; E21-Q24 VanDerWaalsContact O-N 3.16Å; N22-Q24 VanDerWaalsContact C-N 3.3Å; N22-Q24 PolarHBondContact O-N 3.49Å; Q24-A27 PolarHBondContact O-N 3.26Å; Q24-S28 WeakPolarHBondContact O-CB 3.48Å; Q24-S28 PolarHBondContact O-N 3.36Å; Q24-S28 PolarHBondContact O-OG 3.15Å; Q24-Y35 HydrophobicContact CG-CE1 4.39Å
25	V	83.6	Confident	82.3	Confident	103 Å²	103	69.2 Å²	69.2	62%	0.624	40%	0.399	S	S	*	.	H	α-helix	trans	-63.3	-47.4	179	176.3	0	0	0	0	110.4	E21 N22 A27 S28	E21-V25 PolarHBondContact O-N 3.3Å; N22-V25 PolarHBondContact O-N 3.03Å; V25-A27 VanDerWaalsContact C-N 3.27Å; V25-A27 PolarHBondContact O-N 3.31Å; V25-S28 WeakPolarHBondContact O-CB 3.35Å; V25-S28 PolarHBondContact O-N 2.91Å; V25-S28 VanDerWaalsContact O-N 3.11Å
26	E	85.6	Confident	83.8	Confident	149 Å²	149	65.5 Å²	65.5	70%	0.696	37%	0.372	S	S	*	.	H	α-helix	trans	-66.1	-27	179.2	-68	-60.7	146.2	0	0	113.6	N22 S28	N22-E26 WeakPolarHBondContact O-CG 3.4Å; N22-E26 PolarHBondContact O-N 3.48Å; N22-E26 VanDerWaalsContact O-N 3.11Å; E26-S28 VanDerWaalsContact C-N 3.31Å
27	A	88.8	Confident	85	Confident	4 Å²	4	67.1 Å²	67.1	3%	0.033	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-0.3	176.5	0	0	0	0	0	113.7	L23 Q24 V25 Y35 L36 V88 A91	L23-A27 VanDerWaalsContact O-CB 3.24Å; L23-A27 WeakPolarHBondContact O-CB 3.29Å; L23-A27 PolarHBondContact O-N 3.2Å; Q24-A27 PolarHBondContact O-N 3.26Å; V25-A27 VanDerWaalsContact C-N 3.27Å; V25-A27 PolarHBondContact O-N 3.31Å; A27-Y35 HydrophobicContact CB-CD1 3.81Å; A27-Y35 HydrophobicContact CB-CE1 3.83Å; A27-Y35 WeakPolarHBondContact O-CA 3.36Å; A27-L36 PolarHBondContact O-N 3.23Å; A27-V88 HydrophobicContact CB-CB 4.49Å; A27-V88 HydrophobicContact CB-CG2 3.9Å; A27-A91 HydrophobicContact CB-CB 4.18Å
28	S	91.7	Very high	86.2	Confident	33 Å²	33	71.9 Å²	71.9	23%	0.231	39%	0.388	C	S	.	.	B	Isolated β-bridge	trans	-102.2	145.1	-175	-63.1	0	0	0	0	112.6	Q24 V25 E26 E34	Q24-S28 WeakPolarHBondContact O-CB 3.48Å; Q24-S28 PolarHBondContact O-N 3.36Å; Q24-S28 PolarHBondContact O-OG 3.15Å; V25-S28 WeakPolarHBondContact O-CB 3.35Å; V25-S28 PolarHBondContact O-N 2.91Å; V25-S28 VanDerWaalsContact O-N 3.11Å; E26-S28 VanDerWaalsContact C-N 3.31Å; S28-E34 CarbonylContact C-O 3.58Å; S28-E34 WeakPolarHBondContact CA-O 3.46Å
29	C	93.1	Very high	87.3	Confident	1 Å²	1	70 Å²	70	1%	0.007	37%	0.372	C	S	.	.			trans	-78.9	124.3	176.4	-177	0	0	0	0	109.9	V31 C32 L33 E34 L36 C49	C29-V31 PolarHBondContact O-N 2.99Å; C29-C32 VanDerWaalsContact CB-SG 3.57Å; C29-L33 WeakPolarHBondContact O-CA 3.35Å; C29-L33 PolarHBondContact O-N 3.38Å; C29-E34 PolarHBondContact N-O 2.6Å; C29-L36 HydrophobicContact CB-CD2 3.67Å; C29-L36 HydrophobicContact CB-CG 4.28Å; C29-C49 WeakPolarHBondContact CB-SG 3.49Å; C29-C49 PolarHBondContact SG-N 3.38Å; C29-C49 VanDerWaalsContact SG-SG 3.68Å
30	S	90.6	Very high	88.2	Confident	62 Å²	62	67.5 Å²	67.5	43%	0.434	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-4.1	180	72.8	0	0	0	0	114.6	F48 V68	S30-F48 VanDerWaalsContact OG-CE1 3.32Å; S30-F48 WeakPolarHBondContact OG-CE1 3.46Å; S30-V68 VanDerWaalsContact OG-CG2 3.23Å; S30-V68 WeakPolarHBondContact OG-CG2 3.43Å
31	V	91.7	Very high	88.9	Confident	59 Å²	59	68.6 Å²	68.6	36%	0.358	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-49.7	178	179.2	0	0	0	0	111.4	C29 F48 C52 P67	C29-V31 PolarHBondContact O-N 2.99Å; V31-F48 HydrophobicContact CG2-CD1 3.78Å; V31-F48 HydrophobicContact CG2-CE1 4.1Å; V31-C52 HydrophobicContact CB-CB 3.99Å; V31-C52 HydrophobicContact CG1-CB 3.98Å; V31-P67 HydrophobicContact CG2-CB 4.02Å; V31-P67 HydrophobicContact CG2-CG 4.02Å
32	C	92.5	Very high	89.5	Confident	51 Å²	51	63.5 Å²	63.5	35%	0.345	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-7.5	-179.7	68.4	0	0	0	0	113.9	C29 E34	C29-C32 VanDerWaalsContact CB-SG 3.57Å; C32-E34 PolarHBondContact O-N 2.93Å
33	L	89.8	Confident	89.9	Confident	140 Å²	140	63.7 Å²	63.7	73%	0.733	33%	0.329	S	S	*	.	S	Bend	trans	58.8	14.3	-178.3	-49.7	178.9	0	0	0	114.6	C29	C29-L33 WeakPolarHBondContact O-CA 3.35Å; C29-L33 PolarHBondContact O-N 3.38Å
34	E	90.6	Very high	90.2	Very high	102 Å²	102	62 Å²	62	48%	0.477	32%	0.323	S	S	.	.	S	Bend	trans	-100.9	165.2	171.1	-62.5	-173.2	177.9	0	0	110.7	S28 C29 C32 L36 K37	S28-E34 CarbonylContact C-O 3.58Å; S28-E34 WeakPolarHBondContact CA-O 3.46Å; C29-E34 PolarHBondContact N-O 2.6Å; C32-E34 PolarHBondContact O-N 2.93Å; E34-L36 PolarHBondContact O-N 3.48Å; E34-K37 IonicContact OE2-NZ 2.72Å; E34-K37 PolarHBondContact OE2-NZ 3.28Å
35	Y	91.3	Very high	90.5	Very high	40 Å²	40	60.4 Å²	60.4	16%	0.157	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-49.3	135.8	168.9	-77.9	-69.7	0	0	0	112.1	Q24 A27 K37 V88 A91 K92 Q95	Q24-Y35 HydrophobicContact CG-CE1 4.39Å; A27-Y35 HydrophobicContact CB-CD1 3.81Å; A27-Y35 HydrophobicContact CB-CE1 3.83Å; A27-Y35 WeakPolarHBondContact O-CA 3.36Å; Y35-K37 PolarHBondContact O-N 2.91Å; Y35-K37 VanDerWaalsContact O-N 3.17Å; Y35-V88 HydrophobicContact CD1-CG1 3.9Å; Y35-V88 HydrophobicContact CG-CG1 4.29Å; Y35-A91 HydrophobicContact CE1-CB 4.19Å; Y35-K92 VanDerWaalsContact CB-CE 3.4Å; Y35-K92 HydrophobicContact CD1-CG 4.17Å; Y35-K92 HydrophobicContact CD2-CD 4.48Å; Y35-K92 HydrophobicContact CD2-CG 3.83Å; Y35-K92 HydrophobicContact CE1-CG 4.25Å; Y35-K92 HydrophobicContact CE2-CG 3.93Å; Y35-K92 HydrophobicContact CG-CD 4.45Å; Y35-K92 HydrophobicContact CG-CG 3.95Å; Y35-Q95 WeakPolarHBondContact OH-CG 3.46Å; Y35-Q95 PolarHBondContact OH-NE2 2.94Å; Y35-Q95 PolarHBondContact OH-OE1 2.92Å
36	L	91.9	Very high	90.9	Very high	5 Å²	5	58.6 Å²	58.6	3%	0.026	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-57	118.1	-178.2	-72	159.2	0	0	0	111.8	A27 C29 E34 P39 N47 L84 V88	A27-L36 PolarHBondContact O-N 3.23Å; C29-L36 HydrophobicContact CB-CD2 3.67Å; C29-L36 HydrophobicContact CB-CG 4.28Å; E34-L36 PolarHBondContact O-N 3.48Å; L36-P39 HydrophobicContact CB-CB 4.02Å; L36-P39 HydrophobicContact CB-CG 4.41Å; L36-P39 HydrophobicContact CD1-CB 4.33Å; L36-N47 HydrophobicContact CD1-CB 4.42Å; L36-L84 HydrophobicContact CD1-CD2 3.73Å; L36-L84 HydrophobicContact CD1-CG 4.11Å; L36-V88 HydrophobicContact CB-CG2 4Å; L36-V88 HydrophobicContact CD1-CG2 4.25Å
37	K	90.3	Very high	91.3	Very high	120 Å²	120	53.6 Å²	53.6	52%	0.522	29%	0.288	S	S	.	.	S	Bend	trans	-99.9	120.6	173.1	-69.8	166.7	179.4	159.3	0	108.8	E34 Y35 C49 K50	E34-K37 IonicContact OE2-NZ 2.72Å; E34-K37 PolarHBondContact OE2-NZ 3.28Å; Y35-K37 PolarHBondContact O-N 2.91Å; Y35-K37 VanDerWaalsContact O-N 3.17Å; K37-C49 PolarHBondContact N-SG 3.48Å; K37-C49 VanDerWaalsContact O-CA 3.23Å; K37-C49 WeakPolarHBondContact O-CA 3.26Å; K37-C49 VanDerWaalsContact O-CB 3.32Å; K37-C49 WeakPolarHBondContact O-CB 3.49Å; K37-K50 PolarHBondContact O-N 3Å
38	E	91.6	Very high	91.5	Very high	138 Å²	138	53.4 Å²	53.4	65%	0.645	29%	0.287	S	S	*	.	S	Bend	trans	47.9	64.8	-171.4	-63.6	178.9	83.5	0	0	111.9	V40 K50	E38-V40 PolarHBondContact O-N 2.87Å; E38-K50 HydrophobicContact CB-CB 4.04Å; E38-K50 WeakPolarHBondContact O-CB 3.49Å; E38-K50 PolarHBondContact O-N 2.89Å; E38-K50 VanDerWaalsContact O-N 3.11Å
39	P	93.8	Very high	91.7	Very high	10 Å²	10	52 Å²	52	7%	0.065	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	130.7	-176	18.4	-27.7	0	0	0	111.4	L36 F48 N81 L84 G85	L36-P39 HydrophobicContact CB-CB 4.02Å; L36-P39 HydrophobicContact CB-CG 4.41Å; L36-P39 HydrophobicContact CD1-CB 4.33Å; P39-F48 WeakPolarHBondContact CA-O 3.48Å; P39-N81 PolarHBondContact O-N 3.35Å; P39-L84 HydrophobicContact CB-CB 4.44Å; P39-L84 HydrophobicContact CB-CD2 4.07Å; P39-L84 HydrophobicContact CB-CG 4.22Å; P39-L84 HydrophobicContact CG-CB 4.32Å; P39-L84 HydrophobicContact CG-CG 4.37Å; P39-G85 VanDerWaalsContact CG-CA 3.46Å; P39-G85 VanDerWaalsContact CG-N 3.32Å
40	V	93.1	Very high	91.7	Very high	4 Å²	4	56.7 Å²	56.7	2%	0.024	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	139.3	172.3	-65.6	0	0	0	0	109.7	E38 N47 F48 K50 I53 L78 R79	E38-V40 PolarHBondContact O-N 2.87Å; V40-N47 VanDerWaalsContact O-CA 3.3Å; V40-N47 WeakPolarHBondContact O-CA 3.32Å; V40-F48 WeakPolarHBondContact CG2-O 3.37Å; V40-F48 PolarHBondContact N-O 3.43Å; V40-F48 PolarHBondContact O-N 3.3Å; V40-K50 HydrophobicContact CG1-CB 3.94Å; V40-K50 HydrophobicContact CG1-CG 4.17Å; V40-K50 HydrophobicContact CG2-CB 4.44Å; V40-I53 HydrophobicContact CG2-CG2 3.53Å; V40-L78 HydrophobicContact CB-CB 4.31Å; V40-L78 HydrophobicContact CG1-CB 4.41Å; V40-L78 HydrophobicContact CG2-CB 4.47Å; V40-L78 HydrophobicContact CG2-CD2 4.07Å; V40-R79 CarbonylContact C-O 3.58Å; V40-R79 VanDerWaalsContact CA-O 3.24Å; V40-R79 WeakPolarHBondContact CA-O 3.35Å
41	I	92.6	Very high	91.9	Very high	54 Å²	54	57.3 Å²	57.3	28%	0.277	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	136.4	172.9	-167.4	169.4	0	0	0	109.5	N47 R79	I41-N47 WeakPolarHBondContact CB-OD1 3.4Å; I41-R79 HydrophobicContact CG2-CB 3.8Å; I41-R79 PolarHBondContact N-O 2.98Å; I41-R79 PolarHBondContact O-N 3.47Å; I41-R79 VanDerWaalsContact O-N 3.12Å
42	I	90.9	Very high	92	Very high	8 Å²	8	55.7 Å²	55.7	4%	0.041	30%	0.297	C	S	.	.			trans	-105.5	171.4	175.2	68	171	0	0	0	110.7	C44 G45 H46 F48 I53 W57 C66 L78	I42-C44 VanDerWaalsContact CD1-SG 3.59Å; I42-C44 VanDerWaalsContact CG1-SG 3.58Å; I42-C44 PolarHBondContact O-N 3.36Å; I42-G45 PolarHBondContact O-N 2.87Å; I42-H46 PolarHBondContact N-O 3.43Å; I42-F48 HydrophobicContact CD1-CD2 4.34Å; I42-F48 HydrophobicContact CD1-CE2 3.67Å; I42-F48 HydrophobicContact CG1-CE2 4.09Å; I42-F48 HydrophobicContact CG2-CD2 4.46Å; I42-I53 HydrophobicContact CG2-CG1 4.2Å; I42-W57 HydrophobicContact CB-CH2 4.1Å; I42-W57 HydrophobicContact CD1-CZ2 4.11Å; I42-W57 HydrophobicContact CG2-CH2 3.6Å; I42-W57 HydrophobicContact CG2-CZ2 4.13Å; I42-W57 HydrophobicContact CG2-CZ3 4.44Å; I42-C66 HydrophobicContact CD1-CB 3.69Å; I42-L78 HydrophobicContact CG2-CD2 3.59Å
43	E	88.3	Confident	92	Very high	114 Å²	114	53.2 Å²	53.2	53%	0.533	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.5	-170.2	-64.2	-179.2	163.8	0	0	115.1	G45 S73	E43-G45 PolarHBondContact O-N 3.3Å; E43-S73 WeakPolarHBondContact CB-OG 3.46Å; E43-S73 WeakPolarHBondContact CG-OG 3.49Å; E43-S73 WeakPolarHBondContact OE2-CB 3.35Å; E43-S73 PolarHBondContact OE2-OG 2.79Å
44	C	90.6	Very high	92	Very high	33 Å²	33	49.5 Å²	49.5	22%	0.223	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-1.1	176.7	68.1	0	0	0	0	114.1	I42 H46 C66 K71	I42-C44 VanDerWaalsContact CD1-SG 3.59Å; I42-C44 VanDerWaalsContact CG1-SG 3.58Å; I42-C44 PolarHBondContact O-N 3.36Å; C44-H46 PolarHBondContact SG-ND1 3.02Å; C44-C66 PolarHBondContact SG-SG 3.02Å; C44-K71 HydrophobicContact CB-CB 4.23Å; C44-K71 HydrophobicContact CB-CD 4.1Å
45	G	88.5	Confident	92.1	Very high	38 Å²	38	53.9 Å²	53.9	39%	0.392	28%	0.276	S	S	.	.	S	Bend	trans	90.3	-7.2	177.3	0	0	0	0	0	115.6	I42 E43 N47	I42-G45 PolarHBondContact O-N 2.87Å; E43-G45 PolarHBondContact O-N 3.3Å; G45-N47 PolarHBondContact O-ND2 3.26Å
46	H	92.2	Very high	92	Very high	65 Å²	65	58.4 Å²	58.4	30%	0.301	29%	0.293	S	S	.	.			trans	-74.6	147.6	177.4	-68.2	94.2	0	0	0	111.8	I42 C44 F48	I42-H46 PolarHBondContact N-O 3.43Å; C44-H46 PolarHBondContact SG-ND1 3.02Å; H46-F48 HydrophobicContact CB-CE2 3.56Å; H46-F48 HydrophobicContact CB-CZ 3.7Å
47	N	93	Very high	92	Very high	44 Å²	44	58.3 Å²	58.3	24%	0.235	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	137.9	-176.5	-61.3	-91.7	0	0	0	110.9	L36 V40 I41 G45 N81 L84	L36-N47 HydrophobicContact CD1-CB 4.42Å; V40-N47 VanDerWaalsContact O-CA 3.3Å; V40-N47 WeakPolarHBondContact O-CA 3.32Å; I41-N47 WeakPolarHBondContact CB-OD1 3.4Å; G45-N47 PolarHBondContact O-ND2 3.26Å; N47-N81 PolarHBondContact OD1-ND2 2.87Å; N47-L84 HydrophobicContact CB-CD2 3.42Å; N47-L84 VanDerWaalsContact CB-CD2 3.42Å; N47-L84 WeakPolarHBondContact OD1-CD2 3.41Å
48	F	94.1	Very high	91.8	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	161.9	-179.4	-56.1	-81.7	0	0	0	110.4	S30 V31 P39 V40 I42 H46 K50 I53 P67 V68	S30-F48 VanDerWaalsContact OG-CE1 3.32Å; S30-F48 WeakPolarHBondContact OG-CE1 3.46Å; V31-F48 HydrophobicContact CG2-CD1 3.78Å; V31-F48 HydrophobicContact CG2-CE1 4.1Å; P39-F48 WeakPolarHBondContact CA-O 3.48Å; V40-F48 WeakPolarHBondContact CG2-O 3.37Å; V40-F48 PolarHBondContact N-O 3.43Å; V40-F48 PolarHBondContact O-N 3.3Å; I42-F48 HydrophobicContact CD1-CD2 4.34Å; I42-F48 HydrophobicContact CD1-CE2 3.67Å; I42-F48 HydrophobicContact CG1-CE2 4.09Å; I42-F48 HydrophobicContact CG2-CD2 4.46Å; H46-F48 HydrophobicContact CB-CE2 3.56Å; H46-F48 HydrophobicContact CB-CZ 3.7Å; F48-K50 PolarHBondContact O-N 3.26Å; F48-I53 HydrophobicContact CB-CB 3.91Å; F48-I53 HydrophobicContact CB-CG2 4.37Å; F48-I53 HydrophobicContact CD2-CB 4.43Å; F48-I53 HydrophobicContact CD2-CD1 3.99Å; F48-I53 HydrophobicContact CD2-CG1 4.26Å; F48-I53 HydrophobicContact CE2-CD1 4.3Å; F48-I53 HydrophobicContact CG-CB 4.32Å; F48-I53 HydrophobicContact CG-CD1 4.31Å; F48-P67 HydrophobicContact CD1-CG 4.4Å; F48-P67 HydrophobicContact CE1-CB 3.96Å; F48-P67 HydrophobicContact CE1-CG 3.85Å; F48-P67 HydrophobicContact CZ-CB 4.21Å; F48-P67 HydrophobicContact CZ-CG 3.97Å; F48-V68 HydrophobicContact CE1-CG2 3.83Å; F48-V68 HydrophobicContact CZ-CG2 3.79Å
49	C	95.1	Very high	91.5	Very high	4 Å²	4	59.2 Å²	59.2	3%	0.027	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	136.1	164.6	-54.9	0	0	0	0	108.9	C29 K37 A51 C52 I53	C29-C49 WeakPolarHBondContact CB-SG 3.49Å; C29-C49 PolarHBondContact SG-N 3.38Å; C29-C49 VanDerWaalsContact SG-SG 3.68Å; K37-C49 PolarHBondContact N-SG 3.48Å; K37-C49 VanDerWaalsContact O-CA 3.23Å; K37-C49 WeakPolarHBondContact O-CA 3.26Å; K37-C49 VanDerWaalsContact O-CB 3.32Å; K37-C49 WeakPolarHBondContact O-CB 3.49Å; C49-A51 PolarHBondContact O-N 3.24Å; C49-C52 HydrophobicContact CB-CB 3.95Å; C49-C52 WeakPolarHBondContact O-CB 3.47Å; C49-C52 PolarHBondContact O-N 3.46Å; C49-I53 PolarHBondContact O-N 3.47Å; C49-I53 VanDerWaalsContact O-N 3.07Å
50	K	93.5	Very high	91.2	Very high	100 Å²	100	61.6 Å²	61.6	44%	0.435	32%	0.315	S	S	.	.	H	α-helix	trans	-50.1	-45.9	177.4	-176	-179.9	174.6	-170.4	0	112.3	K37 E38 V40 F48 I53 T54	K37-K50 PolarHBondContact O-N 3Å; E38-K50 HydrophobicContact CB-CB 4.04Å; E38-K50 WeakPolarHBondContact O-CB 3.49Å; E38-K50 PolarHBondContact O-N 2.89Å; E38-K50 VanDerWaalsContact O-N 3.11Å; V40-K50 HydrophobicContact CG1-CB 3.94Å; V40-K50 HydrophobicContact CG1-CG 4.17Å; V40-K50 HydrophobicContact CG2-CB 4.44Å; F48-K50 PolarHBondContact O-N 3.26Å; K50-I53 WeakPolarHBondContact O-CG2 3.49Å; K50-T54 WeakPolarHBondContact O-CB 3.43Å; K50-T54 PolarHBondContact O-N 3.07Å; K50-T54 PolarHBondContact O-OG1 3.46Å
51	A	94.1	Very high	90.5	Very high	74 Å²	74	70.2 Å²	70.2	61%	0.612	36%	0.355	S	S	*	.	H	α-helix	trans	-63.7	-42.7	177.8	0	0	0	0	0	112.7	C49 T54 R55	C49-A51 PolarHBondContact O-N 3.24Å; A51-T54 PolarHBondContact O-N 3.02Å; A51-R55 WeakPolarHBondContact O-CB 3.32Å; A51-R55 PolarHBondContact O-N 3.13Å
52	C	94.1	Very high	89.8	Confident	25 Å²	25	77.4 Å²	77.4	17%	0.169	38%	0.378	C	S	.	.	H	α-helix	trans	-63.1	-47.7	-178.7	-68.3	0	0	0	0	112.1	V31 C49 W56	V31-C52 HydrophobicContact CB-CB 3.99Å; V31-C52 HydrophobicContact CG1-CB 3.98Å; C49-C52 HydrophobicContact CB-CB 3.95Å; C49-C52 WeakPolarHBondContact O-CB 3.47Å; C49-C52 PolarHBondContact O-N 3.46Å; C52-W56 WeakPolarHBondContact O-CB 3.29Å; C52-W56 PolarHBondContact O-N 2.93Å
53	I	92.1	Very high	89.5	Confident	0 Å²	0	81.8 Å²	81.8	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-74.4	-32.7	-179.5	-165.4	63.9	0	0	0	112.1	V40 I42 F48 C49 K50 W56 W57 P67 L78	V40-I53 HydrophobicContact CG2-CG2 3.53Å; I42-I53 HydrophobicContact CG2-CG1 4.2Å; F48-I53 HydrophobicContact CB-CB 3.91Å; F48-I53 HydrophobicContact CB-CG2 4.37Å; F48-I53 HydrophobicContact CD2-CB 4.43Å; F48-I53 HydrophobicContact CD2-CD1 3.99Å; F48-I53 HydrophobicContact CD2-CG1 4.26Å; F48-I53 HydrophobicContact CE2-CD1 4.3Å; F48-I53 HydrophobicContact CG-CB 4.32Å; F48-I53 HydrophobicContact CG-CD1 4.31Å; C49-I53 PolarHBondContact O-N 3.47Å; C49-I53 VanDerWaalsContact O-N 3.07Å; K50-I53 WeakPolarHBondContact O-CG2 3.49Å; I53-W56 HydrophobicContact CD1-CB 4.44Å; I53-W56 PolarHBondContact O-N 3.39Å; I53-W57 HydrophobicContact CD1-CD2 4.3Å; I53-W57 HydrophobicContact CD1-CZ2 3.9Å; I53-W57 HydrophobicContact CG1-CD2 4.04Å; I53-W57 HydrophobicContact CG1-CE3 4.23Å; I53-W57 HydrophobicContact CG1-CH2 4.13Å; I53-W57 HydrophobicContact CG1-CZ2 3.9Å; I53-W57 HydrophobicContact CG1-CZ3 4.29Å; I53-W57 PolarHBondContact O-N 3.29Å; I53-W57 VanDerWaalsContact O-N 3.08Å; I53-P67 HydrophobicContact CD1-CG 3.73Å; I53-L78 HydrophobicContact CG1-CD2 4.17Å; I53-L78 HydrophobicContact CG2-CD1 3.9Å; I53-L78 HydrophobicContact CG2-CD2 3.67Å; I53-L78 HydrophobicContact CG2-CG 4.45Å
54	T	90.8	Very high	89.6	Confident	61 Å²	61	76.7 Å²	76.7	37%	0.374	38%	0.378	S	S	.	.	H	α-helix	trans	-64.4	-43.3	176.1	-58.1	0	0	0	0	110.9	K50 A51 W57 E58	K50-T54 WeakPolarHBondContact O-CB 3.43Å; K50-T54 PolarHBondContact O-N 3.07Å; K50-T54 PolarHBondContact O-OG1 3.46Å; A51-T54 PolarHBondContact O-N 3.02Å; T54-W57 CarbonylContact O-C 3.55Å; T54-W57 PolarHBondContact O-N 3.12Å; T54-E58 PolarHBondContact O-N 3.2Å; T54-E58 VanDerWaalsContact O-N 3.11Å
55	R	91.8	Very high	89.6	Confident	194 Å²	194	77 Å²	77	73%	0.732	38%	0.38	S	S	*	.	H	α-helix	trans	-65.7	-40.8	174.4	-173.6	176.7	179.5	179.5	-0.5	112.1	A51 W57 E58	A51-R55 WeakPolarHBondContact O-CB 3.32Å; A51-R55 PolarHBondContact O-N 3.13Å; R55-W57 PolarHBondContact O-N 2.67Å; R55-E58 VanDerWaalsContact O-CB 3.28Å; R55-E58 WeakPolarHBondContact O-CB 3.41Å; R55-E58 PolarHBondContact O-N 3.27Å; R55-E58 VanDerWaalsContact O-N 3.16Å
56	W	89.1	Confident	89.7	Confident	136 Å²	136	75.3 Å²	75.3	52%	0.515	36%	0.362	S	S	.	.	H	α-helix	trans	-60.8	-29.2	176.4	-175.1	-100.9	0	0	0	113	C52 I53 P65 P67	C52-W56 WeakPolarHBondContact O-CB 3.29Å; C52-W56 PolarHBondContact O-N 2.93Å; I53-W56 HydrophobicContact CD1-CB 4.44Å; I53-W56 PolarHBondContact O-N 3.39Å; W56-P65 PolarHBondContact NE1-O 2.92Å; W56-P67 HydrophobicContact CD2-CG 4.22Å; W56-P67 HydrophobicContact CG-CG 3.97Å
57	W	91.4	Very high	89.6	Confident	2 Å²	2	74 Å²	74	1%	0.008	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	5.5	178.4	-68	-15.3	0	0	0	114	I42 I53 T54 R55 D59 L60 F64 P65 R76 L78	I42-W57 HydrophobicContact CB-CH2 4.1Å; I42-W57 HydrophobicContact CD1-CZ2 4.11Å; I42-W57 HydrophobicContact CG2-CH2 3.6Å; I42-W57 HydrophobicContact CG2-CZ2 4.13Å; I42-W57 HydrophobicContact CG2-CZ3 4.44Å; I53-W57 HydrophobicContact CD1-CD2 4.3Å; I53-W57 HydrophobicContact CD1-CZ2 3.9Å; I53-W57 HydrophobicContact CG1-CD2 4.04Å; I53-W57 HydrophobicContact CG1-CE3 4.23Å; I53-W57 HydrophobicContact CG1-CH2 4.13Å; I53-W57 HydrophobicContact CG1-CZ2 3.9Å; I53-W57 HydrophobicContact CG1-CZ3 4.29Å; I53-W57 PolarHBondContact O-N 3.29Å; I53-W57 VanDerWaalsContact O-N 3.08Å; T54-W57 CarbonylContact O-C 3.55Å; T54-W57 PolarHBondContact O-N 3.12Å; R55-W57 PolarHBondContact O-N 2.67Å; W57-D59 PolarHBondContact O-N 3.29Å; W57-L60 PolarHBondContact O-N 3Å; W57-F64 HydrophobicContact CB-CD1 3.8Å; W57-F64 HydrophobicContact CB-CE1 4.27Å; W57-F64 HydrophobicContact CD2-CB 3.87Å; W57-F64 AromaticContact CD2-CD1 3.88Å; W57-F64 HydrophobicContact CD2-CD1 3.88Å; W57-F64 HydrophobicContact CD2-CG 4.19Å; W57-F64 HydrophobicContact CE3-CB 4.31Å; W57-F64 HydrophobicContact CE3-CD1 4.21Å; W57-F64 HydrophobicContact CE3-CG 4.4Å; W57-F64 HydrophobicContact CG-CB 4.25Å; W57-F64 AromaticContact CG-CD1 3.69Å; W57-F64 HydrophobicContact CG-CD1 3.69Å; W57-F64 HydrophobicContact CG-CG 4.4Å; W57-F64 HydrophobicContact CH2-CB 4.3Å; W57-F64 HydrophobicContact CZ2-CB 3.88Å; W57-F64 HydrophobicContact CZ3-CB 4.49Å; W57-P65 PolarHBondContact NE1-O 3.48Å; W57-R76 HydrophobicContact CE3-CG 4.38Å; W57-R76 PolarHBondContact O-NH1 3.37Å; W57-R76 VanDerWaalsContact O-NH1 3.12Å; W57-R76 PolarHBondContact O-NH2 2.97Å; W57-L78 HydrophobicContact CE3-CD2 4.09Å; W57-L78 HydrophobicContact CH2-CD2 3.77Å; W57-L78 HydrophobicContact CZ3-CD2 3.29Å; W57-L78 HydrophobicContact CZ3-CG 3.92Å
58	E	87.1	Confident	89.5	Confident	123 Å²	123	75.2 Å²	75.2	58%	0.575	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-52.7	-169.1	-168.8	160.9	-154.8	0	0	111.8	T54 R55 L60 R76	T54-E58 PolarHBondContact O-N 3.2Å; T54-E58 VanDerWaalsContact O-N 3.11Å; R55-E58 VanDerWaalsContact O-CB 3.28Å; R55-E58 WeakPolarHBondContact O-CB 3.41Å; R55-E58 PolarHBondContact O-N 3.27Å; R55-E58 VanDerWaalsContact O-N 3.16Å; E58-L60 VanDerWaalsContact C-N 3.35Å; E58-L60 PolarHBondContact O-N 2.84Å; E58-R76 PolarHBondContact O-NH2 3.15Å; E58-R76 VanDerWaalsContact O-NH2 3.1Å
59	D	85.8	Confident	89.4	Confident	155 Å²	155	78.1 Å²	78.1	83%	0.829	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	10.4	-174.8	-56.7	-43.1	0	0	0	115.1	W57	W57-D59 PolarHBondContact O-N 3.29Å
60	L	86.9	Confident	89.2	Confident	60 Å²	60	87.6 Å²	87.6	31%	0.314	42%	0.423	S	S	.	.			trans	-105	130.1	-174.5	-59.3	177	0	0	0	112.1	W57 E58 D63 F64 P65 R76	W57-L60 PolarHBondContact O-N 3Å; E58-L60 VanDerWaalsContact C-N 3.35Å; E58-L60 PolarHBondContact O-N 2.84Å; L60-D63 WeakPolarHBondContact CD1-O 3.35Å; L60-F64 HydrophobicContact CB-CD1 4Å; L60-F64 HydrophobicContact CB-CE1 3.79Å; L60-F64 WeakPolarHBondContact O-CE1 3.47Å; L60-F64 WeakPolarHBondContact O-CZ 3.31Å; L60-P65 HydrophobicContact CD1-CG 4.32Å; L60-R76 PolarHBondContact O-NH2 2.96Å
61	E	77.5	Confident	89	Confident	184 Å²	184	89.5 Å²	89.5	86%	0.86	43%	0.431	S	S	*	.	S	Bend	trans	-98.6	-34.4	-176.5	-67.6	-173.6	171.8	0	0	114.5
62	R	78.8	Confident	88.7	Confident	205 Å²	205	89.3 Å²	89.3	77%	0.774	42%	0.422	S	S	*	.	S	Bend	trans	-128.1	-32.6	-172.4	-60.8	-175.2	93	-171.1	8.1	115.3
63	D	85.4	Confident	88.2	Confident	100 Å²	100	88.4 Å²	88.4	54%	0.535	42%	0.416	S	S	.	.			trans	-117.9	117.6	-174	-77.1	-33.1	0	0	0	110.5	L60 P65 T72	L60-D63 WeakPolarHBondContact CD1-O 3.35Å; D63-P65 VanDerWaalsContact O-CD 3.28Å; D63-P65 WeakPolarHBondContact O-CD 3.48Å; D63-T72 HydrophobicContact CB-CG2 3.47Å; D63-T72 VanDerWaalsContact CB-CG2 3.47Å
64	F	88.8	Confident	87.7	Confident	7 Å²	7	98 Å²	98	3%	0.031	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	89.2	-175.1	-59.4	-70	0	0	0	110.8	W57 L60 S73 R76	W57-F64 HydrophobicContact CB-CD1 3.8Å; W57-F64 HydrophobicContact CB-CE1 4.27Å; W57-F64 HydrophobicContact CD2-CB 3.87Å; W57-F64 AromaticContact CD2-CD1 3.88Å; W57-F64 HydrophobicContact CD2-CD1 3.88Å; W57-F64 HydrophobicContact CD2-CG 4.19Å; W57-F64 HydrophobicContact CE3-CB 4.31Å; W57-F64 HydrophobicContact CE3-CD1 4.21Å; W57-F64 HydrophobicContact CE3-CG 4.4Å; W57-F64 HydrophobicContact CG-CB 4.25Å; W57-F64 AromaticContact CG-CD1 3.69Å; W57-F64 HydrophobicContact CG-CD1 3.69Å; W57-F64 HydrophobicContact CG-CG 4.4Å; W57-F64 HydrophobicContact CH2-CB 4.3Å; W57-F64 HydrophobicContact CZ2-CB 3.88Å; W57-F64 HydrophobicContact CZ3-CB 4.49Å; L60-F64 HydrophobicContact CB-CD1 4Å; L60-F64 HydrophobicContact CB-CE1 3.79Å; L60-F64 WeakPolarHBondContact O-CE1 3.47Å; L60-F64 WeakPolarHBondContact O-CZ 3.31Å; F64-S73 WeakPolarHBondContact CD2-O 3.37Å; F64-S73 PolarHBondContact N-O 2.96Å; F64-S73 PolarHBondContact O-N 3.04Å; F64-R76 HydrophobicContact CD1-CG 3.88Å; F64-R76 HydrophobicContact CD2-CG 4.02Å; F64-R76 HydrophobicContact CE1-CG 3.45Å; F64-R76 VanDerWaalsContact CE1-CG 3.45Å; F64-R76 HydrophobicContact CE2-CG 3.61Å; F64-R76 HydrophobicContact CG-CG 4.16Å; F64-R76 HydrophobicContact CZ-CG 3.32Å; F64-R76 VanDerWaalsContact CZ-NE 3.33Å
65	P	90.5	Very high	87.2	Confident	40 Å²	40	103.1 Å²	103.1	26%	0.26	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	140.7	-178.3	30.5	-33.4	0	0	0	111.7	W56 W57 L60 D63	W56-P65 PolarHBondContact NE1-O 2.92Å; W57-P65 PolarHBondContact NE1-O 3.48Å; L60-P65 HydrophobicContact CD1-CG 4.32Å; D63-P65 VanDerWaalsContact O-CD 3.28Å; D63-P65 WeakPolarHBondContact O-CD 3.48Å
66	C	91.8	Very high	86.7	Confident	2 Å²	2	99.5 Å²	99.5	1%	0.014	45%	0.453	C	S	.	.			trans	-67.4	131.8	170.1	174.5	0	0	0	0	111.4	I42 C44 V68 R70 K71	I42-C66 HydrophobicContact CD1-CB 3.69Å; C44-C66 PolarHBondContact SG-SG 3.02Å; C66-V68 PolarHBondContact O-N 3.48Å; C66-V68 VanDerWaalsContact O-N 3.15Å; C66-V68 PolarHBondContact SG-N 2.92Å; C66-V68 VanDerWaalsContact SG-N 3.36Å; C66-R70 WeakPolarHBondContact O-CA 3.46Å; C66-R70 PolarHBondContact O-N 3.21Å; C66-K71 PolarHBondContact N-O 2.92Å
67	P	90.6	Very high	86.5	Confident	37 Å²	37	95 Å²	95	24%	0.24	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.8	175.4	-25.9	32	0	0	0	115.2	V31 F48 I53 W56	V31-P67 HydrophobicContact CG2-CB 4.02Å; V31-P67 HydrophobicContact CG2-CG 4.02Å; F48-P67 HydrophobicContact CD1-CG 4.4Å; F48-P67 HydrophobicContact CE1-CB 3.96Å; F48-P67 HydrophobicContact CE1-CG 3.85Å; F48-P67 HydrophobicContact CZ-CB 4.21Å; F48-P67 HydrophobicContact CZ-CG 3.97Å; I53-P67 HydrophobicContact CD1-CG 3.73Å; W56-P67 HydrophobicContact CD2-CG 4.22Å; W56-P67 HydrophobicContact CG-CG 3.97Å
68	V	91.3	Very high	86.4	Confident	71 Å²	71	97.2 Å²	97.2	43%	0.43	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-61.5	-174.9	179.9	0	0	0	0	111.3	S30 F48 C66	S30-V68 VanDerWaalsContact OG-CG2 3.23Å; S30-V68 WeakPolarHBondContact OG-CG2 3.43Å; F48-V68 HydrophobicContact CE1-CG2 3.83Å; F48-V68 HydrophobicContact CZ-CG2 3.79Å; C66-V68 PolarHBondContact O-N 3.48Å; C66-V68 VanDerWaalsContact O-N 3.15Å; C66-V68 PolarHBondContact SG-N 2.92Å; C66-V68 VanDerWaalsContact SG-N 3.36Å
69	C	91.4	Very high	86.6	Confident	60 Å²	60	99.6 Å²	99.6	41%	0.405	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-3	-173	67	0	0	0	0	114.5	K71	C69-K71 PolarHBondContact O-N 3.23Å
70	R	90.2	Very high	86.9	Confident	203 Å²	203	96.9 Å²	96.9	77%	0.766	45%	0.448	S	S	*	.			trans	59.1	4.9	-178.8	-54.1	-176.6	-177.7	179.4	0.4	116.3	C66 T72	C66-R70 WeakPolarHBondContact O-CA 3.46Å; C66-R70 PolarHBondContact O-N 3.21Å; R70-T72 PolarHBondContact O-N 2.98Å
71	K	89.9	Confident	87.1	Confident	141 Å²	141	95.7 Å²	95.7	61%	0.613	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-60.1	128.3	171.4	-168.4	174.2	-176.3	179.8	0	109.6	C44 C66 C69	C44-K71 HydrophobicContact CB-CB 4.23Å; C44-K71 HydrophobicContact CB-CD 4.1Å; C66-K71 PolarHBondContact N-O 2.92Å; C69-K71 PolarHBondContact O-N 3.23Å
72	T	87.8	Confident	87.6	Confident	70 Å²	70	97.2 Å²	97.2	43%	0.429	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	129	-174.4	-50.4	0	0	0	0	111.5	D63 R70	D63-T72 HydrophobicContact CB-CG2 3.47Å; D63-T72 VanDerWaalsContact CB-CG2 3.47Å; R70-T72 PolarHBondContact O-N 2.98Å
73	S	83.9	Confident	88.1	Confident	6 Å²	6	95 Å²	95	4%	0.042	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	144	170.6	-70.3	0	0	0	0	110.6	E43 F64	E43-S73 WeakPolarHBondContact CB-OG 3.46Å; E43-S73 WeakPolarHBondContact CG-OG 3.49Å; E43-S73 WeakPolarHBondContact OE2-CB 3.35Å; E43-S73 PolarHBondContact OE2-OG 2.79Å; F64-S73 WeakPolarHBondContact CD2-O 3.37Å; F64-S73 PolarHBondContact N-O 2.96Å; F64-S73 PolarHBondContact O-N 3.04Å
74	R	79.9	Confident	88.3	Confident	200 Å²	200	91.2 Å²	91.2	76%	0.755	42%	0.418	S	S	*	.	S	Bend	trans	-82.9	-14.3	178.9	-69.4	-173	176.8	177.4	0.2	113.8
75	Y	80.4	Confident	88.3	Confident	170 Å²	170	91.7 Å²	91.7	67%	0.667	43%	0.425	S	S	*	.	S	Bend	trans	-132.5	149.5	-177.5	-54.6	-76.7	0	0	0	110.1	S77	Y75-S77 PolarHBondContact O-N 3.37Å
76	R	83.2	Confident	88.2	Confident	118 Å²	118	93.3 Å²	93.3	45%	0.445	44%	0.438	S	S	.	.			trans	-74.3	59.5	172.2	-62.8	-171.7	-176.6	-141	6.3	111.4	W57 E58 L60 F64 L78	W57-R76 HydrophobicContact CE3-CG 4.38Å; W57-R76 PolarHBondContact O-NH1 3.37Å; W57-R76 VanDerWaalsContact O-NH1 3.12Å; W57-R76 PolarHBondContact O-NH2 2.97Å; E58-R76 PolarHBondContact O-NH2 3.15Å; E58-R76 VanDerWaalsContact O-NH2 3.1Å; L60-R76 PolarHBondContact O-NH2 2.96Å; F64-R76 HydrophobicContact CD1-CG 3.88Å; F64-R76 HydrophobicContact CD2-CG 4.02Å; F64-R76 HydrophobicContact CE1-CG 3.45Å; F64-R76 VanDerWaalsContact CE1-CG 3.45Å; F64-R76 HydrophobicContact CE2-CG 3.61Å; F64-R76 HydrophobicContact CG-CG 4.16Å; F64-R76 HydrophobicContact CZ-CG 3.32Å; F64-R76 VanDerWaalsContact CZ-NE 3.33Å; R76-L78 PolarHBondContact O-N 2.99Å; R76-L78 VanDerWaalsContact O-N 3.15Å
77	S	83.7	Confident	88	Confident	40 Å²	40	98.1 Å²	98.1	28%	0.28	46%	0.461	S	S	.	.			trans	-82.7	89.8	178.5	-159.7	0	0	0	0	110.5	Y75	Y75-S77 PolarHBondContact O-N 3.37Å
78	L	90.1	Very high	88	Confident	49 Å²	49	96.4 Å²	96.4	26%	0.257	45%	0.45	S	S	.	.			trans	-98.1	113.4	171.1	-61.2	-177	0	0	0	109.2	V40 I42 I53 W57 R76	V40-L78 HydrophobicContact CB-CB 4.31Å; V40-L78 HydrophobicContact CG1-CB 4.41Å; V40-L78 HydrophobicContact CG2-CB 4.47Å; V40-L78 HydrophobicContact CG2-CD2 4.07Å; I42-L78 HydrophobicContact CG2-CD2 3.59Å; I53-L78 HydrophobicContact CG1-CD2 4.17Å; I53-L78 HydrophobicContact CG2-CD1 3.9Å; I53-L78 HydrophobicContact CG2-CD2 3.67Å; I53-L78 HydrophobicContact CG2-CG 4.45Å; W57-L78 HydrophobicContact CE3-CD2 4.09Å; W57-L78 HydrophobicContact CH2-CD2 3.77Å; W57-L78 HydrophobicContact CZ3-CD2 3.29Å; W57-L78 HydrophobicContact CZ3-CG 3.92Å; R76-L78 PolarHBondContact O-N 2.99Å; R76-L78 VanDerWaalsContact O-N 3.15Å
79	R	91.2	Very high	87.9	Confident	173 Å²	173	97.3 Å²	97.3	65%	0.653	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	122.7	176.5	-63.4	-175.4	-174	-164.8	1.4	109.8	V40 I41 N81	V40-R79 CarbonylContact C-O 3.58Å; V40-R79 VanDerWaalsContact CA-O 3.24Å; V40-R79 WeakPolarHBondContact CA-O 3.35Å; I41-R79 HydrophobicContact CG2-CB 3.8Å; I41-R79 PolarHBondContact N-O 2.98Å; I41-R79 PolarHBondContact O-N 3.47Å; I41-R79 VanDerWaalsContact O-N 3.12Å; R79-N81 PolarHBondContact O-N 3.48Å
