A0A3Q0KLE2_SCHMA Loading...

RGS domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KLE2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 548 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	23.8	Very low	28.9	Very low	232 Å²	232	133.7 Å²	133.7	100%	1.143	79%	0.793	S	S	*	*				0	139.9	0	-68.6	172.6	78.5	0	0	108.2	N3	M1-N3 PolarHBondContact O-N 3.1Å
2	S	26.1	Very low	29.4	Very low	114 Å²	114	133.9 Å²	133.9	80%	0.797	79%	0.785	S	S	*	*			trans	27.8	87	162.8	59.2	0	0	0	0	118.1
3	N	26.9	Very low	29.6	Very low	159 Å²	159	133.5 Å²	133.5	85%	0.85	78%	0.784	S	S	*	*			trans	-151.7	122.5	134.9	-126.4	-4.4	0	0	0	110.3	M1 T5	M1-N3 PolarHBondContact O-N 3.1Å; N3-T5 PolarHBondContact O-N 3.16Å
4	S	26.1	Very low	30	Very low	106 Å²	106	134.3 Å²	134.3	74%	0.741	78%	0.784	S	S	*	*			trans	-78	102.2	179.2	46.7	0	0	0	0	110.5
5	T	32.2	Very low	30.1	Very low	128 Å²	128	134.8 Å²	134.8	79%	0.785	78%	0.782	S	S	*	*			trans	-96	103.1	161.7	40.8	0	0	0	0	109.2	N3 I7	N3-T5 PolarHBondContact O-N 3.16Å; T5-I7 PolarHBondContact O-N 3.18Å
6	N	27.3	Very low	30.6	Very low	144 Å²	144	135 Å²	135	77%	0.77	78%	0.779	S	S	*	*			trans	-55.7	119.2	170.3	-70.4	-23.1	0	0	0	109.6	T8	N6-T8 PolarHBondContact O-N 3.07Å
7	I	30.6	Very low	30.9	Very low	157 Å²	157	134.5 Å²	134.5	81%	0.805	77%	0.773	S	S	*	*			trans	-77.9	97.5	162.3	-63.1	176	0	0	0	105.8	T5 T9	T5-I7 PolarHBondContact O-N 3.18Å; I7-T9 PolarHBondContact O-N 3.49Å; I7-T9 VanDerWaalsContact O-N 3.08Å
8	T	29.2	Very low	31	Very low	111 Å²	111	135.1 Å²	135.1	68%	0.681	77%	0.773	S	S	*	*			trans	-75.9	94.3	178.8	-52	0	0	0	0	109.5	N6 T10	N6-T8 PolarHBondContact O-N 3.07Å; T8-T10 HydrophobicContact CG2-CG2 4.25Å; T8-T10 PolarHBondContact O-N 3.28Å
9	T	31.4	Very low	31.1	Very low	124 Å²	124	134.4 Å²	134.4	76%	0.761	78%	0.777	S	S	*	*			trans	-69.8	93.9	170	-44	0	0	0	0	109.3	I7 A11	I7-T9 PolarHBondContact O-N 3.49Å; I7-T9 VanDerWaalsContact O-N 3.08Å; T9-A11 VanDerWaalsContact C-N 3.33Å; T9-A11 PolarHBondContact O-N 3.16Å
10	T	33.7	Very low	31.4	Very low	109 Å²	109	132.3 Å²	132.3	67%	0.669	77%	0.771	S	S	*	*			trans	-71.4	90	171.6	49	0	0	0	0	109.7	T8 I12	T8-T10 HydrophobicContact CG2-CG2 4.25Å; T8-T10 PolarHBondContact O-N 3.28Å; T10-I12 PolarHBondContact O-N 2.98Å
11	A	30.8	Very low	31.7	Very low	87 Å²	87	133.8 Å²	133.8	72%	0.719	77%	0.771	S	S	*	*			trans	-68	95.1	165.5	0	0	0	0	0	108.9	T9 V13	T9-A11 VanDerWaalsContact C-N 3.33Å; T9-A11 PolarHBondContact O-N 3.16Å; A11-V13 PolarHBondContact O-N 3.4Å
12	I	34.2	Very low	32.6	Very low	136 Å²	136	129.1 Å²	129.1	70%	0.697	76%	0.755	S	S	*	*			trans	-77.2	113.5	167.4	-63.8	178.1	0	0	0	107.1	T10 D14	T10-I12 PolarHBondContact O-N 2.98Å; I12-D14 PolarHBondContact O-N 3.24Å