80	P	91.5	Very high	87.6	Confident	99 Å²	99	98.8 Å²	98.8	64%	0.643	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60	126.8	174.7	-23.5	33.8	0	0	0	111.7	R82	P80-R82 PolarHBondContact O-N 3.4Å
81	N	91.1	Very high	87.3	Confident	35 Å²	35	89.2 Å²	89.2	19%	0.187	42%	0.417	C	S	.	.			trans	-99.4	78.8	175.5	-169.5	-18.1	0	0	0	109.5	P39 N47 R79 Q83 L84 G85	P39-N81 PolarHBondContact O-N 3.35Å; N47-N81 PolarHBondContact OD1-ND2 2.87Å; R79-N81 PolarHBondContact O-N 3.48Å; N81-Q83 VanDerWaalsContact C-N 3.27Å; N81-Q83 PolarHBondContact O-N 3.49Å; N81-L84 HydrophobicContact CB-CB 4.05Å; N81-L84 WeakPolarHBondContact ND2-CB 3.37Å; N81-L84 PolarHBondContact O-N 2.91Å; N81-L84 WeakPolarHBondContact OD1-CB 3.24Å; N81-L84 PolarHBondContact OD1-N 3.11Å; N81-G85 PolarHBondContact O-N 2.97Å
82	R	88.4	Confident	87.1	Confident	216 Å²	216	85.5 Å²	85.5	82%	0.815	40%	0.4	S	S	*	.	H	α-helix	trans	-60.3	-36.6	-177	-70.3	-174.6	174.6	172.7	-1.4	112.8	P80 G85 S86	P80-R82 PolarHBondContact O-N 3.4Å; R82-G85 PolarHBondContact O-N 3.37Å; R82-S86 PolarHBondContact O-N 2.92Å; R82-S86 PolarHBondContact O-OG 3.46Å
83	Q	88.1	Confident	86.8	Confident	157 Å²	157	88.2 Å²	88.2	73%	0.734	41%	0.408	S	S	*	.	H	α-helix	trans	-64.7	-45	178.3	-71.4	171.4	-35.3	0	0	111.5	N81 G85 S86 M87	N81-Q83 VanDerWaalsContact C-N 3.27Å; N81-Q83 PolarHBondContact O-N 3.49Å; Q83-G85 VanDerWaalsContact C-N 3.29Å; Q83-G85 PolarHBondContact O-N 2.97Å; Q83-S86 WeakPolarHBondContact O-CB 3.41Å; Q83-S86 PolarHBondContact O-N 3.29Å; Q83-M87 WeakPolarHBondContact O-CG 3.25Å; Q83-M87 PolarHBondContact O-N 3.29Å
84	L	90.3	Very high	86.7	Confident	21 Å²	21	91.8 Å²	91.8	11%	0.11	43%	0.426	C	S	.	.	H	α-helix	trans	-63.5	-37.2	173.1	-176.5	58.7	0	0	0	111.7	L36 P39 N47 N81 S86 M87 V88	L36-L84 HydrophobicContact CD1-CD2 3.73Å; L36-L84 HydrophobicContact CD1-CG 4.11Å; P39-L84 HydrophobicContact CB-CB 4.44Å; P39-L84 HydrophobicContact CB-CD2 4.07Å; P39-L84 HydrophobicContact CB-CG 4.22Å; P39-L84 HydrophobicContact CG-CB 4.32Å; P39-L84 HydrophobicContact CG-CG 4.37Å; N47-L84 HydrophobicContact CB-CD2 3.42Å; N47-L84 VanDerWaalsContact CB-CD2 3.42Å; N47-L84 WeakPolarHBondContact OD1-CD2 3.41Å; N81-L84 HydrophobicContact CB-CB 4.05Å; N81-L84 WeakPolarHBondContact ND2-CB 3.37Å; N81-L84 PolarHBondContact O-N 2.91Å; N81-L84 WeakPolarHBondContact OD1-CB 3.24Å; N81-L84 PolarHBondContact OD1-N 3.11Å; L84-S86 VanDerWaalsContact C-N 3.34Å; L84-S86 PolarHBondContact O-N 3.38Å; L84-M87 HydrophobicContact CB-CE 4.24Å; L84-M87 HydrophobicContact CD1-CE 3.76Å; L84-M87 PolarHBondContact O-N 3.36Å; L84-V88 HydrophobicContact CD1-CG2 4.32Å; L84-V88 HydrophobicContact CG-CG2 4.35Å; L84-V88 WeakPolarHBondContact O-CB 3.37Å; L84-V88 WeakPolarHBondContact O-CG2 3.48Å; L84-V88 PolarHBondContact O-N 2.95Å
85	G	88.4	Confident	86.6	Confident	18 Å²	18	83.3 Å²	83.3	19%	0.186	40%	0.395	C	S	.	.	H	α-helix	trans	-56.4	-46.5	171.3	0	0	0	0	0	112.3	P39 N81 R82 Q83 V88 E89	P39-G85 VanDerWaalsContact CG-CA 3.46Å; P39-G85 VanDerWaalsContact CG-N 3.32Å; N81-G85 PolarHBondContact O-N 2.97Å; R82-G85 PolarHBondContact O-N 3.37Å; Q83-G85 VanDerWaalsContact C-N 3.29Å; Q83-G85 PolarHBondContact O-N 2.97Å; G85-V88 PolarHBondContact O-N 3.43Å; G85-E89 PolarHBondContact O-N 3.2Å; G85-E89 VanDerWaalsContact O-N 3.17Å
86	S	88.2	Confident	86.3	Confident	74 Å²	74	78 Å²	78	52%	0.517	39%	0.386	S	S	.	.	H	α-helix	trans	-63	-41.1	174.6	-59.6	0	0	0	0	112.7	R82 Q83 L84 E89 I90	R82-S86 PolarHBondContact O-N 2.92Å; R82-S86 PolarHBondContact O-OG 3.46Å; Q83-S86 WeakPolarHBondContact O-CB 3.41Å; Q83-S86 PolarHBondContact O-N 3.29Å; L84-S86 VanDerWaalsContact C-N 3.34Å; L84-S86 PolarHBondContact O-N 3.38Å; S86-E89 PolarHBondContact O-N 3.44Å; S86-I90 WeakPolarHBondContact O-CG1 3.27Å; S86-I90 PolarHBondContact O-N 2.93Å
87	M	88.9	Confident	85.9	Confident	102 Å²	102	76.3 Å²	76.3	50%	0.502	39%	0.389	S	S	.	.	H	α-helix	trans	-65.5	-37.4	177.5	-68.4	-170.7	-64.4	0	0	112.6	Q83 L84 E89 I90 A91	Q83-M87 WeakPolarHBondContact O-CG 3.25Å; Q83-M87 PolarHBondContact O-N 3.29Å; L84-M87 HydrophobicContact CB-CE 4.24Å; L84-M87 HydrophobicContact CD1-CE 3.76Å; L84-M87 PolarHBondContact O-N 3.36Å; M87-E89 VanDerWaalsContact C-N 3.34Å; M87-I90 PolarHBondContact O-N 2.91Å; M87-A91 WeakPolarHBondContact O-CB 3.43Å; M87-A91 PolarHBondContact O-N 3.44Å
88	V	89.5	Confident	85.3	Confident	1 Å²	1	78.7 Å²	78.7	1%	0.006	39%	0.394	C	S	.	.	H	α-helix	trans	-63.4	-40.4	175.3	170.4	0	0	0	0	111	A27 Y35 L36 L84 G85 A91 K92	A27-V88 HydrophobicContact CB-CB 4.49Å; A27-V88 HydrophobicContact CB-CG2 3.9Å; Y35-V88 HydrophobicContact CD1-CG1 3.9Å; Y35-V88 HydrophobicContact CG-CG1 4.29Å; L36-V88 HydrophobicContact CB-CG2 4Å; L36-V88 HydrophobicContact CD1-CG2 4.25Å; L84-V88 HydrophobicContact CD1-CG2 4.32Å; L84-V88 HydrophobicContact CG-CG2 4.35Å; L84-V88 WeakPolarHBondContact O-CB 3.37Å; L84-V88 WeakPolarHBondContact O-CG2 3.48Å; L84-V88 PolarHBondContact O-N 2.95Å; G85-V88 PolarHBondContact O-N 3.43Å; V88-A91 PolarHBondContact O-N 3.05Å; V88-K92 WeakPolarHBondContact O-CG 3.26Å; V88-K92 PolarHBondContact O-N 3.45Å
89	E	88.8	Confident	84.2	Confident	90 Å²	90	84.1 Å²	84.1	42%	0.421	41%	0.411	S	S	.	.	H	α-helix	trans	-67	-40	175.2	-67.3	-53.1	130.4	0	0	112.4	G85 S86 M87 A91 K92 Q93	G85-E89 PolarHBondContact O-N 3.2Å; G85-E89 VanDerWaalsContact O-N 3.17Å; S86-E89 PolarHBondContact O-N 3.44Å; M87-E89 VanDerWaalsContact C-N 3.34Å; E89-A91 VanDerWaalsContact C-N 3.34Å; E89-A91 PolarHBondContact O-N 2.91Å; E89-K92 PolarHBondContact O-N 2.99Å; E89-K92 IonicContact OE1-NZ 3.32Å; E89-K92 PolarHBondContact OE1-NZ 3.37Å; E89-K92 IonicContact OE2-NZ 2.83Å; E89-Q93 WeakPolarHBondContact O-CG 3.49Å; E89-Q93 PolarHBondContact O-N 3.49Å
90	I	85	Confident	82.9	Confident	92 Å²	92	82.1 Å²	82.1	47%	0.472	41%	0.408	S	S	.	.	H	α-helix	trans	-61.8	-43.4	173.1	-66.4	165.3	0	0	0	110.6	S86 M87 K92 Q93 L94	S86-I90 WeakPolarHBondContact O-CG1 3.27Å; S86-I90 PolarHBondContact O-N 2.93Å; M87-I90 PolarHBondContact O-N 2.91Å; I90-K92 PolarHBondContact O-N 3.06Å; I90-Q93 PolarHBondContact O-N 3.04Å; I90-L94 HydrophobicContact CG2-CD1 3.91Å; I90-L94 HydrophobicContact CG2-CG 4.37Å; I90-L94 WeakPolarHBondContact O-CG 3.34Å; I90-L94 PolarHBondContact O-N 3.37Å
91	A	85.8	Confident	81.5	Confident	2 Å²	2	82.6 Å²	82.6	2%	0.017	40%	0.404	C	S	.	.	H	α-helix	trans	-60.7	-42.9	176.8	0	0	0	0	0	111.9	L23 A27 Y35 M87 V88 E89 L94 Q95	L23-A91 HydrophobicContact CD2-CB 4.06Å; L23-A91 HydrophobicContact CG-CB 4.07Å; A27-A91 HydrophobicContact CB-CB 4.18Å; Y35-A91 HydrophobicContact CE1-CB 4.19Å; M87-A91 WeakPolarHBondContact O-CB 3.43Å; M87-A91 PolarHBondContact O-N 3.44Å; V88-A91 PolarHBondContact O-N 3.05Å; E89-A91 VanDerWaalsContact C-N 3.34Å; E89-A91 PolarHBondContact O-N 2.91Å; A91-L94 PolarHBondContact O-N 3.4Å; A91-Q95 WeakPolarHBondContact O-CG 3.33Å; A91-Q95 PolarHBondContact O-N 2.96Å
92	K	83.8	Confident	80.1	Confident	62 Å²	62	89.4 Å²	89.4	27%	0.27	43%	0.427	S	S	.	.	H	α-helix	trans	-60.5	-44	173.8	-72.8	173.3	-173.3	167.9	0	112.4	Y35 V88 E89 I90 Q95 A96	Y35-K92 VanDerWaalsContact CB-CE 3.4Å; Y35-K92 HydrophobicContact CD1-CG 4.17Å; Y35-K92 HydrophobicContact CD2-CD 4.48Å; Y35-K92 HydrophobicContact CD2-CG 3.83Å; Y35-K92 HydrophobicContact CE1-CG 4.25Å; Y35-K92 HydrophobicContact CE2-CG 3.93Å; Y35-K92 HydrophobicContact CG-CD 4.45Å; Y35-K92 HydrophobicContact CG-CG 3.95Å; V88-K92 WeakPolarHBondContact O-CG 3.26Å; V88-K92 PolarHBondContact O-N 3.45Å; E89-K92 PolarHBondContact O-N 2.99Å; E89-K92 IonicContact OE1-NZ 3.32Å; E89-K92 PolarHBondContact OE1-NZ 3.37Å; E89-K92 IonicContact OE2-NZ 2.83Å; I90-K92 PolarHBondContact O-N 3.06Å; K92-Q95 PolarHBondContact O-N 3.42Å; K92-A96 PolarHBondContact O-N 3.45Å
93	Q	82.7	Confident	78.8	Confident	127 Å²	127	84.6 Å²	84.6	59%	0.593	42%	0.417	S	S	*	.	H	α-helix	trans	-63.6	-45	178.5	-73.1	176.9	1.2	0	0	111.8	E89 I90 Q95 A96 V97	E89-Q93 WeakPolarHBondContact O-CG 3.49Å; E89-Q93 PolarHBondContact O-N 3.49Å; I90-Q93 PolarHBondContact O-N 3.04Å; Q93-Q95 VanDerWaalsContact C-N 3.3Å; Q93-Q95 PolarHBondContact O-N 3.25Å; Q93-A96 WeakPolarHBondContact O-CB 3.36Å; Q93-A96 PolarHBondContact O-N 3.28Å; Q93-A96 VanDerWaalsContact O-N 3.15Å; Q93-V97 WeakPolarHBondContact O-CG2 3.46Å; Q93-V97 PolarHBondContact O-N 2.72Å
94	L	81.4	Confident	77.7	Confident	81 Å²	81	83.3 Å²	83.3	42%	0.424	41%	0.411	S	S	.	.	H	α-helix	trans	-62.6	-37.9	177.2	-70.2	170.6	0	0	0	112	L20 L23 I90 A91 V97 K98	L20-L94 HydrophobicContact CD1-CB 3.95Å; L20-L94 HydrophobicContact CD1-CD1 4.38Å; L23-L94 HydrophobicContact CD2-CD1 4.48Å; I90-L94 HydrophobicContact CG2-CD1 3.91Å; I90-L94 HydrophobicContact CG2-CG 4.37Å; I90-L94 WeakPolarHBondContact O-CG 3.34Å; I90-L94 PolarHBondContact O-N 3.37Å; A91-L94 PolarHBondContact O-N 3.4Å; L94-V97 PolarHBondContact O-N 3.13Å; L94-K98 PolarHBondContact O-N 2.9Å
95	Q	77.5	Confident	77	Confident	22 Å²	22	85 Å²	85	10%	0.103	43%	0.425	C	S	.	.	H	α-helix	trans	-68.2	-36.7	172.9	-72.5	-148.3	-18.2	0	0	113.5	Y35 A91 K92 Q93 V97 K98 R99	Y35-Q95 WeakPolarHBondContact OH-CG 3.46Å; Y35-Q95 PolarHBondContact OH-NE2 2.94Å; Y35-Q95 PolarHBondContact OH-OE1 2.92Å; A91-Q95 WeakPolarHBondContact O-CG 3.33Å; A91-Q95 PolarHBondContact O-N 2.96Å; K92-Q95 PolarHBondContact O-N 3.42Å; Q93-Q95 VanDerWaalsContact C-N 3.3Å; Q93-Q95 PolarHBondContact O-N 3.25Å; Q95-V97 VanDerWaalsContact C-N 3.35Å; Q95-K98 PolarHBondContact O-N 3.18Å; Q95-R99 WeakPolarHBondContact O-CG 3.5Å; Q95-R99 PolarHBondContact O-N 3.27Å
96	A	75.7	Confident	76.8	Confident	58 Å²	58	86.3 Å²	86.3	48%	0.479	43%	0.427	S	S	.	.	H	α-helix	trans	-63.7	-41.8	174.7	0	0	0	0	0	111.3	K92 Q93 R99 K100	K92-A96 PolarHBondContact O-N 3.45Å; Q93-A96 WeakPolarHBondContact O-CB 3.36Å; Q93-A96 PolarHBondContact O-N 3.28Å; Q93-A96 VanDerWaalsContact O-N 3.15Å; A96-R99 PolarHBondContact O-N 2.91Å; A96-K100 WeakPolarHBondContact O-CB 3.26Å; A96-K100 PolarHBondContact O-N 2.98Å
97	V	73.6	Confident	76.5	Confident	83 Å²	83	83.1 Å²	83.1	50%	0.503	41%	0.405	S	S	.	.	H	α-helix	trans	-62.6	-45.2	174	173.8	0	0	0	0	111	Q93 L94 Q95 R99 K100 I101	Q93-V97 WeakPolarHBondContact O-CG2 3.46Å; Q93-V97 PolarHBondContact O-N 2.72Å; L94-V97 PolarHBondContact O-N 3.13Å; Q95-V97 VanDerWaalsContact C-N 3.35Å; V97-R99 PolarHBondContact O-N 2.5Å; V97-K100 PolarHBondContact O-N 3.34Å; V97-I101 HydrophobicContact CG1-CD1 3.77Å; V97-I101 HydrophobicContact CG1-CG1 4.46Å; V97-I101 VanDerWaalsContact O-CG1 3.32Å; V97-I101 WeakPolarHBondContact O-CG1 3.36Å; V97-I101 PolarHBondContact O-N 3.24Å
98	K	72.3	Confident	76.2	Confident	90 Å²	90	83.3 Å²	83.3	39%	0.391	41%	0.414	S	S	.	.	H	α-helix	trans	-60.9	-41.6	175.9	-178.2	174.9	175.4	-176.5	0	112.4	L20 L94 Q95 R102	L20-K98 HydrophobicContact CD2-CB 4.38Å; L20-K98 HydrophobicContact CD2-CD 3.54Å; L94-K98 PolarHBondContact O-N 2.9Å; Q95-K98 PolarHBondContact O-N 3.18Å; K98-R102 WeakPolarHBondContact O-CB 3.37Å; K98-R102 PolarHBondContact O-N 2.92Å; K98-R102 VanDerWaalsContact O-N 3.08Å
99	R	65.2	Low	75.9	Confident	163 Å²	163	90.5 Å²	90.5	62%	0.615	45%	0.447	S	S	*	.	H	α-helix	trans	-65	-42.4	176.3	-76.2	179.6	-179.2	157.8	2.2	111.7	Q95 A96 V97 R102 D103	Q95-R99 WeakPolarHBondContact O-CG 3.5Å; Q95-R99 PolarHBondContact O-N 3.27Å; A96-R99 PolarHBondContact O-N 2.91Å; V97-R99 PolarHBondContact O-N 2.5Å; R99-R102 PolarHBondContact O-N 3.38Å; R99-D103 PolarHBondContact O-N 2.62Å
100	K	65.1	Low	75.6	Confident	132 Å²	132	89.4 Å²	89.4	57%	0.574	44%	0.442	S	S	*	.	H	α-helix	trans	-63.1	-45	178.3	-169.6	176.6	177.6	-176.1	0	112.5	A96 V97 R102 D103 E104	A96-K100 WeakPolarHBondContact O-CB 3.26Å; A96-K100 PolarHBondContact O-N 2.98Å; V97-K100 PolarHBondContact O-N 3.34Å; K100-R102 VanDerWaalsContact C-N 3.28Å; K100-R102 PolarHBondContact O-N 2.97Å; K100-D103 PolarHBondContact O-N 2.64Å; K100-E104 WeakPolarHBondContact CE-OE1 3.4Å; K100-E104 WeakPolarHBondContact O-CG 3.4Å; K100-E104 PolarHBondContact O-N 2.71Å
101	I	62.3	Low	75.3	Confident	109 Å²	109	91.8 Å²	91.8	56%	0.559	45%	0.451	S	S	*	.	H	α-helix	trans	-62.7	-38	175.8	-65.6	166	0	0	0	111	V97 S105	V97-I101 HydrophobicContact CG1-CD1 3.77Å; V97-I101 HydrophobicContact CG1-CG1 4.46Å; V97-I101 VanDerWaalsContact O-CG1 3.32Å; V97-I101 WeakPolarHBondContact O-CG1 3.36Å; V97-I101 PolarHBondContact O-N 3.24Å; I101-S105 PolarHBondContact O-N 2.75Å; I101-S105 PolarHBondContact O-OG 2.84Å
102	R	61.8	Low	75	Confident	178 Å²	178	96.7 Å²	96.7	67%	0.672	47%	0.473	S	S	*	.	H	α-helix	trans	-66.6	-47.2	176.7	-170.6	180	178.8	-169.8	-1	111.6	K98 R99 K100 E104 S105 L106	K98-R102 WeakPolarHBondContact O-CB 3.37Å; K98-R102 PolarHBondContact O-N 2.92Å; K98-R102 VanDerWaalsContact O-N 3.08Å; R99-R102 PolarHBondContact O-N 3.38Å; K100-R102 VanDerWaalsContact C-N 3.28Å; K100-R102 PolarHBondContact O-N 2.97Å; R102-E104 VanDerWaalsContact C-N 3.35Å; R102-E104 PolarHBondContact O-N 2.99Å; R102-S105 PolarHBondContact O-N 2.8Å; R102-S105 PolarHBondContact O-OG 2.58Å; R102-L106 WeakPolarHBondContact O-CG 3.47Å
103	D	60.4	Low	75	Confident	115 Å²	115	96.3 Å²	96.3	62%	0.615	48%	0.481	S	S	*	.	H	α-helix	trans	-65.2	-35.3	-179.7	-81.5	-9.4	0	0	0	112.8	R99 K100 S105 L106	R99-D103 PolarHBondContact O-N 2.62Å; K100-D103 PolarHBondContact O-N 2.64Å; D103-S105 PolarHBondContact O-N 2.78Å; D103-L106 PolarHBondContact O-N 3.03Å
104	E	65.3	Low	75.3	Confident	130 Å²	130	92 Å²	92	61%	0.607	46%	0.462	S	S	*	.	H	α-helix	trans	-70.1	-18.5	176.2	-72.6	172.4	-178.9	0	0	113.3	K100 R102	K100-E104 WeakPolarHBondContact CE-OE1 3.4Å; K100-E104 WeakPolarHBondContact O-CG 3.4Å; K100-E104 PolarHBondContact O-N 2.71Å; R102-E104 VanDerWaalsContact C-N 3.35Å; R102-E104 PolarHBondContact O-N 2.99Å
105	S	75.3	Confident	75.6	Confident	57 Å²	57	91.1 Å²	91.1	40%	0.399	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	2.3	177.2	68.1	0	0	0	0	114.3	I101 R102 D103 L114	I101-S105 PolarHBondContact O-N 2.75Å; I101-S105 PolarHBondContact O-OG 2.84Å; R102-S105 PolarHBondContact O-N 2.8Å; R102-S105 PolarHBondContact O-OG 2.58Å; D103-S105 PolarHBondContact O-N 2.78Å; S105-L114 PolarHBondContact O-N 3.1Å
106	L	83.8	Confident	76.2	Confident	45 Å²	45	91.5 Å²	91.5	24%	0.236	47%	0.465	C	S	.	.	B	Isolated β-bridge	trans	-108.5	145.3	-178.1	-63.4	174.7	0	0	0	111.4	R102 D103 P108 E112	R102-L106 WeakPolarHBondContact O-CG 3.47Å; D103-L106 PolarHBondContact O-N 3.03Å; L106-P108 WeakPolarHBondContact O-CD 3.25Å; L106-E112 CarbonylContact C-O 3.48Å; L106-E112 WeakPolarHBondContact CA-O 3.14Å
107	C	83.7	Confident	77	Confident	6 Å²	6	90 Å²	90	4%	0.041	45%	0.448	C	S	.	.			trans	-65.7	125.2	174	178.9	0	0	0	0	109.9	Q109 H110 H111 E112 L114 C126	C107-Q109 PolarHBondContact O-N 3.46Å; C107-H110 HydrophobicContact CB-CB 4.34Å; C107-H110 PolarHBondContact O-N 3.41Å; C107-H111 VanDerWaalsContact O-CA 3.26Å; C107-H111 WeakPolarHBondContact O-CA 3.38Å; C107-H111 PolarHBondContact O-N 3.26Å; C107-E112 WeakPolarHBondContact CB-O 3.42Å; C107-E112 PolarHBondContact N-O 3.33Å; C107-L114 HydrophobicContact CB-CD2 3.71Å; C107-L114 HydrophobicContact CB-CG 4.48Å; C107-C126 HydrophobicContact CB-CB 3.77Å; C107-C126 VanDerWaalsContact SG-SG 3.64Å
108	P	82.4	Confident	77.9	Confident	106 Å²	106	86.1 Å²	86.1	69%	0.688	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.4	-179.7	-24.9	33.7	0	0	0	114.1	L106	L106-P108 WeakPolarHBondContact O-CD 3.25Å
109	Q	82.3	Confident	78.8	Confident	153 Å²	153	84.7 Å²	84.7	72%	0.715	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-40.9	-177.5	-63.3	-59.9	-47.4	0	0	112.3	C107	C107-Q109 PolarHBondContact O-N 3.46Å
110	H	81.8	Confident	80.1	Confident	67 Å²	67	81.3 Å²	81.3	31%	0.31	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-8.9	-169.1	-56	111.6	0	0	0	113.8	C107 E112 C126 I128 C129	C107-H110 HydrophobicContact CB-CB 4.34Å; C107-H110 PolarHBondContact O-N 3.41Å; H110-E112 HydrophobicContact CB-CB 4.42Å; H110-E112 HydrophobicContact CB-CG 4.4Å; H110-E112 PolarHBondContact O-N 3.3Å; H110-E112 VanDerWaalsContact O-N 3.12Å; H110-C126 PolarHBondContact ND1-SG 3.17Å; H110-I128 HydrophobicContact CB-CB 4.37Å; H110-I128 HydrophobicContact CB-CD1 4.05Å; H110-C129 PolarHBondContact CE1-SG 2.92Å; H110-C129 PolarHBondContact ND1-SG 2.85Å
111	H	79.7	Confident	81.2	Confident	142 Å²	142	78.3 Å²	78.3	66%	0.657	40%	0.398	S	S	*	.			trans	55.9	23.2	-176.7	-58.8	72	0	0	0	113.8	C107	C107-H111 VanDerWaalsContact O-CA 3.26Å; C107-H111 WeakPolarHBondContact O-CA 3.38Å; C107-H111 PolarHBondContact O-N 3.26Å
112	E	80.1	Confident	82.5	Confident	105 Å²	105	80 Å²	80	49%	0.491	40%	0.404	S	S	.	.			trans	-101.2	155.3	177.8	-75.4	-59.7	154.4	0	0	111.4	L106 C107 H110 L114 C126 I128	L106-E112 CarbonylContact C-O 3.48Å; L106-E112 WeakPolarHBondContact CA-O 3.14Å; C107-E112 WeakPolarHBondContact CB-O 3.42Å; C107-E112 PolarHBondContact N-O 3.33Å; H110-E112 HydrophobicContact CB-CB 4.42Å; H110-E112 HydrophobicContact CB-CG 4.4Å; H110-E112 PolarHBondContact O-N 3.3Å; H110-E112 VanDerWaalsContact O-N 3.12Å; E112-L114 PolarHBondContact O-N 3.18Å; E112-C126 HydrophobicContact CB-CB 3.83Å; E112-I128 HydrophobicContact CG-CD1 3.87Å
113	A	83.9	Confident	83.9	Confident	53 Å²	53	75.9 Å²	75.9	44%	0.438	39%	0.392	S	S	.	.	B	Isolated β-bridge	trans	-60.5	129.4	-179.3	0	0	0	0	0	112.5	S115 C126	A113-S115 VanDerWaalsContact C-N 3.31Å; A113-S115 PolarHBondContact O-N 3.1Å; A113-S115 PolarHBondContact O-OG 3.44Å; A113-C126 WeakPolarHBondContact O-CB 3.48Å
114	L	88.4	Confident	85.3	Confident	37 Å²	37	72.2 Å²	72.2	19%	0.194	38%	0.378	C	S	.	.			trans	-73.2	86.5	171.5	-63.9	177.4	0	0	0	109	S105 C107 E112 A124 C126 L143	S105-L114 PolarHBondContact O-N 3.1Å; C107-L114 HydrophobicContact CB-CD2 3.71Å; C107-L114 HydrophobicContact CB-CG 4.48Å; E112-L114 PolarHBondContact O-N 3.18Å; L114-A124 HydrophobicContact CB-CB 4.11Å; L114-A124 HydrophobicContact CD1-CB 4.43Å; L114-A124 WeakPolarHBondContact CD2-O 3.48Å; L114-C126 HydrophobicContact CD2-CB 4.39Å; L114-L143 WeakPolarHBondContact O-CD2 3.26Å
115	S	86.8	Confident	86.5	Confident	62 Å²	62	66.2 Å²	66.2	43%	0.434	35%	0.35	S	S	.	.			trans	-109.9	-2.4	-172.7	47.2	0	0	0	0	113.3	A113 V125 L143	A113-S115 VanDerWaalsContact C-N 3.31Å; A113-S115 PolarHBondContact O-N 3.1Å; A113-S115 PolarHBondContact O-OG 3.44Å; S115-V125 PolarHBondContact N-O 3.41Å; S115-L143 WeakPolarHBondContact O-CB 3.33Å; S115-L143 PolarHBondContact O-N 2.71Å
116	L	90.4	Very high	87.2	Confident	30 Å²	30	63.5 Å²	63.5	16%	0.157	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	159.4	-178.5	-57.6	173.9	0	0	0	110.4	A124 V125 L127 A130 V140 V141	L116-A124 CarbonylContact O-C 3.55Å; L116-A124 VanDerWaalsContact O-CA 3.28Å; L116-A124 WeakPolarHBondContact O-CA 3.4Å; L116-V125 HydrophobicContact CB-CG2 3.88Å; L116-V125 WeakPolarHBondContact CB-O 3.38Å; L116-V125 PolarHBondContact N-O 2.92Å; L116-V125 PolarHBondContact O-N 2.88Å; L116-L127 HydrophobicContact CD1-CD1 4.14Å; L116-A130 HydrophobicContact CD1-CB 3.59Å; L116-V140 HydrophobicContact CB-CG1 3.52Å; L116-V140 HydrophobicContact CD1-CG1 3.87Å; L116-V140 HydrophobicContact CD2-CG1 4.49Å; L116-V140 HydrophobicContact CG-CG1 4.16Å; L116-V141 CarbonylContact C-O 3.36Å; L116-V141 VanDerWaalsContact CA-O 3.25Å; L116-V141 WeakPolarHBondContact CA-O 3.38Å
117	F	93.5	Very high	87.3	Confident	28 Å²	28	66.7 Å²	66.7	12%	0.123	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	132.6	175.6	-174.9	-97.8	0	0	0	110.6	Y119 Q122 E123 V140 V141 L143 A146 Y150	F117-Y119 HydrophobicContact CD1-CD1 4.31Å; F117-Y119 HydrophobicContact CD1-CE1 4.5Å; F117-Y119 HydrophobicContact CE1-CD1 4.05Å; F117-Y119 HydrophobicContact CE1-CE1 4.46Å; F117-Q122 HydrophobicContact CZ-CB 4.28Å; F117-E123 WeakPolarHBondContact CD2-O 3.36Å; F117-V140 WeakPolarHBondContact O-CA 3.35Å; F117-V141 PolarHBondContact N-O 3.01Å; F117-V141 PolarHBondContact O-N 2.68Å; F117-L143 HydrophobicContact CB-CD1 3.97Å; F117-L143 HydrophobicContact CD2-CD1 4.2Å; F117-A146 HydrophobicContact CB-CB 3.6Å; F117-A146 HydrophobicContact CD1-CB 3.64Å; F117-A146 HydrophobicContact CG-CB 3.72Å; F117-Y150 HydrophobicContact CD1-CE2 4.39Å; F117-Y150 HydrophobicContact CE1-CD2 4.5Å; F117-Y150 AromaticContact CE1-CE2 3.61Å; F117-Y150 HydrophobicContact CE1-CE2 3.61Å; F117-Y150 AromaticContact CZ-CE2 3.98Å; F117-Y150 HydrophobicContact CZ-CE2 3.98Å
118	C	92	Very high	87.5	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	121.2	175.4	-170.8	0	0	0	0	109.8	D121 Q122 E123 V125 H138 V140	C118-D121 HydrophobicContact CB-CB 4.33Å; C118-D121 PolarHBondContact SG-OD2 3.06Å; C118-Q122 VanDerWaalsContact O-CA 3.3Å; C118-Q122 WeakPolarHBondContact O-CA 3.45Å; C118-Q122 PolarHBondContact O-N 3.18Å; C118-E123 PolarHBondContact N-O 2.91Å; C118-V125 HydrophobicContact CB-CG1 4.36Å; C118-H138 WeakPolarHBondContact SG-CB 3.29Å; C118-H138 PolarHBondContact SG-ND1 3.49Å; C118-H138 VanDerWaalsContact SG-ND1 3.41Å; C118-V140 HydrophobicContact CB-CG2 4.36Å
119	Y	90.9	Very high	87.7	Confident	61 Å²	61	65.5 Å²	65.5	24%	0.239	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-37	-177.9	-78.3	-74.3	0	0	0	113.6	F117 Q122 T139 V141 E149 Y150	F117-Y119 HydrophobicContact CD1-CD1 4.31Å; F117-Y119 HydrophobicContact CD1-CE1 4.5Å; F117-Y119 HydrophobicContact CE1-CD1 4.05Å; F117-Y119 HydrophobicContact CE1-CE1 4.46Å; Y119-Q122 WeakPolarHBondContact O-CG 3.33Å; Y119-T139 HydrophobicContact CD2-CG2 3.93Å; Y119-T139 HydrophobicContact CE2-CG2 4.41Å; Y119-T139 PolarHBondContact N-O 2.87Å; Y119-T139 VanDerWaalsContact N-O 3.15Å; Y119-V141 HydrophobicContact CD2-CG2 4.35Å; Y119-V141 HydrophobicContact CE2-CB 4.29Å; Y119-V141 HydrophobicContact CE2-CG1 3.77Å; Y119-V141 HydrophobicContact CE2-CG2 3.5Å; Y119-V141 VanDerWaalsContact CE2-CG2 3.5Å; Y119-E149 WeakPolarHBondContact CE1-OE2 3.16Å; Y119-E149 PolarHBondContact OH-OE2 3.22Å; Y119-Y150 HydrophobicContact CD1-CE2 4.24Å; Y119-Y150 AromaticContact CE1-CE2 3.93Å; Y119-Y150 HydrophobicContact CE1-CE2 3.93Å
120	E	93	Very high	87.9	Confident	91 Å²	91	58.9 Å²	58.9	43%	0.425	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-44.1	-177.2	-67.2	80.9	173.7	0	0	111.3	H138 T139	E120-H138 HydrophobicContact CG-CB 4.48Å; E120-H138 WeakPolarHBondContact OE2-CB 3.33Å; E120-T139 VanDerWaalsContact CD-N 3.29Å; E120-T139 WeakPolarHBondContact OE1-CB 3.42Å; E120-T139 PolarHBondContact OE1-N 2.81Å; E120-T139 PolarHBondContact OE1-OG1 2.78Å; E120-T139 PolarHBondContact OE2-N 3.36Å
121	D	88.1	Confident	87.9	Confident	69 Å²	69	61.4 Å²	61.4	37%	0.369	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-11.3	-178.8	-56.8	-49.8	0	0	0	113.2	C118 E123 H135 H138	C118-D121 HydrophobicContact CB-CB 4.33Å; C118-D121 PolarHBondContact SG-OD2 3.06Å; D121-E123 VanDerWaalsContact C-N 3.3Å; D121-E123 HydrophobicContact CB-CG 3.85Å; D121-E123 PolarHBondContact O-N 3.46Å; D121-H135 IonicContact OD2-CE1 3.46Å; D121-H135 PolarHBondContact OD2-CE1 3.06Å; D121-H135 IonicContact OD2-ND1 2.6Å; D121-H135 PolarHBondContact OD2-ND1 3.05Å; D121-H138 IonicContact OD1-CE1 3.12Å; D121-H138 IonicContact OD1-ND1 2.8Å; D121-H138 IonicContact OD2-CE1 3.79Å; D121-H138 PolarHBondContact OD2-CE1 3.13Å; D121-H138 IonicContact OD2-ND1 3.6Å; D121-H138 PolarHBondContact OD2-ND1 3.42Å
122	Q	90.1	Very high	88.1	Confident	144 Å²	144	56.3 Å²	56.3	67%	0.673	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	39.6	-179.2	-59.6	-179.9	38.4	0	0	114.3	F117 C118 Y119	F117-Q122 HydrophobicContact CZ-CB 4.28Å; C118-Q122 VanDerWaalsContact O-CA 3.3Å; C118-Q122 WeakPolarHBondContact O-CA 3.45Å; C118-Q122 PolarHBondContact O-N 3.18Å; Y119-Q122 WeakPolarHBondContact O-CG 3.33Å
123	E	89.6	Confident	87.8	Confident	92 Å²	92	59.3 Å²	59.3	43%	0.43	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	155.2	-177	64.8	-178	169.9	0	0	112.6	F117 C118 D121 V125 H135	F117-E123 WeakPolarHBondContact CD2-O 3.36Å; C118-E123 PolarHBondContact N-O 2.91Å; D121-E123 VanDerWaalsContact C-N 3.3Å; D121-E123 HydrophobicContact CB-CG 3.85Å; D121-E123 PolarHBondContact O-N 3.46Å; E123-V125 HydrophobicContact CG-CG1 3.99Å; E123-H135 IonicContact OE1-CE1 3.12Å; E123-H135 PolarHBondContact OE1-CE1 2.97Å; E123-H135 VanDerWaalsContact OE1-CE1 3.31Å; E123-H135 IonicContact OE1-NE2 2.7Å
124	A	90.8	Very high	87.4	Confident	38 Å²	38	61 Å²	61	31%	0.314	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	132.3	172.6	0	0	0	0	0	109.7	L114 L116 L143	L114-A124 HydrophobicContact CB-CB 4.11Å; L114-A124 HydrophobicContact CD1-CB 4.43Å; L114-A124 WeakPolarHBondContact CD2-O 3.48Å; L116-A124 CarbonylContact O-C 3.55Å; L116-A124 VanDerWaalsContact O-CA 3.28Å; L116-A124 WeakPolarHBondContact O-CA 3.4Å; A124-L143 HydrophobicContact CB-CD1 4.1Å
125	V	90.6	Very high	87.2	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.024	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	155.3	-176.4	-59.2	0	0	0	0	110.8	S115 L116 C118 E123 C129 V140	S115-V125 PolarHBondContact N-O 3.41Å; L116-V125 HydrophobicContact CB-CG2 3.88Å; L116-V125 WeakPolarHBondContact CB-O 3.38Å; L116-V125 PolarHBondContact N-O 2.92Å; L116-V125 PolarHBondContact O-N 2.88Å; C118-V125 HydrophobicContact CB-CG1 4.36Å; E123-V125 HydrophobicContact CG-CG1 3.99Å; V125-C129 HydrophobicContact CB-CB 3.95Å; V125-V140 HydrophobicContact CG2-CG1 4.05Å
126	C	89.3	Confident	87	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.327	C	S	.	.			trans	-88.2	168.9	171.3	71.2	0	0	0	0	111.3	C107 H110 E112 A113 L114 I128 C129 A130	C107-C126 HydrophobicContact CB-CB 3.77Å; C107-C126 VanDerWaalsContact SG-SG 3.64Å; H110-C126 PolarHBondContact ND1-SG 3.17Å; E112-C126 HydrophobicContact CB-CB 3.83Å; A113-C126 WeakPolarHBondContact O-CB 3.48Å; L114-C126 HydrophobicContact CD2-CB 4.39Å; C126-I128 PolarHBondContact O-N 2.82Å; C126-C129 WeakPolarHBondContact O-CB 3.39Å; C126-C129 PolarHBondContact O-N 2.79Å; C126-C129 VanDerWaalsContact O-N 3.15Å; C126-C129 PolarHBondContact SG-N 3.23Å; C126-C129 VanDerWaalsContact SG-SG 3.6Å; C126-A130 PolarHBondContact O-N 2.84Å
127	L	86.1	Confident	86.8	Confident	113 Å²	113	68.8 Å²	68.8	59%	0.592	36%	0.358	S	S	*	.	H	α-helix	trans	-57.6	-36.4	179.7	-175.3	63.2	0	0	0	113.1	L116 A130 I131	L116-L127 HydrophobicContact CD1-CD1 4.14Å; L127-A130 PolarHBondContact O-N 2.88Å; L127-I131 WeakPolarHBondContact O-CG1 3.43Å; L127-I131 PolarHBondContact O-N 3.43Å
128	I	87.4	Confident	86.7	Confident	72 Å²	72	70.5 Å²	70.5	37%	0.369	37%	0.366	S	S	.	.	H	α-helix	trans	-68.4	-42.9	179.4	-59	172.7	0	0	0	110.5	H110 E112 C126 A130 I131 S132	H110-I128 HydrophobicContact CB-CB 4.37Å; H110-I128 HydrophobicContact CB-CD1 4.05Å; E112-I128 HydrophobicContact CG-CD1 3.87Å; C126-I128 PolarHBondContact O-N 2.82Å; I128-A130 VanDerWaalsContact C-N 3.31Å; I128-A130 PolarHBondContact O-N 2.79Å; I128-I131 WeakPolarHBondContact O-CG1 3.46Å; I128-I131 PolarHBondContact O-N 2.8Å; I128-S132 VanDerWaalsContact O-CB 3.32Å; I128-S132 WeakPolarHBondContact O-CB 3.31Å; I128-S132 PolarHBondContact O-N 3.14Å
129	C	87.4	Confident	86.7	Confident	14 Å²	14	74.2 Å²	74.2	10%	0.095	39%	0.389	C	S	.	.	H	α-helix	trans	-59.4	-42.6	173.6	-71.2	0	0	0	0	111.5	H110 V125 C126 I131 S132 H135	H110-C129 PolarHBondContact CE1-SG 2.92Å; H110-C129 PolarHBondContact ND1-SG 2.85Å; V125-C129 HydrophobicContact CB-CB 3.95Å; C126-C129 WeakPolarHBondContact O-CB 3.39Å; C126-C129 PolarHBondContact O-N 2.79Å; C126-C129 VanDerWaalsContact O-N 3.15Å; C126-C129 PolarHBondContact SG-N 3.23Å; C126-C129 VanDerWaalsContact SG-SG 3.6Å; C129-I131 VanDerWaalsContact C-N 3.34Å; C129-I131 PolarHBondContact O-N 3.14Å; C129-S132 PolarHBondContact O-N 2.88Å; C129-S132 PolarHBondContact O-OG 3.5Å; C129-H135 PolarHBondContact O-CD2 2.84Å
130	A	85.4	Confident	86.7	Confident	15 Å²	15	73.3 Å²	73.3	12%	0.124	39%	0.39	C	S	.	.	H	α-helix	trans	-62.3	-37.1	-178.3	0	0	0	0	0	113.4	L116 C126 L127 I128 V140	L116-A130 HydrophobicContact CD1-CB 3.59Å; C126-A130 PolarHBondContact O-N 2.84Å; L127-A130 PolarHBondContact O-N 2.88Å; I128-A130 VanDerWaalsContact C-N 3.31Å; I128-A130 PolarHBondContact O-N 2.79Å; A130-V140 HydrophobicContact CB-CG1 4.04Å; A130-V140 HydrophobicContact CB-CG2 4.43Å
131	I	83.4	Confident	86.6	Confident	120 Å²	120	70.5 Å²	70.5	62%	0.615	38%	0.379	S	S	*	.	H	α-helix	trans	-88.9	-15.2	178	65.7	178.8	0	0	0	113.5	L127 I128 C129	L127-I131 WeakPolarHBondContact O-CG1 3.43Å; L127-I131 PolarHBondContact O-N 3.43Å; I128-I131 WeakPolarHBondContact O-CG1 3.46Å; I128-I131 PolarHBondContact O-N 2.8Å; C129-I131 VanDerWaalsContact C-N 3.34Å; C129-I131 PolarHBondContact O-N 3.14Å
132	S	83.6	Confident	86.8	Confident	34 Å²	34	70.2 Å²	70.2	24%	0.238	38%	0.38	C	S	.	.	S	Bend	trans	-67.6	159	176.2	77.1	0	0	0	0	111.4	I128 C129 T134 H135 R136	I128-S132 VanDerWaalsContact O-CB 3.32Å; I128-S132 WeakPolarHBondContact O-CB 3.31Å; I128-S132 PolarHBondContact O-N 3.14Å; C129-S132 PolarHBondContact O-N 2.88Å; C129-S132 PolarHBondContact O-OG 3.5Å; S132-T134 PolarHBondContact O-N 2.88Å; S132-T134 PolarHBondContact OG-OG1 3.05Å; S132-H135 PolarHBondContact O-N 2.82Å; S132-R136 WeakPolarHBondContact O-CB 3.37Å; S132-R136 PolarHBondContact O-N 2.92Å
133	H	72.6	Confident	86.8	Confident	168 Å²	168	65.6 Å²	65.6	78%	0.778	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-17.3	-179.6	-75	-76.5	0	0	0	114.5
134	T	75.4	Confident	86.7	Confident	90 Å²	90	67.4 Å²	67.4	55%	0.552	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-40.6	-177.2	61.3	0	0	0	0	113	S132	S132-T134 PolarHBondContact O-N 2.88Å; S132-T134 PolarHBondContact OG-OG1 3.05Å
135	H	83.9	Confident	86.6	Confident	18 Å²	18	70.3 Å²	70.3	8%	0.083	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	5.6	179.9	-52.4	-82.5	0	0	0	113.5	D121 E123 C129 S132 A137 H138 V140	D121-H135 IonicContact OD2-CE1 3.46Å; D121-H135 PolarHBondContact OD2-CE1 3.06Å; D121-H135 IonicContact OD2-ND1 2.6Å; D121-H135 PolarHBondContact OD2-ND1 3.05Å; E123-H135 IonicContact OE1-CE1 3.12Å; E123-H135 PolarHBondContact OE1-CE1 2.97Å; E123-H135 VanDerWaalsContact OE1-CE1 3.31Å; E123-H135 IonicContact OE1-NE2 2.7Å; C129-H135 PolarHBondContact O-CD2 2.84Å; S132-H135 PolarHBondContact O-N 2.82Å; H135-A137 PolarHBondContact O-N 3.28Å; H135-H138 HydrophobicContact CB-CB 4.36Å; H135-H138 AromaticContact ND1-ND1 3.71Å; H135-H138 WeakPolarHBondContact O-CB 3.45Å; H135-H138 PolarHBondContact O-N 3.2Å; H135-V140 HydrophobicContact CB-CG2 4.39Å
136	R	82.6	Confident	86.7	Confident	176 Å²	176	70.1 Å²	70.1	66%	0.664	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-27.7	-177	179.1	173	-178.9	-168.7	0.4	114.6	S132	S132-R136 WeakPolarHBondContact O-CB 3.37Å; S132-R136 PolarHBondContact O-N 2.92Å
137	A	86.4	Confident	86.7	Confident	98 Å²	98	73.8 Å²	73.8	81%	0.81	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-2	178.8	0	0	0	0	0	113.4	H135	H135-A137 PolarHBondContact O-N 3.28Å
138	H	92.4	Very high	86.9	Confident	63 Å²	63	72.6 Å²	72.6	29%	0.292	40%	0.396	S	S	.	.	S	Bend	trans	-90.7	158.4	-177.2	-66.9	-176.2	0	0	0	111.3	C118 E120 D121 H135 V140	C118-H138 WeakPolarHBondContact SG-CB 3.29Å; C118-H138 PolarHBondContact SG-ND1 3.49Å; C118-H138 VanDerWaalsContact SG-ND1 3.41Å; E120-H138 HydrophobicContact CG-CB 4.48Å; E120-H138 WeakPolarHBondContact OE2-CB 3.33Å; D121-H138 IonicContact OD1-CE1 3.12Å; D121-H138 IonicContact OD1-ND1 2.8Å; D121-H138 IonicContact OD2-CE1 3.79Å; D121-H138 PolarHBondContact OD2-CE1 3.13Å; D121-H138 IonicContact OD2-ND1 3.6Å; D121-H138 PolarHBondContact OD2-ND1 3.42Å; H135-H138 HydrophobicContact CB-CB 4.36Å; H135-H138 AromaticContact ND1-ND1 3.71Å; H135-H138 WeakPolarHBondContact O-CB 3.45Å; H135-H138 PolarHBondContact O-N 3.2Å; H138-V140 HydrophobicContact CB-CG2 4.49Å; H138-V140 PolarHBondContact O-N 2.73Å
139	T	90.8	Very high	87.2	Confident	78 Å²	78	72.3 Å²	72.3	48%	0.479	39%	0.393	S	S	.	.			trans	-81.7	105.3	176.1	-48.9	0	0	0	0	108.6	Y119 E120	Y119-T139 HydrophobicContact CD2-CG2 3.93Å; Y119-T139 HydrophobicContact CE2-CG2 4.41Å; Y119-T139 PolarHBondContact N-O 2.87Å; Y119-T139 VanDerWaalsContact N-O 3.15Å; E120-T139 VanDerWaalsContact CD-N 3.29Å; E120-T139 WeakPolarHBondContact OE1-CB 3.42Å; E120-T139 PolarHBondContact OE1-N 2.81Å; E120-T139 PolarHBondContact OE1-OG1 2.78Å; E120-T139 PolarHBondContact OE2-N 3.36Å
140	V	91.9	Very high	87.3	Confident	42 Å²	42	75.1 Å²	75.1	26%	0.255	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	128.1	-179.8	-176.7	0	0	0	0	109.6	L116 F117 C118 V125 A130 H135 H138	L116-V140 HydrophobicContact CB-CG1 3.52Å; L116-V140 HydrophobicContact CD1-CG1 3.87Å; L116-V140 HydrophobicContact CD2-CG1 4.49Å; L116-V140 HydrophobicContact CG-CG1 4.16Å; F117-V140 WeakPolarHBondContact O-CA 3.35Å; C118-V140 HydrophobicContact CB-CG2 4.36Å; V125-V140 HydrophobicContact CG2-CG1 4.05Å; A130-V140 HydrophobicContact CB-CG1 4.04Å; A130-V140 HydrophobicContact CB-CG2 4.43Å; H135-V140 HydrophobicContact CB-CG2 4.39Å; H138-V140 HydrophobicContact CB-CG2 4.49Å; H138-V140 PolarHBondContact O-N 2.73Å
141	V	91.3	Very high	87.7	Confident	33 Å²	33	79.4 Å²	79.4	20%	0.2	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	162.3	178.4	-65.9	0	0	0	0	110.5	L116 F117 Y119 L143 A146	L116-V141 CarbonylContact C-O 3.36Å; L116-V141 VanDerWaalsContact CA-O 3.25Å; L116-V141 WeakPolarHBondContact CA-O 3.38Å; F117-V141 PolarHBondContact N-O 3.01Å; F117-V141 PolarHBondContact O-N 2.68Å; Y119-V141 HydrophobicContact CD2-CG2 4.35Å; Y119-V141 HydrophobicContact CE2-CB 4.29Å; Y119-V141 HydrophobicContact CE2-CG1 3.77Å; Y119-V141 HydrophobicContact CE2-CG2 3.5Å; Y119-V141 VanDerWaalsContact CE2-CG2 3.5Å; V141-L143 PolarHBondContact O-N 3.21Å; V141-A146 HydrophobicContact CG2-CB 3.81Å
142	P	92.5	Very high	88.1	Confident	62 Å²	62	77.7 Å²	77.7	40%	0.403	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.9	137.1	167.1	-26.4	36.3	0	0	0	111.4	D144 D145 A146	P142-D144 PolarHBondContact O-N 2.83Å; P142-D145 HydrophobicContact CB-CB 4.39Å; P142-D145 WeakPolarHBondContact CD-OD2 3.46Å; P142-D145 WeakPolarHBondContact CG-OD2 3.48Å; P142-D145 WeakPolarHBondContact O-CB 3.41Å; P142-D145 PolarHBondContact O-N 2.89Å; P142-D145 VanDerWaalsContact O-N 3.09Å; P142-A146 PolarHBondContact O-N 3.43Å
143	L	89.7	Confident	88.5	Confident	47 Å²	47	80.4 Å²	80.4	25%	0.246	42%	0.415	C	S	.	.	H	α-helix	trans	-59.1	-35.3	-178	-178.9	63.7	0	0	0	111.5	L114 S115 F117 A124 V141 D145 T147	L114-L143 WeakPolarHBondContact O-CD2 3.26Å; S115-L143 WeakPolarHBondContact O-CB 3.33Å; S115-L143 PolarHBondContact O-N 2.71Å; F117-L143 HydrophobicContact CB-CD1 3.97Å; F117-L143 HydrophobicContact CD2-CD1 4.2Å; A124-L143 HydrophobicContact CB-CD1 4.1Å; V141-L143 PolarHBondContact O-N 3.21Å; L143-D145 VanDerWaalsContact C-N 3.35Å; L143-D145 PolarHBondContact O-N 3.14Å; L143-T147 WeakPolarHBondContact O-CB 3.36Å; L143-T147 PolarHBondContact O-N 2.93Å; L143-T147 PolarHBondContact O-OG1 3.12Å
144	D	87.1	Confident	89.5	Confident	130 Å²	130	78.1 Å²	78.1	70%	0.695	41%	0.408	S	S	*	.	H	α-helix	trans	-63.9	-39.2	177.7	-67.9	-28.8	0	0	0	112.1	P142 T147 Q148	P142-D144 PolarHBondContact O-N 2.83Å; D144-T147 PolarHBondContact O-N 3.38Å; D144-Q148 WeakPolarHBondContact O-CB 3.41Å; D144-Q148 PolarHBondContact O-N 3.08Å
145	D	89.6	Confident	90.3	Very high	99 Å²	99	78.8 Å²	78.8	53%	0.529	41%	0.405	S	S	.	.	H	α-helix	trans	-66.7	-48.4	178.5	-66.3	-16.8	0	0	0	110.8	P142 L143 T147 Q148 E149	P142-D145 HydrophobicContact CB-CB 4.39Å; P142-D145 WeakPolarHBondContact CD-OD2 3.46Å; P142-D145 WeakPolarHBondContact CG-OD2 3.48Å; P142-D145 WeakPolarHBondContact O-CB 3.41Å; P142-D145 PolarHBondContact O-N 2.89Å; P142-D145 VanDerWaalsContact O-N 3.09Å; L143-D145 VanDerWaalsContact C-N 3.35Å; L143-D145 PolarHBondContact O-N 3.14Å; D145-T147 VanDerWaalsContact C-N 3.33Å; D145-T147 PolarHBondContact O-N 2.9Å; D145-Q148 PolarHBondContact O-N 3.01Å; D145-E149 PolarHBondContact O-N 3.26Å
146	A	91.1	Very high	90.8	Very high	1 Å²	1	85.2 Å²	85.2	1%	0.008	43%	0.432	C	S	.	.	H	α-helix	trans	-61.9	-41.4	174.7	0	0	0	0	0	111.6	F117 V141 P142 Q148 E149 Y150	F117-A146 HydrophobicContact CB-CB 3.6Å; F117-A146 HydrophobicContact CD1-CB 3.64Å; F117-A146 HydrophobicContact CG-CB 3.72Å; V141-A146 HydrophobicContact CG2-CB 3.81Å; P142-A146 PolarHBondContact O-N 3.43Å; A146-Q148 VanDerWaalsContact C-N 3.32Å; A146-Q148 PolarHBondContact O-N 2.98Å; A146-E149 PolarHBondContact O-N 3.33Å; A146-Y150 VanDerWaalsContact O-CD2 3.26Å; A146-Y150 WeakPolarHBondContact O-CD2 3.43Å; A146-Y150 PolarHBondContact O-N 3.49Å
147	T	90.1	Very high	91.3	Very high	77 Å²	77	80.1 Å²	80.1	47%	0.472	42%	0.423	S	S	.	.	H	α-helix	trans	-59.5	-44.8	177.7	-64.1	0	0	0	0	110.8	L143 D144 D145 K151	L143-T147 WeakPolarHBondContact O-CB 3.36Å; L143-T147 PolarHBondContact O-N 2.93Å; L143-T147 PolarHBondContact O-OG1 3.12Å; D144-T147 PolarHBondContact O-N 3.38Å; D145-T147 VanDerWaalsContact C-N 3.33Å; D145-T147 PolarHBondContact O-N 2.9Å; T147-K151 WeakPolarHBondContact O-CB 3.32Å; T147-K151 PolarHBondContact O-N 3.45Å
148	Q	91.2	Very high	91.7	Very high	88 Å²	88	79.9 Å²	79.9	41%	0.411	41%	0.407	S	S	.	.	H	α-helix	trans	-64.8	-43.8	178	-176.6	56.6	30	0	0	111.5	D144 D145 A146 K151 E152	D144-Q148 WeakPolarHBondContact O-CB 3.41Å; D144-Q148 PolarHBondContact O-N 3.08Å; D145-Q148 PolarHBondContact O-N 3.01Å; A146-Q148 VanDerWaalsContact C-N 3.32Å; A146-Q148 PolarHBondContact O-N 2.98Å; Q148-K151 WeakPolarHBondContact O-CB 3.14Å; Q148-K151 PolarHBondContact O-N 3.48Å; Q148-E152 PolarHBondContact NE2-OE1 3.1Å; Q148-E152 WeakPolarHBondContact O-CG 3.26Å; Q148-E152 PolarHBondContact O-N 2.99Å
149	E	92.4	Very high	91.7	Very high	65 Å²	65	82.7 Å²	82.7	30%	0.304	42%	0.421	S	S	.	.	H	α-helix	trans	-61.5	-49.3	177.2	-171.2	-167.3	162.7	0	0	112.3	Y119 D145 A146 K151 E152 K153	Y119-E149 WeakPolarHBondContact CE1-OE2 3.16Å; Y119-E149 PolarHBondContact OH-OE2 3.22Å; D145-E149 PolarHBondContact O-N 3.26Å; A146-E149 PolarHBondContact O-N 3.33Å; E149-K151 VanDerWaalsContact C-N 3.32Å; E149-K151 PolarHBondContact O-N 3.01Å; E149-E152 PolarHBondContact O-N 3.43Å; E149-K153 WeakPolarHBondContact O-CG 3.38Å; E149-K153 PolarHBondContact O-N 3.24Å; E149-K153 WeakPolarHBondContact OE1-CE 3.44Å; E149-K153 IonicContact OE1-NZ 2.77Å; E149-K153 PolarHBondContact OE1-NZ 2.93Å
150	Y	90.3	Very high	91.9	Very high	74 Å²	74	82.2 Å²	82.2	29%	0.29	42%	0.419	S	S	.	.	H	α-helix	trans	-68.1	-32.9	179.2	-81.2	-75.5	0	0	0	112.1	F117 Y119 A146 E152 K153 L154	F117-Y150 HydrophobicContact CD1-CE2 4.39Å; F117-Y150 HydrophobicContact CE1-CD2 4.5Å; F117-Y150 AromaticContact CE1-CE2 3.61Å; F117-Y150 HydrophobicContact CE1-CE2 3.61Å; F117-Y150 AromaticContact CZ-CE2 3.98Å; F117-Y150 HydrophobicContact CZ-CE2 3.98Å; Y119-Y150 HydrophobicContact CD1-CE2 4.24Å; Y119-Y150 AromaticContact CE1-CE2 3.93Å; Y119-Y150 HydrophobicContact CE1-CE2 3.93Å; A146-Y150 VanDerWaalsContact O-CD2 3.26Å; A146-Y150 WeakPolarHBondContact O-CD2 3.43Å; A146-Y150 PolarHBondContact O-N 3.49Å; Y150-E152 VanDerWaalsContact C-N 3.34Å; Y150-E152 PolarHBondContact O-N 3.11Å; Y150-K153 HydrophobicContact CD1-CD 4.25Å; Y150-K153 HydrophobicContact CE1-CD 4.49Å; Y150-K153 PolarHBondContact O-N 3.25Å; Y150-L154 WeakPolarHBondContact O-CB 3.23Å; Y150-L154 VanDerWaalsContact O-CG 3.23Å; Y150-L154 WeakPolarHBondContact O-CG 3.37Å; Y150-L154 PolarHBondContact O-N 3.34Å
151	K	92.3	Very high	92.1	Very high	105 Å²	105	85.3 Å²	85.3	46%	0.457	43%	0.433	S	S	.	.	H	α-helix	trans	-59.9	-44.7	172.1	-178.5	179.8	179.9	-176.6	0	111.2	T147 Q148 E149 L154 Q155	T147-K151 WeakPolarHBondContact O-CB 3.32Å; T147-K151 PolarHBondContact O-N 3.45Å; Q148-K151 WeakPolarHBondContact O-CB 3.14Å; Q148-K151 PolarHBondContact O-N 3.48Å; E149-K151 VanDerWaalsContact C-N 3.32Å; E149-K151 PolarHBondContact O-N 3.01Å; K151-L154 PolarHBondContact O-N 3.02Å; K151-Q155 WeakPolarHBondContact O-CB 3.4Å; K151-Q155 WeakPolarHBondContact O-CG 3.43Å; K151-Q155 PolarHBondContact O-N 3.44Å
152	E	92.5	Very high	92.3	Very high	84 Å²	84	89.8 Å²	89.8	39%	0.393	45%	0.452	S	S	.	.	H	α-helix	trans	-66	-41.4	175.9	-71.8	175.3	-163.3	0	0	112.3	Q148 E149 Y150 Q155 K156	Q148-E152 PolarHBondContact NE2-OE1 3.1Å; Q148-E152 WeakPolarHBondContact O-CG 3.26Å; Q148-E152 PolarHBondContact O-N 2.99Å; E149-E152 PolarHBondContact O-N 3.43Å; Y150-E152 VanDerWaalsContact C-N 3.34Å; Y150-E152 PolarHBondContact O-N 3.11Å; E152-Q155 PolarHBondContact O-N 3.15Å; E152-K156 WeakPolarHBondContact O-CG 3.39Å; E152-K156 PolarHBondContact O-N 3.08Å
153	K	92.5	Very high	92.5	Very high	90 Å²	90	92 Å²	92	39%	0.391	46%	0.457	S	S	.	.	H	α-helix	trans	-60.2	-45.7	174.5	-72.6	177.2	-176.3	167.9	0	111.5	E149 Y150 K156 C157	E149-K153 WeakPolarHBondContact O-CG 3.38Å; E149-K153 PolarHBondContact O-N 3.24Å; E149-K153 WeakPolarHBondContact OE1-CE 3.44Å; E149-K153 IonicContact OE1-NZ 2.77Å; E149-K153 PolarHBondContact OE1-NZ 2.93Å; Y150-K153 HydrophobicContact CD1-CD 4.25Å; Y150-K153 HydrophobicContact CE1-CD 4.49Å; Y150-K153 PolarHBondContact O-N 3.25Å; K153-K156 PolarHBondContact O-N 3.41Å; K153-C157 PolarHBondContact O-N 3.19Å; K153-C157 PolarHBondContact O-SG 2.81Å; K153-C157 VanDerWaalsContact O-SG 3.35Å
154	L	92.6	Very high	92.9	Very high	120 Å²	120	95.5 Å²	95.5	63%	0.628	47%	0.47	S	S	*	.	H	α-helix	trans	-66.6	-39.2	178	-71.3	171.4	0	0	0	111.8	Y150 K151 K156 C157 L158	Y150-L154 WeakPolarHBondContact O-CB 3.23Å; Y150-L154 VanDerWaalsContact O-CG 3.23Å; Y150-L154 WeakPolarHBondContact O-CG 3.37Å; Y150-L154 PolarHBondContact O-N 3.34Å; K151-L154 PolarHBondContact O-N 3.02Å; L154-K156 VanDerWaalsContact C-N 3.35Å; L154-K156 PolarHBondContact O-N 2.91Å; L154-C157 WeakPolarHBondContact O-CB 3.25Å; L154-C157 PolarHBondContact O-N 3.42Å; L154-C157 VanDerWaalsContact O-N 3.11Å; L154-L158 PolarHBondContact O-N 3.23Å
155	Q	93.3	Very high	93.4	Very high	104 Å²	104	94.6 Å²	94.6	49%	0.486	47%	0.465	S	S	.	.	H	α-helix	trans	-61.5	-41.5	174.2	-78	174.9	-13.3	0	0	112	K151 E152 C157 L158	K151-Q155 WeakPolarHBondContact O-CB 3.4Å; K151-Q155 WeakPolarHBondContact O-CG 3.43Å; K151-Q155 PolarHBondContact O-N 3.44Å; E152-Q155 PolarHBondContact O-N 3.15Å; Q155-C157 PolarHBondContact O-N 3Å; Q155-L158 WeakPolarHBondContact O-CB 3.41Å; Q155-L158 PolarHBondContact O-N 2.83Å; Q155-L158 VanDerWaalsContact O-N 3.07Å
156	K	93.3	Very high	93.7	Very high	154 Å²	154	96.9 Å²	96.9	67%	0.67	47%	0.473	S	S	*	.	H	α-helix	trans	-62	-28.3	174.4	-72.8	171.1	-176.7	170.6	0	112.8	E152 K153 L154 L158 P160	E152-K156 WeakPolarHBondContact O-CG 3.39Å; E152-K156 PolarHBondContact O-N 3.08Å; K153-K156 PolarHBondContact O-N 3.41Å; L154-K156 VanDerWaalsContact C-N 3.35Å; L154-K156 PolarHBondContact O-N 2.91Å; K156-L158 VanDerWaalsContact C-N 3.34Å; K156-P160 WeakPolarHBondContact O-CD 3.41Å
157	C	94.3	Very high	94	Very high	68 Å²	68	101 Å²	101	46%	0.459	49%	0.492	S	S	.	.	H	α-helix	trans	-76.2	-18.8	175.6	-66	0	0	0	0	113.5	K153 L154 Q155 L161	K153-C157 PolarHBondContact O-N 3.19Å; K153-C157 PolarHBondContact O-SG 2.81Å; K153-C157 VanDerWaalsContact O-SG 3.35Å; L154-C157 WeakPolarHBondContact O-CB 3.25Å; L154-C157 PolarHBondContact O-N 3.42Å; L154-C157 VanDerWaalsContact O-N 3.11Å; Q155-C157 PolarHBondContact O-N 3Å; C157-L161 WeakPolarHBondContact O-CD1 3.31Å; C157-L161 VanDerWaalsContact O-CG 3.22Å; C157-L161 WeakPolarHBondContact O-CG 3.25Å; C157-L161 PolarHBondContact O-N 3.25Å
158	L	93.9	Very high	94.4	Very high	93 Å²	93	102.6 Å²	102.6	49%	0.487	50%	0.496	S	S	.	.	H	α-helix	trans	-67.2	-45.3	-177.4	-68.5	173.7	0	0	0	112.2	L154 Q155 K156 L161 E162	L154-L158 PolarHBondContact O-N 3.23Å; Q155-L158 WeakPolarHBondContact O-CB 3.41Å; Q155-L158 PolarHBondContact O-N 2.83Å; Q155-L158 VanDerWaalsContact O-N 3.07Å; K156-L158 VanDerWaalsContact C-N 3.34Å; L158-L161 WeakPolarHBondContact O-CB 3.37Å; L158-L161 PolarHBondContact O-N 3.4Å; L158-L161 VanDerWaalsContact O-N 3.12Å; L158-E162 WeakPolarHBondContact O-CG 3.44Å; L158-E162 PolarHBondContact O-N 3.31Å
159	E	92.9	Very high	94.7	Very high	123 Å²	123	102.8 Å²	102.8	58%	0.575	50%	0.503	S	S	*	.	H	α-helix	trans	-60.2	-48.7	-175.9	174.4	-178.3	-162.8	0	0	112.8	L161 E162 Q163	E159-L161 VanDerWaalsContact C-N 3.28Å; E159-L161 PolarHBondContact O-N 2.85Å; E159-E162 PolarHBondContact O-N 3.06Å; E159-Q163 VanDerWaalsContact O-CG 3.3Å; E159-Q163 WeakPolarHBondContact O-CG 3.38Å; E159-Q163 PolarHBondContact O-N 3.18Å; E159-Q163 PolarHBondContact OE1-NE2 3.39Å
160	P	95.9	Very high	94.9	Very high	67 Å²	67	108 Å²	108	44%	0.435	52%	0.52	S	S	.	.	H	α-helix	trans	-60.2	-35.4	174.1	-24.9	33.9	0	0	0	113.8	K156 K164	K156-P160 WeakPolarHBondContact O-CD 3.41Å; P160-K164 WeakPolarHBondContact O-CB 3.33Å; P160-K164 VanDerWaalsContact O-CG 3.31Å; P160-K164 WeakPolarHBondContact O-CG 3.31Å; P160-K164 PolarHBondContact O-N 3.48Å
161	L	95.8	Very high	95.2	Very high	107 Å²	107	107.6 Å²	107.6	56%	0.56	53%	0.528	S	S	*	.	H	α-helix	trans	-68.7	-44.1	178.7	-70.7	172	0	0	0	111.3	C157 L158 E159 K164 L165	C157-L161 WeakPolarHBondContact O-CD1 3.31Å; C157-L161 VanDerWaalsContact O-CG 3.22Å; C157-L161 WeakPolarHBondContact O-CG 3.25Å; C157-L161 PolarHBondContact O-N 3.25Å; L158-L161 WeakPolarHBondContact O-CB 3.37Å; L158-L161 PolarHBondContact O-N 3.4Å; L158-L161 VanDerWaalsContact O-N 3.12Å; E159-L161 VanDerWaalsContact C-N 3.28Å; E159-L161 PolarHBondContact O-N 2.85Å; L161-K164 PolarHBondContact O-N 3.16Å; L161-L165 WeakPolarHBondContact O-CG 3.15Å; L161-L165 PolarHBondContact O-N 3.19Å
162	E	95.6	Very high	95.4	Very high	127 Å²	127	108.6 Å²	108.6	59%	0.593	53%	0.532	S	S	*	.	H	α-helix	trans	-62.2	-43.6	175.6	-72	176.9	169	0	0	111.5	L158 E159 K164 L165 Q166	L158-E162 WeakPolarHBondContact O-CG 3.44Å; L158-E162 PolarHBondContact O-N 3.31Å; E159-E162 PolarHBondContact O-N 3.06Å; E162-K164 VanDerWaalsContact C-N 3.33Å; E162-K164 PolarHBondContact O-N 3.22Å; E162-L165 PolarHBondContact O-N 3.44Å; E162-Q166 PolarHBondContact O-N 3.27Å
163	Q	96.2	Very high	95.6	Very high	109 Å²	109	106.8 Å²	106.8	51%	0.509	53%	0.529	S	S	.	.	H	α-helix	trans	-59.1	-44.2	174.4	-72.1	176.1	8.7	0	0	111.6	E159 Q166 E167	E159-Q163 VanDerWaalsContact O-CG 3.3Å; E159-Q163 WeakPolarHBondContact O-CG 3.38Å; E159-Q163 PolarHBondContact O-N 3.18Å; E159-Q163 PolarHBondContact OE1-NE2 3.39Å; Q163-Q166 PolarHBondContact O-N 3.04Å; Q163-E167 WeakPolarHBondContact O-CB 3.38Å; Q163-E167 PolarHBondContact O-N 2.83Å
164	K	97.3	Very high	95.7	Very high	120 Å²	120	105.6 Å²	105.6	52%	0.522	53%	0.532	S	S	.	.	H	α-helix	trans	-65.5	-39.6	177.4	-75.8	-72.9	164	-159.7	0	112.5	P160 L161 E162 Q166 E167 I168	P160-K164 WeakPolarHBondContact O-CB 3.33Å; P160-K164 VanDerWaalsContact O-CG 3.31Å; P160-K164 WeakPolarHBondContact O-CG 3.31Å; P160-K164 PolarHBondContact O-N 3.48Å; L161-K164 PolarHBondContact O-N 3.16Å; E162-K164 VanDerWaalsContact C-N 3.33Å; E162-K164 PolarHBondContact O-N 3.22Å; K164-Q166 VanDerWaalsContact C-N 3.33Å; K164-Q166 PolarHBondContact O-N 3.07Å; K164-E167 IonicContact NZ-OE2 3.1Å; K164-E167 PolarHBondContact NZ-OE2 3.29Å; K164-E167 PolarHBondContact O-N 2.79Å; K164-I168 VanDerWaalsContact O-CG1 3.3Å; K164-I168 WeakPolarHBondContact O-CG1 3.47Å; K164-I168 PolarHBondContact O-N 3.09Å
165	L	97.4	Very high	95.8	Very high	112 Å²	112	104.1 Å²	104.1	59%	0.586	52%	0.522	S	S	*	.	H	α-helix	trans	-62.3	-40.6	174.2	-74.8	170.3	0	0	0	111.9	L161 E162 T169	L161-L165 WeakPolarHBondContact O-CG 3.15Å; L161-L165 PolarHBondContact O-N 3.19Å; E162-L165 PolarHBondContact O-N 3.44Å; L165-T169 WeakPolarHBondContact O-CB 3.35Å; L165-T169 PolarHBondContact O-N 3.18Å; L165-T169 PolarHBondContact O-OG1 3.36Å
166	Q	96.8	Very high	96	Very high	147 Å²	147	105.2 Å²	105.2	69%	0.687	53%	0.527	S	S	*	.	H	α-helix	trans	-66.3	-42.5	175.9	-167.4	-178.6	17.6	0	0	111.6	E162 Q163 K164 T169 R170	E162-Q166 PolarHBondContact O-N 3.27Å; Q163-Q166 PolarHBondContact O-N 3.04Å; K164-Q166 VanDerWaalsContact C-N 3.33Å; K164-Q166 PolarHBondContact O-N 3.07Å; Q166-T169 PolarHBondContact O-N 2.88Å; Q166-R170 WeakPolarHBondContact O-CB 3.48Å; Q166-R170 PolarHBondContact O-N 3.47Å
167	E	97.6	Very high	96.1	Very high	88 Å²	88	104.2 Å²	104.2	41%	0.411	52%	0.522	S	S	.	.	H	α-helix	trans	-59.7	-47.5	176.4	-172.9	179.5	-169.8	0	0	111.5	Q163 K164 R170 C171	Q163-E167 WeakPolarHBondContact O-CB 3.38Å; Q163-E167 PolarHBondContact O-N 2.83Å; K164-E167 IonicContact NZ-OE2 3.1Å; K164-E167 PolarHBondContact NZ-OE2 3.29Å; K164-E167 PolarHBondContact O-N 2.79Å; E167-R170 PolarHBondContact O-N 3.01Å; E167-C171 WeakPolarHBondContact O-CB 3.14Å; E167-C171 PolarHBondContact O-N 2.92Å
168	I	97.4	Very high	96.2	Very high	109 Å²	109	105.3 Å²	105.3	56%	0.559	52%	0.519	S	S	*	.	H	α-helix	trans	-63	-45.4	177.9	-70.1	168.2	0	0	0	110.6	K164 R170 C171 K172	K164-I168 VanDerWaalsContact O-CG1 3.3Å; K164-I168 WeakPolarHBondContact O-CG1 3.47Å; K164-I168 PolarHBondContact O-N 3.09Å; I168-R170 VanDerWaalsContact C-N 3.34Å; I168-R170 PolarHBondContact O-N 3.4Å; I168-C171 PolarHBondContact O-N 3.35Å; I168-K172 WeakPolarHBondContact O-CB 3.38Å; I168-K172 PolarHBondContact O-N 3.49Å
169	T	97.8	Very high	96.4	Very high	93 Å²	93	104.4 Å²	104.4	57%	0.571	52%	0.519	S	S	*	.	H	α-helix	trans	-59.9	-45.1	178.4	-61.2	0	0	0	0	111.4	L165 Q166 K172 S173	L165-T169 WeakPolarHBondContact O-CB 3.35Å; L165-T169 PolarHBondContact O-N 3.18Å; L165-T169 PolarHBondContact O-OG1 3.36Å; Q166-T169 PolarHBondContact O-N 2.88Å; T169-K172 PolarHBondContact O-N 2.72Å; T169-S173 WeakPolarHBondContact O-CB 3.37Å; T169-S173 PolarHBondContact O-N 3.08Å
170	R	96.8	Very high	96.6	Very high	173 Å²	173	100.3 Å²	100.3	65%	0.653	51%	0.51	S	S	*	.	H	α-helix	trans	-61.4	-47.5	175.9	-177.4	-179	61.6	161	-1.9	111	Q166 E167 I168 S173 S174	Q166-R170 WeakPolarHBondContact O-CB 3.48Å; Q166-R170 PolarHBondContact O-N 3.47Å; E167-R170 PolarHBondContact O-N 3.01Å; I168-R170 VanDerWaalsContact C-N 3.34Å; I168-R170 PolarHBondContact O-N 3.4Å; R170-S173 PolarHBondContact O-N 3.29Å; R170-S173 PolarHBondContact O-OG 3.09Å; R170-S174 PolarHBondContact O-N 3.43Å
171	C	96.5	Very high	96.6	Very high	66 Å²	66	102 Å²	102	45%	0.446	51%	0.512	S	S	.	.	H	α-helix	trans	-59.7	-49.9	178.7	-165.7	0	0	0	0	111.2	E167 I168 S173 S174 E175	E167-C171 WeakPolarHBondContact O-CB 3.14Å; E167-C171 PolarHBondContact O-N 2.92Å; I168-C171 PolarHBondContact O-N 3.35Å; C171-S173 VanDerWaalsContact C-N 3.34Å; C171-S173 PolarHBondContact O-N 3.37Å; C171-S174 WeakPolarHBondContact O-CA 3.5Å; C171-S174 WeakPolarHBondContact O-CB 3.24Å; C171-S174 PolarHBondContact O-N 3.26Å; C171-E175 WeakPolarHBondContact O-CG 3.43Å; C171-E175 PolarHBondContact O-N 3.37Å
172	K	97.1	Very high	96.7	Very high	126 Å²	126	102 Å²	102	55%	0.548	51%	0.512	S	S	.	.	H	α-helix	trans	-53.8	-48.4	175.5	-180	178.2	172.9	-179.5	0	111.9	I168 T169 S174 E175 E176	I168-K172 WeakPolarHBondContact O-CB 3.38Å; I168-K172 PolarHBondContact O-N 3.49Å; T169-K172 PolarHBondContact O-N 2.72Å; K172-S174 PolarHBondContact O-N 3.46Å; K172-E175 PolarHBondContact O-N 2.96Å; K172-E176 WeakPolarHBondContact CE-OE1 3.37Å; K172-E176 HydrophobicContact CG-CG 4.44Å; K172-E176 IonicContact NZ-OE1 3.31Å; K172-E176 WeakPolarHBondContact O-CG 3.5Å; K172-E176 PolarHBondContact O-N 3.14Å
173	S	95.9	Very high	96.8	Very high	47 Å²	47	103.7 Å²	103.7	33%	0.329	52%	0.517	S	S	.	.	H	α-helix	trans	-62.7	-30.8	178.5	77.8	0	0	0	0	113.2	T169 R170 C171 K177	T169-S173 WeakPolarHBondContact O-CB 3.37Å; T169-S173 PolarHBondContact O-N 3.08Å; R170-S173 PolarHBondContact O-N 3.29Å; R170-S173 PolarHBondContact O-OG 3.09Å; C171-S173 VanDerWaalsContact C-N 3.34Å; C171-S173 PolarHBondContact O-N 3.37Å; S173-K177 WeakPolarHBondContact O-CG 3.34Å
174	S	95.5	Very high	96.8	Very high	64 Å²	64	107 Å²	107	45%	0.448	53%	0.525	S	S	.	.	H	α-helix	trans	-74.1	-43.7	174.6	-170.6	0	0	0	0	111.2	R170 C171 K172 K177 K178	R170-S174 PolarHBondContact O-N 3.43Å; C171-S174 WeakPolarHBondContact O-CA 3.5Å; C171-S174 WeakPolarHBondContact O-CB 3.24Å; C171-S174 PolarHBondContact O-N 3.26Å; K172-S174 PolarHBondContact O-N 3.46Å; S174-K177 PolarHBondContact O-N 3.01Å; S174-K178 PolarHBondContact O-N 2.87Å
175	E	95.4	Very high	96.8	Very high	90 Å²	90	107 Å²	107	42%	0.421	53%	0.53	S	S	.	.	H	α-helix	trans	-62.6	-41.2	177.3	-66.6	-56.9	145.9	0	0	111.6	C171 K172 K177 K178 P179	C171-E175 WeakPolarHBondContact O-CG 3.43Å; C171-E175 PolarHBondContact O-N 3.37Å; K172-E175 PolarHBondContact O-N 2.96Å; E175-K177 PolarHBondContact O-N 3.42Å; E175-K178 PolarHBondContact O-N 3.47Å; E175-K178 VanDerWaalsContact O-N 3.14Å; E175-K178 WeakPolarHBondContact OE1-CE 3.5Å; E175-K178 IonicContact OE1-NZ 3.9Å; E175-K178 PolarHBondContact OE1-NZ 3.3Å; E175-K178 WeakPolarHBondContact OE2-CD 3.45Å; E175-K178 WeakPolarHBondContact OE2-CE 3.5Å; E175-K178 IonicContact OE2-NZ 3.99Å; E175-K178 PolarHBondContact OE2-NZ 3.04Å; E175-P179 WeakPolarHBondContact O-CD 3Å
176	E	96.5	Very high	96.7	Very high	126 Å²	126	105.1 Å²	105.1	59%	0.589	52%	0.523	S	S	*	.	H	α-helix	trans	-63.3	-23.3	178.6	-74.7	173.2	170.3	0	0	113.4	K172	K172-E176 WeakPolarHBondContact CE-OE1 3.37Å; K172-E176 HydrophobicContact CG-CG 4.44Å; K172-E176 IonicContact NZ-OE1 3.31Å; K172-E176 WeakPolarHBondContact O-CG 3.5Å; K172-E176 PolarHBondContact O-N 3.14Å
177	K	96.1	Very high	96.7	Very high	133 Å²	133	102 Å²	102	58%	0.578	51%	0.509	S	S	*	.	H	α-helix	trans	-81.1	-30.3	175.5	-69.6	171.9	-175.1	178.5	0	113.2	S173 S174 E175 G180 E181	S173-K177 WeakPolarHBondContact O-CG 3.34Å; S174-K177 PolarHBondContact O-N 3.01Å; E175-K177 PolarHBondContact O-N 3.42Å; K177-G180 PolarHBondContact O-N 3.09Å; K177-E181 PolarHBondContact O-N 2.96Å
178	K	96.8	Very high	96.6	Very high	92 Å²	92	100.8 Å²	100.8	40%	0.4	51%	0.51	S	S	.	.	H	α-helix	trans	-56.9	-39.3	-175.1	-67.4	-175.4	-170.8	167.6	0	114.3	S174 E175 G180 E181 L182	S174-K178 PolarHBondContact O-N 2.87Å; E175-K178 PolarHBondContact O-N 3.47Å; E175-K178 VanDerWaalsContact O-N 3.14Å; E175-K178 WeakPolarHBondContact OE1-CE 3.5Å; E175-K178 IonicContact OE1-NZ 3.9Å; E175-K178 PolarHBondContact OE1-NZ 3.3Å; E175-K178 WeakPolarHBondContact OE2-CD 3.45Å; E175-K178 WeakPolarHBondContact OE2-CE 3.5Å; E175-K178 IonicContact OE2-NZ 3.99Å; E175-K178 PolarHBondContact OE2-NZ 3.04Å; K178-G180 VanDerWaalsContact C-N 3.27Å; K178-G180 PolarHBondContact O-N 3.17Å; K178-E181 PolarHBondContact O-N 3.43Å; K178-L182 WeakPolarHBondContact O-CB 3.32Å; K178-L182 PolarHBondContact O-N 2.85Å
179	P	97.2	Very high	96.4	Very high	74 Å²	74	102.2 Å²	102.2	48%	0.481	51%	0.508	S	S	.	.	H	α-helix	trans	-58.3	-37.7	175.6	-27.4	34.6	0	0	0	113.4	E175 K183	E175-P179 WeakPolarHBondContact O-CD 3Å; P179-K183 WeakPolarHBondContact O-CB 3.12Å; P179-K183 WeakPolarHBondContact O-CG 3.49Å; P179-K183 PolarHBondContact O-N 2.77Å
180	G	97.1	Very high	96.2	Very high	37 Å²	37	104.5 Å²	104.5	38%	0.381	51%	0.506	S	S	.	.	H	α-helix	trans	-69.6	-39.9	176.8	0	0	0	0	0	112.4	K177 K178 R184	K177-G180 PolarHBondContact O-N 3.09Å; K178-G180 VanDerWaalsContact C-N 3.27Å; K178-G180 PolarHBondContact O-N 3.17Å; G180-R184 WeakPolarHBondContact O-CG 2.92Å; G180-R184 PolarHBondContact O-N 2.92Å; G180-R184 VanDerWaalsContact O-N 3.11Å
181	E	96.7	Very high	96.1	Very high	102 Å²	102	100.5 Å²	100.5	48%	0.477	50%	0.495	S	S	.	.	H	α-helix	trans	-63.6	-46.3	173.1	-70.5	174.2	-175.9	0	0	111.9	K177 K178 K183 R184 L185	K177-E181 PolarHBondContact O-N 2.96Å; K178-E181 PolarHBondContact O-N 3.43Å; E181-K183 PolarHBondContact O-N 3.34Å; E181-R184 PolarHBondContact O-N 2.94Å; E181-L185 WeakPolarHBondContact O-CB 3.42Å; E181-L185 PolarHBondContact O-N 3.45Å
182	L	96.3	Very high	95.7	Very high	107 Å²	107	100.5 Å²	100.5	56%	0.56	49%	0.489	S	S	*	.	H	α-helix	trans	-60.4	-45.6	176.7	179.2	61.6	0	0	0	111.4	K178 R184 L185 V186	K178-L182 WeakPolarHBondContact O-CB 3.32Å; K178-L182 PolarHBondContact O-N 2.85Å; L182-R184 VanDerWaalsContact C-N 3.34Å; L182-R184 PolarHBondContact O-N 3.17Å; L182-L185 PolarHBondContact O-N 3.12Å; L182-V186 HydrophobicContact CD1-CG2 3.96Å; L182-V186 HydrophobicContact CG-CG2 4.31Å; L182-V186 WeakPolarHBondContact O-CB 3.38Å; L182-V186 VanDerWaalsContact O-CG2 3.29Å; L182-V186 WeakPolarHBondContact O-CG2 3.08Å; L182-V186 PolarHBondContact O-N 2.95Å
183	K	97.9	Very high	94.9	Very high	162 Å²	162	98.1 Å²	98.1	70%	0.704	48%	0.481	S	S	*	.	H	α-helix	trans	-57.7	-45.4	176.1	-79.9	179	-179.8	-178.5	0	111.8	P179 E181 V186 E187	P179-K183 WeakPolarHBondContact O-CB 3.12Å; P179-K183 WeakPolarHBondContact O-CG 3.49Å; P179-K183 PolarHBondContact O-N 2.77Å; E181-K183 PolarHBondContact O-N 3.34Å; K183-V186 PolarHBondContact O-N 3.4Å; K183-E187 WeakPolarHBondContact O-CB 3.36Å; K183-E187 PolarHBondContact O-N 2.96Å
184	R	97.8	Very high	94.6	Very high	178 Å²	178	100.3 Å²	100.3	67%	0.672	49%	0.489	S	S	*	.	H	α-helix	trans	-63.2	-42.8	176.9	-73.6	-174.1	-67.5	162.1	-1.1	112.1	G180 E181 L182 E187 S188	G180-R184 WeakPolarHBondContact O-CG 2.92Å; G180-R184 PolarHBondContact O-N 2.92Å; G180-R184 VanDerWaalsContact O-N 3.11Å; E181-R184 PolarHBondContact O-N 2.94Å; L182-R184 VanDerWaalsContact C-N 3.34Å; L182-R184 PolarHBondContact O-N 3.17Å; R184-E187 PolarHBondContact O-N 2.97Å; R184-S188 WeakPolarHBondContact O-CB 3.39Å; R184-S188 PolarHBondContact O-N 3.44Å
185	L	96	Very high	94.2	Very high	121 Å²	121	103.3 Å²	103.3	63%	0.634	49%	0.49	S	S	*	.	H	α-helix	trans	-64.5	-45.3	178.6	-175.7	64.4	0	0	0	111.7	E181 L182 S188 R189	E181-L185 WeakPolarHBondContact O-CB 3.42Å; E181-L185 PolarHBondContact O-N 3.45Å; L182-L185 PolarHBondContact O-N 3.12Å; L185-S188 PolarHBondContact O-N 3.41Å; L185-R189 WeakPolarHBondContact O-CB 3.39Å; L185-R189 PolarHBondContact O-N 2.87Å
186	V	95.6	Very high	93.5	Very high	73 Å²	73	104.1 Å²	104.1	44%	0.442	49%	0.494	S	S	.	.	H	α-helix	trans	-62.5	-43.8	177.2	170	0	0	0	0	110.8	L182 K183 R189 R190	L182-V186 HydrophobicContact CD1-CG2 3.96Å; L182-V186 HydrophobicContact CG-CG2 4.31Å; L182-V186 WeakPolarHBondContact O-CB 3.38Å; L182-V186 VanDerWaalsContact O-CG2 3.29Å; L182-V186 WeakPolarHBondContact O-CG2 3.08Å; L182-V186 PolarHBondContact O-N 2.95Å; K183-V186 PolarHBondContact O-N 3.4Å; V186-R189 PolarHBondContact O-N 3.37Å; V186-R190 WeakPolarHBondContact O-CB 3.38Å; V186-R190 PolarHBondContact O-N 3.38Å
187	E	97.8	Very high	92.7	Very high	81 Å²	81	103.6 Å²	103.6	38%	0.379	49%	0.49	S	S	.	.	H	α-helix	trans	-67.2	-43.1	179.5	-169.7	54.4	-146.8	0	0	111.9	K183 R184 R189 R190 Q191	K183-E187 WeakPolarHBondContact O-CB 3.36Å; K183-E187 PolarHBondContact O-N 2.96Å; R184-E187 PolarHBondContact O-N 2.97Å; E187-R189 VanDerWaalsContact C-N 3.25Å; E187-R189 PolarHBondContact O-N 2.89Å; E187-R190 PolarHBondContact O-N 3.07Å; E187-R190 IonicContact OE2-NH1 3.53Å; E187-Q191 WeakPolarHBondContact O-CG 3.48Å; E187-Q191 PolarHBondContact O-N 3.29Å
188	S	94.8	Very high	92.4	Very high	63 Å²	63	103.2 Å²	103.2	44%	0.441	49%	0.49	S	S	.	.	H	α-helix	trans	-56.9	-41.4	172.3	-177.6	0	0	0	0	111.7	R184 L185 Q192	R184-S188 WeakPolarHBondContact O-CB 3.39Å; R184-S188 PolarHBondContact O-N 3.44Å; L185-S188 PolarHBondContact O-N 3.41Å; S188-Q192 WeakPolarHBondContact O-CB 3.43Å; S188-Q192 PolarHBondContact O-N 2.78Å