13	V	32.2	Very low	33.2	Very low	128 Å²	128	131.5 Å²	131.5	78%	0.776	75%	0.751	S	S	*	*			trans	-78.2	104.2	171.9	175.6	0	0	0	0	107.8	A11	A11-V13 PolarHBondContact O-N 3.4Å
14	D	35.1	Very low	33.6	Very low	145 Å²	145	126.6 Å²	126.6	78%	0.775	73%	0.73	S	S	*	*			trans	-120.8	104.1	165.9	-90	-43.2	0	0	0	110.1	I12 N16	I12-D14 PolarHBondContact O-N 3.24Å; D14-N16 PolarHBondContact O-N 3.1Å
15	N	32.4	Very low	34.2	Very low	142 Å²	142	126.8 Å²	126.8	76%	0.759	72%	0.722	S	S	*	*			trans	-64.9	120.8	160.9	-96.9	-27.5	0	0	0	108.4
16	N	37.7	Very low	34.4	Very low	138 Å²	138	128.2 Å²	128.2	74%	0.738	72%	0.718	S	S	*	*				174.7	130.6	128.5	-89.6	-38.9	0	0	0	113.7	D14	D14-N16 PolarHBondContact O-N 3.1Å
17	N	36.2	Very low	35	Very low	127 Å²	127	126.5 Å²	126.5	68%	0.679	71%	0.707	S	S	*	*			trans	59.8	103	143.2	-58	-28.6	0	0	0	120.8
18	N	32.2	Very low	35.5	Very low	145 Å²	145	123.7 Å²	123.7	78%	0.775	69%	0.693	S	S	*	*				62	126.4	126.7	-59.3	-16.7	0	0	0	121
19	S	32.8	Very low	35.9	Very low	121 Å²	121	125.2 Å²	125.2	85%	0.846	69%	0.692	S	S	*	*			trans	73.3	69	151.9	68	0	0	0	0	119.5
20	S	37.6	Very low	37.1	Very low	93 Å²	93	123 Å²	123	65%	0.65	68%	0.678	S	S	*	*			trans	-156.4	12.6	159.8	60.4	0	0	0	0	117.4	T22 K23	S20-T22 VanDerWaalsContact C-N 3.34Å; S20-T22 PolarHBondContact O-N 3.05Å; S20-T22 VanDerWaalsContact O-N 3.08Å; S20-K23 PolarHBondContact O-N 3.34Å
21	E	38.1	Very low	38.1	Very low	164 Å²	164	121.2 Å²	121.2	77%	0.766	67%	0.668	S	S	*	*	H	α-helix	trans	-55.8	-35.1	-162.9	-68.3	177.1	138.9	0	0	115.8	K23 S24	E21-K23 PolarHBondContact O-N 2.71Å; E21-K23 VanDerWaalsContact O-N 3.11Å; E21-S24 PolarHBondContact O-N 2.98Å; E21-S24 VanDerWaalsContact O-N 3.17Å
22	T	41.8	Very low	39.4	Very low	134 Å²	134	119.5 Å²	119.5	82%	0.822	65%	0.653	S	S	*	*	H	α-helix	trans	-71	-7.5	-176.9	52.6	0	0	0	0	115.7	S20	S20-T22 VanDerWaalsContact C-N 3.34Å; S20-T22 PolarHBondContact O-N 3.05Å; S20-T22 VanDerWaalsContact O-N 3.08Å
23	K	38	Very low	41.3	Very low	163 Å²	163	114 Å²	114	71%	0.709	63%	0.627	S	S	*	*	H	α-helix	trans	-97.2	-27	171.2	-109.9	180	179.7	177.2	0	113.4	S20 E21 I27	S20-K23 PolarHBondContact O-N 3.34Å; E21-K23 PolarHBondContact O-N 2.71Å; E21-K23 VanDerWaalsContact O-N 3.11Å; K23-I27 WeakPolarHBondContact O-CG1 3.33Å
24	S	37.2	Very low	43.4	Very low	57 Å²	57	109.4 Å²	109.4	40%	0.399	60%	0.598	S	S	.	*	H	α-helix	trans	-69.1	-48.6	-175.2	-158	0	0	0	0	111.2	E21 K26 I27 I28	E21-S24 PolarHBondContact O-N 2.98Å; E21-S24 VanDerWaalsContact O-N 3.17Å; S24-K26 VanDerWaalsContact C-N 3.3Å; S24-K26 PolarHBondContact O-N 3.31Å; S24-I27 WeakPolarHBondContact O-CA 3.42Å; S24-I27 WeakPolarHBondContact O-CB 3.43Å; S24-I27 PolarHBondContact O-N 3Å; S24-I28 WeakPolarHBondContact O-CG1 3.17Å; S24-I28 PolarHBondContact O-N 3.37Å