189	R	92.4	Very high	91.7	Very high	138 Å²	138	101.9 Å²	101.9	52%	0.521	49%	0.486	S	S	.	.	H	α-helix	trans	-71	-39.8	178.7	-167.9	63.3	174.9	174.8	2.3	112	L185 V186 E187 Q192 I193	L185-R189 WeakPolarHBondContact O-CB 3.39Å; L185-R189 PolarHBondContact O-N 2.87Å; V186-R189 PolarHBondContact O-N 3.37Å; E187-R189 VanDerWaalsContact C-N 3.25Å; E187-R189 PolarHBondContact O-N 2.89Å; R189-Q192 VanDerWaalsContact NH1-CD 3.31Å; R189-Q192 PolarHBondContact O-N 3.27Å; R189-I193 HydrophobicContact CG-CD1 4.34Å; R189-I193 VanDerWaalsContact O-CG1 3.31Å; R189-I193 WeakPolarHBondContact O-CG1 3.22Å; R189-I193 PolarHBondContact O-N 3.07Å
190	R	95.1	Very high	90.7	Very high	141 Å²	141	101.1 Å²	101.1	53%	0.532	48%	0.477	S	S	.	.	H	α-helix	trans	-57.9	-49.2	173.1	173.1	177.9	-94.7	126.7	-4.3	110.4	V186 E187 Q192 I193 L194	V186-R190 WeakPolarHBondContact O-CB 3.38Å; V186-R190 PolarHBondContact O-N 3.38Å; E187-R190 PolarHBondContact O-N 3.07Å; E187-R190 IonicContact OE2-NH1 3.53Å; R190-Q192 VanDerWaalsContact C-N 3.32Å; R190-Q192 PolarHBondContact O-N 3.5Å; R190-I193 PolarHBondContact O-N 3.29Å; R190-L194 HydrophobicContact CG-CD1 4.21Å; R190-L194 WeakPolarHBondContact O-CG 3.3Å; R190-L194 PolarHBondContact O-N 3.07Å
191	Q	94.5	Very high	89.9	Confident	90 Å²	90	104.4 Å²	104.4	42%	0.421	48%	0.482	S	S	.	.	H	α-helix	trans	-63.5	-38	178.1	-69	179.4	-2.3	0	0	112.5	E187 L194 R195	E187-Q191 WeakPolarHBondContact O-CG 3.48Å; E187-Q191 PolarHBondContact O-N 3.29Å; Q191-L194 PolarHBondContact O-N 2.94Å; Q191-R195 WeakPolarHBondContact O-CG 3.37Å; Q191-R195 PolarHBondContact O-N 2.87Å
192	Q	86.9	Confident	89.4	Confident	65 Å²	65	104.4 Å²	104.4	30%	0.304	48%	0.478	S	S	.	.	H	α-helix	trans	-60.9	-47.1	174	179.2	177.7	2	0	0	111.5	S188 R189 R190 L194 R195 E196	S188-Q192 WeakPolarHBondContact O-CB 3.43Å; S188-Q192 PolarHBondContact O-N 2.78Å; R189-Q192 VanDerWaalsContact NH1-CD 3.31Å; R189-Q192 PolarHBondContact O-N 3.27Å; R190-Q192 VanDerWaalsContact C-N 3.32Å; R190-Q192 PolarHBondContact O-N 3.5Å; Q192-L194 VanDerWaalsContact C-N 3.33Å; Q192-L194 PolarHBondContact O-N 3.29Å; Q192-R195 PolarHBondContact O-N 2.77Å; Q192-E196 HydrophobicContact CG-CG 4.46Å; Q192-E196 WeakPolarHBondContact CG-OE1 3.49Å; Q192-E196 PolarHBondContact NE2-OE1 3.21Å; Q192-E196 WeakPolarHBondContact O-CG 3.15Å; Q192-E196 PolarHBondContact O-N 3.13Å
193	I	81	Confident	88.4	Confident	77 Å²	77	102.5 Å²	102.5	40%	0.395	46%	0.463	S	S	.	.	H	α-helix	trans	-57.8	-48.8	177.2	-68.2	163.6	0	0	0	109.8	R189 R190 R195 E196 F197	R189-I193 HydrophobicContact CG-CD1 4.34Å; R189-I193 VanDerWaalsContact O-CG1 3.31Å; R189-I193 WeakPolarHBondContact O-CG1 3.22Å; R189-I193 PolarHBondContact O-N 3.07Å; R190-I193 PolarHBondContact O-N 3.29Å; I193-R195 PolarHBondContact O-N 3.35Å; I193-E196 PolarHBondContact O-N 2.97Å; I193-F197 HydrophobicContact CG2-CD2 3.94Å; I193-F197 HydrophobicContact CG2-CE2 4.05Å; I193-F197 WeakPolarHBondContact O-CD2 3.5Å; I193-F197 PolarHBondContact O-N 2.98Å; I193-F197 VanDerWaalsContact O-N 3.08Å
194	L	90.4	Very high	87.4	Confident	93 Å²	93	97.7 Å²	97.7	49%	0.487	45%	0.445	S	S	.	.	H	α-helix	trans	-58.6	-46.6	179.5	-68.2	173.1	0	0	0	112	R190 Q191 Q192 E196 F197 E198	R190-L194 HydrophobicContact CG-CD1 4.21Å; R190-L194 WeakPolarHBondContact O-CG 3.3Å; R190-L194 PolarHBondContact O-N 3.07Å; Q191-L194 PolarHBondContact O-N 2.94Å; Q192-L194 VanDerWaalsContact C-N 3.33Å; Q192-L194 PolarHBondContact O-N 3.29Å; L194-E196 PolarHBondContact O-N 2.78Å; L194-F197 PolarHBondContact O-N 3.22Å; L194-E198 WeakPolarHBondContact O-CG 3.24Å; L194-E198 PolarHBondContact O-N 3.24Å
195	R	86.9	Confident	86.7	Confident	127 Å²	127	93.6 Å²	93.6	48%	0.479	44%	0.436	S	S	.	.	H	α-helix	trans	-61.6	-41.1	177.4	-73.4	-171	-61.3	-94.7	0.6	113.2	Q191 Q192 I193 F197 E198 E199	Q191-R195 WeakPolarHBondContact O-CG 3.37Å; Q191-R195 PolarHBondContact O-N 2.87Å; Q192-R195 PolarHBondContact O-N 2.77Å; I193-R195 PolarHBondContact O-N 3.35Å; R195-F197 VanDerWaalsContact C-N 3.29Å; R195-F197 PolarHBondContact O-N 2.85Å; R195-E198 PolarHBondContact O-N 3.31Å; R195-E199 WeakPolarHBondContact O-CB 3.48Å; R195-E199 PolarHBondContact O-N 3.45Å
196	E	79.3	Confident	86.1	Confident	107 Å²	107	92.2 Å²	92.2	50%	0.5	43%	0.427	S	S	.	.	H	α-helix	trans	-62.8	-38.5	177.4	-74.6	175.1	-166.4	0	0	111.3	Q192 I193 L194 L200	Q192-E196 HydrophobicContact CG-CG 4.46Å; Q192-E196 WeakPolarHBondContact CG-OE1 3.49Å; Q192-E196 PolarHBondContact NE2-OE1 3.21Å; Q192-E196 WeakPolarHBondContact O-CG 3.15Å; Q192-E196 PolarHBondContact O-N 3.13Å; I193-E196 PolarHBondContact O-N 2.97Å; L194-E196 PolarHBondContact O-N 2.78Å; E196-L200 PolarHBondContact O-N 2.92Å; E196-L200 VanDerWaalsContact O-N 3.14Å
197	F	79.4	Confident	85.1	Confident	115 Å²	115	91.2 Å²	91.2	50%	0.504	42%	0.417	S	S	.	.	H	α-helix	trans	-73.8	-39.6	175.6	-87.3	-91.6	0	0	0	113.1	I193 L194 R195 E199 L200 H201	I193-F197 HydrophobicContact CG2-CD2 3.94Å; I193-F197 HydrophobicContact CG2-CE2 4.05Å; I193-F197 WeakPolarHBondContact O-CD2 3.5Å; I193-F197 PolarHBondContact O-N 2.98Å; I193-F197 VanDerWaalsContact O-N 3.08Å; L194-F197 PolarHBondContact O-N 3.22Å; R195-F197 VanDerWaalsContact C-N 3.29Å; R195-F197 PolarHBondContact O-N 2.85Å; F197-E199 VanDerWaalsContact C-N 3.29Å; F197-E199 PolarHBondContact O-N 2.96Å; F197-L200 WeakPolarHBondContact O-CB 3.38Å; F197-L200 PolarHBondContact O-N 3.29Å; F197-L200 VanDerWaalsContact O-N 3.17Å; F197-H201 PolarHBondContact O-CD2 2.89Å; F197-H201 PolarHBondContact O-N 3.4Å
198	E	90.9	Very high	84.2	Confident	124 Å²	124	92.5 Å²	92.5	58%	0.579	42%	0.423	S	S	*	.	H	α-helix	trans	-58.1	-44.1	174.1	-76.7	168.1	-175.6	0	0	111.2	L194 R195 L200 H201 R202	L194-E198 WeakPolarHBondContact O-CG 3.24Å; L194-E198 PolarHBondContact O-N 3.24Å; R195-E198 PolarHBondContact O-N 3.31Å; E198-L200 VanDerWaalsContact C-N 3.33Å; E198-L200 PolarHBondContact O-N 2.98Å; E198-H201 PolarHBondContact O-N 2.98Å; E198-R202 WeakPolarHBondContact O-CB 3.26Å; E198-R202 PolarHBondContact O-N 3.21Å
199	E	81.1	Confident	83.8	Confident	65 Å²	65	94.5 Å²	94.5	30%	0.304	43%	0.426	S	S	.	.	H	α-helix	trans	-64.7	-37.5	176.3	177.6	61.7	-174.2	0	0	112.2	R195 F197 R202 R203	R195-E199 WeakPolarHBondContact O-CB 3.48Å; R195-E199 PolarHBondContact O-N 3.45Å; F197-E199 VanDerWaalsContact C-N 3.29Å; F197-E199 PolarHBondContact O-N 2.96Å; E199-R202 IonicContact OE1-CZ 3.96Å; E199-R202 IonicContact OE1-NE 2.71Å; E199-R202 IonicContact OE1-NH2 3.8Å; E199-R202 PolarHBondContact OE1-NH2 2.85Å; E199-R202 IonicContact OE2-CZ 3.16Å; E199-R202 IonicContact OE2-NE 2.78Å; E199-R202 PolarHBondContact OE2-NE 3.08Å; E199-R202 IonicContact OE2-NH2 3.72Å; E199-R202 PolarHBondContact OE2-NH2 2.88Å; E199-R203 WeakPolarHBondContact O-CD 3.34Å; E199-R203 VanDerWaalsContact O-CG 3.26Å; E199-R203 WeakPolarHBondContact O-CG 3.15Å; E199-R203 PolarHBondContact O-N 3.44Å; E199-R203 VanDerWaalsContact O-N 3.14Å; E199-R203 IonicContact OE1-CZ 2.75Å; E199-R203 IonicContact OE1-NE 2.58Å; E199-R203 PolarHBondContact OE1-NE 3.21Å; E199-R203 IonicContact OE1-NH2 2.84Å; E199-R203 PolarHBondContact OE1-NH2 2.88Å
200	L	75.9	Confident	83.3	Confident	58 Å²	58	92 Å²	92	30%	0.304	43%	0.426	S	S	.	.	H	α-helix	trans	-63.5	-47.4	173.6	-175.5	68.7	0	0	0	111.2	E196 F197 E198 R203 L204 I301	E196-L200 PolarHBondContact O-N 2.92Å; E196-L200 VanDerWaalsContact O-N 3.14Å; F197-L200 WeakPolarHBondContact O-CB 3.38Å; F197-L200 PolarHBondContact O-N 3.29Å; F197-L200 VanDerWaalsContact O-N 3.17Å; E198-L200 VanDerWaalsContact C-N 3.33Å; E198-L200 PolarHBondContact O-N 2.98Å; L200-R203 PolarHBondContact O-N 3.2Å; L200-L204 HydrophobicContact CG-CD1 4.28Å; L200-L204 VanDerWaalsContact O-CG 3.3Å; L200-L204 WeakPolarHBondContact O-CG 3.06Å; L200-L204 PolarHBondContact O-N 3.38Å; L200-I301 HydrophobicContact CD1-CD1 3.45Å; L200-I301 VanDerWaalsContact CD1-CD1 3.45Å; L200-I301 HydrophobicContact CD1-CG1 4.21Å; L200-I301 HydrophobicContact CD1-CG2 3.85Å
201	H	81.9	Confident	82.4	Confident	106 Å²	106	89.5 Å²	89.5	49%	0.491	42%	0.422	S	S	.	.	H	α-helix	trans	-60	-48.4	177.5	-73.8	-56.4	0	0	0	111.5	F197 E198 R203 L204 D205	F197-H201 PolarHBondContact O-CD2 2.89Å; F197-H201 PolarHBondContact O-N 3.4Å; E198-H201 PolarHBondContact O-N 2.98Å; H201-R203 VanDerWaalsContact C-N 3.28Å; H201-R203 PolarHBondContact O-N 3.32Å; H201-L204 WeakPolarHBondContact O-CB 3.4Å; H201-L204 PolarHBondContact O-N 3.21Å; H201-L204 VanDerWaalsContact O-N 3.08Å; H201-D205 PolarHBondContact O-N 2.86Å
202	R	85.4	Confident	81.9	Confident	102 Å²	102	88.7 Å²	88.7	39%	0.385	42%	0.42	S	S	.	.	H	α-helix	trans	-53.6	-45.3	177	-173.8	-173.1	66.7	74.9	4.6	112	E198 E199 D205 E206	E198-R202 WeakPolarHBondContact O-CB 3.26Å; E198-R202 PolarHBondContact O-N 3.21Å; E199-R202 IonicContact OE1-CZ 3.96Å; E199-R202 IonicContact OE1-NE 2.71Å; E199-R202 IonicContact OE1-NH2 3.8Å; E199-R202 PolarHBondContact OE1-NH2 2.85Å; E199-R202 IonicContact OE2-CZ 3.16Å; E199-R202 IonicContact OE2-NE 2.78Å; E199-R202 PolarHBondContact OE2-NE 3.08Å; E199-R202 IonicContact OE2-NH2 3.72Å; E199-R202 PolarHBondContact OE2-NH2 2.88Å; R202-D205 PolarHBondContact O-N 3.46Å; R202-E206 IonicContact CZ-OE1 2.72Å; R202-E206 IonicContact CZ-OE2 2.62Å; R202-E206 IonicContact NH1-OE1 3.76Å; R202-E206 PolarHBondContact NH1-OE1 3.42Å; R202-E206 IonicContact NH1-OE2 2.71Å; R202-E206 PolarHBondContact NH1-OE2 2.93Å; R202-E206 WeakPolarHBondContact O-CG 3.44Å; R202-E206 PolarHBondContact O-N 3.47Å
203	R	76	Confident	81.9	Confident	66 Å²	66	88 Å²	88	25%	0.249	42%	0.422	C	S	.	.	H	α-helix	trans	-67.8	-38.9	178.9	-71	166.3	-178.2	-115.1	-0.1	112.9	E199 L200 H201 D205 E206 E207	E199-R203 WeakPolarHBondContact O-CD 3.34Å; E199-R203 VanDerWaalsContact O-CG 3.26Å; E199-R203 WeakPolarHBondContact O-CG 3.15Å; E199-R203 PolarHBondContact O-N 3.44Å; E199-R203 VanDerWaalsContact O-N 3.14Å; E199-R203 IonicContact OE1-CZ 2.75Å; E199-R203 IonicContact OE1-NE 2.58Å; E199-R203 PolarHBondContact OE1-NE 3.21Å; E199-R203 IonicContact OE1-NH2 2.84Å; E199-R203 PolarHBondContact OE1-NH2 2.88Å; L200-R203 PolarHBondContact O-N 3.2Å; H201-R203 VanDerWaalsContact C-N 3.28Å; H201-R203 PolarHBondContact O-N 3.32Å; R203-D205 VanDerWaalsContact C-N 3.31Å; R203-E206 PolarHBondContact O-N 3.35Å; R203-E207 WeakPolarHBondContact O-CG 3.25Å; R203-E207 PolarHBondContact O-N 3.12Å
204	L	77.1	Confident	82	Confident	62 Å²	62	89.7 Å²	89.7	33%	0.325	42%	0.424	S	S	.	.	H	α-helix	trans	-63.2	-42.1	175.7	-70.9	173.9	0	0	0	110.8	L200 H201 E207 Q208 A297 I301	L200-L204 HydrophobicContact CG-CD1 4.28Å; L200-L204 VanDerWaalsContact O-CG 3.3Å; L200-L204 WeakPolarHBondContact O-CG 3.06Å; L200-L204 PolarHBondContact O-N 3.38Å; H201-L204 WeakPolarHBondContact O-CB 3.4Å; H201-L204 PolarHBondContact O-N 3.21Å; H201-L204 VanDerWaalsContact O-N 3.08Å; L204-E207 PolarHBondContact O-N 2.8Å; L204-Q208 WeakPolarHBondContact O-CB 3.48Å; L204-Q208 PolarHBondContact O-N 2.87Å; L204-A297 HydrophobicContact CD2-CB 3.65Å; L204-I301 HydrophobicContact CD2-CD1 3.79Å; L204-I301 HydrophobicContact CG-CD1 4.22Å
205	D	83.3	Confident	81.7	Confident	92 Å²	92	88.7 Å²	88.7	49%	0.492	42%	0.419	S	S	.	.	H	α-helix	trans	-64.6	-44.1	176.5	-68.8	-25.6	0	0	0	111.1	H201 R202 R203 E207 Q208 Q209	H201-D205 PolarHBondContact O-N 2.86Å; R202-D205 PolarHBondContact O-N 3.46Å; R203-D205 VanDerWaalsContact C-N 3.31Å; D205-E207 PolarHBondContact O-N 3.03Å; D205-Q208 WeakPolarHBondContact O-CB 3.25Å; D205-Q208 PolarHBondContact O-N 2.81Å; D205-Q209 WeakPolarHBondContact O-CG 3.37Å; D205-Q209 PolarHBondContact O-N 2.8Å
206	E	81.5	Confident	81.8	Confident	91 Å²	91	87.7 Å²	87.7	43%	0.425	42%	0.419	S	S	.	.	H	α-helix	trans	-59.2	-46.8	175.5	-77.2	170.8	179.1	0	0	112.4	R202 R203 Q208 Q209 V210	R202-E206 IonicContact CZ-OE1 2.72Å; R202-E206 IonicContact CZ-OE2 2.62Å; R202-E206 IonicContact NH1-OE1 3.76Å; R202-E206 PolarHBondContact NH1-OE1 3.42Å; R202-E206 IonicContact NH1-OE2 2.71Å; R202-E206 PolarHBondContact NH1-OE2 2.93Å; R202-E206 WeakPolarHBondContact O-CG 3.44Å; R202-E206 PolarHBondContact O-N 3.47Å; R203-E206 PolarHBondContact O-N 3.35Å; E206-Q208 VanDerWaalsContact C-N 3.32Å; E206-Q208 PolarHBondContact O-N 2.87Å; E206-Q209 PolarHBondContact O-N 3.48Å; E206-V210 WeakPolarHBondContact O-CG2 3.33Å; E206-V210 PolarHBondContact O-N 2.89Å
207	E	74.9	Confident	82.3	Confident	53 Å²	53	88.6 Å²	88.6	25%	0.248	42%	0.424	C	S	.	.	H	α-helix	trans	-64.1	-38.6	176.2	-70.6	-63	135.8	0	0	111.9	R203 L204 D205 Q209 V210 L211 K300	R203-E207 WeakPolarHBondContact O-CG 3.25Å; R203-E207 PolarHBondContact O-N 3.12Å; L204-E207 PolarHBondContact O-N 2.8Å; D205-E207 PolarHBondContact O-N 3.03Å; E207-Q209 VanDerWaalsContact C-N 3.34Å; E207-Q209 PolarHBondContact O-N 3.34Å; E207-V210 PolarHBondContact O-N 2.73Å; E207-L211 VanDerWaalsContact O-CG 3.25Å; E207-L211 WeakPolarHBondContact O-CG 3.07Å; E207-L211 PolarHBondContact O-N 2.9Å; E207-L211 VanDerWaalsContact O-N 3.1Å; E207-K300 VanDerWaalsContact CD-CD 3.46Å; E207-K300 HydrophobicContact CG-CD 4.39Å; E207-K300 WeakPolarHBondContact OE1-CD 3.37Å; E207-K300 WeakPolarHBondContact OE1-CE 3.38Å; E207-K300 IonicContact OE1-NZ 2.72Å; E207-K300 PolarHBondContact OE1-NZ 2.88Å; E207-K300 VanDerWaalsContact OE2-CD 3.23Å; E207-K300 WeakPolarHBondContact OE2-CD 3.3Å; E207-K300 IonicContact OE2-NZ 2.99Å; E207-K300 PolarHBondContact OE2-NZ 2.9Å
208	Q	79.9	Confident	82.7	Confident	107 Å²	107	84.4 Å²	84.4	50%	0.5	41%	0.406	S	S	.	.	H	α-helix	trans	-59.9	-45.5	174.5	179.9	-179.5	-53.1	0	0	111	L204 D205 E206 L211 L212	L204-Q208 WeakPolarHBondContact O-CB 3.48Å; L204-Q208 PolarHBondContact O-N 2.87Å; D205-Q208 WeakPolarHBondContact O-CB 3.25Å; D205-Q208 PolarHBondContact O-N 2.81Å; E206-Q208 VanDerWaalsContact C-N 3.32Å; E206-Q208 PolarHBondContact O-N 2.87Å; Q208-L211 PolarHBondContact O-N 2.95Å; Q208-L212 HydrophobicContact CG-CD1 4.15Å; Q208-L212 WeakPolarHBondContact O-CG 3.47Å; Q208-L212 PolarHBondContact O-N 2.86Å
209	Q	86	Confident	82.6	Confident	106 Å²	106	83.9 Å²	83.9	50%	0.495	40%	0.403	S	S	.	.	H	α-helix	trans	-62.9	-43.8	179.1	-67.4	-55.2	-28.9	0	0	111.8	D205 E206 E207 L211 L212 S213	D205-Q209 WeakPolarHBondContact O-CG 3.37Å; D205-Q209 PolarHBondContact O-N 2.8Å; E206-Q209 PolarHBondContact O-N 3.48Å; E207-Q209 VanDerWaalsContact C-N 3.34Å; E207-Q209 PolarHBondContact O-N 3.34Å; Q209-L211 VanDerWaalsContact C-N 3.29Å; Q209-L211 PolarHBondContact O-N 2.82Å; Q209-L212 PolarHBondContact O-N 2.92Å; Q209-S213 PolarHBondContact O-N 3.33Å; Q209-S213 PolarHBondContact O-OG 2.91Å; Q209-S213 VanDerWaalsContact O-OG 3.13Å
210	V	81	Confident	83.2	Confident	86 Å²	86	86.8 Å²	86.8	52%	0.521	42%	0.417	S	S	.	.	H	α-helix	trans	-58.7	-41.3	176.9	170.8	0	0	0	0	111.8	E206 E207 R214	E206-V210 WeakPolarHBondContact O-CG2 3.33Å; E206-V210 PolarHBondContact O-N 2.89Å; E207-V210 PolarHBondContact O-N 2.73Å; V210-R214 PolarHBondContact O-N 3.24Å
211	L	77.6	Confident	84	Confident	87 Å²	87	88.2 Å²	88.2	46%	0.455	43%	0.425	S	S	.	.	H	α-helix	trans	-66.5	-40.3	178.2	-68.1	171	0	0	0	112.2	E207 Q208 Q209 L215 F288	E207-L211 VanDerWaalsContact O-CG 3.25Å; E207-L211 WeakPolarHBondContact O-CG 3.07Å; E207-L211 PolarHBondContact O-N 2.9Å; E207-L211 VanDerWaalsContact O-N 3.1Å; Q208-L211 PolarHBondContact O-N 2.95Å; Q209-L211 VanDerWaalsContact C-N 3.29Å; Q209-L211 PolarHBondContact O-N 2.82Å; L211-L215 PolarHBondContact O-N 3.31Å; L211-F288 HydrophobicContact CD2-CD1 3.92Å; L211-F288 HydrophobicContact CD2-CE1 3.37Å; L211-F288 HydrophobicContact CD2-CZ 4.32Å
212	L	84.3	Confident	84.5	Confident	73 Å²	73	83.8 Å²	83.8	38%	0.382	41%	0.405	S	S	.	.	H	α-helix	trans	-66.5	-46.3	176.7	-69.5	173.3	0	0	0	111.2	Q208 Q209 R214 L215 E216	Q208-L212 HydrophobicContact CG-CD1 4.15Å; Q208-L212 WeakPolarHBondContact O-CG 3.47Å; Q208-L212 PolarHBondContact O-N 2.86Å; Q209-L212 PolarHBondContact O-N 2.92Å; L212-R214 VanDerWaalsContact C-N 3.32Å; L212-R214 PolarHBondContact O-N 3.47Å; L212-L215 WeakPolarHBondContact O-CB 3.1Å; L212-L215 PolarHBondContact O-N 3.46Å; L212-L215 VanDerWaalsContact O-N 3.1Å; L212-E216 WeakPolarHBondContact O-CG 3.41Å; L212-E216 PolarHBondContact O-N 3.44Å
213	S	87	Confident	84.9	Confident	50 Å²	50	82.4 Å²	82.4	35%	0.35	41%	0.405	S	S	.	.	H	α-helix	trans	-59.8	-41.6	177.4	-59.6	0	0	0	0	112.3	Q209 L215 E216 E217	Q209-S213 PolarHBondContact O-N 3.33Å; Q209-S213 PolarHBondContact O-OG 2.91Å; Q209-S213 VanDerWaalsContact O-OG 3.13Å; S213-L215 VanDerWaalsContact C-N 3.31Å; S213-L215 PolarHBondContact O-N 3.11Å; S213-E216 PolarHBondContact O-N 3.42Å; S213-E217 WeakPolarHBondContact O-CG 3.37Å; S213-E217 PolarHBondContact O-N 2.82Å
214	R	82.5	Confident	85.8	Confident	113 Å²	113	82.9 Å²	82.9	43%	0.426	41%	0.41	S	S	.	.	H	α-helix	trans	-63.9	-36.6	176.2	-179.1	169.9	169.6	-178.9	1.3	112.5	V210 L212 E217 E218 E285 F288	V210-R214 PolarHBondContact O-N 3.24Å; L212-R214 VanDerWaalsContact C-N 3.32Å; L212-R214 PolarHBondContact O-N 3.47Å; R214-E217 PolarHBondContact O-N 3.24Å; R214-E218 WeakPolarHBondContact O-CB 3.4Å; R214-E218 PolarHBondContact O-N 2.96Å; R214-E285 IonicContact CZ-OE2 2.62Å; R214-E285 IonicContact NH2-OE2 2.64Å; R214-E285 PolarHBondContact NH2-OE2 3.25Å; R214-F288 HydrophobicContact CG-CZ 4.46Å
215	L	83.6	Confident	86.6	Confident	72 Å²	72	85.3 Å²	85.3	38%	0.377	42%	0.415	S	S	.	.	H	α-helix	trans	-68	-40.2	175.9	-178.5	64.3	0	0	0	111.3	L211 L212 S213 E218 E219 L284	L211-L215 PolarHBondContact O-N 3.31Å; L212-L215 WeakPolarHBondContact O-CB 3.1Å; L212-L215 PolarHBondContact O-N 3.46Å; L212-L215 VanDerWaalsContact O-N 3.1Å; S213-L215 VanDerWaalsContact C-N 3.31Å; S213-L215 PolarHBondContact O-N 3.11Å; L215-E218 PolarHBondContact O-N 2.85Å; L215-E219 WeakPolarHBondContact O-CB 3.35Å; L215-E219 PolarHBondContact O-N 2.92Å; L215-L284 HydrophobicContact CD1-CD1 4.34Å; L215-L284 HydrophobicContact CD1-CD2 4.35Å
216	E	89.6	Confident	87.1	Confident	106 Å²	106	83.6 Å²	83.6	50%	0.495	41%	0.405	S	S	.	.	H	α-helix	trans	-63.3	-41.3	174.4	-71.5	173.3	-176.4	0	0	111.7	L212 S213 E219 Q220	L212-E216 WeakPolarHBondContact O-CG 3.41Å; L212-E216 PolarHBondContact O-N 3.44Å; S213-E216 PolarHBondContact O-N 3.42Å; E216-E219 PolarHBondContact O-N 2.95Å; E216-Q220 WeakPolarHBondContact O-CB 3.27Å; E216-Q220 VanDerWaalsContact O-CG 3.26Å; E216-Q220 WeakPolarHBondContact O-CG 3.27Å; E216-Q220 PolarHBondContact O-N 3.48Å
217	E	89.9	Confident	87.7	Confident	126 Å²	126	86.4 Å²	86.4	59%	0.589	41%	0.412	S	S	*	.	H	α-helix	trans	-61.6	-44.4	174.6	-74.6	171.9	-170.5	0	0	111.8	S213 R214 Q220 D221	S213-E217 WeakPolarHBondContact O-CG 3.37Å; S213-E217 PolarHBondContact O-N 2.82Å; R214-E217 PolarHBondContact O-N 3.24Å; E217-Q220 PolarHBondContact O-N 2.86Å; E217-D221 PolarHBondContact O-N 3.36Å
218	E	86.7	Confident	88.7	Confident	28 Å²	28	89.1 Å²	89.1	13%	0.131	42%	0.424	C	S	.	.	H	α-helix	trans	-64.8	-42.4	177.3	-175.1	175	-167.4	0	0	112	R214 L215 Q220 D221 I222 L284 E285	R214-E218 WeakPolarHBondContact O-CB 3.4Å; R214-E218 PolarHBondContact O-N 2.96Å; L215-E218 PolarHBondContact O-N 2.85Å; E218-Q220 VanDerWaalsContact C-N 3.32Å; E218-Q220 PolarHBondContact O-N 3.34Å; E218-D221 PolarHBondContact O-N 3.38Å; E218-I222 HydrophobicContact CG-CD1 4.06Å; E218-I222 WeakPolarHBondContact O-CG1 2.93Å; E218-I222 PolarHBondContact O-N 3.39Å; E218-L284 HydrophobicContact CG-CD2 4.1Å; E218-L284 WeakPolarHBondContact OE1-CA 3.34Å; E218-E285 WeakPolarHBondContact OE1-CB 3.37Å; E218-E285 WeakPolarHBondContact OE1-CG 3.46Å; E218-E285 PolarHBondContact OE1-N 2.93Å
219	E	89.6	Confident	89.3	Confident	112 Å²	112	85.2 Å²	85.2	52%	0.523	41%	0.407	S	S	.	.	H	α-helix	trans	-58	-45.8	173.2	-179.9	179.9	-158.3	0	0	111.1	L215 E216 I222 L223	L215-E219 WeakPolarHBondContact O-CB 3.35Å; L215-E219 PolarHBondContact O-N 2.92Å; E216-E219 PolarHBondContact O-N 2.95Å; E219-I222 PolarHBondContact O-N 2.87Å; E219-L223 HydrophobicContact CG-CD1 3.92Å; E219-L223 HydrophobicContact CG-CG 4.37Å; E219-L223 WeakPolarHBondContact O-CB 3.4Å; E219-L223 VanDerWaalsContact O-CG 3.26Å; E219-L223 WeakPolarHBondContact O-CG 3.35Å; E219-L223 PolarHBondContact O-N 3.33Å
220	Q	94.3	Very high	89.6	Confident	126 Å²	126	83.1 Å²	83.1	59%	0.589	41%	0.408	S	S	*	.	H	α-helix	trans	-63.6	-42	179.3	-73.6	176.4	19.4	0	0	112.6	E216 E217 E218 L223 Q224	E216-Q220 WeakPolarHBondContact O-CB 3.27Å; E216-Q220 VanDerWaalsContact O-CG 3.26Å; E216-Q220 WeakPolarHBondContact O-CG 3.27Å; E216-Q220 PolarHBondContact O-N 3.48Å; E217-Q220 PolarHBondContact O-N 2.86Å; E218-Q220 VanDerWaalsContact C-N 3.32Å; E218-Q220 PolarHBondContact O-N 3.34Å; Q220-L223 PolarHBondContact O-N 3.02Å; Q220-Q224 WeakPolarHBondContact O-CB 3.3Å; Q220-Q224 PolarHBondContact O-N 2.95Å
221	D	92.6	Very high	90.3	Very high	88 Å²	88	81.7 Å²	81.7	47%	0.471	41%	0.405	S	S	.	.	H	α-helix	trans	-60.8	-49.5	175.8	179.5	70.8	0	0	0	111.6	E217 E218 L223 Q224 R225	E217-D221 PolarHBondContact O-N 3.36Å; E218-D221 PolarHBondContact O-N 3.38Å; D221-L223 PolarHBondContact O-N 3.43Å; D221-Q224 PolarHBondContact O-N 2.96Å; D221-R225 WeakPolarHBondContact O-CG 3.43Å; D221-R225 PolarHBondContact O-N 2.7Å; D221-R225 VanDerWaalsContact OD2-CD 3.25Å; D221-R225 WeakPolarHBondContact OD2-CD 3.34Å; D221-R225 IonicContact OD2-NH1 2.84Å
222	I	91.5	Very high	91	Very high	13 Å²	13	81.5 Å²	81.5	7%	0.067	40%	0.402	C	S	.	.	H	α-helix	trans	-62.3	-44.7	179.9	-65.9	170.4	0	0	0	110.3	E218 E219 Q224 R225 L226 I282 L284	E218-I222 HydrophobicContact CG-CD1 4.06Å; E218-I222 WeakPolarHBondContact O-CG1 2.93Å; E218-I222 PolarHBondContact O-N 3.39Å; E219-I222 PolarHBondContact O-N 2.87Å; I222-Q224 VanDerWaalsContact C-N 3.32Å; I222-Q224 PolarHBondContact O-N 2.79Å; I222-R225 PolarHBondContact O-N 3.12Å; I222-L226 HydrophobicContact CG2-CD1 3.89Å; I222-L226 HydrophobicContact CG2-CG 4.37Å; I222-L226 WeakPolarHBondContact O-CB 3.12Å; I222-L226 VanDerWaalsContact O-CG 3.27Å; I222-L226 WeakPolarHBondContact O-CG 3.4Å; I222-L226 PolarHBondContact O-N 3.02Å; I222-I282 HydrophobicContact CG2-CG2 4.04Å; I222-L284 HydrophobicContact CD1-CD2 3.93Å
223	L	94.4	Very high	91.4	Very high	74 Å²	74	80.8 Å²	80.8	39%	0.387	40%	0.398	S	S	.	.	H	α-helix	trans	-61.5	-39.5	176.9	-75.7	175.3	0	0	0	112.3	E219 Q220 D221 L226 R227	E219-L223 HydrophobicContact CG-CD1 3.92Å; E219-L223 HydrophobicContact CG-CG 4.37Å; E219-L223 WeakPolarHBondContact O-CB 3.4Å; E219-L223 VanDerWaalsContact O-CG 3.26Å; E219-L223 WeakPolarHBondContact O-CG 3.35Å; E219-L223 PolarHBondContact O-N 3.33Å; Q220-L223 PolarHBondContact O-N 3.02Å; D221-L223 PolarHBondContact O-N 3.43Å; L223-L226 PolarHBondContact O-N 3.09Å; L223-R227 WeakPolarHBondContact O-CG 3.24Å; L223-R227 PolarHBondContact O-N 3.09Å
224	Q	95.2	Very high	91.7	Very high	76 Å²	76	79 Å²	79	36%	0.355	39%	0.388	S	S	.	.	H	α-helix	trans	-65.4	-47.4	177.9	-177.1	58.4	27.1	0	0	111	Q220 D221 I222 L226 R227 E228	Q220-Q224 WeakPolarHBondContact O-CB 3.3Å; Q220-Q224 PolarHBondContact O-N 2.95Å; D221-Q224 PolarHBondContact O-N 2.96Å; I222-Q224 VanDerWaalsContact C-N 3.32Å; I222-Q224 PolarHBondContact O-N 2.79Å; Q224-L226 VanDerWaalsContact C-N 3.3Å; Q224-L226 PolarHBondContact O-N 3.08Å; Q224-R227 WeakPolarHBondContact O-CB 3.17Å; Q224-R227 PolarHBondContact O-N 3.38Å; Q224-R227 VanDerWaalsContact O-N 3.15Å; Q224-E228 PolarHBondContact NE2-OE1 3.47Å; Q224-E228 WeakPolarHBondContact O-CG 3.31Å; Q224-E228 PolarHBondContact O-N 3.46Å
225	R	93.9	Very high	92.1	Very high	113 Å²	113	77.1 Å²	77.1	43%	0.426	39%	0.386	S	S	.	.	H	α-helix	trans	-60.5	-38.7	175.9	-70.4	168.2	58	-165.9	-4.1	112.5	D221 I222 N229 V280	D221-R225 WeakPolarHBondContact O-CG 3.43Å; D221-R225 PolarHBondContact O-N 2.7Å; D221-R225 VanDerWaalsContact OD2-CD 3.25Å; D221-R225 WeakPolarHBondContact OD2-CD 3.34Å; D221-R225 IonicContact OD2-NH1 2.84Å; I222-R225 PolarHBondContact O-N 3.12Å; R225-N229 WeakPolarHBondContact O-CB 3.42Å; R225-N229 PolarHBondContact O-N 3.09Å; R225-V280 HydrophobicContact CB-CG1 4.2Å
226	L	93	Very high	92.5	Very high	55 Å²	55	75.7 Å²	75.7	29%	0.288	38%	0.377	S	S	.	.	H	α-helix	trans	-64.3	-43.3	174.7	-75.2	168.5	0	0	0	111.9	I222 L223 Q224 N229 A230 V280 I282	I222-L226 HydrophobicContact CG2-CD1 3.89Å; I222-L226 HydrophobicContact CG2-CG 4.37Å; I222-L226 WeakPolarHBondContact O-CB 3.12Å; I222-L226 VanDerWaalsContact O-CG 3.27Å; I222-L226 WeakPolarHBondContact O-CG 3.4Å; I222-L226 PolarHBondContact O-N 3.02Å; L223-L226 PolarHBondContact O-N 3.09Å; Q224-L226 VanDerWaalsContact C-N 3.3Å; Q224-L226 PolarHBondContact O-N 3.08Å; L226-N229 PolarHBondContact O-N 3.32Å; L226-A230 WeakPolarHBondContact O-CB 3.39Å; L226-A230 PolarHBondContact O-N 3.37Å; L226-V280 HydrophobicContact CD2-CB 3.91Å; L226-V280 HydrophobicContact CD2-CG1 4.09Å; L226-V280 HydrophobicContact CG-CG1 4.32Å; L226-I282 HydrophobicContact CD1-CD1 4.29Å; L226-I282 HydrophobicContact CD1-CG1 4.32Å; L226-I282 HydrophobicContact CD2-CG1 4.48Å
227	R	94.6	Very high	92.6	Very high	151 Å²	151	79 Å²	79	57%	0.57	39%	0.385	S	S	*	.	H	α-helix	trans	-62.2	-47	176.7	-78.3	-176.9	-122	147.2	-5.8	111.8	L223 Q224 A230 A231	L223-R227 WeakPolarHBondContact O-CG 3.24Å; L223-R227 PolarHBondContact O-N 3.09Å; Q224-R227 WeakPolarHBondContact O-CB 3.17Å; Q224-R227 PolarHBondContact O-N 3.38Å; Q224-R227 VanDerWaalsContact O-N 3.15Å; R227-A230 PolarHBondContact O-N 3.27Å; R227-A231 PolarHBondContact O-N 2.55Å
228	E	94.6	Very high	92.8	Very high	109 Å²	109	79.6 Å²	79.6	51%	0.509	38%	0.382	S	S	.	.	H	α-helix	trans	-62	-44.4	178.5	-72.3	172.1	-173.3	0	0	111.5	Q224 A230 A231 H232	Q224-E228 PolarHBondContact NE2-OE1 3.47Å; Q224-E228 WeakPolarHBondContact O-CG 3.31Å; Q224-E228 PolarHBondContact O-N 3.46Å; E228-A230 PolarHBondContact O-N 3.33Å; E228-A231 PolarHBondContact O-N 3.29Å; E228-H232 WeakPolarHBondContact O-CB 3.44Å; E228-H232 PolarHBondContact O-N 2.79Å
229	N	93.3	Very high	93	Very high	25 Å²	25	83.6 Å²	83.6	13%	0.134	40%	0.404	C	S	.	.	H	α-helix	trans	-64.4	-40.7	176.4	-168.7	50.6	0	0	0	111.9	R225 L226 A231 H232 L233 T278 V280	R225-N229 WeakPolarHBondContact O-CB 3.42Å; R225-N229 PolarHBondContact O-N 3.09Å; L226-N229 PolarHBondContact O-N 3.32Å; N229-A231 PolarHBondContact O-N 2.82Å; N229-H232 PolarHBondContact O-N 2.69Å; N229-L233 WeakPolarHBondContact O-CB 3.42Å; N229-L233 VanDerWaalsContact O-CG 3.24Å; N229-L233 WeakPolarHBondContact O-CG 3.43Å; N229-L233 PolarHBondContact O-N 3.41Å; N229-T278 PolarHBondContact ND2-O 3.11Å; N229-T278 VanDerWaalsContact ND2-O 3.11Å; N229-T278 PolarHBondContact OD1-O 2.84Å; N229-V280 HydrophobicContact CB-CG2 3.61Å
230	A	93.3	Very high	93.2	Very high	62 Å²	62	81.3 Å²	81.3	51%	0.512	40%	0.395	S	S	.	.	H	α-helix	trans	-62.5	-41.7	176.8	0	0	0	0	0	112.2	L226 R227 E228 G234	L226-A230 WeakPolarHBondContact O-CB 3.39Å; L226-A230 PolarHBondContact O-N 3.37Å; R227-A230 PolarHBondContact O-N 3.27Å; E228-A230 PolarHBondContact O-N 3.33Å; A230-G234 PolarHBondContact O-N 2.79Å
231	A	93.8	Very high	93.2	Very high	56 Å²	56	78.1 Å²	78.1	46%	0.463	39%	0.39	S	S	.	.	H	α-helix	trans	-62.2	-49.6	174.8	0	0	0	0	0	111.2	R227 E228 N229 L233 G234 D235	R227-A231 PolarHBondContact O-N 2.55Å; E228-A231 PolarHBondContact O-N 3.29Å; N229-A231 PolarHBondContact O-N 2.82Å; A231-L233 PolarHBondContact O-N 2.79Å; A231-G234 CarbonylContact O-C 3.56Å; A231-G234 WeakPolarHBondContact O-CA 3.31Å; A231-G234 PolarHBondContact O-N 3.29Å; A231-D235 PolarHBondContact O-N 3.22Å
232	H	93.2	Very high	93.2	Very high	84 Å²	84	80.4 Å²	80.4	39%	0.389	40%	0.398	S	S	.	.	H	α-helix	trans	-60.2	-41.8	178.2	172.2	-112.5	0	0	0	113	E228 N229 G234 D235 K236	E228-H232 WeakPolarHBondContact O-CB 3.44Å; E228-H232 PolarHBondContact O-N 2.79Å; N229-H232 PolarHBondContact O-N 2.69Å; H232-G234 VanDerWaalsContact C-N 3.32Å; H232-D235 PolarHBondContact O-N 2.66Å; H232-K236 WeakPolarHBondContact CE1-CE 3.48Å; H232-K236 PolarHBondContact CE1-NZ 2.79Å; H232-K236 WeakPolarHBondContact NE2-CE 3.48Å; H232-K236 PolarHBondContact O-N 3.14Å
233	L	92.4	Very high	93.3	Very high	57 Å²	57	80.8 Å²	80.8	30%	0.298	40%	0.4	S	S	.	.	H	α-helix	trans	-65.5	-36.7	172.8	-69.4	177.2	0	0	0	111.9	N229 A231 D235 R237 V277	N229-L233 WeakPolarHBondContact O-CB 3.42Å; N229-L233 VanDerWaalsContact O-CG 3.24Å; N229-L233 WeakPolarHBondContact O-CG 3.43Å; N229-L233 PolarHBondContact O-N 3.41Å; A231-L233 PolarHBondContact O-N 2.79Å; L233-D235 VanDerWaalsContact C-N 3.31Å; L233-D235 PolarHBondContact O-N 2.93Å; L233-R237 VanDerWaalsContact O-CB 3.31Å; L233-R237 WeakPolarHBondContact O-CB 3.47Å; L233-R237 PolarHBondContact O-N 3.14Å; L233-V277 HydrophobicContact CD2-CG1 3.72Å
234	G	93.3	Very high	93.2	Very high	14 Å²	14	79.5 Å²	79.5	14%	0.144	40%	0.4	C	S	.	.	H	α-helix	trans	-60.8	-38.4	173.3	0	0	0	0	0	112.8	A230 A231 H232 R238	A230-G234 PolarHBondContact O-N 2.79Å; A231-G234 CarbonylContact O-C 3.56Å; A231-G234 WeakPolarHBondContact O-CA 3.31Å; A231-G234 PolarHBondContact O-N 3.29Å; H232-G234 VanDerWaalsContact C-N 3.32Å; G234-R238 VanDerWaalsContact C-NH1 3.26Å; G234-R238 WeakPolarHBondContact O-CG 3.43Å; G234-R238 PolarHBondContact O-N 3.23Å; G234-R238 PolarHBondContact O-NH1 3.09Å
235	D	92.2	Very high	93.1	Very high	73 Å²	73	78.6 Å²	78.6	39%	0.39	41%	0.405	S	S	.	.	H	α-helix	trans	-71.1	-51	177.7	-65	-3.1	0	0	0	110.8	A231 H232 L233 R237 R238 D239	A231-D235 PolarHBondContact O-N 3.22Å; H232-D235 PolarHBondContact O-N 2.66Å; L233-D235 VanDerWaalsContact C-N 3.31Å; L233-D235 PolarHBondContact O-N 2.93Å; D235-R237 PolarHBondContact O-N 3.47Å; D235-R238 WeakPolarHBondContact O-CA 3.38Å; D235-R238 WeakPolarHBondContact O-CB 3.37Å; D235-R238 PolarHBondContact O-N 3.06Å; D235-R238 IonicContact OD1-CZ 3.96Å; D235-R238 IonicContact OD1-NH1 2.81Å; D235-R238 PolarHBondContact OD1-NH1 3.21Å; D235-R238 IonicContact OD1-NH2 2.6Å; D235-R238 PolarHBondContact OD1-NH2 3.48Å; D235-D239 PolarHBondContact O-N 3.14Å
236	K	90.5	Very high	93	Very high	42 Å²	42	75.6 Å²	75.6	18%	0.183	40%	0.396	C	S	.	.	H	α-helix	trans	-52.8	-42.2	173.2	-78	-177.7	165.7	-177.9	0	112.2	H232 R238 D239 L240 M275 E276	H232-K236 WeakPolarHBondContact CE1-CE 3.48Å; H232-K236 PolarHBondContact CE1-NZ 2.79Å; H232-K236 WeakPolarHBondContact NE2-CE 3.48Å; H232-K236 PolarHBondContact O-N 3.14Å; K236-R238 VanDerWaalsContact C-N 3.34Å; K236-R238 PolarHBondContact O-N 2.97Å; K236-D239 PolarHBondContact O-N 3.24Å; K236-L240 WeakPolarHBondContact O-CB 3.45Å; K236-L240 VanDerWaalsContact O-CG 3.29Å; K236-L240 WeakPolarHBondContact O-CG 3.34Å; K236-L240 PolarHBondContact O-N 3.31Å; K236-M275 HydrophobicContact CB-CE 4.38Å; K236-M275 HydrophobicContact CD-CE 4.04Å; K236-M275 HydrophobicContact CD-SD 4.11Å; K236-M275 HydrophobicContact CG-CE 4.39Å; K236-M275 HydrophobicContact CG-SD 4.4Å; K236-E276 PolarHBondContact NZ-O 2.83Å
237	R	92.9	Very high	92.9	Very high	176 Å²	176	75.3 Å²	75.3	66%	0.664	40%	0.397	S	S	*	.	H	α-helix	trans	-61.5	-41.2	176.3	-177.2	-171.9	64.8	176.3	-1.1	111.8	L233 D235 A241	L233-R237 VanDerWaalsContact O-CB 3.31Å; L233-R237 WeakPolarHBondContact O-CB 3.47Å; L233-R237 PolarHBondContact O-N 3.14Å; D235-R237 PolarHBondContact O-N 3.47Å; R237-A241 WeakPolarHBondContact O-CB 3.46Å; R237-A241 PolarHBondContact O-N 2.88Å
238	R	94.3	Very high	92.8	Very high	138 Å²	138	74.5 Å²	74.5	52%	0.521	40%	0.399	S	S	.	.	H	α-helix	trans	-66.3	-42.8	178	-71.6	-167.6	-53.1	-81.7	16.3	111.2	G234 D235 K236 L240 A241 H242	G234-R238 VanDerWaalsContact C-NH1 3.26Å; G234-R238 WeakPolarHBondContact O-CG 3.43Å; G234-R238 PolarHBondContact O-N 3.23Å; G234-R238 PolarHBondContact O-NH1 3.09Å; D235-R238 WeakPolarHBondContact O-CA 3.38Å; D235-R238 WeakPolarHBondContact O-CB 3.37Å; D235-R238 PolarHBondContact O-N 3.06Å; D235-R238 IonicContact OD1-CZ 3.96Å; D235-R238 IonicContact OD1-NH1 2.81Å; D235-R238 PolarHBondContact OD1-NH1 3.21Å; D235-R238 IonicContact OD1-NH2 2.6Å; D235-R238 PolarHBondContact OD1-NH2 3.48Å; K236-R238 VanDerWaalsContact C-N 3.34Å; K236-R238 PolarHBondContact O-N 2.97Å; R238-L240 PolarHBondContact O-N 2.96Å; R238-A241 PolarHBondContact O-N 3.33Å; R238-H242 WeakPolarHBondContact O-CB 3.24Å; R238-H242 PolarHBondContact O-N 2.87Å
239	D	91.2	Very high	92.6	Very high	112 Å²	112	70.9 Å²	70.9	60%	0.599	39%	0.391	S	S	*	.	H	α-helix	trans	-62.2	-43.7	177.5	-65.1	-19.6	0	0	0	111.6	D235 K236 H242 L243	D235-D239 PolarHBondContact O-N 3.14Å; K236-D239 PolarHBondContact O-N 3.24Å; D239-H242 PolarHBondContact O-N 3.11Å; D239-L243 WeakPolarHBondContact O-CB 3.31Å; D239-L243 PolarHBondContact O-N 3.11Å
240	L	92.2	Very high	92.4	Very high	64 Å²	64	71.3 Å²	71.3	34%	0.335	39%	0.392	S	S	.	.	H	α-helix	trans	-64.8	-41.5	175.7	-70.9	178.8	0	0	0	112.4	K236 R238 H242 L243 A244 V272 M275	K236-L240 WeakPolarHBondContact O-CB 3.45Å; K236-L240 VanDerWaalsContact O-CG 3.29Å; K236-L240 WeakPolarHBondContact O-CG 3.34Å; K236-L240 PolarHBondContact O-N 3.31Å; R238-L240 PolarHBondContact O-N 2.96Å; L240-H242 VanDerWaalsContact C-N 3.34Å; L240-L243 PolarHBondContact O-N 3.04Å; L240-A244 WeakPolarHBondContact O-CB 3.29Å; L240-A244 PolarHBondContact O-N 2.99Å; L240-V272 HydrophobicContact CD2-CB 4.11Å; L240-V272 HydrophobicContact CD2-CG1 3.46Å; L240-V272 VanDerWaalsContact CD2-CG1 3.46Å; L240-V272 HydrophobicContact CD2-CG2 3.44Å; L240-V272 VanDerWaalsContact CD2-CG2 3.44Å; L240-M275 HydrophobicContact CD1-CE 3.87Å; L240-M275 HydrophobicContact CD2-CE 4.43Å; L240-M275 HydrophobicContact CG-CE 4.34Å
241	A	94.2	Very high	92.1	Very high	59 Å²	59	72.7 Å²	72.7	49%	0.488	40%	0.397	S	S	.	.	H	α-helix	trans	-63.8	-40.6	176.3	0	0	0	0	0	111.7	R237 R238 A244 A245	R237-A241 WeakPolarHBondContact O-CB 3.46Å; R237-A241 PolarHBondContact O-N 2.88Å; R238-A241 PolarHBondContact O-N 3.33Å; A241-A244 PolarHBondContact O-N 3.46Å; A241-A245 PolarHBondContact O-N 3.09Å
242	H	93.6	Very high	91.9	Very high	135 Å²	135	77.4 Å²	77.4	63%	0.625	41%	0.413	S	S	*	.	H	α-helix	trans	-64.1	-44.9	174.8	-177.7	-77.6	0	0	0	111.6	R238 D239 L240 A244 A245 E246	R238-H242 WeakPolarHBondContact O-CB 3.24Å; R238-H242 PolarHBondContact O-N 2.87Å; D239-H242 PolarHBondContact O-N 3.11Å; L240-H242 VanDerWaalsContact C-N 3.34Å; H242-A244 VanDerWaalsContact C-N 3.34Å; H242-A244 PolarHBondContact O-N 2.88Å; H242-A245 PolarHBondContact O-N 3.1Å; H242-E246 PolarHBondContact O-N 3.13Å
243	L	92.4	Very high	91.8	Very high	22 Å²	22	77.9 Å²	77.9	12%	0.115	42%	0.416	C	S	.	.	H	α-helix	trans	-63.5	-39.8	177	-177.3	62.1	0	0	0	111.8	D239 L240 E246 V247 T265 K268 V272	D239-L243 WeakPolarHBondContact O-CB 3.31Å; D239-L243 PolarHBondContact O-N 3.11Å; L240-L243 PolarHBondContact O-N 3.04Å; L243-E246 WeakPolarHBondContact O-CB 3.21Å; L243-E246 PolarHBondContact O-N 3.04Å; L243-V247 WeakPolarHBondContact O-CG2 3.48Å; L243-V247 PolarHBondContact O-N 3.28Å; L243-T265 HydrophobicContact CD1-CG2 4.41Å; L243-K268 HydrophobicContact CD1-CB 3.94Å; L243-K268 HydrophobicContact CD1-CD 4Å; L243-K268 HydrophobicContact CD2-CB 4.09Å; L243-V272 HydrophobicContact CD2-CG2 3.86Å
244	A	92.4	Very high	91.5	Very high	47 Å²	47	79 Å²	79	39%	0.388	43%	0.428	S	S	.	.	H	α-helix	trans	-60.2	-46.8	174.5	0	0	0	0	0	111.2	L240 A241 H242 E246 V247 E248	L240-A244 WeakPolarHBondContact O-CB 3.29Å; L240-A244 PolarHBondContact O-N 2.99Å; A241-A244 PolarHBondContact O-N 3.46Å; H242-A244 VanDerWaalsContact C-N 3.34Å; H242-A244 PolarHBondContact O-N 2.88Å; A244-E246 PolarHBondContact O-N 3.37Å; A244-V247 PolarHBondContact O-N 3.25Å; A244-E248 WeakPolarHBondContact O-CG 3.11Å; A244-E248 PolarHBondContact O-N 3.47Å
245	A	93.8	Very high	91.1	Very high	57 Å²	57	80.4 Å²	80.4	47%	0.471	44%	0.443	S	S	.	.	H	α-helix	trans	-63.7	-37.8	175.8	0	0	0	0	0	112.9	A241 H242 G249	A241-A245 PolarHBondContact O-N 3.09Å; H242-A245 PolarHBondContact O-N 3.1Å; A245-G249 PolarHBondContact O-N 2.97Å
246	E	91.5	Very high	90.8	Very high	49 Å²	49	84.7 Å²	84.7	23%	0.229	46%	0.459	C	S	.	.	H	α-helix	trans	-59.5	-46.1	173.5	-174	-170.3	146	0	0	110.7	H242 L243 A244 K250 T265 K268	H242-E246 PolarHBondContact O-N 3.13Å; L243-E246 WeakPolarHBondContact O-CB 3.21Å; L243-E246 PolarHBondContact O-N 3.04Å; A244-E246 PolarHBondContact O-N 3.37Å; E246-K250 WeakPolarHBondContact O-CG 3.47Å; E246-K250 PolarHBondContact O-N 2.94Å; E246-T265 PolarHBondContact OE1-OG1 3.29Å; E246-K268 IonicContact OE1-NZ 3.65Å; E246-K268 IonicContact OE2-NZ 3.3Å; E246-K268 PolarHBondContact OE2-NZ 3.44Å
247	V	91.4	Very high	90.6	Very high	50 Å²	50	86.8 Å²	86.8	30%	0.303	47%	0.469	S	S	.	.	H	α-helix	trans	-66.4	-48.5	179.2	172.1	0	0	0	0	111.3	L243 A244 G249 K250 C251 T265	L243-V247 WeakPolarHBondContact O-CG2 3.48Å; L243-V247 PolarHBondContact O-N 3.28Å; A244-V247 PolarHBondContact O-N 3.25Å; V247-G249 VanDerWaalsContact C-N 3.32Å; V247-G249 PolarHBondContact O-N 2.91Å; V247-K250 PolarHBondContact O-N 2.6Å; V247-C251 PolarHBondContact O-N 2.81Å; V247-C251 PolarHBondContact O-SG 3.44Å; V247-T265 HydrophobicContact CG2-CG2 3.7Å
248	E	92.5	Very high	90.3	Very high	134 Å²	134	81.4 Å²	81.4	63%	0.626	45%	0.452	S	S	*	.	H	α-helix	trans	-58	-44.8	176.6	-74.6	177.4	175.5	0	0	111.5	A244 K250 C251 L252	A244-E248 WeakPolarHBondContact O-CG 3.11Å; A244-E248 PolarHBondContact O-N 3.47Å; E248-K250 PolarHBondContact O-N 3.29Å; E248-C251 WeakPolarHBondContact O-CB 3.33Å; E248-C251 PolarHBondContact O-N 3.01Å; E248-L252 PolarHBondContact O-N 2.74Å
249	G	90.6	Very high	90.1	Very high	33 Å²	33	80.1 Å²	80.1	34%	0.34	46%	0.455	S	S	.	.	H	α-helix	trans	-60.2	-44.5	176.7	0	0	0	0	0	112.7	A245 V247 C251 L252 Q253	A245-G249 PolarHBondContact O-N 2.97Å; V247-G249 VanDerWaalsContact C-N 3.32Å; V247-G249 PolarHBondContact O-N 2.91Å; G249-C251 PolarHBondContact O-N 3.06Å; G249-L252 PolarHBondContact O-N 3.34Å; G249-Q253 WeakPolarHBondContact O-CG 3.3Å
250	K	88.7	Confident	89.9	Confident	34 Å²	34	80.3 Å²	80.3	15%	0.148	45%	0.45	C	S	.	.	H	α-helix	trans	-63.6	-38.4	175.9	-76.8	-167	175.1	-159.3	0	112.6	E246 V247 E248 L252 Q253 M258 K260 T265	E246-K250 WeakPolarHBondContact O-CG 3.47Å; E246-K250 PolarHBondContact O-N 2.94Å; V247-K250 PolarHBondContact O-N 2.6Å; E248-K250 PolarHBondContact O-N 3.29Å; K250-L252 PolarHBondContact O-N 3.32Å; K250-Q253 WeakPolarHBondContact O-CB 3.38Å; K250-Q253 PolarHBondContact O-N 2.91Å; K250-Q253 VanDerWaalsContact O-N 3.13Å; K250-M258 WeakPolarHBondContact O-CG 3.43Å; K250-K260 PolarHBondContact NZ-O 3.3Å; K250-T265 PolarHBondContact NZ-OG1 3.07Å
251	C	87.3	Confident	89.6	Confident	90 Å²	90	82.6 Å²	82.6	61%	0.608	46%	0.463	S	S	*	.	H	α-helix	trans	-62.5	-22.5	177.6	-70.6	0	0	0	0	113.7	V247 E248 G249	V247-C251 PolarHBondContact O-N 2.81Å; V247-C251 PolarHBondContact O-SG 3.44Å; E248-C251 WeakPolarHBondContact O-CB 3.33Å; E248-C251 PolarHBondContact O-N 3.01Å; G249-C251 PolarHBondContact O-N 3.06Å
252	L	89.9	Confident	89.3	Confident	156 Å²	156	82 Å²	82	82%	0.817	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-6.8	178.5	-64.9	172	0	0	0	113.6	E248 G249 K250	E248-L252 PolarHBondContact O-N 2.74Å; G249-L252 PolarHBondContact O-N 3.34Å; K250-L252 PolarHBondContact O-N 3.32Å
253	Q	89.9	Confident	89	Confident	93 Å²	93	82.8 Å²	82.8	44%	0.435	46%	0.455	S	S	.	.	S	Bend	trans	-81.8	164.4	-178.2	-71.8	173	-13.5	0	0	112.6	G249 K250 E257 M258	G249-Q253 WeakPolarHBondContact O-CG 3.3Å; K250-Q253 WeakPolarHBondContact O-CB 3.38Å; K250-Q253 PolarHBondContact O-N 2.91Å; K250-Q253 VanDerWaalsContact O-N 3.13Å; Q253-E257 HydrophobicContact CB-CB 4.13Å; Q253-M258 HydrophobicContact CB-CB 4.4Å
254	S	87.9	Confident	88.9	Confident	80 Å²	80	84.4 Å²	84.4	56%	0.559	47%	0.468	S	S	*	.			trans	-65.4	152.2	171.8	68.7	0	0	0	0	110.7	F256 E257 M258	S254-F256 PolarHBondContact O-N 3.19Å; S254-E257 PolarHBondContact O-N 3.29Å; S254-M258 PolarHBondContact O-N 3.38Å
255	G	83.8	Confident	88.7	Confident	45 Å²	45	82.6 Å²	82.6	46%	0.464	45%	0.452	S	S	.	.	H	α-helix	trans	-56	-32.1	-167.8	0	0	0	0	0	115.5	L259	G255-L259 WeakPolarHBondContact O-CD1 3.37Å; G255-L259 VanDerWaalsContact O-CG 3.23Å; G255-L259 WeakPolarHBondContact O-CG 3.39Å; G255-L259 PolarHBondContact O-N 3.19Å
256	F	86.6	Confident	88.4	Confident	163 Å²	163	84.7 Å²	84.7	72%	0.715	46%	0.455	S	S	*	.	H	α-helix	trans	-70.8	-48.1	175	176.8	-96.4	0	0	0	112.3	S254 L259 K260	S254-F256 PolarHBondContact O-N 3.19Å; F256-L259 PolarHBondContact O-N 2.88Å; F256-K260 PolarHBondContact O-N 3.2Å
257	E	85.6	Confident	88.3	Confident	85 Å²	85	87 Å²	87	40%	0.397	47%	0.466	S	S	.	.	H	α-helix	trans	-66.3	-38.6	-179.7	-72.2	-62.4	154.2	0	0	111.8	Q253 S254 L259 K260	Q253-E257 HydrophobicContact CB-CB 4.13Å; S254-E257 PolarHBondContact O-N 3.29Å; E257-L259 VanDerWaalsContact C-N 3.33Å; E257-L259 PolarHBondContact O-N 3.45Å; E257-K260 VanDerWaalsContact O-CB 3.31Å; E257-K260 WeakPolarHBondContact O-CB 3.4Å; E257-K260 PolarHBondContact O-N 2.75Å
258	M	87.9	Confident	88.2	Confident	64 Å²	64	88.7 Å²	88.7	32%	0.315	47%	0.469	S	S	.	.	H	α-helix	trans	-59	-42.3	174.8	178.8	-165	74.3	0	0	112.4	K250 Q253 S254 K260	K250-M258 WeakPolarHBondContact O-CG 3.43Å; Q253-M258 HydrophobicContact CB-CB 4.4Å; S254-M258 PolarHBondContact O-N 3.38Å; M258-K260 VanDerWaalsContact C-N 3.25Å; M258-K260 PolarHBondContact O-N 3.26Å
259	L	88.8	Confident	87.9	Confident	110 Å²	110	84.2 Å²	84.2	58%	0.576	45%	0.452	S	S	*	.	H	α-helix	trans	-75.6	-14.1	-176.8	-71.2	174.3	0	0	0	113.1	G255 F256 E257 D261 V262	G255-L259 WeakPolarHBondContact O-CD1 3.37Å; G255-L259 VanDerWaalsContact O-CG 3.23Å; G255-L259 WeakPolarHBondContact O-CG 3.39Å; G255-L259 PolarHBondContact O-N 3.19Å; F256-L259 PolarHBondContact O-N 2.88Å; E257-L259 VanDerWaalsContact C-N 3.33Å; E257-L259 PolarHBondContact O-N 3.45Å; L259-D261 PolarHBondContact O-N 2.95Å; L259-V262 HydrophobicContact CD2-CG1 4.31Å; L259-V262 WeakPolarHBondContact O-CG1 3.44Å; L259-V262 PolarHBondContact O-N 3.26Å
260	K	86.6	Confident	87.7	Confident	116 Å²	116	87.5 Å²	87.5	50%	0.504	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	123.3	176.4	-166	178.3	176.7	-177.5	0	110.3	K250 F256 E257 M258 V262	K250-K260 PolarHBondContact NZ-O 3.3Å; F256-K260 PolarHBondContact O-N 3.2Å; E257-K260 VanDerWaalsContact O-CB 3.31Å; E257-K260 WeakPolarHBondContact O-CB 3.4Å; E257-K260 PolarHBondContact O-N 2.75Å; M258-K260 VanDerWaalsContact C-N 3.25Å; M258-K260 PolarHBondContact O-N 3.26Å; K260-V262 PolarHBondContact O-N 2.92Å
261	D	87.1	Confident	87.5	Confident	112 Å²	112	92.9 Å²	92.9	60%	0.599	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	20.7	-178.1	-52.4	-47.7	0	0	0	114.7	L259 K263 S264 T265	L259-D261 PolarHBondContact O-N 2.95Å; D261-K263 PolarHBondContact O-N 3.43Å; D261-S264 WeakPolarHBondContact O-CB 3.43Å; D261-S264 PolarHBondContact O-N 2.93Å; D261-T265 PolarHBondContact O-N 3.49Å
262	V	87.6	Confident	87.5	Confident	48 Å²	48	91.1 Å²	91.1	29%	0.291	47%	0.468	S	S	.	.	H	α-helix	trans	-59.2	-33.7	-176.5	71.2	0	0	0	0	112.3	L259 K260 S264 T265 L266	L259-V262 HydrophobicContact CD2-CG1 4.31Å; L259-V262 WeakPolarHBondContact O-CG1 3.44Å; L259-V262 PolarHBondContact O-N 3.26Å; K260-V262 PolarHBondContact O-N 2.92Å; V262-S264 VanDerWaalsContact C-N 3.33Å; V262-S264 PolarHBondContact O-N 2.94Å; V262-T265 PolarHBondContact O-N 2.84Å; V262-L266 HydrophobicContact CG2-CD1 4.15Å; V262-L266 HydrophobicContact CG2-CG 4.43Å; V262-L266 WeakPolarHBondContact O-CB 3.49Å; V262-L266 WeakPolarHBondContact O-CG 3.32Å; V262-L266 PolarHBondContact O-N 3.33Å
263	K	87.8	Confident	86.9	Confident	150 Å²	150	90.9 Å²	90.9	65%	0.652	46%	0.461	S	S	*	.	H	α-helix	trans	-61.1	-41.1	177.2	-169.3	-179.1	177.1	-174.6	0	111.8	D261 L266 E267	D261-K263 PolarHBondContact O-N 3.43Å; K263-L266 PolarHBondContact O-N 3.27Å; K263-E267 WeakPolarHBondContact CE-OE1 3.29Å; K263-E267 WeakPolarHBondContact O-CB 3.4Å; K263-E267 VanDerWaalsContact O-CG 3.29Å; K263-E267 WeakPolarHBondContact O-CG 3.5Å; K263-E267 PolarHBondContact O-N 3.33Å
264	S	89.3	Confident	86.3	Confident	56 Å²	56	92 Å²	92	39%	0.392	47%	0.474	S	S	.	.	H	α-helix	trans	-66.2	-43.7	177.4	177.1	0	0	0	0	111.6	D261 V262 L266 E267 K268	D261-S264 WeakPolarHBondContact O-CB 3.43Å; D261-S264 PolarHBondContact O-N 2.93Å; V262-S264 VanDerWaalsContact C-N 3.33Å; V262-S264 PolarHBondContact O-N 2.94Å; S264-L266 PolarHBondContact O-N 3.38Å; S264-E267 PolarHBondContact O-N 3.33Å; S264-K268 WeakPolarHBondContact O-CG 3.4Å; S264-K268 PolarHBondContact O-N 3.35Å
265	T	88.2	Confident	85.9	Confident	9 Å²	9	91.6 Å²	91.6	6%	0.055	46%	0.464	C	S	.	.	H	α-helix	trans	-63.4	-41.9	175.8	-51.8	0	0	0	0	111.2	L243 E246 V247 K250 D261 V262 K268 C269	L243-T265 HydrophobicContact CD1-CG2 4.41Å; E246-T265 PolarHBondContact OE1-OG1 3.29Å; V247-T265 HydrophobicContact CG2-CG2 3.7Å; K250-T265 PolarHBondContact NZ-OG1 3.07Å; D261-T265 PolarHBondContact O-N 3.49Å; V262-T265 PolarHBondContact O-N 2.84Å; T265-K268 WeakPolarHBondContact O-CB 3.33Å; T265-K268 PolarHBondContact O-N 3.47Å; T265-C269 PolarHBondContact O-N 2.96Å; T265-C269 PolarHBondContact O-SG 2.81Å; T265-C269 VanDerWaalsContact O-SG 3.37Å
266	L	87.9	Confident	85.5	Confident	101 Å²	101	96.9 Å²	96.9	53%	0.529	48%	0.477	S	S	.	.	H	α-helix	trans	-63.9	-41.7	175.4	-74.4	168.6	0	0	0	112.5	V262 K263 S264 K268 C269 E270	V262-L266 HydrophobicContact CG2-CD1 4.15Å; V262-L266 HydrophobicContact CG2-CG 4.43Å; V262-L266 WeakPolarHBondContact O-CB 3.49Å; V262-L266 WeakPolarHBondContact O-CG 3.32Å; V262-L266 PolarHBondContact O-N 3.33Å; K263-L266 PolarHBondContact O-N 3.27Å; S264-L266 PolarHBondContact O-N 3.38Å; L266-K268 VanDerWaalsContact C-N 3.3Å; L266-K268 PolarHBondContact O-N 3.12Å; L266-C269 PolarHBondContact O-N 2.98Å; L266-C269 VanDerWaalsContact O-N 3.15Å; L266-E270 PolarHBondContact O-N 3.29Å
267	E	89.6	Confident	85.2	Confident	99 Å²	99	94.1 Å²	94.1	46%	0.463	47%	0.473	S	S	.	.	H	α-helix	trans	-61.3	-36.9	175	-76.7	171.3	-167.2	0	0	112.2	K263 S264 K271	K263-E267 WeakPolarHBondContact CE-OE1 3.29Å; K263-E267 WeakPolarHBondContact O-CB 3.4Å; K263-E267 VanDerWaalsContact O-CG 3.29Å; K263-E267 WeakPolarHBondContact O-CG 3.5Å; K263-E267 PolarHBondContact O-N 3.33Å; S264-E267 PolarHBondContact O-N 3.33Å; E267-K271 WeakPolarHBondContact O-CG 3.43Å; E267-K271 PolarHBondContact O-N 2.89Å
268	K	89.3	Confident	84.8	Confident	85 Å²	85	93.8 Å²	93.8	37%	0.37	48%	0.477	S	S	.	.	H	α-helix	trans	-65.3	-43	172.2	-66.4	173.3	-170.1	173.2	0	111.5	L243 E246 S264 T265 L266 K271 V272	L243-K268 HydrophobicContact CD1-CB 3.94Å; L243-K268 HydrophobicContact CD1-CD 4Å; L243-K268 HydrophobicContact CD2-CB 4.09Å; E246-K268 IonicContact OE1-NZ 3.65Å; E246-K268 IonicContact OE2-NZ 3.3Å; E246-K268 PolarHBondContact OE2-NZ 3.44Å; S264-K268 WeakPolarHBondContact O-CG 3.4Å; S264-K268 PolarHBondContact O-N 3.35Å; T265-K268 WeakPolarHBondContact O-CB 3.33Å; T265-K268 PolarHBondContact O-N 3.47Å; L266-K268 VanDerWaalsContact C-N 3.3Å; L266-K268 PolarHBondContact O-N 3.12Å; K268-K271 PolarHBondContact O-N 3.23Å; K268-V272 PolarHBondContact O-N 3.01Å
269	C	86.2	Confident	84.5	Confident	40 Å²	40	96.2 Å²	96.2	27%	0.27	50%	0.5	S	S	.	.	H	α-helix	trans	-64.9	-38.1	177.9	-69.3	0	0	0	0	113	T265 L266 K271 V272	T265-C269 PolarHBondContact O-N 2.96Å; T265-C269 PolarHBondContact O-SG 2.81Å; T265-C269 VanDerWaalsContact O-SG 3.37Å; L266-C269 PolarHBondContact O-N 2.98Å; L266-C269 VanDerWaalsContact O-N 3.15Å; C269-K271 VanDerWaalsContact C-N 3.34Å; C269-V272 WeakPolarHBondContact O-CB 3.06Å; C269-V272 PolarHBondContact O-N 2.95Å
270	E	86.2	Confident	84.4	Confident	102 Å²	102	92.7 Å²	92.7	48%	0.477	48%	0.483	S	S	.	.	H	α-helix	trans	-64.8	-38.7	175.3	-72.5	-59.3	148.4	0	0	111.7	L266 V272 K273	L266-E270 PolarHBondContact O-N 3.29Å; E270-V272 PolarHBondContact O-N 3.26Å; E270-K273 VanDerWaalsContact CD-NZ 3.25Å; E270-K273 WeakPolarHBondContact O-CB 3.45Å; E270-K273 PolarHBondContact O-N 3.05Å; E270-K273 VanDerWaalsContact O-N 3.13Å; E270-K273 IonicContact OE1-NZ 2.67Å; E270-K273 PolarHBondContact OE1-NZ 3.49Å; E270-K273 WeakPolarHBondContact OE2-CD 3.35Å; E270-K273 IonicContact OE2-NZ 3.12Å; E270-K273 PolarHBondContact OE2-NZ 2.88Å; E270-K273 VanDerWaalsContact OE2-NZ 3.12Å
271	K	84.5	Confident	84.2	Confident	147 Å²	147	90.1 Å²	90.1	64%	0.639	48%	0.48	S	S	*	.	H	α-helix	trans	-61.9	-29.5	176	-73.5	173.3	-177.6	178.2	0	113.3	E267 K268 C269 T274	E267-K271 WeakPolarHBondContact O-CG 3.43Å; E267-K271 PolarHBondContact O-N 2.89Å; K268-K271 PolarHBondContact O-N 3.23Å; C269-K271 VanDerWaalsContact C-N 3.34Å; K271-T274 PolarHBondContact O-N 3.42Å; K271-T274 PolarHBondContact O-OG1 2.97Å
272	V	86.4	Confident	84	Confident	52 Å²	52	90.4 Å²	90.4	32%	0.315	48%	0.48	S	S	.	.	H	α-helix	trans	-67.7	-35.5	176.2	173.8	0	0	0	0	111.7	L240 L243 K268 C269 E270 T274 M275	L240-V272 HydrophobicContact CD2-CB 4.11Å; L240-V272 HydrophobicContact CD2-CG1 3.46Å; L240-V272 VanDerWaalsContact CD2-CG1 3.46Å; L240-V272 HydrophobicContact CD2-CG2 3.44Å; L240-V272 VanDerWaalsContact CD2-CG2 3.44Å; L243-V272 HydrophobicContact CD2-CG2 3.86Å; K268-V272 PolarHBondContact O-N 3.01Å; C269-V272 WeakPolarHBondContact O-CB 3.06Å; C269-V272 PolarHBondContact O-N 2.95Å; E270-V272 PolarHBondContact O-N 3.26Å; V272-T274 PolarHBondContact O-N 3.48Å; V272-M275 VanDerWaalsContact O-CB 3.32Å; V272-M275 WeakPolarHBondContact O-CB 3.33Å; V272-M275 PolarHBondContact O-N 3.37Å
273	K	77.5	Confident	83.6	Confident	152 Å²	152	94.8 Å²	94.8	66%	0.661	50%	0.497	S	S	*	.	H	α-helix	trans	-63.3	-25.2	-179.9	-65.2	179.5	-172.3	164.8	0	113	E270	E270-K273 VanDerWaalsContact CD-NZ 3.25Å; E270-K273 WeakPolarHBondContact O-CB 3.45Å; E270-K273 PolarHBondContact O-N 3.05Å; E270-K273 VanDerWaalsContact O-N 3.13Å; E270-K273 IonicContact OE1-NZ 2.67Å; E270-K273 PolarHBondContact OE1-NZ 3.49Å; E270-K273 WeakPolarHBondContact OE2-CD 3.35Å; E270-K273 IonicContact OE2-NZ 3.12Å; E270-K273 PolarHBondContact OE2-NZ 2.88Å; E270-K273 VanDerWaalsContact OE2-NZ 3.12Å
274	T	76.8	Confident	82.9	Confident	117 Å²	117	92 Å²	92	72%	0.718	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	2.7	177.1	51.9	0	0	0	0	113.5	K271 V272 E276	K271-T274 PolarHBondContact O-N 3.42Å; K271-T274 PolarHBondContact O-OG1 2.97Å; V272-T274 PolarHBondContact O-N 3.48Å; T274-E276 PolarHBondContact O-N 3.34Å
275	M	80.3	Confident	81.8	Confident	70 Å²	70	93.6 Å²	93.6	35%	0.345	49%	0.491	S	S	.	.			trans	-80.2	121	-175.1	-165	176.5	72.9	0	0	111.1	K236 L240 V272	K236-M275 HydrophobicContact CB-CE 4.38Å; K236-M275 HydrophobicContact CD-CE 4.04Å; K236-M275 HydrophobicContact CD-SD 4.11Å; K236-M275 HydrophobicContact CG-CE 4.39Å; K236-M275 HydrophobicContact CG-SD 4.4Å; L240-M275 HydrophobicContact CD1-CE 3.87Å; L240-M275 HydrophobicContact CD2-CE 4.43Å; L240-M275 HydrophobicContact CG-CE 4.34Å; V272-M275 VanDerWaalsContact O-CB 3.32Å; V272-M275 WeakPolarHBondContact O-CB 3.33Å; V272-M275 PolarHBondContact O-N 3.37Å
276	E	75.3	Confident	80.3	Confident	157 Å²	157	99.8 Å²	99.8	73%	0.734	52%	0.517	S	S	*	.			trans	-83.8	143.2	174.8	-70.1	-173.7	166.1	0	0	112.4	K236 T274	K236-E276 PolarHBondContact NZ-O 2.83Å; T274-E276 PolarHBondContact O-N 3.34Å
277	V	80.8	Confident	78.6	Confident	105 Å²	105	99.8 Å²	99.8	64%	0.636	52%	0.517	S	S	*	.			trans	-112.4	109.8	174.8	179.5	0	0	0	0	107.8	L233	L233-V277 HydrophobicContact CD2-CG1 3.72Å
278	T	77.9	Confident	76.7	Confident	77 Å²	77	98.9 Å²	98.9	47%	0.472	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-92.6	130.4	-178.9	43.1	0	0	0	0	111.2	N229	N229-T278 PolarHBondContact ND2-O 3.11Å; N229-T278 VanDerWaalsContact ND2-O 3.11Å; N229-T278 PolarHBondContact OD1-O 2.84Å
279	S	81.5	Confident	74.4	Confident	115 Å²	115	99.3 Å²	99.3	80%	0.804	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-96.8	145.6	168.2	61.2	0	0	0	0	110.5
280	V	86.4	Confident	72.4	Confident	36 Å²	36	103 Å²	103	22%	0.218	54%	0.543	C	S	.	.	P	Polyproline II helix	trans	-93.5	131.2	175.5	176.6	0	0	0	0	108.4	R225 L226 N229	R225-V280 HydrophobicContact CB-CG1 4.2Å; L226-V280 HydrophobicContact CD2-CB 3.91Å; L226-V280 HydrophobicContact CD2-CG1 4.09Å; L226-V280 HydrophobicContact CG-CG1 4.32Å; N229-V280 HydrophobicContact CB-CG2 3.61Å
281	S	81.1	Confident	70.2	Confident	63 Å²	63	104 Å²	104	44%	0.441	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-76.5	148.4	175.2	-175.9	0	0	0	0	111.4	E283	S281-E283 WeakPolarHBondContact OG-CG 3.49Å; S281-E283 PolarHBondContact OG-N 3.35Å
282	I	83.9	Confident	68.4	Low	118 Å²	118	101.3 Å²	101.3	61%	0.605	54%	0.543	S	S	*	.			trans	-112	30	178.5	-40.7	179.1	0	0	0	109.9	I222 L226 L284	I222-I282 HydrophobicContact CG2-CG2 4.04Å; L226-I282 HydrophobicContact CD1-CD1 4.29Å; L226-I282 HydrophobicContact CD1-CG1 4.32Å; L226-I282 HydrophobicContact CD2-CG1 4.48Å; I282-L284 PolarHBondContact O-N 3.25Å
283	E	79	Confident	66.6	Low	139 Å²	139	109.7 Å²	109.7	65%	0.65	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-79.2	118.2	177	-75.5	-178.6	-153.1	0	0	110.5	S281	S281-E283 WeakPolarHBondContact OG-CG 3.49Å; S281-E283 PolarHBondContact OG-N 3.35Å
284	L	72.8	Confident	65.2	Low	91 Å²	91	109.8 Å²	109.8	48%	0.476	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-70.8	145.9	168.3	-63.6	172.1	0	0	0	110.3	L215 E218 I222 I282 K286	L215-L284 HydrophobicContact CD1-CD1 4.34Å; L215-L284 HydrophobicContact CD1-CD2 4.35Å; E218-L284 HydrophobicContact CG-CD2 4.1Å; E218-L284 WeakPolarHBondContact OE1-CA 3.34Å; I222-L284 HydrophobicContact CD1-CD2 3.93Å; I282-L284 PolarHBondContact O-N 3.25Å; L284-K286 PolarHBondContact O-N 2.98Å; L284-K286 VanDerWaalsContact O-N 3.12Å
285	E	66	Low	63.7	Low	91 Å²	91	107.5 Å²	107.5	43%	0.425	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-53.2	118	171	-79.4	-170	165.2	0	0	109.5	R214 E218 N287	R214-E285 IonicContact CZ-OE2 2.62Å; R214-E285 IonicContact NH2-OE2 2.64Å; R214-E285 PolarHBondContact NH2-OE2 3.25Å; E218-E285 WeakPolarHBondContact OE1-CB 3.37Å; E218-E285 WeakPolarHBondContact OE1-CG 3.46Å; E218-E285 PolarHBondContact OE1-N 2.93Å; E285-N287 HydrophobicContact CB-CB 4.43Å; E285-N287 PolarHBondContact O-N 3.31Å; E285-N287 PolarHBondContact OE2-ND2 3.15Å
286	K	57.9	Low	62.2	Low	138 Å²	138	110.4 Å²	110.4	60%	0.6	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-67.7	14	-179.4	-64.3	178.1	-177.2	167.6	0	113.9	L284 F288	L284-K286 PolarHBondContact O-N 2.98Å; L284-K286 VanDerWaalsContact O-N 3.12Å; K286-F288 PolarHBondContact O-N 3.14Å
287	N	52.3	Low	60.9	Low	102 Å²	102	104.1 Å²	104.1	55%	0.545	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-67.1	-18.2	-173.6	-68.4	-23.4	0	0	0	112.7	E285	E285-N287 HydrophobicContact CB-CB 4.43Å; E285-N287 PolarHBondContact O-N 3.31Å; E285-N287 PolarHBondContact OE2-ND2 3.15Å
288	F	49.7	Very low	59.4	Low	80 Å²	80	103.9 Å²	103.9	35%	0.351	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-107.7	-11.2	-173.3	-56.8	-68.1	0	0	0	115.7	L211 R214 K286	L211-F288 HydrophobicContact CD2-CD1 3.92Å; L211-F288 HydrophobicContact CD2-CE1 3.37Å; L211-F288 HydrophobicContact CD2-CZ 4.32Å; R214-F288 HydrophobicContact CG-CZ 4.46Å; K286-F288 PolarHBondContact O-N 3.14Å
289	S	40	Very low	58.2	Low	93 Å²	93	104.1 Å²	104.1	65%	0.65	52%	0.523	S	S	*	.	S	Bend	trans	-98.7	-11.3	-167.2	-13.8	0	0	0	0	114.8
290	N	43.4	Very low	56.8	Low	118 Å²	118	103.2 Å²	103.2	63%	0.631	51%	0.505	S	S	*	.	S	Bend	trans	-112	3.8	-163.8	-74	-10.2	0	0	0	116.4
291	F	41.6	Very low	55.2	Low	124 Å²	124	103 Å²	103	54%	0.544	50%	0.502	S	S	.	.	S	Bend	trans	-132.3	142.7	175.5	-86.8	-92	0	0	0	111.7	R293 Y295 F296	F291-R293 PolarHBondContact O-N 3.46Å; F291-R293 VanDerWaalsContact O-N 3.09Å; F291-Y295 HydrophobicContact CD1-CD1 4.29Å; F291-F296 HydrophobicContact CB-CD2 4.35Å; F291-F296 HydrophobicContact CB-CE2 4.17Å; F291-F296 HydrophobicContact CG-CE2 4.36Å
292	P	46.1	Very low	53.8	Low	89 Å²	89	103.8 Å²	103.8	58%	0.578	50%	0.501	S	S	*	.			trans	-54.3	121.7	175	-20.8	30.9	0	0	0	109.2	Q294 Y295	P292-Q294 PolarHBondContact O-N 3.14Å; P292-Y295 VanDerWaalsContact O-CB 3.25Å; P292-Y295 WeakPolarHBondContact O-CB 3.47Å; P292-Y295 PolarHBondContact O-N 3.39Å
293	R	48.8	Very low	52.4	Low	229 Å²	229	104.1 Å²	104.1	86%	0.864	50%	0.498	S	S	*	.	H	α-helix	trans	-51.7	-24.8	-175.3	-74.9	-178.9	171.6	-172.5	-4.2	114.3	F291 Y295	F291-R293 PolarHBondContact O-N 3.46Å; F291-R293 VanDerWaalsContact O-N 3.09Å; R293-Y295 PolarHBondContact O-N 3.13Å
294	Q	48.1	Very low	51.2	Low	153 Å²	153	103.8 Å²	103.8	72%	0.715	50%	0.496	S	S	*	.	H	α-helix	trans	-62.5	-29.9	174.5	-57.6	166.1	14.3	0	0	112	P292 L298	P292-Q294 PolarHBondContact O-N 3.14Å; Q294-L298 HydrophobicContact CB-CD1 4.34Å; Q294-L298 VanDerWaalsContact O-CB 3.25Å; Q294-L298 WeakPolarHBondContact O-CB 3.13Å; Q294-L298 WeakPolarHBondContact O-CD1 3.3Å; Q294-L298 PolarHBondContact O-N 2.98Å
295	Y	44.7	Very low	50.1	Low	70 Å²	70	105.8 Å²	105.8	28%	0.275	51%	0.507	S	S	.	.	H	α-helix	trans	-75.3	-40.1	-171.3	-162.7	-105.5	0	0	0	113.1	F291 P292 R293 R299 E366	F291-Y295 HydrophobicContact CD1-CD1 4.29Å; P292-Y295 VanDerWaalsContact O-CB 3.25Å; P292-Y295 WeakPolarHBondContact O-CB 3.47Å; P292-Y295 PolarHBondContact O-N 3.39Å; R293-Y295 PolarHBondContact O-N 3.13Å; Y295-R299 WeakPolarHBondContact O-CB 3.42Å; Y295-R299 PolarHBondContact O-N 3.07Å; Y295-E366 PolarHBondContact OH-OE1 3.32Å
296	F	49.4	Very low	49.6	Very low	130 Å²	130	107.1 Å²	107.1	57%	0.57	52%	0.516	S	S	*	.	H	α-helix	trans	-77.7	-44.5	-177.1	-93.3	-88	0	0	0	113.6	F291 R299 K300	F291-F296 HydrophobicContact CB-CD2 4.35Å; F291-F296 HydrophobicContact CB-CE2 4.17Å; F291-F296 HydrophobicContact CG-CE2 4.36Å; F296-R299 PolarHBondContact O-N 3.31Å; F296-K300 WeakPolarHBondContact O-CB 3.49Å; F296-K300 PolarHBondContact O-N 3.42Å
297	A	47.5	Very low	49.6	Very low	25 Å²	25	103 Å²	103	21%	0.207	51%	0.508	C	S	.	.	H	α-helix	trans	-66.3	-47	178.7	0	0	0	0	0	111.3	L204 R299 K300 I301	L204-A297 HydrophobicContact CD2-CB 3.65Å; A297-R299 PolarHBondContact O-N 2.93Å; A297-K300 PolarHBondContact O-N 3.47Å; A297-I301 WeakPolarHBondContact O-CD1 3.38Å; A297-I301 WeakPolarHBondContact O-CG1 3.33Å; A297-I301 PolarHBondContact O-N 3.27Å; A297-I301 VanDerWaalsContact O-N 3.08Å
298	L	49.4	Very low	50.4	Low	101 Å²	101	103.1 Å²	103.1	53%	0.529	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-40.9	172.8	-88.1	113.6	0	0	0	111.8	Q294 K300 I301 L302	Q294-L298 HydrophobicContact CB-CD1 4.34Å; Q294-L298 VanDerWaalsContact O-CB 3.25Å; Q294-L298 WeakPolarHBondContact O-CB 3.13Å; Q294-L298 WeakPolarHBondContact O-CD1 3.3Å; Q294-L298 PolarHBondContact O-N 2.98Å; L298-K300 VanDerWaalsContact C-N 3.31Å; L298-K300 PolarHBondContact O-N 3.37Å; L298-I301 PolarHBondContact O-N 3.02Å; L298-L302 HydrophobicContact CB-CD1 4.22Å; L298-L302 HydrophobicContact CD2-CD1 4.48Å; L298-L302 WeakPolarHBondContact O-CA 3.22Å; L298-L302 WeakPolarHBondContact O-CB 3.47Å; L298-L302 WeakPolarHBondContact O-CD1 2.91Å; L298-L302 WeakPolarHBondContact O-CG 3.33Å; L298-L302 PolarHBondContact O-N 3.47Å
299	R	51.8	Low	51.6	Low	81 Å²	81	101.6 Å²	101.6	31%	0.306	51%	0.505	S	S	.	.	H	α-helix	trans	-67.3	-30.6	179.7	-165.3	178.7	-165.5	-163.7	9	112.3	Y295 F296 A297 K303	Y295-R299 WeakPolarHBondContact O-CB 3.42Å; Y295-R299 PolarHBondContact O-N 3.07Å; F296-R299 PolarHBondContact O-N 3.31Å; A297-R299 PolarHBondContact O-N 2.93Å; R299-K303 WeakPolarHBondContact O-CA 3.31Å; R299-K303 WeakPolarHBondContact O-CB 3.46Å; R299-K303 WeakPolarHBondContact O-CG 3.36Å; R299-K303 PolarHBondContact O-N 3.21Å