25	D	36.7	Very low	45.5	Very low	109 Å²	109	106 Å²	106	58%	0.583	58%	0.58	S	S	*	*	H	α-helix	trans	-58.6	-39.3	-177.4	-67.5	-14.8	0	0	0	112.9	I27 I28 Q29	D25-I27 VanDerWaalsContact C-N 3.28Å; D25-I27 PolarHBondContact O-N 3.02Å; D25-I28 PolarHBondContact O-N 3.25Å; D25-Q29 WeakPolarHBondContact O-CB 3.44Å; D25-Q29 PolarHBondContact O-N 3.48Å
26	K	37.1	Very low	47.8	Very low	159 Å²	159	103 Å²	103	69%	0.691	56%	0.561	S	S	*	*	H	α-helix	trans	-65.2	-30.4	175.5	-91.5	-178.9	174.7	173.7	0	113.3	S24 T30	S24-K26 VanDerWaalsContact C-N 3.3Å; S24-K26 PolarHBondContact O-N 3.31Å; K26-T30 WeakPolarHBondContact O-CB 3.44Å; K26-T30 VanDerWaalsContact O-CG2 3.3Å; K26-T30 WeakPolarHBondContact O-CG2 3.36Å; K26-T30 PolarHBondContact O-N 2.93Å; K26-T30 PolarHBondContact O-OG1 3.09Å
27	I	41	Very low	49.9	Very low	107 Å²	107	96.5 Å²	96.5	55%	0.549	53%	0.526	S	S	.	.	H	α-helix	trans	-79.4	-43.6	178.3	-64.2	168.6	0	0	0	109.6	K23 S24 D25 T30 T31	K23-I27 WeakPolarHBondContact O-CG1 3.33Å; S24-I27 WeakPolarHBondContact O-CA 3.42Å; S24-I27 WeakPolarHBondContact O-CB 3.43Å; S24-I27 PolarHBondContact O-N 3Å; D25-I27 VanDerWaalsContact C-N 3.28Å; D25-I27 PolarHBondContact O-N 3.02Å; I27-T30 PolarHBondContact O-N 2.97Å; I27-T30 PolarHBondContact O-OG1 3.34Å; I27-T31 PolarHBondContact O-N 3Å; I27-T31 PolarHBondContact O-OG1 3.02Å; I27-T31 VanDerWaalsContact O-OG1 3.09Å
28	I	39.5	Very low	52	Low	99 Å²	99	91.8 Å²	91.8	51%	0.508	50%	0.501	S	S	.	.	H	α-helix	trans	-65.2	-42.8	178.2	-64	166.1	0	0	0	111.4	S24 D25 T31 A32	S24-I28 WeakPolarHBondContact O-CG1 3.17Å; S24-I28 PolarHBondContact O-N 3.37Å; D25-I28 PolarHBondContact O-N 3.25Å; I28-T31 PolarHBondContact O-N 3.19Å; I28-T31 PolarHBondContact O-OG1 3.28Å; I28-A32 PolarHBondContact O-N 3.33Å; I28-A32 VanDerWaalsContact O-N 3.12Å
29	Q	39.3	Very low	54.3	Low	143 Å²	143	91.5 Å²	91.5	67%	0.668	49%	0.49	S	S	*	.	H	α-helix	trans	-71.6	-30.4	-179.8	-162.4	171.5	44.4	0	0	112.3	D25 S33	D25-Q29 WeakPolarHBondContact O-CB 3.44Å; D25-Q29 PolarHBondContact O-N 3.48Å; Q29-S33 PolarHBondContact O-N 2.97Å
30	T	54.9	Low	56.6	Low	76 Å²	76	85.8 Å²	85.8	47%	0.466	45%	0.45	S	S	.	.	H	α-helix	trans	-74.9	-38.6	173.8	45.5	0	0	0	0	112.5	K26 I27 S33 I34	K26-T30 WeakPolarHBondContact O-CB 3.44Å; K26-T30 VanDerWaalsContact O-CG2 3.3Å; K26-T30 WeakPolarHBondContact O-CG2 3.36Å; K26-T30 PolarHBondContact O-N 2.93Å; K26-T30 PolarHBondContact O-OG1 3.09Å; I27-T30 PolarHBondContact O-N 2.97Å; I27-T30 PolarHBondContact O-OG1 3.34Å; T30-S33 PolarHBondContact O-N 3.43Å; T30-S33 PolarHBondContact O-OG 3.07Å; T30-I34 WeakPolarHBondContact O-CG1 3.47Å; T30-I34 PolarHBondContact O-N 3.12Å