300	K	53	Low	53.9	Low	97 Å²	97	99.3 Å²	99.3	42%	0.422	49%	0.487	S	S	.	.	H	α-helix	trans	-74.9	-37.3	175.8	-148.8	-177.9	-170	-174.9	0	112	E207 F296 A297 L298 Q304	E207-K300 VanDerWaalsContact CD-CD 3.46Å; E207-K300 HydrophobicContact CG-CD 4.39Å; E207-K300 WeakPolarHBondContact OE1-CD 3.37Å; E207-K300 WeakPolarHBondContact OE1-CE 3.38Å; E207-K300 IonicContact OE1-NZ 2.72Å; E207-K300 PolarHBondContact OE1-NZ 2.88Å; E207-K300 VanDerWaalsContact OE2-CD 3.23Å; E207-K300 WeakPolarHBondContact OE2-CD 3.3Å; E207-K300 IonicContact OE2-NZ 2.99Å; E207-K300 PolarHBondContact OE2-NZ 2.9Å; F296-K300 WeakPolarHBondContact O-CB 3.49Å; F296-K300 PolarHBondContact O-N 3.42Å; A297-K300 PolarHBondContact O-N 3.47Å; L298-K300 VanDerWaalsContact C-N 3.31Å; L298-K300 PolarHBondContact O-N 3.37Å; K300-Q304 PolarHBondContact O-N 3.39Å
301	I	53.2	Low	56.2	Low	32 Å²	32	95 Å²	95	16%	0.164	46%	0.464	C	S	.	.	H	α-helix	trans	-69	-44.3	171.8	-69.5	155.8	0	0	0	110.9	L200 L204 A297 L298 K303 Q304	L200-I301 HydrophobicContact CD1-CD1 3.45Å; L200-I301 VanDerWaalsContact CD1-CD1 3.45Å; L200-I301 HydrophobicContact CD1-CG1 4.21Å; L200-I301 HydrophobicContact CD1-CG2 3.85Å; L204-I301 HydrophobicContact CD2-CD1 3.79Å; L204-I301 HydrophobicContact CG-CD1 4.22Å; A297-I301 WeakPolarHBondContact O-CD1 3.38Å; A297-I301 WeakPolarHBondContact O-CG1 3.33Å; A297-I301 PolarHBondContact O-N 3.27Å; A297-I301 VanDerWaalsContact O-N 3.08Å; L298-I301 PolarHBondContact O-N 3.02Å; I301-K303 VanDerWaalsContact C-N 3.33Å; I301-K303 PolarHBondContact O-N 3.39Å; I301-Q304 PolarHBondContact O-N 3.43Å
302	L	51.6	Low	58.5	Low	78 Å²	78	90.2 Å²	90.2	41%	0.408	44%	0.444	S	S	.	.	H	α-helix	trans	-64.5	-34.9	174.3	-72.1	165.2	0	0	0	111.7	L298 Q304 L305 I306	L298-L302 HydrophobicContact CB-CD1 4.22Å; L298-L302 HydrophobicContact CD2-CD1 4.48Å; L298-L302 WeakPolarHBondContact O-CA 3.22Å; L298-L302 WeakPolarHBondContact O-CB 3.47Å; L298-L302 WeakPolarHBondContact O-CD1 2.91Å; L298-L302 WeakPolarHBondContact O-CG 3.33Å; L298-L302 PolarHBondContact O-N 3.47Å; L302-Q304 PolarHBondContact O-N 3.08Å; L302-L305 HydrophobicContact CD2-CD1 4.37Å; L302-L305 CarbonylContact O-C 3.55Å; L302-L305 WeakPolarHBondContact O-CA 3.3Å; L302-L305 WeakPolarHBondContact O-CB 3.49Å; L302-L305 PolarHBondContact O-N 2.64Å; L302-I306 WeakPolarHBondContact O-CG1 3.22Å; L302-I306 PolarHBondContact O-N 3.3Å
303	K	54.9	Low	60.6	Low	125 Å²	125	88.1 Å²	88.1	54%	0.543	43%	0.43	S	S	.	.	H	α-helix	trans	-59.5	-30.3	174.1	-90.8	176.9	177.9	-170.7	0	113	R299 I301 L305 I306	R299-K303 WeakPolarHBondContact O-CA 3.31Å; R299-K303 WeakPolarHBondContact O-CB 3.46Å; R299-K303 WeakPolarHBondContact O-CG 3.36Å; R299-K303 PolarHBondContact O-N 3.21Å; I301-K303 VanDerWaalsContact C-N 3.33Å; I301-K303 PolarHBondContact O-N 3.39Å; K303-L305 VanDerWaalsContact C-N 3.28Å; K303-I306 HydrophobicContact CB-CD1 4.26Å; K303-I306 HydrophobicContact CG-CD1 3.79Å; K303-I306 WeakPolarHBondContact O-CB 3.35Å; K303-I306 PolarHBondContact O-N 3.29Å
304	Q	52.4	Low	62.5	Low	132 Å²	132	81.8 Å²	81.8	62%	0.617	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-10.9	173.6	-61.3	-168.8	22.7	0	0	113.3	K300 I301 L302	K300-Q304 PolarHBondContact O-N 3.39Å; I301-Q304 PolarHBondContact O-N 3.43Å; L302-Q304 PolarHBondContact O-N 3.08Å
305	L	50.3	Low	64.5	Low	134 Å²	134	74.7 Å²	74.7	70%	0.702	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	0.5	170.8	-60.6	169	0	0	0	112.1	L302 K303 A307	L302-L305 HydrophobicContact CD2-CD1 4.37Å; L302-L305 CarbonylContact O-C 3.55Å; L302-L305 WeakPolarHBondContact O-CA 3.3Å; L302-L305 WeakPolarHBondContact O-CB 3.49Å; L302-L305 PolarHBondContact O-N 2.64Å; K303-L305 VanDerWaalsContact C-N 3.28Å; L305-A307 PolarHBondContact O-N 2.96Å
306	I	54.7	Low	66.6	Low	119 Å²	119	71.6 Å²	71.6	61%	0.61	37%	0.367	S	S	*	.			trans	-73.4	113.5	174.9	-67.9	175	0	0	0	107.8	L302 K303	L302-I306 WeakPolarHBondContact O-CG1 3.22Å; L302-I306 PolarHBondContact O-N 3.3Å; K303-I306 HydrophobicContact CB-CD1 4.26Å; K303-I306 HydrophobicContact CG-CD1 3.79Å; K303-I306 WeakPolarHBondContact O-CB 3.35Å; K303-I306 PolarHBondContact O-N 3.29Å
307	A	58.8	Low	68.5	Low	52 Å²	52	66.3 Å²	66.3	43%	0.43	34%	0.344	S	S	.	.			trans	-59.4	136.3	168.2	0	0	0	0	0	109.5	L305 V309 F358	L305-A307 PolarHBondContact O-N 2.96Å; A307-V309 PolarHBondContact O-N 3.07Å; A307-F358 HydrophobicContact CB-CE1 3.99Å; A307-F358 HydrophobicContact CB-CZ 4.16Å
308	D	69.5	Low	70.5	Confident	104 Å²	104	65.4 Å²	65.4	56%	0.556	34%	0.335	S	S	*	.			trans	-73.5	95	179.4	-163.1	4.3	0	0	0	110.3	K327	D308-K327 WeakPolarHBondContact OD1-CE 3.37Å; D308-K327 IonicContact OD1-NZ 3.56Å; D308-K327 PolarHBondContact OD1-NZ 3.41Å; D308-K327 IonicContact OD2-NZ 2.75Å; D308-K327 PolarHBondContact OD2-NZ 3.4Å
309	V	74.9	Confident	72.3	Confident	48 Å²	48	61.6 Å²	61.6	29%	0.291	32%	0.316	S	S	.	.			trans	-88.9	113	179.8	-179.2	0	0	0	0	109.1	A307 A354 F358	A307-V309 PolarHBondContact O-N 3.07Å; V309-A354 HydrophobicContact CG1-CB 3.56Å; V309-F358 HydrophobicContact CG2-CZ 4.14Å
310	T	88.6	Confident	74	Confident	44 Å²	44	58.3 Å²	58.3	27%	0.27	30%	0.304	S	S	.	.			trans	-102.3	136.1	172.3	57	0	0	0	0	110.4	A354 T355	T310-A354 CarbonylContact O-C 3.54Å; T310-A354 VanDerWaalsContact O-CA 3.26Å; T310-A354 WeakPolarHBondContact O-CA 3.47Å; T310-T355 PolarHBondContact O-N 3.49Å; T310-T355 PolarHBondContact O-OG1 3.36Å; T310-T355 PolarHBondContact OG1-OG1 2.88Å
311	L	90.1	Very high	75.6	Confident	29 Å²	29	56.4 Å²	56.4	15%	0.152	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-79.2	137.7	179.6	-62.1	173.2	0	0	0	111.1	P313 L322 R326 V329 V352	L311-P313 VanDerWaalsContact O-CD 3.29Å; L311-P313 WeakPolarHBondContact O-CD 3.36Å; L311-L322 HydrophobicContact CB-CD1 4.14Å; L311-L322 HydrophobicContact CB-CD2 3.99Å; L311-L322 HydrophobicContact CD1-CD2 3.67Å; L311-L322 HydrophobicContact CG-CD2 4.47Å; L311-R326 WeakPolarHBondContact CB-O 3.45Å; L311-R326 WeakPolarHBondContact CG-O 3.41Å; L311-R326 PolarHBondContact N-O 3.13Å; L311-V329 HydrophobicContact CD1-CB 4.13Å; L311-V352 HydrophobicContact CB-CG2 4.11Å; L311-V352 HydrophobicContact CD1-CG1 4.46Å; L311-V352 HydrophobicContact CD2-CG1 4.07Å; L311-V352 HydrophobicContact CD2-CG2 4.4Å
312	D	90.9	Very high	77.3	Confident	23 Å²	23	56.6 Å²	56.6	12%	0.123	30%	0.302	C	S	.	.			trans	-86.2	110.7	-179.7	-176.8	-4.8	0	0	0	111.3	E314 T315 A316 L353	D312-E314 PolarHBondContact O-N 2.94Å; D312-E314 WeakPolarHBondContact OD1-CB 3.39Å; D312-E314 PolarHBondContact OD1-N 3.2Å; D312-T315 HydrophobicContact CB-CG2 4.16Å; D312-T315 PolarHBondContact O-N 3.26Å; D312-T315 VanDerWaalsContact O-N 3.15Å; D312-T315 PolarHBondContact O-OG1 3.28Å; D312-T315 WeakPolarHBondContact OD2-CG2 3.22Å; D312-A316 PolarHBondContact O-N 3.45Å; D312-L353 PolarHBondContact N-O 3.19Å
313	P	89.5	Confident	78.9	Confident	44 Å²	44	54.6 Å²	54.6	29%	0.286	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.4	179.2	-18.8	32.8	0	0	0	114.3	L311 T315 L322 R345	L311-P313 VanDerWaalsContact O-CD 3.29Å; L311-P313 WeakPolarHBondContact O-CD 3.36Å; P313-T315 VanDerWaalsContact C-N 3.27Å; P313-T315 PolarHBondContact O-N 3.01Å; P313-L322 HydrophobicContact CB-CD1 4.02Å; P313-L322 HydrophobicContact CG-CD1 3.96Å; P313-R345 PolarHBondContact O-NH1 3.43Å; P313-R345 PolarHBondContact O-NH2 3.23Å
314	E	88.7	Confident	80.3	Confident	96 Å²	96	58.2 Å²	58.2	45%	0.449	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-24.3	178.5	-62.3	-166.8	168.2	0	0	112.1	D312 T342 R345	D312-E314 PolarHBondContact O-N 2.94Å; D312-E314 WeakPolarHBondContact OD1-CB 3.39Å; D312-E314 PolarHBondContact OD1-N 3.2Å; E314-T342 PolarHBondContact O-OG1 3.13Å; E314-R345 WeakPolarHBondContact O-CA 3.49Å; E314-R345 PolarHBondContact O-N 3.26Å
315	T	90.1	Very high	81.7	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.031	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-23	177.8	67.8	0	0	0	0	112.4	D312 P313 H317 R344 F346 L353	D312-T315 HydrophobicContact CB-CG2 4.16Å; D312-T315 PolarHBondContact O-N 3.26Å; D312-T315 VanDerWaalsContact O-N 3.15Å; D312-T315 PolarHBondContact O-OG1 3.28Å; D312-T315 WeakPolarHBondContact OD2-CG2 3.22Å; P313-T315 VanDerWaalsContact C-N 3.27Å; P313-T315 PolarHBondContact O-N 3.01Å; T315-H317 PolarHBondContact O-N 3.19Å; T315-R344 HydrophobicContact CG2-CB 4.32Å; T315-F346 WeakPolarHBondContact O-CD2 3.38Å; T315-F346 PolarHBondContact O-N 3.45Å; T315-L353 HydrophobicContact CG2-CB 4.13Å; T315-L353 HydrophobicContact CG2-CD1 4.13Å; T315-L353 HydrophobicContact CG2-CG 4.22Å; T315-L353 PolarHBondContact OG1-N 3.38Å
316	A	89.9	Confident	83.4	Confident	4 Å²	4	55.6 Å²	55.6	3%	0.033	30%	0.295	C	S	.	.			trans	-60.1	129.8	-170.9	0	0	0	0	0	113.5	D312 L322 R345 V352	D312-A316 PolarHBondContact O-N 3.45Å; A316-L322 HydrophobicContact CB-CD1 4.11Å; A316-L322 HydrophobicContact CB-CG 4.36Å; A316-R345 VanDerWaalsContact O-CG 3.25Å; A316-R345 WeakPolarHBondContact O-CG 3.26Å; A316-R345 PolarHBondContact O-NH1 2.95Å; A316-V352 HydrophobicContact CB-CB 4.14Å; A316-V352 HydrophobicContact CB-CG2 3.77Å
317	H	88.9	Confident	84.7	Confident	20 Å²	20	55 Å²	55	9%	0.093	29%	0.288	C	S	.	.			trans	-59.8	144.9	175.2	-174.3	-83.5	0	0	0	112.1	T315 N319 L320 F346 T347 Y349 C351	T315-H317 PolarHBondContact O-N 3.19Å; H317-N319 PolarHBondContact CE1-OD1 2.54Å; H317-N319 VanDerWaalsContact CE1-OD1 3.24Å; H317-N319 WeakPolarHBondContact ND1-CB 3.39Å; H317-N319 PolarHBondContact ND1-N 3.47Å; H317-N319 PolarHBondContact O-N 3.3Å; H317-L320 HydrophobicContact CB-CD1 4.07Å; H317-L320 HydrophobicContact CB-CG 4.14Å; H317-L320 WeakPolarHBondContact O-CB 3.49Å; H317-L320 PolarHBondContact O-N 2.62Å; H317-F346 VanDerWaalsContact CA-O 3.31Å; H317-F346 WeakPolarHBondContact CA-O 3.32Å; H317-F346 HydrophobicContact CB-CB 4.38Å; H317-F346 PolarHBondContact CD2-O 3.32Å; H317-T347 PolarHBondContact NE2-O 3.33Å; H317-Y349 PolarHBondContact CD2-O 2.96Å; H317-C351 PolarHBondContact N-O 3.33Å
318	P	88.4	Confident	85.6	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.032	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-4.3	179.2	-30	37.8	0	0	0	118	R335 L336 L339 F346	P318-R335 HydrophobicContact CB-CG 3.59Å; P318-L336 WeakPolarHBondContact O-CB 3.41Å; P318-L336 WeakPolarHBondContact O-CG 3.5Å; P318-L336 PolarHBondContact O-N 2.99Å; P318-L339 HydrophobicContact CB-CD1 4.06Å; P318-L339 HydrophobicContact CG-CD1 4.43Å; P318-F346 WeakPolarHBondContact CD-O 3.4Å
319	N	88	Confident	86.3	Confident	22 Å²	22	52.8 Å²	52.8	12%	0.118	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	10.5	176.3	-72.5	69.3	0	0	0	111.2	H317 F331 V332 E333	H317-N319 PolarHBondContact CE1-OD1 2.54Å; H317-N319 VanDerWaalsContact CE1-OD1 3.24Å; H317-N319 WeakPolarHBondContact ND1-CB 3.39Å; H317-N319 PolarHBondContact ND1-N 3.47Å; H317-N319 PolarHBondContact O-N 3.3Å; N319-F331 HydrophobicContact CB-CD2 4.15Å; N319-F331 HydrophobicContact CB-CE2 3.66Å; N319-F331 HydrophobicContact CB-CZ 4.2Å; N319-F331 CarbonylContact O-C 3.55Å; N319-F331 VanDerWaalsContact O-CA 3.31Å; N319-F331 WeakPolarHBondContact O-CA 3.39Å; N319-F331 WeakPolarHBondContact O-CD2 3.21Å; N319-V332 WeakPolarHBondContact CB-O 3.47Å; N319-V332 PolarHBondContact ND2-O 2.84Å; N319-V332 PolarHBondContact O-N 3.42Å; N319-E333 PolarHBondContact ND2-O 3.41Å
320	L	87.8	Confident	86.5	Confident	11 Å²	11	55 Å²	55	6%	0.058	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	116.6	177.8	-64.1	-177.9	0	0	0	108.8	H317 V329 K330 F331 P350 C351 V352	H317-L320 HydrophobicContact CB-CD1 4.07Å; H317-L320 HydrophobicContact CB-CG 4.14Å; H317-L320 WeakPolarHBondContact O-CB 3.49Å; H317-L320 PolarHBondContact O-N 2.62Å; L320-V329 HydrophobicContact CB-CG2 3.63Å; L320-V329 HydrophobicContact CD1-CG2 4.16Å; L320-V329 HydrophobicContact CD2-CG2 3.77Å; L320-V329 HydrophobicContact CG-CG2 4.04Å; L320-K330 CarbonylContact C-O 3.54Å; L320-K330 WeakPolarHBondContact CA-O 3.09Å; L320-F331 HydrophobicContact CD2-CB 4.3Å; L320-F331 HydrophobicContact CD2-CD2 3.99Å; L320-P350 HydrophobicContact CD2-CB 4.22Å; L320-P350 HydrophobicContact CG-CB 4.4Å; L320-C351 WeakPolarHBondContact CD1-O 3.47Å; L320-V352 HydrophobicContact CD1-CB 4.16Å; L320-V352 HydrophobicContact CD1-CG1 4.14Å
321	V	86.3	Confident	86.1	Confident	58 Å²	58	55.2 Å²	55.2	35%	0.352	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	118.3	171.8	-179.7	0	0	0	0	107.4	V329 K330 V332 L336	V321-V329 CarbonylContact O-C 3.59Å; V321-V329 WeakPolarHBondContact O-CA 3.48Å; V321-K330 HydrophobicContact CB-CB 4.47Å; V321-K330 PolarHBondContact N-O 3.37Å; V321-K330 PolarHBondContact O-N 3.3Å; V321-V332 HydrophobicContact CG2-CG1 3.74Å; V321-V332 HydrophobicContact CG2-CG2 4Å; V321-L336 HydrophobicContact CG2-CD1 4.01Å; V321-L336 HydrophobicContact CG2-CD2 4.48Å
322	L	88.3	Confident	85.6	Confident	36 Å²	36	55.6 Å²	55.6	19%	0.188	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	145.2	173.9	-57.8	-179.8	0	0	0	109.9	L311 P313 A316 S328 V329 V352	L311-L322 HydrophobicContact CB-CD1 4.14Å; L311-L322 HydrophobicContact CB-CD2 3.99Å; L311-L322 HydrophobicContact CD1-CD2 3.67Å; L311-L322 HydrophobicContact CG-CD2 4.47Å; P313-L322 HydrophobicContact CB-CD1 4.02Å; P313-L322 HydrophobicContact CG-CD1 3.96Å; A316-L322 HydrophobicContact CB-CD1 4.11Å; A316-L322 HydrophobicContact CB-CG 4.36Å; L322-S328 WeakPolarHBondContact CA-O 3.44Å; L322-V329 HydrophobicContact CD2-CB 3.93Å; L322-V329 HydrophobicContact CD2-CG2 3.82Å; L322-V352 HydrophobicContact CD2-CG2 4.28Å
323	S	86.1	Confident	84.7	Confident	36 Å²	36	62.3 Å²	62.3	25%	0.252	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-66.3	159.8	168	52.7	0	0	0	0	111.1	D325 R326 K327 S328	S323-D325 VanDerWaalsContact C-N 3.27Å; S323-D325 VanDerWaalsContact CB-OD1 3.25Å; S323-D325 WeakPolarHBondContact CB-OD1 3.35Å; S323-D325 PolarHBondContact O-N 3.09Å; S323-D325 PolarHBondContact OG-OD1 2.68Å; S323-R326 WeakPolarHBondContact O-CA 3.49Å; S323-R326 PolarHBondContact O-N 3.24Å; S323-K327 PolarHBondContact OG-N 3.39Å; S323-S328 PolarHBondContact N-O 3.46Å; S323-S328 WeakPolarHBondContact OG-CA 3.49Å; S323-S328 WeakPolarHBondContact OG-CB 3.11Å; S323-S328 PolarHBondContact OG-N 2.83Å; S323-S328 PolarHBondContact OG-O 3.2Å
324	E	83.8	Confident	84.1	Confident	200 Å²	200	65.4 Å²	65.4	94%	0.935	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-38.4	179.7	-171.3	173.6	-169.4	0	0	112.3	R326	E324-R326 PolarHBondContact O-N 3.5Å
325	D	81.9	Confident	83.6	Confident	92 Å²	92	68 Å²	68	49%	0.492	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-5.3	174.6	71.5	-5.7	0	0	0	114	S323 K327	S323-D325 VanDerWaalsContact C-N 3.27Å; S323-D325 VanDerWaalsContact CB-OD1 3.25Å; S323-D325 WeakPolarHBondContact CB-OD1 3.35Å; S323-D325 PolarHBondContact O-N 3.09Å; S323-D325 PolarHBondContact OG-OD1 2.68Å; D325-K327 HydrophobicContact CB-CG 4.4Å; D325-K327 WeakPolarHBondContact O-CG 3.23Å; D325-K327 PolarHBondContact O-N 3.24Å; D325-K327 PolarHBondContact OD1-N 3.36Å
326	R	87	Confident	82.9	Confident	119 Å²	119	70.9 Å²	70.9	45%	0.449	35%	0.351	S	S	.	.	S	Bend	trans	56.6	23.2	-176.8	-51.4	-175.2	-174.6	-177.9	1	114.7	L311 S323 E324	L311-R326 WeakPolarHBondContact CB-O 3.45Å; L311-R326 WeakPolarHBondContact CG-O 3.41Å; L311-R326 PolarHBondContact N-O 3.13Å; S323-R326 WeakPolarHBondContact O-CA 3.49Å; S323-R326 PolarHBondContact O-N 3.24Å; E324-R326 PolarHBondContact O-N 3.5Å
327	K	82.2	Confident	81.9	Confident	107 Å²	107	81.4 Å²	81.4	47%	0.465	39%	0.39	S	S	.	.	S	Bend	trans	-100.9	-10.6	178.2	-57.2	-163.9	-176.3	-161.5	0	113.4	D308 S323 D325	D308-K327 WeakPolarHBondContact OD1-CE 3.37Å; D308-K327 IonicContact OD1-NZ 3.56Å; D308-K327 PolarHBondContact OD1-NZ 3.41Å; D308-K327 IonicContact OD2-NZ 2.75Å; D308-K327 PolarHBondContact OD2-NZ 3.4Å; S323-K327 PolarHBondContact OG-N 3.39Å; D325-K327 HydrophobicContact CB-CG 4.4Å; D325-K327 WeakPolarHBondContact O-CG 3.23Å; D325-K327 PolarHBondContact O-N 3.24Å; D325-K327 PolarHBondContact OD1-N 3.36Å
328	S	77.5	Confident	81	Confident	66 Å²	66	88.1 Å²	88.1	46%	0.462	43%	0.427	S	S	.	.			trans	-130.8	154.1	-178	-56.3	0	0	0	0	111.6	L322 S323	L322-S328 WeakPolarHBondContact CA-O 3.44Å; S323-S328 PolarHBondContact N-O 3.46Å; S323-S328 WeakPolarHBondContact OG-CA 3.49Å; S323-S328 WeakPolarHBondContact OG-CB 3.11Å; S323-S328 PolarHBondContact OG-N 2.83Å; S323-S328 PolarHBondContact OG-O 3.2Å
329	V	82.4	Confident	80.3	Confident	44 Å²	44	91 Å²	91	27%	0.267	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	134.3	177.2	64.7	0	0	0	0	110.6	L311 L320 V321 L322	L311-V329 HydrophobicContact CD1-CB 4.13Å; L320-V329 HydrophobicContact CB-CG2 3.63Å; L320-V329 HydrophobicContact CD1-CG2 4.16Å; L320-V329 HydrophobicContact CD2-CG2 3.77Å; L320-V329 HydrophobicContact CG-CG2 4.04Å; V321-V329 CarbonylContact O-C 3.59Å; V321-V329 WeakPolarHBondContact O-CA 3.48Å; L322-V329 HydrophobicContact CD2-CB 3.93Å; L322-V329 HydrophobicContact CD2-CG2 3.82Å
330	K	80.3	Confident	79.6	Confident	94 Å²	94	94 Å²	94	41%	0.409	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	131.4	174.4	179.9	164.7	177.9	158.8	0	109.8	L320 V321 D377	L320-K330 CarbonylContact C-O 3.54Å; L320-K330 WeakPolarHBondContact CA-O 3.09Å; V321-K330 HydrophobicContact CB-CB 4.47Å; V321-K330 PolarHBondContact N-O 3.37Å; V321-K330 PolarHBondContact O-N 3.3Å; K330-D377 IonicContact NZ-OD2 3.09Å; K330-D377 PolarHBondContact NZ-OD2 3.03Å
331	F	79.8	Confident	78.8	Confident	49 Å²	49	100.8 Å²	100.8	22%	0.215	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	137	173	-179.2	-91.8	0	0	0	110.3	N319 L320 E333 P350 A382 L383	N319-F331 HydrophobicContact CB-CD2 4.15Å; N319-F331 HydrophobicContact CB-CE2 3.66Å; N319-F331 HydrophobicContact CB-CZ 4.2Å; N319-F331 CarbonylContact O-C 3.55Å; N319-F331 VanDerWaalsContact O-CA 3.31Å; N319-F331 WeakPolarHBondContact O-CA 3.39Å; N319-F331 WeakPolarHBondContact O-CD2 3.21Å; L320-F331 HydrophobicContact CD2-CB 4.3Å; L320-F331 HydrophobicContact CD2-CD2 3.99Å; F331-E333 HydrophobicContact CE1-CG 4.39Å; F331-P350 HydrophobicContact CD2-CB 4.13Å; F331-P350 HydrophobicContact CE2-CB 4.01Å; F331-A382 HydrophobicContact CE1-CB 4.46Å; F331-L383 HydrophobicContact CB-CB 4Å; F331-L383 HydrophobicContact CB-CD1 4.23Å; F331-L383 HydrophobicContact CB-CD2 4.09Å; F331-L383 HydrophobicContact CB-CG 4.34Å
332	V	78.9	Confident	78.5	Confident	36 Å²	36	99.2 Å²	99.2	22%	0.218	49%	0.49	C	S	.	.			trans	-123	137.4	175.1	-66.9	0	0	0	0	110.3	N319 V321 T334	N319-V332 WeakPolarHBondContact CB-O 3.47Å; N319-V332 PolarHBondContact ND2-O 2.84Å; N319-V332 PolarHBondContact O-N 3.42Å; V321-V332 HydrophobicContact CG2-CG1 3.74Å; V321-V332 HydrophobicContact CG2-CG2 4Å; V332-T334 VanDerWaalsContact C-N 3.33Å; V332-T334 WeakPolarHBondContact CG2-O 3.45Å
333	E	72.1	Confident	78.2	Confident	165 Å²	165	104.2 Å²	104.2	77%	0.771	52%	0.524	S	S	*	.	S	Bend	trans	-69.1	-35	179.2	-65.7	-169.4	159.5	0	0	111.8	N319 F331	N319-E333 PolarHBondContact ND2-O 3.41Å; F331-E333 HydrophobicContact CE1-CG 4.39Å
334	T	78.1	Confident	78.1	Confident	108 Å²	108	110.5 Å²	110.5	66%	0.663	54%	0.542	S	S	*	.	S	Bend	trans	-85.4	122.7	177.5	-57	0	0	0	0	110.2	V332 L336	V332-T334 VanDerWaalsContact C-N 3.33Å; V332-T334 WeakPolarHBondContact CG2-O 3.45Å; T334-L336 PolarHBondContact O-N 3.46Å
335	R	77.8	Confident	78.4	Confident	150 Å²	150	102.1 Å²	102.1	57%	0.566	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-61.3	128.3	177	-169.9	-179.7	175.2	166.1	-1.2	110.9	P318	P318-R335 HydrophobicContact CB-CG 3.59Å
336	L	76.5	Confident	78.6	Confident	66 Å²	66	101.1 Å²	101.1	35%	0.346	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-64.7	134.3	172.5	-64.8	167.5	0	0	0	110.1	P318 V321 T334 L339	P318-L336 WeakPolarHBondContact O-CB 3.41Å; P318-L336 WeakPolarHBondContact O-CG 3.5Å; P318-L336 PolarHBondContact O-N 2.99Å; V321-L336 HydrophobicContact CG2-CD1 4.01Å; V321-L336 HydrophobicContact CG2-CD2 4.48Å; T334-L336 PolarHBondContact O-N 3.46Å; L336-L339 HydrophobicContact CB-CD1 3.7Å; L336-L339 HydrophobicContact CB-CG 4.02Å; L336-L339 HydrophobicContact CD1-CD1 3.86Å; L336-L339 HydrophobicContact CD1-CG 4.4Å; L336-L339 HydrophobicContact CG-CD1 4.44Å
337	R	67.9	Low	78.3	Confident	225 Å²	225	99.8 Å²	99.8	85%	0.849	50%	0.499	S	S	*	.	S	Bend	trans	-100.4	-18.9	-171.6	-65.2	-174.6	-178.2	-177.4	0.3	114.6
338	D	70.5	Confident	78.1	Confident	161 Å²	161	102.2 Å²	102.2	86%	0.861	51%	0.51	S	S	*	.	S	Bend	trans	-111.4	32.1	-173.1	-54.2	-43.8	0	0	0	113.5
339	L	73.1	Confident	78.1	Confident	66 Å²	66	106 Å²	106	35%	0.346	52%	0.515	S	S	.	.			trans	-89.6	138.8	177.4	-71.2	170.5	0	0	0	111	P318 L336 D341	P318-L339 HydrophobicContact CB-CD1 4.06Å; P318-L339 HydrophobicContact CG-CD1 4.43Å; L336-L339 HydrophobicContact CB-CD1 3.7Å; L336-L339 HydrophobicContact CB-CG 4.02Å; L336-L339 HydrophobicContact CD1-CD1 3.86Å; L336-L339 HydrophobicContact CD1-CG 4.4Å; L336-L339 HydrophobicContact CG-CD1 4.44Å; L339-D341 PolarHBondContact O-N 3.4Å
340	P	72.6	Confident	77.9	Confident	86 Å²	86	105.4 Å²	105.4	56%	0.558	51%	0.512	S	S	*	.			trans	-57	127	174.1	-20.2	29.3	0	0	0	110.7	T342 R345	P340-T342 HydrophobicContact CB-CG2 4.31Å; P340-T342 PolarHBondContact O-N 3.16Å; P340-R345 VanDerWaalsContact O-CZ 3.28Å; P340-R345 PolarHBondContact O-NE 3.05Å; P340-R345 PolarHBondContact O-NH2 3Å
341	D	72.3	Confident	78.1	Confident	153 Å²	153	103.3 Å²	103.3	82%	0.818	51%	0.508	S	S	*	.			trans	-77.8	101.6	175.9	-165.6	18.3	0	0	0	109.2	L339	L339-D341 PolarHBondContact O-N 3.4Å
342	T	79.4	Confident	78.5	Confident	25 Å²	25	102.5 Å²	102.5	15%	0.153	51%	0.508	C	S	.	.			trans	-114.2	141.8	-179.7	59.5	0	0	0	0	109.1	E314 P340 R344 R345	E314-T342 PolarHBondContact O-OG1 3.13Å; P340-T342 HydrophobicContact CB-CG2 4.31Å; P340-T342 PolarHBondContact O-N 3.16Å; T342-R344 PolarHBondContact O-N 3.42Å; T342-R345 VanDerWaalsContact O-CB 3.31Å; T342-R345 WeakPolarHBondContact O-CB 3.21Å; T342-R345 PolarHBondContact O-N 3.11Å
343	P	81.9	Confident	79	Confident	141 Å²	141	105.2 Å²	105.2	92%	0.916	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-13	179.5	24.5	-33.3	0	0	0	113.5
344	R	84.3	Confident	79.7	Confident	168 Å²	168	99 Å²	99	63%	0.634	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-11.1	176.6	-63.1	-178.3	174.8	-166.7	-0.9	113.2	T315 T342	T315-R344 HydrophobicContact CG2-CB 4.32Å; T342-R344 PolarHBondContact O-N 3.42Å
345	R	89.6	Confident	80.1	Confident	24 Å²	24	97.3 Å²	97.3	9%	0.091	49%	0.487	C	S	.	.	S	Bend	trans	-74.5	129.2	-173.6	-166.5	174.4	-63.6	-68.9	-3.7	111.5	P313 E314 A316 P340 T342 T347	P313-R345 PolarHBondContact O-NH1 3.43Å; P313-R345 PolarHBondContact O-NH2 3.23Å; E314-R345 WeakPolarHBondContact O-CA 3.49Å; E314-R345 PolarHBondContact O-N 3.26Å; A316-R345 VanDerWaalsContact O-CG 3.25Å; A316-R345 WeakPolarHBondContact O-CG 3.26Å; A316-R345 PolarHBondContact O-NH1 2.95Å; P340-R345 VanDerWaalsContact O-CZ 3.28Å; P340-R345 PolarHBondContact O-NE 3.05Å; P340-R345 PolarHBondContact O-NH2 3Å; T342-R345 VanDerWaalsContact O-CB 3.31Å; T342-R345 WeakPolarHBondContact O-CB 3.21Å; T342-R345 PolarHBondContact O-N 3.11Å; R345-T347 PolarHBondContact O-N 3.21Å
346	F	85.8	Confident	80.3	Confident	71 Å²	71	97.6 Å²	97.6	31%	0.311	50%	0.495	S	S	.	.			trans	-69.8	130	170.7	-65.4	-68	0	0	0	110.6	T315 H317 P318 C351 L353	T315-F346 WeakPolarHBondContact O-CD2 3.38Å; T315-F346 PolarHBondContact O-N 3.45Å; H317-F346 VanDerWaalsContact CA-O 3.31Å; H317-F346 WeakPolarHBondContact CA-O 3.32Å; H317-F346 HydrophobicContact CB-CB 4.38Å; H317-F346 PolarHBondContact CD2-O 3.32Å; P318-F346 WeakPolarHBondContact CD-O 3.4Å; F346-C351 HydrophobicContact CB-CB 4.33Å; F346-C351 HydrophobicContact CD1-CB 4.36Å; F346-C351 HydrophobicContact CD2-CB 3.54Å; F346-C351 WeakPolarHBondContact CD2-O 3.42Å; F346-C351 HydrophobicContact CE2-CB 3.83Å; F346-C351 HydrophobicContact CG-CB 3.83Å; F346-C351 HydrophobicContact CZ-CB 4.38Å; F346-L353 HydrophobicContact CE2-CD1 4.48Å; F346-L353 HydrophobicContact CE2-CD2 4.06Å; F346-L353 HydrophobicContact CE2-CG 3.82Å; F346-L353 HydrophobicContact CZ-CD1 4.35Å; F346-L353 HydrophobicContact CZ-CD2 4.05Å; F346-L353 HydrophobicContact CZ-CG 4.06Å
347	T	81.5	Confident	80.4	Confident	91 Å²	91	97.7 Å²	97.7	56%	0.558	51%	0.511	S	S	*	.	S	Bend	trans	-118.6	-15	-178.3	53.1	0	0	0	0	113.9	H317 R345	H317-T347 PolarHBondContact NE2-O 3.33Å; R345-T347 PolarHBondContact O-N 3.21Å
348	F	78	Confident	80.7	Confident	158 Å²	158	91.6 Å²	91.6	69%	0.693	49%	0.491	S	S	*	.	S	Bend	trans	-106.2	-42.2	-175.9	-167.8	-95.4	0	0	0	113.2
349	Y	76.8	Confident	80.9	Confident	144 Å²	144	90.8 Å²	90.8	57%	0.565	49%	0.492	S	S	*	.	S	Bend	trans	-113.8	143.3	177.7	-67.6	-63.1	0	0	0	110.7	H317 C351	H317-Y349 PolarHBondContact CD2-O 2.96Å; Y349-C351 PolarHBondContact O-N 2.98Å
350	P	78.1	Confident	80.7	Confident	33 Å²	33	92.3 Å²	92.3	21%	0.214	51%	0.509	C	S	.	.			trans	-73.5	75.4	177.8	32.2	-34.8	0	0	0	110	L320 F331 F386	L320-P350 HydrophobicContact CD2-CB 4.22Å; L320-P350 HydrophobicContact CG-CB 4.4Å; F331-P350 HydrophobicContact CD2-CB 4.13Å; F331-P350 HydrophobicContact CE2-CB 4.01Å; P350-F386 HydrophobicContact CG-CE1 4.1Å; P350-F386 HydrophobicContact CG-CE2 4.4Å; P350-F386 HydrophobicContact CG-CZ 4.04Å
351	C	84.6	Confident	80.3	Confident	49 Å²	49	91.3 Å²	91.3	33%	0.331	51%	0.514	S	S	.	.			trans	-118.4	157.4	-178.2	-62.1	0	0	0	0	110.6	H317 L320 F346 Y349	H317-C351 PolarHBondContact N-O 3.33Å; L320-C351 WeakPolarHBondContact CD1-O 3.47Å; F346-C351 HydrophobicContact CB-CB 4.33Å; F346-C351 HydrophobicContact CD1-CB 4.36Å; F346-C351 HydrophobicContact CD2-CB 3.54Å; F346-C351 WeakPolarHBondContact CD2-O 3.42Å; F346-C351 HydrophobicContact CE2-CB 3.83Å; F346-C351 HydrophobicContact CG-CB 3.83Å; F346-C351 HydrophobicContact CZ-CB 4.38Å; Y349-C351 PolarHBondContact O-N 2.98Å
352	V	88.7	Confident	79.1	Confident	33 Å²	33	96.1 Å²	96.1	20%	0.2	52%	0.52	C	S	.	.			trans	-149.3	143.2	171.8	57.1	0	0	0	0	107.2	L311 A316 L320 L322	L311-V352 HydrophobicContact CB-CG2 4.11Å; L311-V352 HydrophobicContact CD1-CG1 4.46Å; L311-V352 HydrophobicContact CD2-CG1 4.07Å; L311-V352 HydrophobicContact CD2-CG2 4.4Å; A316-V352 HydrophobicContact CB-CB 4.14Å; A316-V352 HydrophobicContact CB-CG2 3.77Å; L320-V352 HydrophobicContact CD1-CB 4.16Å; L320-V352 HydrophobicContact CD1-CG1 4.14Å; L322-V352 HydrophobicContact CD2-CG2 4.28Å
353	L	89.3	Confident	78.1	Confident	93 Å²	93	99.1 Å²	99.1	49%	0.487	53%	0.533	S	S	.	.			trans	-96.9	162.8	173.4	-58.8	-177.5	0	0	0	110.6	D312 T315 F346	D312-L353 PolarHBondContact N-O 3.19Å; T315-L353 HydrophobicContact CG2-CB 4.13Å; T315-L353 HydrophobicContact CG2-CD1 4.13Å; T315-L353 HydrophobicContact CG2-CG 4.22Å; T315-L353 PolarHBondContact OG1-N 3.38Å; F346-L353 HydrophobicContact CE2-CD1 4.48Å; F346-L353 HydrophobicContact CE2-CD2 4.06Å; F346-L353 HydrophobicContact CE2-CG 3.82Å; F346-L353 HydrophobicContact CZ-CD1 4.35Å; F346-L353 HydrophobicContact CZ-CD2 4.05Å; F346-L353 HydrophobicContact CZ-CG 4.06Å
354	A	86.4	Confident	76.7	Confident	35 Å²	35	100.9 Å²	100.9	29%	0.289	52%	0.522	S	S	.	.	B	Isolated β-bridge	trans	-74.1	151.1	161.8	0	0	0	0	0	110.3	V309 T310 E356	V309-A354 HydrophobicContact CG1-CB 3.56Å; T310-A354 CarbonylContact O-C 3.54Å; T310-A354 VanDerWaalsContact O-CA 3.26Å; T310-A354 WeakPolarHBondContact O-CA 3.47Å; A354-E356 WeakPolarHBondContact CB-O 3.45Å; A354-E356 PolarHBondContact O-N 3.49Å
355	T	86.6	Confident	75.4	Confident	72 Å²	72	100.5 Å²	100.5	44%	0.442	52%	0.521	S	S	.	.	S	Bend	trans	-59.8	-38.4	173.9	-45.6	0	0	0	0	111.2	T310	T310-T355 PolarHBondContact O-N 3.49Å; T310-T355 PolarHBondContact O-OG1 3.36Å; T310-T355 PolarHBondContact OG1-OG1 2.88Å
356	E	82.8	Confident	73.3	Confident	156 Å²	156	103.7 Å²	103.7	73%	0.729	54%	0.537	S	S	*	.	S	Bend	trans	-112.9	139.6	178.6	-62	-172.7	168.1	0	0	110.9	A354	A354-E356 WeakPolarHBondContact CB-O 3.45Å; A354-E356 PolarHBondContact O-N 3.49Å
357	G	77.5	Confident	71.8	Confident	67 Å²	67	105.8 Å²	105.8	69%	0.691	56%	0.555	S	S	*	*			trans	-109.7	148.1	176.1	0	0	0	0	0	111.7
358	F	75.6	Confident	70.5	Confident	97 Å²	97	106.2 Å²	106.2	43%	0.425	55%	0.551	S	S	.	*			trans	-81.9	126.9	174.4	-52.8	-78.2	0	0	0	110.6	A307 V309 H363 W365	A307-F358 HydrophobicContact CB-CE1 3.99Å; A307-F358 HydrophobicContact CB-CZ 4.16Å; V309-F358 HydrophobicContact CG2-CZ 4.14Å; F358-H363 WeakPolarHBondContact CB-NE2 3.24Å; F358-H363 AromaticContact CD1-CE1 3.4Å; F358-H363 WeakPolarHBondContact CD1-CE1 3.36Å; F358-H363 AromaticContact CD1-ND1 3.75Å; F358-H363 AromaticContact CG-CE1 3.58Å; F358-H363 AromaticContact CG-ND1 3.89Å; F358-H363 AromaticContact CG-NE2 3.9Å; F358-W365 HydrophobicContact CD2-CZ2 4.07Å; F358-W365 AromaticContact CE2-CH2 3.67Å; F358-W365 HydrophobicContact CE2-CH2 3.67Å; F358-W365 AromaticContact CE2-CZ2 3.54Å; F358-W365 HydrophobicContact CE2-CZ2 3.54Å; F358-W365 HydrophobicContact CZ-CH2 4.42Å; F358-W365 HydrophobicContact CZ-CZ2 4.46Å
359	T	74.6	Confident	70	Confident	145 Å²	145	100.3 Å²	100.3	89%	0.89	53%	0.531	S	S	*	.			trans	-99.4	-17	-177.8	55.2	0	0	0	0	114
360	S	67.7	Low	69.7	Low	98 Å²	98	93.9 Å²	93.9	69%	0.685	51%	0.508	S	S	*	.	S	Bend	trans	-162.9	172.9	176.6	63.9	0	0	0	0	111.1	H363	S360-H363 PolarHBondContact O-CE1 3.06Å; S360-H363 PolarHBondContact O-NE2 3.32Å
361	G	64.4	Low	69.3	Low	65 Å²	65	95.5 Å²	95.5	67%	0.67	51%	0.513	S	S	*	.	S	Bend	trans	104.5	179.4	176.5	0	0	0	0	0	115.3