31	T	56.3	Low	58.7	Low	73 Å²	73	83 Å²	83	45%	0.448	43%	0.427	S	S	.	.	H	α-helix	trans	-63.2	-48.4	174.9	45.1	0	0	0	0	112	I27 I28 S33 I34 D35	I27-T31 PolarHBondContact O-N 3Å; I27-T31 PolarHBondContact O-OG1 3.02Å; I27-T31 VanDerWaalsContact O-OG1 3.09Å; I28-T31 PolarHBondContact O-N 3.19Å; I28-T31 PolarHBondContact O-OG1 3.28Å; T31-S33 VanDerWaalsContact C-N 3.28Å; T31-S33 PolarHBondContact O-N 3.28Å; T31-I34 PolarHBondContact O-N 3.28Å; T31-D35 PolarHBondContact O-N 3.32Å; T31-D35 VanDerWaalsContact O-N 3.11Å
32	A	58.3	Low	60.8	Low	50 Å²	50	81 Å²	81	41%	0.413	41%	0.414	S	S	.	.	H	α-helix	trans	-56.7	-41.7	177.3	0	0	0	0	0	112.3	I28 I34 D35 E36	I28-A32 PolarHBondContact O-N 3.33Å; I28-A32 VanDerWaalsContact O-N 3.12Å; A32-I34 VanDerWaalsContact C-N 3.29Å; A32-I34 PolarHBondContact O-N 2.65Å; A32-D35 PolarHBondContact O-N 3.02Å; A32-E36 WeakPolarHBondContact O-CG 3.48Å; A32-E36 PolarHBondContact O-N 3.13Å; A32-E36 VanDerWaalsContact O-N 3.15Å
33	S	73.6	Confident	62.7	Low	22 Å²	22	77 Å²	77	15%	0.154	39%	0.386	C	S	.	.	H	α-helix	trans	-65.4	-28.3	177.2	78.1	0	0	0	0	113.9	Q29 T30 T31 L37 H327	Q29-S33 PolarHBondContact O-N 2.97Å; T30-S33 PolarHBondContact O-N 3.43Å; T30-S33 PolarHBondContact O-OG 3.07Å; T31-S33 VanDerWaalsContact C-N 3.28Å; T31-S33 PolarHBondContact O-N 3.28Å; S33-L37 PolarHBondContact O-N 2.86Å; S33-H327 PolarHBondContact O-CD2 3.42Å; S33-H327 PolarHBondContact O-NE2 3.19Å
34	I	76.6	Confident	64.8	Low	30 Å²	30	69.4 Å²	69.4	15%	0.154	35%	0.353	C	S	.	.	H	α-helix	trans	-77.8	-40.7	179	-74.9	166.3	0	0	0	110.3	T30 T31 A32 E36 L37 I38 M262 A266	T30-I34 WeakPolarHBondContact O-CG1 3.47Å; T30-I34 PolarHBondContact O-N 3.12Å; T31-I34 PolarHBondContact O-N 3.28Å; A32-I34 VanDerWaalsContact C-N 3.29Å; A32-I34 PolarHBondContact O-N 2.65Å; I34-E36 VanDerWaalsContact C-N 3.33Å; I34-E36 PolarHBondContact O-N 3.26Å; I34-L37 WeakPolarHBondContact O-CB 3.13Å; I34-L37 PolarHBondContact O-N 2.85Å; I34-L37 VanDerWaalsContact O-N 3.13Å; I34-I38 HydrophobicContact CG2-CD1 3.88Å; I34-I38 PolarHBondContact O-N 2.95Å; I34-I38 VanDerWaalsContact O-N 3.1Å; I34-M262 HydrophobicContact CG2-CB 4.32Å; I34-A266 HydrophobicContact CD1-CB 4.44Å; I34-A266 HydrophobicContact CG1-CB 4.22Å; I34-A266 HydrophobicContact CG2-CB 3.72Å
35	D	78.1	Confident	66.8	Low	75 Å²	75	70.4 Å²	70.4	40%	0.401	36%	0.357	S	S	.	.	H	α-helix	trans	-64.9	-38.8	178.3	-62.8	-27.7	0	0	0	111	T31 A32 L37 I38 Y39 M262	T31-D35 PolarHBondContact O-N 3.32Å; T31-D35 VanDerWaalsContact O-N 3.11Å; A32-D35 PolarHBondContact O-N 3.02Å; D35-L37 VanDerWaalsContact C-N 3.32Å; D35-L37 PolarHBondContact O-N 3.48Å; D35-I38 PolarHBondContact O-N 3.08Å; D35-Y39 WeakPolarHBondContact O-CB 3.46Å; D35-Y39 PolarHBondContact O-N 3.15Å; D35-M262 WeakPolarHBondContact OD1-CG 3.38Å
36	E	80.8	Confident	68.8	Low	79 Å²	79	69.6 Å²	69.6	37%	0.369	35%	0.35	S	S	.	.	H	α-helix	trans	-55.5	-42.5	170.1	-75.9	179.5	171.2	0	0	112.9	A32 I34 G40 H330	A32-E36 WeakPolarHBondContact O-CG 3.48Å; A32-E36 PolarHBondContact O-N 3.13Å; A32-E36 VanDerWaalsContact O-N 3.15Å; I34-E36 VanDerWaalsContact C-N 3.33Å; I34-E36 PolarHBondContact O-N 3.26Å; E36-G40 PolarHBondContact O-N 3.42Å; E36-H330 IonicContact OE2-CE1 3.74Å; E36-H330 IonicContact OE2-CG 3.86Å; E36-H330 IonicContact OE2-ND1 2.84Å; E36-H330 PolarHBondContact OE2-ND1 3.32Å
37	L	82.3	Confident	71	Confident	1 Å²	1	66 Å²	66	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-65.4	-47.7	179.2	179.5	60.2	0	0	0	111.6	S33 I34 D35 G40 L41 Y270 I323 H327 I332	S33-L37 PolarHBondContact O-N 2.86Å; I34-L37 WeakPolarHBondContact O-CB 3.13Å; I34-L37 PolarHBondContact O-N 2.85Å; I34-L37 VanDerWaalsContact O-N 3.13Å; D35-L37 VanDerWaalsContact C-N 3.32Å; D35-L37 PolarHBondContact O-N 3.48Å; L37-G40 PolarHBondContact O-N 3.35Å; L37-L41 HydrophobicContact CD1-CD1 3.94Å; L37-L41 HydrophobicContact CD1-CG 4.27Å; L37-L41 HydrophobicContact CG-CD1 4Å; L37-L41 WeakPolarHBondContact O-CB 3.42Å; L37-L41 VanDerWaalsContact O-CG 3.29Å; L37-L41 WeakPolarHBondContact O-CG 3.4Å; L37-L41 PolarHBondContact O-N 3.01Å; L37-Y270 HydrophobicContact CD2-CE2 4.33Å; L37-I323 HydrophobicContact CD1-CG2 3.94Å; L37-H327 HydrophobicContact CD1-CB 4.16Å; L37-I332 HydrophobicContact CD1-CD1 3.8Å
38	I	79.9	Confident	72.9	Confident	28 Å²	28	62 Å²	62	14%	0.144	32%	0.316	C	S	.	.	H	α-helix	trans	-70	-41.4	-175.8	-64.7	171.6	0	0	0	110.4	I34 D35 Y42 M262 I265	I34-I38 HydrophobicContact CG2-CD1 3.88Å; I34-I38 PolarHBondContact O-N 2.95Å; I34-I38 VanDerWaalsContact O-N 3.1Å; D35-I38 PolarHBondContact O-N 3.08Å; I38-Y42 WeakPolarHBondContact O-CB 3.26Å; I38-Y42 PolarHBondContact O-N 3.44Å; I38-M262 HydrophobicContact CB-SD 4.45Å; I38-M262 HydrophobicContact CD1-CB 3.85Å; I38-M262 HydrophobicContact CD1-CG 4.33Å; I38-M262 VanDerWaalsContact CD1-O 3.27Å; I38-M262 WeakPolarHBondContact CD1-O 3.49Å; I38-M262 HydrophobicContact CD1-SD 3.66Å; I38-M262 HydrophobicContact CG2-SD 3.98Å; I38-I265 HydrophobicContact CD1-CB 4.08Å; I38-I265 HydrophobicContact CD1-CG2 4.01Å; I38-I265 HydrophobicContact CG1-CG2 4.02Å