362	R	48	Very low	68.6	Low	253 Å²	253	94.6 Å²	94.6	96%	0.955	51%	0.507	S	S	*	.			trans	-105.1	122.9	172.5	-73.6	-170.1	-69	-143.6	-0.6	109
363	H	57.4	Low	67.8	Low	89 Å²	89	93.9 Å²	93.9	41%	0.412	50%	0.502	S	S	.	.			trans	-117	139.9	-174.8	-57.4	-72	0	0	0	110	F358 S360	F358-H363 WeakPolarHBondContact CB-NE2 3.24Å; F358-H363 AromaticContact CD1-CE1 3.4Å; F358-H363 WeakPolarHBondContact CD1-CE1 3.36Å; F358-H363 AromaticContact CD1-ND1 3.75Å; F358-H363 AromaticContact CG-CE1 3.58Å; F358-H363 AromaticContact CG-ND1 3.89Å; F358-H363 AromaticContact CG-NE2 3.9Å; S360-H363 PolarHBondContact O-CE1 3.06Å; S360-H363 PolarHBondContact O-NE2 3.32Å
364	Y	52.1	Low	67	Low	177 Å²	177	89.7 Å²	89.7	69%	0.694	48%	0.48	S	S	*	.			trans	-118.5	131.1	178	172.3	-96.1	0	0	0	109.3	E366	Y364-E366 HydrophobicContact CE1-CB 3.93Å
365	W	58	Low	66.1	Low	161 Å²	161	91.3 Å²	91.3	61%	0.61	49%	0.494	S	S	*	.			trans	-122.8	119.6	179	-58.6	89.7	0	0	0	108.9	F358 V367	F358-W365 HydrophobicContact CD2-CZ2 4.07Å; F358-W365 AromaticContact CE2-CH2 3.67Å; F358-W365 HydrophobicContact CE2-CH2 3.67Å; F358-W365 AromaticContact CE2-CZ2 3.54Å; F358-W365 HydrophobicContact CE2-CZ2 3.54Å; F358-W365 HydrophobicContact CZ-CH2 4.42Å; F358-W365 HydrophobicContact CZ-CZ2 4.46Å; W365-V367 HydrophobicContact CB-CG2 4.46Å
366	E	45.5	Very low	65	Low	91 Å²	91	95.8 Å²	95.8	43%	0.425	51%	0.51	S	S	.	.			trans	-94.2	117.5	168.8	-170.1	176.1	-152.4	0	0	107.8	Y295 Y364	Y295-E366 PolarHBondContact OH-OE1 3.32Å; Y364-E366 HydrophobicContact CE1-CB 3.93Å
367	V	54.6	Low	64.4	Low	114 Å²	114	90 Å²	90	69%	0.691	48%	0.484	S	S	*	.			trans	-117	101.8	-177.9	-170	0	0	0	0	109.4	W365 A369	W365-V367 HydrophobicContact CB-CG2 4.46Å; V367-A369 HydrophobicContact CG1-CB 3.87Å; V367-A369 PolarHBondContact O-N 3.17Å
368	E	54	Low	64.4	Low	100 Å²	100	89.7 Å²	89.7	47%	0.467	47%	0.469	S	S	.	.			trans	-89.8	77.2	169.1	-63	-178	155.9	0	0	109.4	C372	E368-C372 HydrophobicContact CB-CB 4.22Å; E368-C372 WeakPolarHBondContact CB-SG 3.48Å; E368-C372 WeakPolarHBondContact O-CB 3.13Å; E368-C372 PolarHBondContact OE2-SG 3.45Å
369	A	67.6	Low	64.4	Low	35 Å²	35	92.2 Å²	92.2	29%	0.289	48%	0.483	S	S	.	.	H	α-helix	trans	-68.7	-70.1	-155.5	0	0	0	0	0	115.2	V367 V373 Y387	V367-A369 HydrophobicContact CG1-CB 3.87Å; V367-A369 PolarHBondContact O-N 3.17Å; A369-V373 WeakPolarHBondContact O-CG2 3.37Å; A369-Y387 HydrophobicContact CB-CD2 4.25Å; A369-Y387 VanDerWaalsContact O-CD2 3.24Å; A369-Y387 WeakPolarHBondContact O-CD2 3.28Å
370	A	70.5	Confident	64.7	Low	9 Å²	9	86.3 Å²	86.3	7%	0.074	45%	0.446	C	S	.	.	H	α-helix	trans	-93.6	-26.9	-167	0	0	0	0	0	114.6	A384 C388 L417	A370-A384 HydrophobicContact CB-CB 4.2Å; A370-A384 WeakPolarHBondContact O-CB 3.44Å; A370-C388 WeakPolarHBondContact CB-SG 3.41Å; A370-L417 HydrophobicContact CB-CB 4.47Å; A370-L417 HydrophobicContact CB-CD2 4.14Å
371	H	70.4	Confident	65.3	Low	67 Å²	67	84 Å²	84	31%	0.31	42%	0.424	S	S	.	.	H	α-helix	trans	-74.4	-41.3	-177.2	-175.1	-91.1	0	0	0	111.6	V373 L374 A375 L417 W459	H371-V373 PolarHBondContact O-N 2.94Å; H371-L374 PolarHBondContact O-N 2.98Å; H371-L374 VanDerWaalsContact O-N 3.16Å; H371-A375 WeakPolarHBondContact O-CB 3.43Å; H371-A375 PolarHBondContact O-N 2.95Å; H371-L417 HydrophobicContact CB-CD2 4.03Å; H371-W459 AromaticContact CD2-CH2 3.93Å; H371-W459 AromaticContact CD2-CZ2 3.88Å; H371-W459 AromaticContact CE1-CH2 3.5Å; H371-W459 VanDerWaalsContact CE1-CH2 3.5Å; H371-W459 WeakPolarHBondContact CE1-CH2 3.39Å; H371-W459 AromaticContact CE1-CZ2 3.61Å; H371-W459 AromaticContact NE2-CE2 3.6Å; H371-W459 AromaticContact NE2-CH2 3.24Å; H371-W459 WeakPolarHBondContact NE2-CH2 3.46Å; H371-W459 AromaticContact NE2-CZ2 3Å; H371-W459 WeakPolarHBondContact NE2-CZ2 3.38Å
372	C	69.8	Low	66.1	Low	30 Å²	30	82.3 Å²	82.3	20%	0.203	40%	0.404	C	S	.	.	H	α-helix	trans	-69.4	-34.7	-178.3	-64.1	0	0	0	0	112.4	E368 L374 A375 Q376	E368-C372 HydrophobicContact CB-CB 4.22Å; E368-C372 WeakPolarHBondContact CB-SG 3.48Å; E368-C372 WeakPolarHBondContact O-CB 3.13Å; E368-C372 PolarHBondContact OE2-SG 3.45Å; C372-L374 VanDerWaalsContact C-N 3.29Å; C372-L374 PolarHBondContact O-N 3.39Å; C372-A375 PolarHBondContact O-N 2.87Å; C372-Q376 WeakPolarHBondContact O-CB 3.47Å; C372-Q376 WeakPolarHBondContact O-CG 3.43Å; C372-Q376 PolarHBondContact O-N 3.26Å
373	V	70.8	Confident	67.5	Low	17 Å²	17	70.8 Å²	70.8	10%	0.103	36%	0.361	C	S	.	.	H	α-helix	trans	-56.2	-45.1	170.3	172.6	0	0	0	0	111.1	A369 H371 D377 N380 L383 A384 Y387	A369-V373 WeakPolarHBondContact O-CG2 3.37Å; H371-V373 PolarHBondContact O-N 2.94Å; V373-D377 PolarHBondContact O-N 3.23Å; V373-N380 HydrophobicContact CG1-CB 3.39Å; V373-N380 WeakPolarHBondContact CG1-O 3.41Å; V373-L383 HydrophobicContact CG1-CB 4.12Å; V373-L383 HydrophobicContact CG1-CD2 4.02Å; V373-L383 HydrophobicContact CG1-CG 4.13Å; V373-L383 HydrophobicContact CG2-CD2 4.31Å; V373-L383 HydrophobicContact CG2-CG 4.47Å; V373-A384 HydrophobicContact CB-CB 4.33Å; V373-A384 HydrophobicContact CG1-CB 4.13Å; V373-Y387 HydrophobicContact CG2-CD2 3.97Å; V373-Y387 HydrophobicContact CG2-CE2 3.62Å
374	L	72.8	Confident	68.6	Low	6 Å²	6	66.6 Å²	66.6	3%	0.031	34%	0.342	C	S	.	.	H	α-helix	trans	-75.7	-30.2	178.7	-67.5	-176.9	0	0	0	113.6	H371 C372 D377 P378 Q381 A384 L417 V419 L422 T423	H371-L374 PolarHBondContact O-N 2.98Å; H371-L374 VanDerWaalsContact O-N 3.16Å; C372-L374 VanDerWaalsContact C-N 3.29Å; C372-L374 PolarHBondContact O-N 3.39Å; L374-D377 CarbonylContact O-C 3.52Å; L374-P378 WeakPolarHBondContact O-CA 3.24Å; L374-Q381 HydrophobicContact CD2-CB 4.31Å; L374-Q381 HydrophobicContact CD2-CG 3.92Å; L374-A384 HydrophobicContact CD1-CB 4.16Å; L374-A384 HydrophobicContact CD2-CB 3.85Å; L374-A384 HydrophobicContact CG-CB 3.7Å; L374-L417 HydrophobicContact CD1-CB 4.24Å; L374-L417 HydrophobicContact CD1-CD2 3.97Å; L374-V419 HydrophobicContact CD1-CG2 3.95Å; L374-L422 HydrophobicContact CB-CD2 4.08Å; L374-L422 HydrophobicContact CD1-CD2 4.16Å; L374-L422 HydrophobicContact CD2-CD2 4.34Å; L374-L422 HydrophobicContact CG-CD2 4.44Å; L374-T423 HydrophobicContact CD1-CG2 4.13Å
375	A	66.9	Low	70.2	Confident	69 Å²	69	61.4 Å²	61.4	57%	0.57	32%	0.321	S	S	*	.	H	α-helix	trans	-74.1	-34.7	179.1	0	0	0	0	0	112.1	H371 C372	H371-A375 WeakPolarHBondContact O-CB 3.43Å; H371-A375 PolarHBondContact O-N 2.95Å; C372-A375 PolarHBondContact O-N 2.87Å
376	Q	64.8	Low	71.3	Confident	166 Å²	166	57.1 Å²	57.1	78%	0.776	31%	0.306	S	S	*	.	H	α-helix	trans	-75.4	-41.9	175.3	-71.8	175.6	-4.8	0	0	111.8	C372	C372-Q376 WeakPolarHBondContact O-CB 3.47Å; C372-Q376 WeakPolarHBondContact O-CG 3.43Å; C372-Q376 PolarHBondContact O-N 3.26Å
377	D	69.1	Low	73	Confident	35 Å²	35	56.5 Å²	56.5	19%	0.187	30%	0.301	C	S	.	.			trans	-150.1	105.4	179.5	-178	-6.4	0	0	0	109.9	K330 V373 L374 E379 N380	K330-D377 IonicContact NZ-OD2 3.09Å; K330-D377 PolarHBondContact NZ-OD2 3.03Å; V373-D377 PolarHBondContact O-N 3.23Å; L374-D377 CarbonylContact O-C 3.52Å; D377-E379 PolarHBondContact O-N 3.18Å; D377-E379 WeakPolarHBondContact OD1-CB 3.46Å; D377-E379 PolarHBondContact OD1-N 3.02Å; D377-N380 WeakPolarHBondContact CB-ND2 3.4Å; D377-N380 WeakPolarHBondContact O-CB 3.3Å; D377-N380 PolarHBondContact O-N 2.81Å
378	P	76.8	Confident	74.4	Confident	60 Å²	60	51.1 Å²	51.1	39%	0.39	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-18.6	-179	-25.6	34.9	0	0	0	114.8	L374 N380 Q381 L422	L374-P378 WeakPolarHBondContact O-CA 3.24Å; P378-N380 VanDerWaalsContact C-N 3.31Å; P378-Q381 WeakPolarHBondContact O-CG 3.16Å; P378-Q381 PolarHBondContact O-NE2 3.35Å; P378-L422 HydrophobicContact CB-CD1 3.68Å; P378-L422 HydrophobicContact CB-CD2 4.21Å
379	E	77.7	Confident	75.8	Confident	150 Å²	150	52.6 Å²	52.6	70%	0.701	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-17.2	177.9	-62.9	-57.8	133.3	0	0	112.7	D377 Q381	D377-E379 PolarHBondContact O-N 3.18Å; D377-E379 WeakPolarHBondContact OD1-CB 3.46Å; D377-E379 PolarHBondContact OD1-N 3.02Å; E379-Q381 PolarHBondContact O-N 3.3Å
380	N	79	Confident	76.3	Confident	21 Å²	21	53.2 Å²	53.2	11%	0.112	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	34.4	-178.4	-71.4	-29.5	0	0	0	114	V373 D377 P378 A382 L383 A384	V373-N380 HydrophobicContact CG1-CB 3.39Å; V373-N380 WeakPolarHBondContact CG1-O 3.41Å; D377-N380 WeakPolarHBondContact CB-ND2 3.4Å; D377-N380 WeakPolarHBondContact O-CB 3.3Å; D377-N380 PolarHBondContact O-N 2.81Å; P378-N380 VanDerWaalsContact C-N 3.31Å; N380-A382 VanDerWaalsContact C-N 3.3Å; N380-A382 PolarHBondContact O-N 3.04Å; N380-L383 PolarHBondContact O-N 2.84Å; N380-A384 PolarHBondContact O-N 3.31Å
381	Q	81.8	Confident	76.7	Confident	50 Å²	50	56.2 Å²	56.2	23%	0.234	28%	0.283	C	S	.	.	H	α-helix	trans	-63.6	-33.5	-176.1	-52.5	-173.8	16.9	0	0	113.4	L374 P378 E379 R385 T423	L374-Q381 HydrophobicContact CD2-CB 4.31Å; L374-Q381 HydrophobicContact CD2-CG 3.92Å; P378-Q381 WeakPolarHBondContact O-CG 3.16Å; P378-Q381 PolarHBondContact O-NE2 3.35Å; E379-Q381 PolarHBondContact O-N 3.3Å; Q381-R385 WeakPolarHBondContact O-CB 3.33Å; Q381-R385 PolarHBondContact O-N 2.88Å; Q381-T423 HydrophobicContact CB-CG2 4.46Å; Q381-T423 HydrophobicContact CG-CG2 4.12Å
382	A	79.8	Confident	77.3	Confident	29 Å²	29	55 Å²	55	24%	0.24	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-43.5	177.1	0	0	0	0	0	111.6	F331 N380 R385 F386	F331-A382 HydrophobicContact CE1-CB 4.46Å; N380-A382 VanDerWaalsContact C-N 3.3Å; N380-A382 PolarHBondContact O-N 3.04Å; A382-R385 WeakPolarHBondContact O-CB 3.25Å; A382-R385 PolarHBondContact O-N 3.12Å; A382-F386 WeakPolarHBondContact O-CB 3.3Å; A382-F386 PolarHBondContact O-N 3.43Å
383	L	77.6	Confident	77.8	Confident	11 Å²	11	55.1 Å²	55.1	6%	0.058	28%	0.276	C	S	.	.	H	α-helix	trans	-67.2	-46.3	177.7	-179	59.2	0	0	0	111.4	F331 V373 N380 R385 F386 Y387	F331-L383 HydrophobicContact CB-CB 4Å; F331-L383 HydrophobicContact CB-CD1 4.23Å; F331-L383 HydrophobicContact CB-CD2 4.09Å; F331-L383 HydrophobicContact CB-CG 4.34Å; V373-L383 HydrophobicContact CG1-CB 4.12Å; V373-L383 HydrophobicContact CG1-CD2 4.02Å; V373-L383 HydrophobicContact CG1-CG 4.13Å; V373-L383 HydrophobicContact CG2-CD2 4.31Å; V373-L383 HydrophobicContact CG2-CG 4.47Å; N380-L383 PolarHBondContact O-N 2.84Å; L383-R385 VanDerWaalsContact C-N 3.28Å; L383-R385 PolarHBondContact O-N 2.97Å; L383-F386 WeakPolarHBondContact O-CB 3.42Å; L383-F386 PolarHBondContact O-N 2.82Å; L383-F386 VanDerWaalsContact O-N 3.09Å; L383-Y387 HydrophobicContact CD1-CD1 4.28Å; L383-Y387 HydrophobicContact CD1-CE1 3.71Å; L383-Y387 HydrophobicContact CD1-CE2 4.4Å; L383-Y387 HydrophobicContact CG-CE1 4.42Å; L383-Y387 HydrophobicContact CG-CE2 4.26Å; L383-Y387 PolarHBondContact O-N 2.83Å
384	A	81.4	Confident	77.9	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-57.2	-43	175	0	0	0	0	0	111.7	A370 V373 L374 N380 Y387 C388	A370-A384 HydrophobicContact CB-CB 4.2Å; A370-A384 WeakPolarHBondContact O-CB 3.44Å; V373-A384 HydrophobicContact CB-CB 4.33Å; V373-A384 HydrophobicContact CG1-CB 4.13Å; L374-A384 HydrophobicContact CD1-CB 4.16Å; L374-A384 HydrophobicContact CD2-CB 3.85Å; L374-A384 HydrophobicContact CG-CB 3.7Å; N380-A384 PolarHBondContact O-N 3.31Å; A384-Y387 PolarHBondContact O-N 2.8Å; A384-C388 PolarHBondContact O-N 2.62Å; A384-C388 PolarHBondContact O-SG 3.15Å
385	R	85.8	Confident	78	Confident	68 Å²	68	58.7 Å²	58.7	26%	0.257	30%	0.295	S	S	.	.	H	α-helix	trans	-63.1	-41.6	174.8	-175.2	-172	-51.5	134.5	10.5	112.2	Q381 A382 L383 C388 Y389 C414 S416 T443	Q381-R385 WeakPolarHBondContact O-CB 3.33Å; Q381-R385 PolarHBondContact O-N 2.88Å; A382-R385 WeakPolarHBondContact O-CB 3.25Å; A382-R385 PolarHBondContact O-N 3.12Å; L383-R385 VanDerWaalsContact C-N 3.28Å; L383-R385 PolarHBondContact O-N 2.97Å; R385-C388 PolarHBondContact O-N 3.06Å; R385-Y389 WeakPolarHBondContact O-CB 3.41Å; R385-Y389 PolarHBondContact O-N 3.15Å; R385-C414 VanDerWaalsContact CG-O 3.27Å; R385-C414 WeakPolarHBondContact CG-O 3.43Å; R385-S416 PolarHBondContact NE-OG 2.87Å; R385-T443 VanDerWaalsContact NH2-CG2 3.33Å; R385-T443 PolarHBondContact NH2-OG1 3.04Å; R385-T443 VanDerWaalsContact NH2-OG1 3.17Å
386	F	80	Confident	78.7	Confident	70 Å²	70	62.9 Å²	62.9	31%	0.307	30%	0.3	S	S	.	.	H	α-helix	trans	-62.3	-41.7	177	178	-103.2	0	0	0	111.8	P350 A382 L383 Y389 T390	P350-F386 HydrophobicContact CG-CE1 4.1Å; P350-F386 HydrophobicContact CG-CE2 4.4Å; P350-F386 HydrophobicContact CG-CZ 4.04Å; A382-F386 WeakPolarHBondContact O-CB 3.3Å; A382-F386 PolarHBondContact O-N 3.43Å; L383-F386 WeakPolarHBondContact O-CB 3.42Å; L383-F386 PolarHBondContact O-N 2.82Å; L383-F386 VanDerWaalsContact O-N 3.09Å; F386-Y389 PolarHBondContact O-N 2.93Å; F386-T390 WeakPolarHBondContact O-CB 3.42Å; F386-T390 PolarHBondContact O-N 3.35Å; F386-T390 PolarHBondContact O-OG1 3.41Å
387	Y	81.3	Confident	79.4	Confident	78 Å²	78	64.9 Å²	64.9	31%	0.306	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-47.8	174.3	-71.4	-10.3	0	0	0	112.3	A369 V373 L383 A384 Y389 T390 E391	A369-Y387 HydrophobicContact CB-CD2 4.25Å; A369-Y387 VanDerWaalsContact O-CD2 3.24Å; A369-Y387 WeakPolarHBondContact O-CD2 3.28Å; V373-Y387 HydrophobicContact CG2-CD2 3.97Å; V373-Y387 HydrophobicContact CG2-CE2 3.62Å; L383-Y387 HydrophobicContact CD1-CD1 4.28Å; L383-Y387 HydrophobicContact CD1-CE1 3.71Å; L383-Y387 HydrophobicContact CD1-CE2 4.4Å; L383-Y387 HydrophobicContact CG-CE1 4.42Å; L383-Y387 HydrophobicContact CG-CE2 4.26Å; L383-Y387 PolarHBondContact O-N 2.83Å; A384-Y387 PolarHBondContact O-N 2.8Å; Y387-Y389 VanDerWaalsContact C-N 3.29Å; Y387-Y389 PolarHBondContact O-N 2.69Å; Y387-T390 PolarHBondContact O-N 3.18Å; Y387-E391 WeakPolarHBondContact O-CB 3.33Å; Y387-E391 PolarHBondContact O-N 3.04Å
388	C	83.6	Confident	79.7	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.014	32%	0.32	C	S	.	.	H	α-helix	trans	-61.3	-36.5	175.8	-67.5	0	0	0	0	113.2	A370 A384 R385 R392 L410 S415	A370-C388 WeakPolarHBondContact CB-SG 3.41Å; A384-C388 PolarHBondContact O-N 2.62Å; A384-C388 PolarHBondContact O-SG 3.15Å; R385-C388 PolarHBondContact O-N 3.06Å; C388-R392 VanDerWaalsContact O-CB 3.31Å; C388-R392 WeakPolarHBondContact O-CB 3.4Å; C388-R392 PolarHBondContact O-N 3.43Å; C388-R392 VanDerWaalsContact O-N 3.09Å; C388-L410 HydrophobicContact CB-CD1 4.16Å; C388-L410 HydrophobicContact CB-CD2 3.73Å; C388-L410 WeakPolarHBondContact SG-CD2 3.43Å; C388-S415 WeakPolarHBondContact CB-O 3.42Å
389	Y	84.2	Confident	80	Confident	131 Å²	131	72.1 Å²	72.1	51%	0.514	34%	0.34	S	S	.	.	H	α-helix	trans	-65.4	-45.5	174.4	171.9	-95.1	0	0	0	111.5	R385 F386 Y387 R392 T393	R385-Y389 WeakPolarHBondContact O-CB 3.41Å; R385-Y389 PolarHBondContact O-N 3.15Å; F386-Y389 PolarHBondContact O-N 2.93Å; Y387-Y389 VanDerWaalsContact C-N 3.29Å; Y387-Y389 PolarHBondContact O-N 2.69Å; Y389-R392 PolarHBondContact O-N 3.43Å; Y389-T393 WeakPolarHBondContact O-CB 3.46Å; Y389-T393 PolarHBondContact O-N 3.4Å; Y389-T393 PolarHBondContact O-OG1 3.15Å
390	T	78.8	Confident	79.7	Confident	47 Å²	47	69.9 Å²	69.9	29%	0.288	33%	0.332	S	S	.	.	H	α-helix	trans	-64.1	-48.7	179.7	-59.3	0	0	0	0	110.8	F386 Y387 R392 T393 I394	F386-T390 WeakPolarHBondContact O-CB 3.42Å; F386-T390 PolarHBondContact O-N 3.35Å; F386-T390 PolarHBondContact O-OG1 3.41Å; Y387-T390 PolarHBondContact O-N 3.18Å; T390-R392 VanDerWaalsContact C-N 3.31Å; T390-R392 PolarHBondContact O-N 3.08Å; T390-T393 WeakPolarHBondContact O-CB 3.48Å; T390-T393 PolarHBondContact O-N 3.24Å; T390-I394 HydrophobicContact CG2-CD1 3.88Å; T390-I394 HydrophobicContact CG2-CG1 4.44Å; T390-I394 WeakPolarHBondContact O-CG1 3.49Å; T390-I394 PolarHBondContact O-N 2.95Å
391	E	78.6	Confident	79.6	Confident	72 Å²	72	80.3 Å²	80.3	34%	0.336	37%	0.37	S	S	.	.	H	α-helix	trans	-55.7	-45.1	175	-171.2	-146	154.6	0	0	111.4	Y387 T393 A395 R402	Y387-E391 WeakPolarHBondContact O-CB 3.33Å; Y387-E391 PolarHBondContact O-N 3.04Å; E391-T393 VanDerWaalsContact C-N 3.32Å; E391-T393 PolarHBondContact O-N 2.93Å; E391-A395 WeakPolarHBondContact O-CB 3.11Å; E391-A395 PolarHBondContact O-N 2.91Å; E391-R402 IonicContact OE1-CZ 2.73Å; E391-R402 IonicContact OE1-NE 3.01Å; E391-R402 PolarHBondContact OE1-NE 3.41Å; E391-R402 VanDerWaalsContact OE1-NE 3.12Å; E391-R402 IonicContact OE1-NH2 2.68Å; E391-R402 PolarHBondContact OE1-NH2 2.95Å; E391-R402 IonicContact OE2-CZ 3.88Å; E391-R402 IonicContact OE2-NH2 3.08Å; E391-R402 PolarHBondContact OE2-NH2 3.36Å
392	R	82.3	Confident	79.1	Confident	41 Å²	41	79.3 Å²	79.3	16%	0.155	36%	0.364	C	S	.	.	H	α-helix	trans	-62.7	-38.8	176	-178.2	179.5	-71.4	177.9	-0.2	112.2	C388 Y389 T390 K396 C411 S415	C388-R392 VanDerWaalsContact O-CB 3.31Å; C388-R392 WeakPolarHBondContact O-CB 3.4Å; C388-R392 PolarHBondContact O-N 3.43Å; C388-R392 VanDerWaalsContact O-N 3.09Å; Y389-R392 PolarHBondContact O-N 3.43Å; T390-R392 VanDerWaalsContact C-N 3.31Å; T390-R392 PolarHBondContact O-N 3.08Å; R392-K396 WeakPolarHBondContact O-CG 3.47Å; R392-K396 PolarHBondContact O-N 2.69Å; R392-K396 VanDerWaalsContact O-N 3.11Å; R392-C411 PolarHBondContact NH1-O 2.99Å; R392-C411 PolarHBondContact NH2-O 3.26Å; R392-S415 PolarHBondContact NH1-OG 2.94Å
393	T	80.3	Confident	78.8	Confident	34 Å²	34	81.8 Å²	81.8	21%	0.209	37%	0.373	C	S	.	.	H	α-helix	trans	-70	-44.9	-179.2	-60.2	0	0	0	0	111.1	Y389 T390 E391 K396 R397	Y389-T393 WeakPolarHBondContact O-CB 3.46Å; Y389-T393 PolarHBondContact O-N 3.4Å; Y389-T393 PolarHBondContact O-OG1 3.15Å; T390-T393 WeakPolarHBondContact O-CB 3.48Å; T390-T393 PolarHBondContact O-N 3.24Å; E391-T393 VanDerWaalsContact C-N 3.32Å; E391-T393 PolarHBondContact O-N 2.93Å; T393-K396 PolarHBondContact O-N 3.37Å; T393-R397 WeakPolarHBondContact O-CG 3.23Å; T393-R397 PolarHBondContact O-N 2.94Å
394	I	74.3	Confident	78.6	Confident	86 Å²	86	83.7 Å²	83.7	44%	0.441	39%	0.387	S	S	.	.	H	α-helix	trans	-59.4	-51.2	174.6	-67.6	169.7	0	0	0	110	T390 K396 R397 L398	T390-I394 HydrophobicContact CG2-CD1 3.88Å; T390-I394 HydrophobicContact CG2-CG1 4.44Å; T390-I394 WeakPolarHBondContact O-CG1 3.49Å; T390-I394 PolarHBondContact O-N 2.95Å; I394-K396 VanDerWaalsContact C-N 3.26Å; I394-K396 PolarHBondContact O-N 3.11Å; I394-R397 PolarHBondContact O-N 3.33Å; I394-R397 VanDerWaalsContact O-N 3.14Å; I394-L398 HydrophobicContact CG2-CD1 3.61Å; I394-L398 HydrophobicContact CG2-CG 4.23Å; I394-L398 WeakPolarHBondContact O-CB 3.32Å; I394-L398 WeakPolarHBondContact O-CG 3.18Å; I394-L398 PolarHBondContact O-N 2.96Å
395	A	74.3	Confident	78.3	Confident	11 Å²	11	85 Å²	85	9%	0.091	40%	0.396	C	S	.	.	H	α-helix	trans	-59.6	-36.3	-179.4	0	0	0	0	0	113	E391 V399 L400 R402	E391-A395 WeakPolarHBondContact O-CB 3.11Å; E391-A395 PolarHBondContact O-N 2.91Å; A395-V399 WeakPolarHBondContact O-CA 3.43Å; A395-V399 PolarHBondContact O-N 2.84Å; A395-V399 VanDerWaalsContact O-N 3.11Å; A395-L400 HydrophobicContact CB-CB 4.3Å; A395-L400 PolarHBondContact O-N 3.29Å; A395-R402 HydrophobicContact CB-CG 3.67Å
396	K	82.1	Confident	77.8	Confident	158 Å²	158	84.4 Å²	84.4	69%	0.687	40%	0.4	S	S	*	.	H	α-helix	trans	-67.9	-48	174.1	-77.5	178.3	177.6	-173.5	0	112.1	R392 T393 I394 L398 V399	R392-K396 WeakPolarHBondContact O-CG 3.47Å; R392-K396 PolarHBondContact O-N 2.69Å; R392-K396 VanDerWaalsContact O-N 3.11Å; T393-K396 PolarHBondContact O-N 3.37Å; I394-K396 VanDerWaalsContact C-N 3.26Å; I394-K396 PolarHBondContact O-N 3.11Å; K396-L398 VanDerWaalsContact C-N 3.33Å; K396-L398 PolarHBondContact O-N 2.72Å; K396-V399 PolarHBondContact O-N 2.79Å
397	R	79.1	Confident	77.8	Confident	208 Å²	208	86.1 Å²	86.1	79%	0.785	41%	0.407	S	S	*	.	H	α-helix	trans	-65.2	-36.8	-178.1	-74.2	-177.5	178	-175.6	0	112.4	T393 I394	T393-R397 WeakPolarHBondContact O-CG 3.23Å; T393-R397 PolarHBondContact O-N 2.94Å; I394-R397 PolarHBondContact O-N 3.33Å; I394-R397 VanDerWaalsContact O-N 3.14Å
398	L	75.6	Confident	77.9	Confident	114 Å²	114	84 Å²	84	60%	0.597	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	4.7	-178.7	-60.3	-176.8	0	0	0	113.7	I394 K396 L400	I394-L398 HydrophobicContact CG2-CD1 3.61Å; I394-L398 HydrophobicContact CG2-CG 4.23Å; I394-L398 WeakPolarHBondContact O-CB 3.32Å; I394-L398 WeakPolarHBondContact O-CG 3.18Å; I394-L398 PolarHBondContact O-N 2.96Å; K396-L398 VanDerWaalsContact C-N 3.33Å; K396-L398 PolarHBondContact O-N 2.72Å; L398-L400 HydrophobicContact CB-CD1 4.01Å; L398-L400 HydrophobicContact CB-CD2 4.5Å; L398-L400 HydrophobicContact CB-CG 3.79Å; L398-L400 HydrophobicContact CD1-CD1 4.17Å; L398-L400 PolarHBondContact O-N 3.21Å
399	V	82.9	Confident	77.8	Confident	133 Å²	133	85.3 Å²	85.3	81%	0.806	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	36.2	179.9	-159.7	0	0	0	0	112.6	A395 K396	A395-V399 WeakPolarHBondContact O-CA 3.43Å; A395-V399 PolarHBondContact O-N 2.84Å; A395-V399 VanDerWaalsContact O-N 3.11Å; K396-V399 PolarHBondContact O-N 2.79Å
400	L	71.2	Confident	78	Confident	103 Å²	103	79.1 Å²	79.1	54%	0.539	38%	0.382	S	S	.	.			trans	-81.9	129.7	-179	-61.8	174.3	0	0	0	111	A395 L398 R402	A395-L400 HydrophobicContact CB-CB 4.3Å; A395-L400 PolarHBondContact O-N 3.29Å; L398-L400 HydrophobicContact CB-CD1 4.01Å; L398-L400 HydrophobicContact CB-CD2 4.5Å; L398-L400 HydrophobicContact CB-CG 3.79Å; L398-L400 HydrophobicContact CD1-CD1 4.17Å; L398-L400 PolarHBondContact O-N 3.21Å; L400-R402 PolarHBondContact O-N 3.17Å; L400-R402 VanDerWaalsContact O-N 3.1Å
401	R	76.2	Confident	78.6	Confident	239 Å²	239	76.9 Å²	76.9	90%	0.902	37%	0.368	S	S	*	.			trans	-74.7	100.8	173.9	-170.6	176.8	-176.2	169	0.9	109.6
402	R	71.4	Confident	79.1	Confident	29 Å²	29	81.7 Å²	81.7	11%	0.109	38%	0.383	C	S	.	.			trans	-72.1	138.9	171.5	-60.1	174.9	64.5	177	4.1	111.3	E391 A395 L400 K407	E391-R402 IonicContact OE1-CZ 2.73Å; E391-R402 IonicContact OE1-NE 3.01Å; E391-R402 PolarHBondContact OE1-NE 3.41Å; E391-R402 VanDerWaalsContact OE1-NE 3.12Å; E391-R402 IonicContact OE1-NH2 2.68Å; E391-R402 PolarHBondContact OE1-NH2 2.95Å; E391-R402 IonicContact OE2-CZ 3.88Å; E391-R402 IonicContact OE2-NH2 3.08Å; E391-R402 PolarHBondContact OE2-NH2 3.36Å; A395-R402 HydrophobicContact CB-CG 3.67Å; L400-R402 PolarHBondContact O-N 3.17Å; L400-R402 VanDerWaalsContact O-N 3.1Å; R402-K407 HydrophobicContact CB-CD 4.39Å; R402-K407 HydrophobicContact CB-CG 3.99Å; R402-K407 WeakPolarHBondContact O-CE 3.37Å; R402-K407 PolarHBondContact O-NZ 3.01Å; R402-K407 VanDerWaalsContact O-NZ 3.13Å
403	D	73.4	Confident	79.4	Confident	81 Å²	81	81.7 Å²	81.7	43%	0.433	40%	0.396	S	S	.	.			trans	-59.3	139.1	176.3	-172.1	-88.5	0	0	0	111.4	S405 V406 K407	D403-S405 VanDerWaalsContact C-N 3.26Å; D403-S405 PolarHBondContact O-N 3.36Å; D403-S405 WeakPolarHBondContact OD1-CB 3.49Å; D403-S405 PolarHBondContact OD1-N 3.15Å; D403-S405 PolarHBondContact OD1-OG 3.47Å; D403-V406 HydrophobicContact CB-CG2 4.27Å; D403-V406 PolarHBondContact O-N 3.44Å; D403-K407 PolarHBondContact O-N 3.02Å; D403-K407 VanDerWaalsContact O-N 3.09Å
404	P	74.8	Confident	79.7	Confident	52 Å²	52	81.6 Å²	81.6	34%	0.338	40%	0.396	S	S	.	.	H	α-helix	trans	-54.8	-36.1	177.5	-27.1	36.1	0	0	0	114.3	K407 R408	P404-K407 PolarHBondContact O-N 3.43Å; P404-R408 WeakPolarHBondContact O-CB 3.23Å; P404-R408 WeakPolarHBondContact O-CD 3.49Å; P404-R408 WeakPolarHBondContact O-CG 3.32Å; P404-R408 PolarHBondContact O-N 2.96Å; P404-R408 VanDerWaalsContact O-N 3.09Å
405	S	73.3	Confident	80.5	Confident	28 Å²	28	77.7 Å²	77.7	20%	0.196	38%	0.377	C	S	.	.	H	α-helix	trans	-63.2	-43.4	179.6	67.4	0	0	0	0	111.7	D403 R408 T409	D403-S405 VanDerWaalsContact C-N 3.26Å; D403-S405 PolarHBondContact O-N 3.36Å; D403-S405 WeakPolarHBondContact OD1-CB 3.49Å; D403-S405 PolarHBondContact OD1-N 3.15Å; D403-S405 PolarHBondContact OD1-OG 3.47Å; S405-R408 PolarHBondContact O-N 2.93Å; S405-T409 PolarHBondContact O-N 3.27Å
406	V	75.7	Confident	81.2	Confident	56 Å²	56	77.3 Å²	77.3	34%	0.339	37%	0.373	S	S	.	.	H	α-helix	trans	-69.8	-38.7	177.2	-174.7	0	0	0	0	111.3	D403 R408 T409	D403-V406 HydrophobicContact CB-CG2 4.27Å; D403-V406 PolarHBondContact O-N 3.44Å; V406-R408 PolarHBondContact O-N 3.11Å; V406-T409 PolarHBondContact O-N 3.48Å; V406-T409 PolarHBondContact O-OG1 2.91Å
407	K	79.7	Confident	81.5	Confident	105 Å²	105	70.6 Å²	70.6	46%	0.457	35%	0.345	S	S	.	.	H	α-helix	trans	-62.4	-32.3	175.9	-73	177.2	-177.8	165.6	0	112.5	R402 D403 P404 T409	R402-K407 HydrophobicContact CB-CD 4.39Å; R402-K407 HydrophobicContact CB-CG 3.99Å; R402-K407 WeakPolarHBondContact O-CE 3.37Å; R402-K407 PolarHBondContact O-NZ 3.01Å; R402-K407 VanDerWaalsContact O-NZ 3.13Å; D403-K407 PolarHBondContact O-N 3.02Å; D403-K407 VanDerWaalsContact O-N 3.09Å; P404-K407 PolarHBondContact O-N 3.43Å; K407-T409 VanDerWaalsContact C-N 3.35Å
408	R	84.2	Confident	81.9	Confident	34 Å²	34	60.8 Å²	60.8	13%	0.128	31%	0.308	C	S	.	.	H	α-helix	trans	-77.2	-19.8	-176.7	-71.1	167.3	76.3	141.7	-0.3	112.9	P404 S405 V406 L410 F450 L451 L458	P404-R408 WeakPolarHBondContact O-CB 3.23Å; P404-R408 WeakPolarHBondContact O-CD 3.49Å; P404-R408 WeakPolarHBondContact O-CG 3.32Å; P404-R408 PolarHBondContact O-N 2.96Å; P404-R408 VanDerWaalsContact O-N 3.09Å; S405-R408 PolarHBondContact O-N 2.93Å; V406-R408 PolarHBondContact O-N 3.11Å; R408-L410 VanDerWaalsContact C-N 3.3Å; R408-F450 HydrophobicContact CB-CD1 4.24Å; R408-F450 HydrophobicContact CB-CE1 3.9Å; R408-F450 HydrophobicContact CB-CZ 4.37Å; R408-F450 HydrophobicContact CG-CD1 3.86Å; R408-F450 HydrophobicContact CG-CE1 3.76Å; R408-F450 VanDerWaalsContact O-CZ 3.24Å; R408-F450 WeakPolarHBondContact O-CZ 3.44Å; R408-L451 PolarHBondContact NH2-O 2.98Å; R408-L458 HydrophobicContact CB-CD2 3.76Å; R408-L458 HydrophobicContact CG-CD2 4.47Å
409	T	82.5	Confident	82.3	Confident	29 Å²	29	56.2 Å²	56.2	18%	0.178	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-1.4	174.8	60.5	0	0	0	0	113.4	S405 V406 K407 L417 L418	S405-T409 PolarHBondContact O-N 3.27Å; V406-T409 PolarHBondContact O-N 3.48Å; V406-T409 PolarHBondContact O-OG1 2.91Å; K407-T409 VanDerWaalsContact C-N 3.35Å; T409-L417 CarbonylContact O-C 3.51Å; T409-L418 WeakPolarHBondContact O-CB 3.43Å; T409-L418 PolarHBondContact O-N 3.05Å
410	L	88.4	Confident	82.4	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.01	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-114.1	142.4	-176.2	-60.1	-171.5	0	0	0	114.3	C388 R408 R412 L417 Q448	C388-L410 HydrophobicContact CB-CD1 4.16Å; C388-L410 HydrophobicContact CB-CD2 3.73Å; C388-L410 WeakPolarHBondContact SG-CD2 3.43Å; R408-L410 VanDerWaalsContact C-N 3.3Å; L410-R412 PolarHBondContact O-N 3.22Å; L410-L417 HydrophobicContact CD2-CD1 3.75Å; L410-Q448 PolarHBondContact O-NE2 3.39Å; L410-Q448 VanDerWaalsContact O-NE2 3.08Å; L410-Q448 PolarHBondContact O-OE1 2.97Å
411	C	89.6	Confident	82.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.273	C	S	.	.			trans	-65.2	126.3	170.6	-173.6	0	0	0	0	111	R392 G413 C414 S415 S416 L418 C441 C444	R392-C411 PolarHBondContact NH1-O 2.99Å; R392-C411 PolarHBondContact NH2-O 3.26Å; C411-G413 VanDerWaalsContact C-N 3.25Å; C411-G413 PolarHBondContact O-N 3.29Å; C411-G413 PolarHBondContact SG-N 2.96Å; C411-G413 VanDerWaalsContact SG-N 3.36Å; C411-C414 VanDerWaalsContact SG-SG 3.66Å; C411-S415 VanDerWaalsContact O-CA 3.27Å; C411-S415 WeakPolarHBondContact O-CA 3.35Å; C411-S415 PolarHBondContact O-N 3.37Å; C411-S415 VanDerWaalsContact O-N 3.12Å; C411-S416 WeakPolarHBondContact CB-O 3.46Å; C411-S416 PolarHBondContact N-O 2.77Å; C411-L418 HydrophobicContact CB-CD2 3.98Å; C411-L418 HydrophobicContact CB-CG 4.46Å; C411-C441 HydrophobicContact CB-CB 4.24Å; C411-C444 PolarHBondContact SG-SG 3.25Å
412	R	89.1	Confident	83.1	Confident	172 Å²	172	41.7 Å²	41.7	65%	0.649	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-19.9	175.4	-75.9	179.1	-174.4	-168.9	2.7	113.6	L410 R446	L410-R412 PolarHBondContact O-N 3.22Å; R412-R446 PolarHBondContact O-NH1 3.37Å
413	G	88.3	Confident	83.8	Confident	41 Å²	41	40.4 Å²	40.4	42%	0.423	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-74.7	176.6	0	0	0	0	0	111.7	C411	C411-G413 VanDerWaalsContact C-N 3.25Å; C411-G413 PolarHBondContact O-N 3.29Å; C411-G413 PolarHBondContact SG-N 2.96Å; C411-G413 VanDerWaalsContact SG-N 3.36Å
414	C	88.6	Confident	84.6	Confident	32 Å²	32	36.6 Å²	36.6	22%	0.216	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	2.3	-170.3	60.6	0	0	0	0	115	R385 C411 S416 C444	R385-C414 VanDerWaalsContact CG-O 3.27Å; R385-C414 WeakPolarHBondContact CG-O 3.43Å; C411-C414 VanDerWaalsContact SG-SG 3.66Å; C414-S416 PolarHBondContact O-N 3.33Å; C414-S416 PolarHBondContact SG-OG 3.33Å; C414-C444 HydrophobicContact CB-CB 3.99Å; C414-C444 VanDerWaalsContact SG-SG 3.69Å
415	S	90.1	Very high	85.4	Confident	5 Å²	5	37.4 Å²	37.4	4%	0.035	22%	0.221	C	C	.	.			trans	63.5	12.3	-175.3	-44.2	0	0	0	0	115.5	C388 R392 C411 L417	C388-S415 WeakPolarHBondContact CB-O 3.42Å; R392-S415 PolarHBondContact NH1-OG 2.94Å; C411-S415 VanDerWaalsContact O-CA 3.27Å; C411-S415 WeakPolarHBondContact O-CA 3.35Å; C411-S415 PolarHBondContact O-N 3.37Å; C411-S415 VanDerWaalsContact O-N 3.12Å; S415-L417 PolarHBondContact O-N 3.45Å
416	S	88.9	Confident	86.1	Confident	2 Å²	2	39 Å²	39	1%	0.014	23%	0.225	C	C	.	.			trans	-56.1	139.9	170.3	-64.7	0	0	0	0	110.9	R385 C411 C414 T443	R385-S416 PolarHBondContact NE-OG 2.87Å; C411-S416 WeakPolarHBondContact CB-O 3.46Å; C411-S416 PolarHBondContact N-O 2.77Å; C414-S416 PolarHBondContact O-N 3.33Å; C414-S416 PolarHBondContact SG-OG 3.33Å; S416-T443 PolarHBondContact OG-OG1 3.08Å
417	L	88.3	Confident	86.6	Confident	17 Å²	17	41.5 Å²	41.5	9%	0.089	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-60	139.7	163.5	-166.3	66	0	0	0	108.2	A370 H371 L374 T409 L410 S415 V419 T423	A370-L417 HydrophobicContact CB-CB 4.47Å; A370-L417 HydrophobicContact CB-CD2 4.14Å; H371-L417 HydrophobicContact CB-CD2 4.03Å; L374-L417 HydrophobicContact CD1-CB 4.24Å; L374-L417 HydrophobicContact CD1-CD2 3.97Å; T409-L417 CarbonylContact O-C 3.51Å; L410-L417 HydrophobicContact CD2-CD1 3.75Å; S415-L417 PolarHBondContact O-N 3.45Å; L417-V419 HydrophobicContact CD2-CG2 3.8Å; L417-V419 HydrophobicContact CG-CG2 3.94Å; L417-T423 WeakPolarHBondContact O-CB 3.41Å; L417-T423 PolarHBondContact O-OG1 2.78Å
418	L	87.4	Confident	86.9	Confident	2 Å²	2	42 Å²	42	1%	0.01	23%	0.233	C	C	.	.			trans	-102.4	82.6	-178.1	-62.5	176.8	0	0	0	108.7	T409 C411 C424 Q439 C441	T409-L418 WeakPolarHBondContact O-CB 3.43Å; T409-L418 PolarHBondContact O-N 3.05Å; C411-L418 HydrophobicContact CB-CD2 3.98Å; C411-L418 HydrophobicContact CB-CG 4.46Å; L418-C424 VanDerWaalsContact C-SG 3.58Å; L418-C424 HydrophobicContact CB-CB 4.21Å; L418-C424 HydrophobicContact CD2-CB 3.71Å; L418-Q439 HydrophobicContact CD1-CB 4.4Å; L418-C441 HydrophobicContact CD2-CB 3.96Å
419	V	85.1	Confident	86.9	Confident	19 Å²	19	46 Å²	46	12%	0.115	25%	0.248	C	C	.	.			trans	-96.9	114.9	173.2	-175.1	0	0	0	0	107.8	L374 L417 G421 L422 T423 C424	L374-V419 HydrophobicContact CD1-CG2 3.95Å; L417-V419 HydrophobicContact CD2-CG2 3.8Å; L417-V419 HydrophobicContact CG-CG2 3.94Å; V419-G421 PolarHBondContact O-N 2.91Å; V419-L422 HydrophobicContact CB-CB 4.14Å; V419-L422 HydrophobicContact CG1-CB 4.04Å; V419-L422 HydrophobicContact CG1-CD2 4.41Å; V419-L422 PolarHBondContact O-N 3.35Å; V419-T423 WeakPolarHBondContact CB-OG1 3.47Å; V419-T423 PolarHBondContact N-OG1 3.5Å; V419-T423 PolarHBondContact O-N 3.03Å; V419-T423 PolarHBondContact O-OG1 2.99Å; V419-C424 VanDerWaalsContact C-SG 3.52Å; V419-C424 PolarHBondContact O-N 3.07Å
420	P	83.3	Confident	86.9	Confident	42 Å²	42	53.9 Å²	53.9	27%	0.273	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-55.9	134.7	178.2	-26.4	37.3	0	0	0	111.5	L422 C424 Q426	P420-L422 PolarHBondContact O-N 3.06Å; P420-C424 CarbonylContact C-O 3.58Å; P420-C424 WeakPolarHBondContact CA-O 3.17Å; P420-Q426 HydrophobicContact CB-CB 4.01Å; P420-Q426 HydrophobicContact CG-CB 4.2Å
421	G	80.1	Confident	86.4	Confident	80 Å²	80	57.3 Å²	57.3	83%	0.825	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	82	-19.9	-179.8	0	0	0	0	0	114.7	V419 C424	V419-G421 PolarHBondContact O-N 2.91Å; G421-C424 PolarHBondContact N-O 3.21Å
422	L	82.9	Confident	85.9	Confident	47 Å²	47	68.8 Å²	68.8	25%	0.246	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-57.4	-179.7	-179.9	61.2	0	0	0	112.8	L374 P378 V419 P420 L442	L374-L422 HydrophobicContact CB-CD2 4.08Å; L374-L422 HydrophobicContact CD1-CD2 4.16Å; L374-L422 HydrophobicContact CD2-CD2 4.34Å; L374-L422 HydrophobicContact CG-CD2 4.44Å; P378-L422 HydrophobicContact CB-CD1 3.68Å; P378-L422 HydrophobicContact CB-CD2 4.21Å; V419-L422 HydrophobicContact CB-CB 4.14Å; V419-L422 HydrophobicContact CG1-CB 4.04Å; V419-L422 HydrophobicContact CG1-CD2 4.41Å; V419-L422 PolarHBondContact O-N 3.35Å; P420-L422 PolarHBondContact O-N 3.06Å; L422-L442 WeakPolarHBondContact O-CD1 3.44Å
423	T	86.1	Confident	85.4	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.018	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-8.1	-174.8	41.3	0	0	0	0	112.9	L374 Q381 L417 V419 L442	L374-T423 HydrophobicContact CD1-CG2 4.13Å; Q381-T423 HydrophobicContact CB-CG2 4.46Å; Q381-T423 HydrophobicContact CG-CG2 4.12Å; L417-T423 WeakPolarHBondContact O-CB 3.41Å; L417-T423 PolarHBondContact O-OG1 2.78Å; V419-T423 WeakPolarHBondContact CB-OG1 3.47Å; V419-T423 PolarHBondContact N-OG1 3.5Å; V419-T423 PolarHBondContact O-N 3.03Å; V419-T423 PolarHBondContact O-OG1 2.99Å; T423-L442 PolarHBondContact O-N 3.1Å
424	C	90.9	Very high	85	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	156.6	172.8	76.3	0	0	0	0	112.5	L418 V419 P420 G421 T440	L418-C424 VanDerWaalsContact C-SG 3.58Å; L418-C424 HydrophobicContact CB-CB 4.21Å; L418-C424 HydrophobicContact CD2-CB 3.71Å; V419-C424 VanDerWaalsContact C-SG 3.52Å; V419-C424 PolarHBondContact O-N 3.07Å; P420-C424 CarbonylContact C-O 3.58Å; P420-C424 WeakPolarHBondContact CA-O 3.17Å; G421-C424 PolarHBondContact N-O 3.21Å; C424-T440 CarbonylContact C-O 3.56Å; C424-T440 WeakPolarHBondContact CA-O 3.42Å; C424-T440 VanDerWaalsContact CB-O 3.26Å; C424-T440 WeakPolarHBondContact CB-O 3.39Å
425	T	90.2	Very high	84.8	Confident	69 Å²	69	71.9 Å²	71.9	42%	0.423	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	146.4	163.3	61.6	0	0	0	0	109.9	Q439 T440 L442	T425-Q439 CarbonylContact O-C 3.43Å; T425-Q439 VanDerWaalsContact O-CA 3.24Å; T425-Q439 WeakPolarHBondContact O-CA 3.22Å; T425-T440 PolarHBondContact N-O 3.24Å; T425-T440 PolarHBondContact O-N 3.12Å; T425-T440 WeakPolarHBondContact OG1-CB 3.5Å; T425-L442 HydrophobicContact CG2-CD2 3.8Å
426	Q	88.6	Confident	84.6	Confident	61 Å²	61	75.4 Å²	75.4	29%	0.285	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	134.1	179.3	-178.5	163.7	-54.6	0	0	110.7	P420 T437 Q439	P420-Q426 HydrophobicContact CB-CB 4.01Å; P420-Q426 HydrophobicContact CG-CB 4.2Å; Q426-T437 HydrophobicContact CG-CG2 3.6Å; Q426-Q439 HydrophobicContact CB-CG 4.48Å; Q426-Q439 HydrophobicContact CG-CG 4.37Å
427	R	87.1	Confident	84.5	Confident	109 Å²	109	75.3 Å²	75.3	41%	0.411	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	140.7	172.8	62.7	-173.2	172.2	-169.6	-8.3	110.8	V438	R427-V438 HydrophobicContact CG-CB 3.75Å; R427-V438 HydrophobicContact CG-CG1 4.47Å; R427-V438 HydrophobicContact CG-CG2 4.45Å; R427-V438 PolarHBondContact N-O 3.24Å; R427-V438 PolarHBondContact O-N 3.32Å
428	Q	85.7	Confident	84.6	Confident	115 Å²	115	74.5 Å²	74.5	54%	0.537	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	140.9	173.2	-68	-170.2	-6.7	0	0	110.7	W436	Q428-W436 CarbonylContact C-O 3.48Å; Q428-W436 WeakPolarHBondContact CA-O 3.49Å
429	R	82.8	Confident	84.7	Confident	120 Å²	120	74.6 Å²	74.6	45%	0.453	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	137.9	174.9	-68	-169.1	174.2	-158.5	-3.6	109.5	W436 V438	R429-W436 PolarHBondContact N-O 3.33Å; R429-W436 PolarHBondContact O-N 3.02Å; R429-V438 HydrophobicContact CG-CG2 4.22Å
430	R	83.5	Confident	85.1	Confident	194 Å²	194	74.5 Å²	74.5	73%	0.732	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	127.2	172	-162.4	175.3	-177.2	-174.7	-2.3	108.9	Q434	R430-Q434 WeakPolarHBondContact CA-O 3.4Å
431	C	78.4	Confident	85.6	Confident	73 Å²	73	72.5 Å²	72.5	49%	0.493	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	128.4	176.4	-172	0	0	0	0	109	G433 Q434	C431-G433 VanDerWaalsContact C-N 3.31Å; C431-G433 PolarHBondContact O-N 2.98Å; C431-Q434 PolarHBondContact N-O 3.08Å; C431-Q434 PolarHBondContact O-N 2.64Å
432	R	78.4	Confident	86.1	Confident	241 Å²	241	72.3 Å²	72.3	91%	0.909	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	46.2	180	-60.2	-178.5	179	-175	-1.6	113.7	Q434	R432-Q434 PolarHBondContact O-N 3.46Å; R432-Q434 VanDerWaalsContact O-N 3.09Å
433	G	79.1	Confident	86.4	Confident	60 Å²	60	72.7 Å²	72.7	62%	0.619	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-16.6	180	0	0	0	0	0	115.5	C431	C431-G433 VanDerWaalsContact C-N 3.31Å; C431-G433 PolarHBondContact O-N 2.98Å
434	Q	80.6	Confident	86.7	Confident	98 Å²	98	75 Å²	75	46%	0.458	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	143.5	179.6	-67.4	178.4	-14.8	0	0	112.1	R430 C431 R432 L451	R430-Q434 WeakPolarHBondContact CA-O 3.4Å; C431-Q434 PolarHBondContact N-O 3.08Å; C431-Q434 PolarHBondContact O-N 2.64Å; R432-Q434 PolarHBondContact O-N 3.46Å; R432-Q434 VanDerWaalsContact O-N 3.09Å; Q434-L451 HydrophobicContact CB-CD1 3.91Å; Q434-L451 HydrophobicContact CG-CD1 4.29Å
435	R	84.1	Confident	86.9	Confident	152 Å²	152	81 Å²	81	57%	0.574	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	131.3	173.5	-64.7	-174.4	-169.4	-178.5	3.8	109.9	N452	R435-N452 HydrophobicContact CB-CB 4.14Å; R435-N452 WeakPolarHBondContact O-CB 3.47Å; R435-N452 PolarHBondContact O-N 3.24Å
436	W	85.6	Confident	87.1	Confident	79 Å²	79	84 Å²	84	30%	0.299	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	135.5	-179.8	-64.2	82.2	0	0	0	109.6	Q428 R429 F450 L451	Q428-W436 CarbonylContact C-O 3.48Å; Q428-W436 WeakPolarHBondContact CA-O 3.49Å; R429-W436 PolarHBondContact N-O 3.33Å; R429-W436 PolarHBondContact O-N 3.02Å; W436-F450 CarbonylContact C-O 3.49Å; W436-F450 VanDerWaalsContact CA-O 3.3Å; W436-F450 WeakPolarHBondContact CA-O 3.14Å; W436-L451 HydrophobicContact CD2-CB 4.49Å; W436-L451 HydrophobicContact CD2-CD1 4.09Å; W436-L451 HydrophobicContact CE3-CB 3.99Å; W436-L451 HydrophobicContact CE3-CD1 4.42Å; W436-L451 HydrophobicContact CH2-CB 3.97Å; W436-L451 HydrophobicContact CH2-CD1 4.12Å; W436-L451 HydrophobicContact CZ2-CB 4.46Å; W436-L451 HydrophobicContact CZ2-CD1 3.76Å; W436-L451 HydrophobicContact CZ3-CB 3.71Å; W436-L451 HydrophobicContact CZ3-CD1 4.44Å
437	T	87.1	Confident	87.2	Confident	0 Å²	0	83.9 Å²	83.9	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.4	169.7	-63.5	0	0	0	0	109.4	Q426 Q439 R449 F450 N452 L458	Q426-T437 HydrophobicContact CG-CG2 3.6Å; T437-Q439 HydrophobicContact CG2-CG 4.15Å; T437-R449 WeakPolarHBondContact O-CA 3.42Å; T437-F450 PolarHBondContact N-O 3.43Å; T437-F450 PolarHBondContact O-N 3.06Å; T437-N452 WeakPolarHBondContact CB-OD1 3.43Å; T437-N452 PolarHBondContact N-OD1 3.47Å; T437-N452 VanDerWaalsContact N-OD1 3.14Å; T437-N452 PolarHBondContact OG1-ND2 3.02Å; T437-N452 PolarHBondContact OG1-OD1 3.15Å; T437-L458 VanDerWaalsContact CB-CD1 3.45Å; T437-L458 HydrophobicContact CG2-CD1 3.53Å
438	V	89.1	Confident	87.4	Confident	1 Å²	1	79.2 Å²	79.2	1%	0.006	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	117	174.4	-172.3	0	0	0	0	108.2	R427 R429 Q448 R449	R427-V438 HydrophobicContact CG-CB 3.75Å; R427-V438 HydrophobicContact CG-CG1 4.47Å; R427-V438 HydrophobicContact CG-CG2 4.45Å; R427-V438 PolarHBondContact N-O 3.24Å; R427-V438 PolarHBondContact O-N 3.32Å; R429-V438 HydrophobicContact CG-CG2 4.22Å; V438-Q448 CarbonylContact C-O 3.52Å; V438-Q448 VanDerWaalsContact CA-O 3.29Å; V438-Q448 WeakPolarHBondContact CA-O 3.42Å; V438-R449 HydrophobicContact CG1-CG 4.25Å; V438-R449 HydrophobicContact CG2-CG 4.03Å
439	Q	90.9	Very high	87.5	Confident	3 Å²	3	82.1 Å²	82.1	1%	0.014	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	132.2	174.4	-69	-176.3	-30.2	0	0	110	L418 T425 Q426 T437 S447 Q448 F450	L418-Q439 HydrophobicContact CD1-CB 4.4Å; T425-Q439 CarbonylContact O-C 3.43Å; T425-Q439 VanDerWaalsContact O-CA 3.24Å; T425-Q439 WeakPolarHBondContact O-CA 3.22Å; Q426-Q439 HydrophobicContact CB-CG 4.48Å; Q426-Q439 HydrophobicContact CG-CG 4.37Å; T437-Q439 HydrophobicContact CG2-CG 4.15Å; Q439-S447 CarbonylContact O-C 3.51Å; Q439-S447 WeakPolarHBondContact O-CA 3.36Å; Q439-Q448 PolarHBondContact N-O 3.34Å; Q439-Q448 PolarHBondContact O-N 2.83Å; Q439-F450 HydrophobicContact CB-CE2 4.28Å; Q439-F450 HydrophobicContact CG-CD2 4.5Å; Q439-F450 HydrophobicContact CG-CE2 4.36Å
440	T	93.3	Very high	87.7	Confident	17 Å²	17	77 Å²	77	10%	0.104	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	118.1	176.6	-42.8	0	0	0	0	109	C424 T425 L442 S447	C424-T440 CarbonylContact C-O 3.56Å; C424-T440 WeakPolarHBondContact CA-O 3.42Å; C424-T440 VanDerWaalsContact CB-O 3.26Å; C424-T440 WeakPolarHBondContact CB-O 3.39Å; T425-T440 PolarHBondContact N-O 3.24Å; T425-T440 PolarHBondContact O-N 3.12Å; T425-T440 WeakPolarHBondContact OG1-CB 3.5Å; T440-L442 PolarHBondContact O-N 3.04Å; T440-S447 PolarHBondContact OG1-OG 3.11Å
441	C	93.4	Very high	87.7	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	127.6	-179.6	-179.9	0	0	0	0	110.8	C411 L418 T443 Q445 R446	C411-C441 HydrophobicContact CB-CB 4.24Å; L418-C441 HydrophobicContact CD2-CB 3.96Å; C441-T443 VanDerWaalsContact C-N 3.28Å; C441-T443 PolarHBondContact O-N 2.71Å; C441-T443 PolarHBondContact SG-N 2.91Å; C441-T443 VanDerWaalsContact SG-N 3.44Å; C441-Q445 WeakPolarHBondContact O-CA 3.28Å; C441-Q445 PolarHBondContact O-N 3.35Å; C441-R446 PolarHBondContact N-O 2.71Å
442	L	91.5	Very high	87.5	Confident	76 Å²	76	69.3 Å²	69.3	40%	0.398	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-27	178.4	-68.4	174.6	0	0	0	112.2	L422 T423 T425 T440 Q445	L422-L442 WeakPolarHBondContact O-CD1 3.44Å; T423-L442 PolarHBondContact O-N 3.1Å; T425-L442 HydrophobicContact CG2-CD2 3.8Å; T440-L442 PolarHBondContact O-N 3.04Å; L442-Q445 PolarHBondContact O-NE2 3.41Å; L442-Q445 VanDerWaalsContact O-NE2 3.12Å
443	T	88.4	Confident	87.1	Confident	55 Å²	55	60.8 Å²	60.8	34%	0.337	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-49.7	178.8	-47.2	0	0	0	0	113	R385 S416 C441	R385-T443 VanDerWaalsContact NH2-CG2 3.33Å; R385-T443 PolarHBondContact NH2-OG1 3.04Å; R385-T443 VanDerWaalsContact NH2-OG1 3.17Å; S416-T443 PolarHBondContact OG-OG1 3.08Å; C441-T443 VanDerWaalsContact C-N 3.28Å; C441-T443 PolarHBondContact O-N 2.71Å; C441-T443 PolarHBondContact SG-N 2.91Å; C441-T443 VanDerWaalsContact SG-N 3.44Å
444	C	92.5	Very high	86.4	Confident	53 Å²	53	63.5 Å²	63.5	36%	0.358	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	6.5	-170.7	82.4	0	0	0	0	113.8	C411 C414 R446	C411-C444 PolarHBondContact SG-SG 3.25Å; C414-C444 HydrophobicContact CB-CB 3.99Å; C414-C444 VanDerWaalsContact SG-SG 3.69Å; C444-R446 PolarHBondContact O-N 3.24Å; C444-R446 VanDerWaalsContact SG-CB 3.53Å
445	Q	93.9	Very high	85.7	Confident	125 Å²	125	61.6 Å²	61.6	58%	0.584	31%	0.314	S	S	*	.			trans	59.1	10.1	178.3	-57.6	-59.5	-29.2	0	0	115.9	C441 L442 S447	C441-Q445 WeakPolarHBondContact O-CA 3.28Å; C441-Q445 PolarHBondContact O-N 3.35Å; L442-Q445 PolarHBondContact O-NE2 3.41Å; L442-Q445 VanDerWaalsContact O-NE2 3.12Å; Q445-S447 PolarHBondContact O-N 3.38Å
446	R	94.3	Very high	84.9	Confident	132 Å²	132	57.6 Å²	57.6	50%	0.498	30%	0.302	S	S	.	.			trans	-75.9	128.4	179.1	-166	173.6	-167.4	173.5	6.2	110.2	R412 C441 C444	R412-R446 PolarHBondContact O-NH1 3.37Å; C441-R446 PolarHBondContact N-O 2.71Å; C444-R446 PolarHBondContact O-N 3.24Å; C444-R446 VanDerWaalsContact SG-CB 3.53Å
447	S	92.6	Very high	83.8	Confident	59 Å²	59	57.5 Å²	57.5	41%	0.413	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	136.5	173.4	-70.9	0	0	0	0	111.9	Q439 T440 Q445	Q439-S447 CarbonylContact O-C 3.51Å; Q439-S447 WeakPolarHBondContact O-CA 3.36Å; T440-S447 PolarHBondContact OG1-OG 3.11Å; Q445-S447 PolarHBondContact O-N 3.38Å
448	Q	90.5	Very high	82.9	Confident	11 Å²	11	57.6 Å²	57.6	5%	0.051	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	141.4	170.4	-76	166.5	-116.5	0	0	109.7	L410 V438 Q439 F450	L410-Q448 PolarHBondContact O-NE2 3.39Å; L410-Q448 VanDerWaalsContact O-NE2 3.08Å; L410-Q448 PolarHBondContact O-OE1 2.97Å; V438-Q448 CarbonylContact C-O 3.52Å; V438-Q448 VanDerWaalsContact CA-O 3.29Å; V438-Q448 WeakPolarHBondContact CA-O 3.42Å; Q439-Q448 PolarHBondContact N-O 3.34Å; Q439-Q448 PolarHBondContact O-N 2.83Å; Q448-F450 HydrophobicContact CB-CE1 4.49Å; Q448-F450 HydrophobicContact CB-CE2 3.72Å; Q448-F450 HydrophobicContact CB-CZ 3.72Å; Q448-F450 HydrophobicContact CG-CZ 4.48Å
449	R	88.6	Confident	81.6	Confident	175 Å²	175	60.5 Å²	60.5	66%	0.66	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	133	177.8	-55.1	-173.5	-176.9	173.1	2.3	108.9	T437 V438	T437-R449 WeakPolarHBondContact O-CA 3.42Å; V438-R449 HydrophobicContact CG1-CG 4.25Å; V438-R449 HydrophobicContact CG2-CG 4.03Å
450	F	86.1	Confident	80.1	Confident	12 Å²	12	61 Å²	61	5%	0.053	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	130.1	-177.1	-60.3	-68.6	0	0	0	108.7	R408 W436 T437 Q439 Q448 L458	R408-F450 HydrophobicContact CB-CD1 4.24Å; R408-F450 HydrophobicContact CB-CE1 3.9Å; R408-F450 HydrophobicContact CB-CZ 4.37Å; R408-F450 HydrophobicContact CG-CD1 3.86Å; R408-F450 HydrophobicContact CG-CE1 3.76Å; R408-F450 VanDerWaalsContact O-CZ 3.24Å; R408-F450 WeakPolarHBondContact O-CZ 3.44Å; W436-F450 CarbonylContact C-O 3.49Å; W436-F450 VanDerWaalsContact CA-O 3.3Å; W436-F450 WeakPolarHBondContact CA-O 3.14Å; T437-F450 PolarHBondContact N-O 3.43Å; T437-F450 PolarHBondContact O-N 3.06Å; Q439-F450 HydrophobicContact CB-CE2 4.28Å; Q439-F450 HydrophobicContact CG-CD2 4.5Å; Q439-F450 HydrophobicContact CG-CE2 4.36Å; Q448-F450 HydrophobicContact CB-CE1 4.49Å; Q448-F450 HydrophobicContact CB-CE2 3.72Å; Q448-F450 HydrophobicContact CB-CZ 3.72Å; Q448-F450 HydrophobicContact CG-CZ 4.48Å; F450-L458 HydrophobicContact CB-CD1 3.92Å; F450-L458 HydrophobicContact CB-CD2 4.13Å; F450-L458 HydrophobicContact CD1-CD2 4.4Å; F450-L458 HydrophobicContact CD2-CD1 4.15Å; F450-L458 HydrophobicContact CD2-CD2 4.04Å; F450-L458 HydrophobicContact CG-CD1 4.31Å; F450-L458 HydrophobicContact CG-CD2 3.95Å
451	L	83.3	Confident	78.6	Confident	63 Å²	63	61.7 Å²	61.7	33%	0.33	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	131.2	171.3	-179.4	66.7	0	0	0	108.3	R408 Q434 W436 D453	R408-L451 PolarHBondContact NH2-O 2.98Å; Q434-L451 HydrophobicContact CB-CD1 3.91Å; Q434-L451 HydrophobicContact CG-CD1 4.29Å; W436-L451 HydrophobicContact CD2-CB 4.49Å; W436-L451 HydrophobicContact CD2-CD1 4.09Å; W436-L451 HydrophobicContact CE3-CB 3.99Å; W436-L451 HydrophobicContact CE3-CD1 4.42Å; W436-L451 HydrophobicContact CH2-CB 3.97Å; W436-L451 HydrophobicContact CH2-CD1 4.12Å; W436-L451 HydrophobicContact CZ2-CB 4.46Å; W436-L451 HydrophobicContact CZ2-CD1 3.76Å; W436-L451 HydrophobicContact CZ3-CB 3.71Å; W436-L451 HydrophobicContact CZ3-CD1 4.44Å; L451-D453 PolarHBondContact O-N 2.67Å
452	N	75.1	Confident	77	Confident	43 Å²	43	66.2 Å²	66.2	23%	0.23	35%	0.345	C	S	.	.			trans	-72.3	105	177.5	-66.6	4.6	0	0	0	108.2	R435 T437	R435-N452 HydrophobicContact CB-CB 4.14Å; R435-N452 WeakPolarHBondContact O-CB 3.47Å; R435-N452 PolarHBondContact O-N 3.24Å; T437-N452 WeakPolarHBondContact CB-OD1 3.43Å; T437-N452 PolarHBondContact N-OD1 3.47Å; T437-N452 VanDerWaalsContact N-OD1 3.14Å; T437-N452 PolarHBondContact OG1-ND2 3.02Å; T437-N452 PolarHBondContact OG1-OD1 3.15Å
453	D	69.3	Low	75.1	Confident	63 Å²	63	66.8 Å²	66.8	34%	0.337	35%	0.353	S	S	.	.			trans	-118.1	122.3	-174.4	-178.7	-18	0	0	0	108.4	L451 G455 H456	L451-D453 PolarHBondContact O-N 2.67Å; D453-G455 PolarHBondContact O-N 3.49Å; D453-G455 PolarHBondContact OD1-N 3.31Å; D453-H456 HydrophobicContact CB-CB 4.39Å; D453-H456 CarbonylContact O-C 3.5Å; D453-H456 PolarHBondContact O-N 3.1Å; D453-H456 VanDerWaalsContact O-N 3.09Å; D453-H456 IonicContact OD2-CD2 3.71Å; D453-H456 PolarHBondContact OD2-CD2 2.77Å
454	P	64.4	Low	73.3	Confident	117 Å²	117	69.4 Å²	69.4	76%	0.76	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-28.5	178.3	-23.3	33.1	0	0	0	114.4
455	G	65.4	Low	71.3	Confident	57 Å²	57	68.4 Å²	68.4	59%	0.588	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-12.1	178.7	0	0	0	0	0	114.3	D453	D453-G455 PolarHBondContact O-N 3.49Å; D453-G455 PolarHBondContact OD1-N 3.31Å
456	H	67.1	Low	69	Low	68 Å²	68	66.3 Å²	66.3	32%	0.315	35%	0.347	S	S	.	.	S	Bend	trans	-140.7	62	-173	-62	-45.6	0	0	0	111.8	D453	D453-H456 HydrophobicContact CB-CB 4.39Å; D453-H456 CarbonylContact O-C 3.5Å; D453-H456 PolarHBondContact O-N 3.1Å; D453-H456 VanDerWaalsContact O-N 3.09Å; D453-H456 IonicContact OD2-CD2 3.71Å; D453-H456 PolarHBondContact OD2-CD2 2.77Å
457	L	63.9	Low	66.7	Low	78 Å²	78	67.1 Å²	67.1	41%	0.408	36%	0.361	S	S	.	.			trans	-58.3	134.6	-178.7	-62	172.3	0	0	0	112.4	D461 R462	L457-D461 HydrophobicContact CB-CB 4.39Å; L457-D461 HydrophobicContact CD2-CB 4.13Å; L457-R462 HydrophobicContact CB-CG 4.47Å
458	L	67.4	Low	64.1	Low	2 Å²	2	68 Å²	68	1%	0.01	38%	0.378	C	S	.	.			trans	-76.6	161.5	168.8	-58.2	171.7	0	0	0	109.9	R408 T437 F450 G460 D461 R462	R408-L458 HydrophobicContact CB-CD2 3.76Å; R408-L458 HydrophobicContact CG-CD2 4.47Å; T437-L458 VanDerWaalsContact CB-CD1 3.45Å; T437-L458 HydrophobicContact CG2-CD1 3.53Å; F450-L458 HydrophobicContact CB-CD1 3.92Å; F450-L458 HydrophobicContact CB-CD2 4.13Å; F450-L458 HydrophobicContact CD1-CD2 4.4Å; F450-L458 HydrophobicContact CD2-CD1 4.15Å; F450-L458 HydrophobicContact CD2-CD2 4.04Å; F450-L458 HydrophobicContact CG-CD1 4.31Å; F450-L458 HydrophobicContact CG-CD2 3.95Å; L458-G460 VanDerWaalsContact C-N 3.32Å; L458-G460 PolarHBondContact O-N 3.12Å; L458-D461 VanDerWaalsContact CB-OD2 3.31Å; L458-D461 WeakPolarHBondContact CB-OD2 3.48Å; L458-D461 PolarHBondContact N-OD2 2.79Å; L458-D461 WeakPolarHBondContact O-CA 3.46Å; L458-D461 WeakPolarHBondContact O-CB 3.26Å; L458-D461 PolarHBondContact O-N 3.4Å; L458-R462 WeakPolarHBondContact O-CG 3.36Å; L458-R462 PolarHBondContact O-N 3.17Å
459	W	62.6	Low	61.5	Low	61 Å²	61	72 Å²	72	23%	0.231	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-50.8	-49.2	177.4	179.3	-103.3	0	0	0	112.6	H371 D461 R462 A465	H371-W459 AromaticContact CD2-CH2 3.93Å; H371-W459 AromaticContact CD2-CZ2 3.88Å; H371-W459 AromaticContact CE1-CH2 3.5Å; H371-W459 VanDerWaalsContact CE1-CH2 3.5Å; H371-W459 WeakPolarHBondContact CE1-CH2 3.39Å; H371-W459 AromaticContact CE1-CZ2 3.61Å; H371-W459 AromaticContact NE2-CE2 3.6Å; H371-W459 AromaticContact NE2-CH2 3.24Å; H371-W459 WeakPolarHBondContact NE2-CH2 3.46Å; H371-W459 AromaticContact NE2-CZ2 3Å; H371-W459 WeakPolarHBondContact NE2-CZ2 3.38Å; W459-D461 PolarHBondContact O-N 3.22Å; W459-R462 WeakPolarHBondContact O-CB 3.22Å; W459-R462 PolarHBondContact O-N 3.49Å; W459-A465 WeakPolarHBondContact O-CB 3.28Å
460	G	58.3	Low	58.8	Low	15 Å²	15	71.8 Å²	71.8	16%	0.155	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-68.9	-11.8	177.8	0	0	0	0	0	115.5	L458 Q466	L458-G460 VanDerWaalsContact C-N 3.32Å; L458-G460 PolarHBondContact O-N 3.12Å; G460-Q466 PolarHBondContact O-NE2 3.34Å
461	D	61.1	Low	56.4	Low	30 Å²	30	75.5 Å²	75.5	16%	0.16	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-91	-6.9	174.3	-57.8	-37	0	0	0	111.6	L457 L458 W459	L457-D461 HydrophobicContact CB-CB 4.39Å; L457-D461 HydrophobicContact CD2-CB 4.13Å; L458-D461 VanDerWaalsContact CB-OD2 3.31Å; L458-D461 WeakPolarHBondContact CB-OD2 3.48Å; L458-D461 PolarHBondContact N-OD2 2.79Å; L458-D461 WeakPolarHBondContact O-CA 3.46Å; L458-D461 WeakPolarHBondContact O-CB 3.26Å; L458-D461 PolarHBondContact O-N 3.4Å; W459-D461 PolarHBondContact O-N 3.22Å
462	R	60.8	Low	54.4	Low	95 Å²	95	80.2 Å²	80.2	36%	0.358	47%	0.473	S	S	.	.	S	Bend	trans	-83.5	144.9	178	-51.5	-169.6	172.1	-165.3	-4.4	111.1	L457 L458 W459 E464 A465	L457-R462 HydrophobicContact CB-CG 4.47Å; L458-R462 WeakPolarHBondContact O-CG 3.36Å; L458-R462 PolarHBondContact O-N 3.17Å; W459-R462 WeakPolarHBondContact O-CB 3.22Å; W459-R462 PolarHBondContact O-N 3.49Å; R462-E464 WeakPolarHBondContact CB-OE2 3.32Å; R462-E464 PolarHBondContact O-N 3.41Å; R462-E464 VanDerWaalsContact O-N 3.13Å; R462-A465 PolarHBondContact O-N 2.72Å
463	P	51.5	Low	52.3	Low	89 Å²	89	84 Å²	84	58%	0.578	50%	0.502	S	S	*	.	H	α-helix	trans	-53.8	-35.4	-178.5	-25.4	34.2	0	0	0	113.4	A465 Q466	P463-A465 PolarHBondContact O-N 3.16Å; P463-Q466 PolarHBondContact O-N 3.36Å
464	E	50.8	Low	50.4	Low	110 Å²	110	90.6 Å²	90.6	51%	0.514	53%	0.528	S	S	.	.	H	α-helix	trans	-66.1	-26.1	-178.3	-52.1	80.2	-175.2	0	0	112.6	R462	R462-E464 WeakPolarHBondContact CB-OE2 3.32Å; R462-E464 PolarHBondContact O-N 3.41Å; R462-E464 VanDerWaalsContact O-N 3.13Å
465	A	50.7	Low	48.9	Very low	32 Å²	32	90.7 Å²	90.7	26%	0.264	53%	0.529	S	S	.	.	H	α-helix	trans	-91.2	-9.7	178.5	0	0	0	0	0	113.5	W459 R462 P463	W459-A465 WeakPolarHBondContact O-CB 3.28Å; R462-A465 PolarHBondContact O-N 2.72Å; P463-A465 PolarHBondContact O-N 3.16Å
466	Q	46.1	Very low	47.2	Very low	81 Å²	81	96.5 Å²	96.5	38%	0.379	55%	0.545	S	S	.	.	H	α-helix	trans	-96.6	-11.7	-174.3	-69.3	178.6	-1.9	0	0	113.9	G460 P463 G468 S469	G460-Q466 PolarHBondContact O-NE2 3.34Å; P463-Q466 PolarHBondContact O-N 3.36Å; Q466-G468 PolarHBondContact O-N 2.96Å; Q466-G468 VanDerWaalsContact O-N 3.13Å; Q466-S469 PolarHBondContact O-N 2.93Å; Q466-S469 VanDerWaalsContact O-N 3.09Å
467	L	44.9	Very low	45.5	Very low	149 Å²	149	101.7 Å²	101.7	78%	0.78	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-18.9	-176.6	-74.7	161.9	0	0	0	114.5
468	G	37.5	Very low	43.9	Very low	76 Å²	76	104.1 Å²	104.1	78%	0.784	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-7.7	175.6	0	0	0	0	0	115.6	Q466	Q466-G468 PolarHBondContact O-N 2.96Å; Q466-G468 VanDerWaalsContact O-N 3.13Å
469	S	35.8	Very low	42.2	Very low	96 Å²	96	112 Å²	112	67%	0.671	63%	0.631	S	S	*	*	S	Bend	trans	-109.8	-0.3	-165.1	-43.7	0	0	0	0	115.4	Q466	Q466-S469 PolarHBondContact O-N 2.93Å; Q466-S469 VanDerWaalsContact O-N 3.09Å
470	Q	33.8	Very low	40.7	Very low	171 Å²	171	114.5 Å²	114.5	80%	0.799	66%	0.656	S	S	*	*			trans	-99.1	4.9	-175.8	-74.3	-164.6	5.1	0	0	115.1	D472	Q470-D472 PolarHBondContact O-N 2.96Å
471	A	34.8	Very low	39.4	Very low	89 Å²	89	121.8 Å²	121.8	74%	0.736	69%	0.691	S	S	*	*	S	Bend	trans	-94.3	68.5	167.9	0	0	0	0	0	109.4
472	D	40.8	Very low	37.9	Very low	163 Å²	163	127 Å²	127	87%	0.872	72%	0.724	S	S	*	*			trans	170.8	90.1	151.2	-90	-26.5	0	0	0	111.5	Q470	Q470-D472 PolarHBondContact O-N 2.96Å
473	S	31.1	Very low	36.3	Very low	121 Å²	121	126.6 Å²	126.6	85%	0.846	74%	0.741	S	S	*	*			trans	-153.1	122.7	145.6	53.9	0	0	0	0	111
474	K	29.9	Very low	35.3	Very low	203 Å²	203	131.8 Å²	131.8	88%	0.883	76%	0.757	S	S	*	*			trans	-42.7	164.4	-178	-90.3	175.2	174.3	176.3	0	117.8
475	P	31.7	Very low	34.1	Very low	119 Å²	119	131 Å²	131	77%	0.773	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-71.6	142.2	-169.2	2.2	11.8	0	0	0	113.2
476	L	30	Very low	33	Very low	178 Å²	178	137.1 Å²	137.1	93%	0.932	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-64.7	130.6	167.2	-87.3	126.3	0	0	0	110.7
477	Q	31.3	Very low	32.1	Very low	178 Å²	178	138.1 Å²	138.1	83%	0.832	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-70.5	153.8	167.8	-74.8	-172.3	-21.9	0	0	111.3
478	P	31	Very low	31.3	Very low	128 Å²	128	138 Å²	138	83%	0.831	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-77.6	135.9	179.9	13.7	-1.2	0	0	0	111.7
479	L	32.2	Very low	30.8	Very low	167 Å²	167	145.8 Å²	145.8	87%	0.874	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-71.1	149.3	172.1	-83.1	152.4	0	0	0	111.3
480	P	30.8	Very low	30.4	Very low	115 Å²	115	149 Å²	149	75%	0.747	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-77.4	146.6	-176.3	-5	22.4	0	0	0	112.7
481	N	30.2	Very low	30.4	Very low	167 Å²	167	146 Å²	146	89%	0.893	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-51.5	128.5	164.7	-88.2	-23.1	0	0	0	112.4
482	T	29.6	Very low	30	Very low	140 Å²	140	150.7 Å²	150.7	86%	0.859	82%	0.823	S	S	*	*			trans	-137.1	106.3	146.5	21.5	0	0	0	0	109.1
483	A	28.3	Very low	29.4	Very low	87 Å²	87	151.8 Å²	151.8	72%	0.719	82%	0.823	S	S	*	*			trans	-72.8	132	161.7	0	0	0	0	0	109
484	H	29.2	Very low	29.2	Very low	197 Å²	197	156 Å²	156	91%	0.912	83%	0.826	S	S	*	*			trans	-152.8	145.9	141.9	-90.4	-52.2	0	0	0	110.3
485	S	26.5	Very low	29.1	Very low	94 Å²	94	154.4 Å²	154.4	66%	0.657	82%	0.824	S	S	*	*			trans	-87	150.1	-156.7	61.9	0	0	0	0	115.3
486	I	27.3	Very low	28.9	Very low	160 Å²	160	156.7 Å²	156.7	82%	0.821	82%	0.824	S	S	*	*			trans	48.6	118.7	130.5	-52.8	166.4	0	0	0	117.7
487	S	26.9	Very low	28.9	Very low	103 Å²	103	153.4 Å²	153.4	72%	0.72	81%	0.812	S	S	*	*				177.1	135.9	105.2	-174.1	0	0	0	0	112.3
488	D	28.2	Very low	28.9	Very low	145 Å²	145	154.3 Å²	154.3	78%	0.775	82%	0.816	S	S	*	*			trans	-40.8	143.9	160.7	-71.6	-56.9	0	0	0	114.4
489	R	27.9	Very low	28.8	Very low	241 Å²	241	151.1 Å²	151.1	91%	0.909	81%	0.806	S	S	*	*			trans	-175.3	108.3	136.8	-100.2	165.8	-160	-125.3	6.3	111
490	L	27.9	Very low	28.7	Very low	164 Å²	164	148.9 Å²	148.9	86%	0.859	81%	0.805	S	S	*	*			trans	-66.3	151.9	143.7	-87	152.4	0	0	0	108.4
491	P	33.1	Very low	28.8	Very low	107 Å²	107	149 Å²	149	70%	0.695	81%	0.808	S	S	*	*				-152.3	149.6	97.9	36.4	-17	0	0	0	117.3
492	E	26.2	Very low	29.1	Very low	187 Å²	187	148.8 Å²	148.8	87%	0.874	81%	0.807	S	S	*	*			trans	56	132.4	130.2	-62.7	-179.9	152	0	0	123.7
493	E	27.5	Very low	29.8	Very low	186 Å²	186	155 Å²	155	87%	0.869	83%	0.826	S	S	*	*			trans	-56.7	148.3	163.5	-64	173.6	126.6	0	0	114
494	K	28.1	Very low	29.8	Very low	210 Å²	210	158.4 Å²	158.4	91%	0.913	83%	0.831	S	S	*	*			trans	-141.5	109	144.8	-86.4	-168.3	177.6	177.3	0	111.5
495	M	26.5	Very low	29.9	Very low	170 Å²	170	156.3 Å²	156.3	84%	0.837	83%	0.827	S	S	*	*			trans	-75.9	140.7	149.8	-94	171.7	65.9	0	0	109.5
496	Q	29	Very low	30.1	Very low	167 Å²	167	159.8 Å²	159.8	78%	0.78	84%	0.837	S	S	*	*				163.5	112	129.7	-96.1	178.6	-0.9	0	0	111.1
497	T	29.4	Very low	30.2	Very low	109 Å²	109	159.8 Å²	159.8	67%	0.669	84%	0.837	S	S	*	*				69.6	122.2	99.2	62.9	0	0	0	0	113.2
498	Q	30.4	Very low	30.4	Very low	196 Å²	196	163.3 Å²	163.3	92%	0.916	85%	0.845	S	S	*	*				174	159.7	72.7	-104.2	160.3	12.6	0	0	104
499	G	29.3	Very low	30.6	Very low	61 Å²	61	164.5 Å²	164.5	63%	0.629	85%	0.849	S	S	*	*			cis	152	149.9	15.3	0	0	0	0	0	108.1
500	S	31.1	Very low	30.8	Very low	121 Å²	121	159.1 Å²	159.1	85%	0.846	85%	0.845	S	S	*	*			trans	71.1	133.9	155.8	-46.4	0	0	0	0	117.7
501	S	32.8	Very low	31	Very low	116 Å²	116	158.7 Å²	158.7	81%	0.811	84%	0.844	S	S	*	*				-165	152.7	54.1	-57.6	0	0	0	0	113.1
502	N	36	Very low	30.8	Very low	163 Å²	163	163 Å²	163	87%	0.872	86%	0.857	S	S	*	*			trans	-51.7	143.5	174.5	-63.5	-32.3	0	0	0	115.7
503	Q	43.6	Very low	31.2	Very low	270 Å²	270	160.8 Å²	160.8	100%	1.262	86%	0.855	S	S	*	*				-153.7	0	111.9	-111.5	-179.1	9.1	0	0	110.3

Retrieved 503 of 503 residues in 125.4 ms (Link to these results)

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