39	Y	80.6	Confident	75	Confident	139 Å²	139	58.6 Å²	58.6	55%	0.545	30%	0.3	S	S	.	.	H	α-helix	trans	-63.2	-46.7	174.1	-173.3	-94.4	0	0	0	111.7	D35 L41 Y42 H43	D35-Y39 WeakPolarHBondContact O-CB 3.46Å; D35-Y39 PolarHBondContact O-N 3.15Å; Y39-L41 PolarHBondContact O-N 2.9Å; Y39-Y42 PolarHBondContact O-N 3.27Å; Y39-H43 AromaticContact CD1-CD2 3.79Å; Y39-H43 AromaticContact CE1-CD2 3.44Å; Y39-H43 VanDerWaalsContact CE1-CD2 3.44Å; Y39-H43 WeakPolarHBondContact CE1-CD2 3.39Å; Y39-H43 AromaticContact CE1-NE2 3.59Å; Y39-H43 AromaticContact CE2-CD2 3.87Å; Y39-H43 AromaticContact CE2-NE2 3.58Å; Y39-H43 AromaticContact CZ-CD2 3.5Å; Y39-H43 VanDerWaalsContact CZ-CD2 3.5Å; Y39-H43 AromaticContact CZ-NE2 3.16Å; Y39-H43 PolarHBondContact O-CD2 3.27Å; Y39-H43 PolarHBondContact O-N 3Å; Y39-H43 PolarHBondContact OH-NE2 3.47Å
40	G	81.2	Confident	77	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.7	-45.3	176.8	0	0	0	0	0	112.7	E36 L37 H43 I44	E36-G40 PolarHBondContact O-N 3.42Å; L37-G40 PolarHBondContact O-N 3.35Å; G40-H43 PolarHBondContact O-N 3.15Å; G40-I44 VanDerWaalsContact O-CG1 3.28Å; G40-I44 WeakPolarHBondContact O-CG1 3.27Å; G40-I44 PolarHBondContact O-N 2.84Å
41	L	81.6	Confident	78.5	Confident	34 Å²	34	57 Å²	57	18%	0.178	30%	0.302	C	S	.	.	H	α-helix	trans	-63.1	-43.6	175.1	-75.8	168.9	0	0	0	112.3	L37 Y39 H43 I44 T45 I269 I323	L37-L41 HydrophobicContact CD1-CD1 3.94Å; L37-L41 HydrophobicContact CD1-CG 4.27Å; L37-L41 HydrophobicContact CG-CD1 4Å; L37-L41 WeakPolarHBondContact O-CB 3.42Å; L37-L41 VanDerWaalsContact O-CG 3.29Å; L37-L41 WeakPolarHBondContact O-CG 3.4Å; L37-L41 PolarHBondContact O-N 3.01Å; Y39-L41 PolarHBondContact O-N 2.9Å; L41-H43 VanDerWaalsContact C-N 3.34Å; L41-H43 PolarHBondContact O-N 3.29Å; L41-I44 PolarHBondContact O-N 3.22Å; L41-T45 WeakPolarHBondContact O-CG2 3.42Å; L41-T45 PolarHBondContact O-N 2.83Å; L41-I269 HydrophobicContact CD1-CD1 3.57Å; L41-I323 HydrophobicContact CD2-CD1 4.14Å; L41-I323 HydrophobicContact CD2-CG2 4.24Å
42	Y	81.2	Confident	79.8	Confident	124 Å²	124	54.6 Å²	54.6	49%	0.486	29%	0.288	S	S	.	.	H	α-helix	trans	-57.9	-46.7	175.7	177.9	-98.4	0	0	0	111.2	I38 Y39 T45 M46	I38-Y42 WeakPolarHBondContact O-CB 3.26Å; I38-Y42 PolarHBondContact O-N 3.44Å; Y39-Y42 PolarHBondContact O-N 3.27Å; Y42-T45 PolarHBondContact O-N 3.01Å; Y42-T45 PolarHBondContact O-OG1 3.48Å; Y42-M46 HydrophobicContact CD1-CG 4.26Å; Y42-M46 HydrophobicContact CE1-CG 3.89Å; Y42-M46 HydrophobicContact CE1-SD 3.9Å; Y42-M46 WeakPolarHBondContact O-CG 3.21Å; Y42-M46 PolarHBondContact O-N 2.84Å; Y42-M46 VanDerWaalsContact O-N 3.1Å; Y42-M46 PolarHBondContact OH-SD 3.15Å
43	H	81.6	Confident	80.9	Confident	50 Å²	50	57 Å²	57	23%	0.231	29%	0.287	C	S	.	.	H	α-helix	trans	-63	-44	175.8	-88	-88	0	0	0	113.1	Y39 G40 L41 T45 M46 E47 I336	Y39-H43 AromaticContact CD1-CD2 3.79Å; Y39-H43 AromaticContact CE1-CD2 3.44Å; Y39-H43 VanDerWaalsContact CE1-CD2 3.44Å; Y39-H43 WeakPolarHBondContact CE1-CD2 3.39Å; Y39-H43 AromaticContact CE1-NE2 3.59Å; Y39-H43 AromaticContact CE2-CD2 3.87Å; Y39-H43 AromaticContact CE2-NE2 3.58Å; Y39-H43 AromaticContact CZ-CD2 3.5Å; Y39-H43 VanDerWaalsContact CZ-CD2 3.5Å; Y39-H43 AromaticContact CZ-NE2 3.16Å; Y39-H43 PolarHBondContact O-CD2 3.27Å; Y39-H43 PolarHBondContact O-N 3Å; Y39-H43 PolarHBondContact OH-NE2 3.47Å; G40-H43 PolarHBondContact O-N 3.15Å; L41-H43 VanDerWaalsContact C-N 3.34Å; L41-H43 PolarHBondContact O-N 3.29Å; H43-T45 PolarHBondContact O-N 3.21Å; H43-M46 WeakPolarHBondContact O-CB 3.37Å; H43-M46 PolarHBondContact O-N 3.34Å; H43-E47 WeakPolarHBondContact O-CG 3.46Å; H43-E47 PolarHBondContact O-N 3.33Å; H43-I336 HydrophobicContact CB-CD1 3.78Å; H43-I336 HydrophobicContact CB-CG1 4.21Å; H43-I336 HydrophobicContact CB-CG2 4.16Å
44	I	82.3	Confident	81.4	Confident	3 Å²	3	62.5 Å²	62.5	2%	0.015	31%	0.309	C	S	.	.	H	α-helix	trans	-55.2	-40.5	173.7	-71.1	164.2	0	0	0	110.9	G40 L41 M46 L335 I336 F340 S341 M344	G40-I44 VanDerWaalsContact O-CG1 3.28Å; G40-I44 WeakPolarHBondContact O-CG1 3.27Å; G40-I44 PolarHBondContact O-N 2.84Å; L41-I44 PolarHBondContact O-N 3.22Å; I44-M46 PolarHBondContact O-N 3.41Å; I44-L335 HydrophobicContact CD1-CD2 4.27Å; I44-L335 HydrophobicContact CD1-CG 4.38Å; I44-I336 HydrophobicContact CG1-CG1 4.29Å; I44-F340 HydrophobicContact CD1-CE1 4.42Å; I44-S341 VanDerWaalsContact O-CB 3.31Å; I44-S341 WeakPolarHBondContact O-CB 3.21Å; I44-S341 PolarHBondContact O-OG 3.4Å; I44-M344 HydrophobicContact CG2-SD 4.02Å
45	T	79.5	Confident	81.8	Confident	78 Å²	78	63 Å²	63	48%	0.479	32%	0.319	S	S	.	.	H	α-helix	trans	-71.4	-25.8	176.3	64.6	0	0	0	0	114.4	L41 Y42 H43	L41-T45 WeakPolarHBondContact O-CG2 3.42Å; L41-T45 PolarHBondContact O-N 2.83Å; Y42-T45 PolarHBondContact O-N 3.01Å; Y42-T45 PolarHBondContact O-OG1 3.48Å; H43-T45 PolarHBondContact O-N 3.21Å
46	M	78.7	Confident	82	Confident	91 Å²	91	59.7 Å²	59.7	45%	0.448	30%	0.301	S	S	.	.	H	α-helix	trans	-76.4	-36.7	176.7	-66.9	-111.4	68.9	0	0	112.1	Y42 H43 I44 I48	Y42-M46 HydrophobicContact CD1-CG 4.26Å; Y42-M46 HydrophobicContact CE1-CG 3.89Å; Y42-M46 HydrophobicContact CE1-SD 3.9Å; Y42-M46 WeakPolarHBondContact O-CG 3.21Å; Y42-M46 PolarHBondContact O-N 2.84Å; Y42-M46 VanDerWaalsContact O-N 3.1Å; Y42-M46 PolarHBondContact OH-SD 3.15Å; H43-M46 WeakPolarHBondContact O-CB 3.37Å; H43-M46 PolarHBondContact O-N 3.34Å; I44-M46 PolarHBondContact O-N 3.41Å; M46-I48 PolarHBondContact O-N 3.4Å
47	E	84	Confident	82	Confident	83 Å²	83	57.2 Å²	57.2	39%	0.388	29%	0.291	S	S	.	.	S	Bend	trans	-73.4	1.2	-179.5	-67.9	-59.4	143.9	0	0	114.7	H43 S49 I336	H43-E47 WeakPolarHBondContact O-CG 3.46Å; H43-E47 PolarHBondContact O-N 3.33Å; E47-S49 PolarHBondContact O-N 2.91Å; E47-I336 HydrophobicContact CG-CG2 3.74Å
48	I	81.2	Confident	82.2	Confident	25 Å²	25	63.1 Å²	63.1	13%	0.128	32%	0.322	C	S	.	.			trans	-68.2	118.5	178.7	-64.6	175.1	0	0	0	110.6	M46 R53 L345	M46-I48 PolarHBondContact O-N 3.4Å; I48-R53 HydrophobicContact CG2-CB 4.29Å; I48-R53 PolarHBondContact O-NH2 3.16Å; I48-L345 HydrophobicContact CD1-CB 4.35Å; I48-L345 HydrophobicContact CD1-CD2 4.39Å; I48-L345 HydrophobicContact CG2-CD2 3.64Å
49	S	83.3	Confident	82.3	Confident	26 Å²	26	67.2 Å²	67.2	18%	0.182	34%	0.339	C	S	.	.			trans	-56.5	138.3	177.9	174.6	0	0	0	0	112.2	E47 T51 C52 R53 N342	E47-S49 PolarHBondContact O-N 2.91Å; S49-T51 PolarHBondContact O-N 3.42Å; S49-T51 PolarHBondContact OG-N 2.79Å; S49-T51 PolarHBondContact OG-OG1 3.41Å; S49-C52 PolarHBondContact O-N 2.66Å; S49-R53 PolarHBondContact O-N 3.13Å; S49-N342 WeakPolarHBondContact CB-OD1 3.47Å; S49-N342 PolarHBondContact N-OD1 3.38Å
50	P	81.9	Confident	82.4	Confident	91 Å²	91	61.4 Å²	61.4	59%	0.591	32%	0.318	S	S	*	.	H	α-helix	trans	-59.8	-34.2	177	24.9	-34.4	0	0	0	112.7	R53 Q54	P50-R53 PolarHBondContact O-N 3Å; P50-Q54 WeakPolarHBondContact O-CG 3.17Å; P50-Q54 PolarHBondContact O-N 3.03Å
51	T	85.5	Confident	82.6	Confident	96 Å²	96	63.2 Å²	63.2	59%	0.589	33%	0.33	S	S	*	.	H	α-helix	trans	-68.6	-40.2	177.8	56.8	0	0	0	0	111.9	S49 R53 Q54 A55	S49-T51 PolarHBondContact O-N 3.42Å; S49-T51 PolarHBondContact OG-N 2.79Å; S49-T51 PolarHBondContact OG-OG1 3.41Å; T51-R53 VanDerWaalsContact C-N 3.35Å; T51-Q54 PolarHBondContact O-N 3.45Å; T51-A55 WeakPolarHBondContact O-CB 3.36Å; T51-A55 PolarHBondContact O-N 2.87Å
52	C	84.5	Confident	82.7	Confident	22 Å²	22	63.3 Å²	63.3	15%	0.149	34%	0.339	C	S	.	.	H	α-helix	trans	-65.1	-40.5	174.3	-176.5	0	0	0	0	111.2	S49 Q54 A55 A56 N342	S49-C52 PolarHBondContact O-N 2.66Å; C52-Q54 PolarHBondContact O-N 3.46Å; C52-A55 PolarHBondContact O-N 2.92Å; C52-A56 WeakPolarHBondContact O-CB 3.3Å; C52-A56 PolarHBondContact O-N 3.17Å; C52-N342 HydrophobicContact CB-CB 4.04Å; C52-N342 VanDerWaalsContact CB-OD1 3.3Å; C52-N342 WeakPolarHBondContact CB-OD1 3.04Å; C52-N342 VanDerWaalsContact SG-CB 3.58Å
53	R	81.5	Confident	82.6	Confident	101 Å²	101	59 Å²	59	38%	0.381	32%	0.323	S	S	.	.	H	α-helix	trans	-61.8	-42.4	176.3	-160.6	178.9	-52.5	-172.7	4.6	112.4	I48 S49 P50 T51 T57 V157	I48-R53 HydrophobicContact CG2-CB 4.29Å; I48-R53 PolarHBondContact O-NH2 3.16Å; S49-R53 PolarHBondContact O-N 3.13Å; P50-R53 PolarHBondContact O-N 3Å; T51-R53 VanDerWaalsContact C-N 3.35Å; R53-T57 WeakPolarHBondContact O-CB 3.44Å; R53-T57 PolarHBondContact O-N 3.24Å; R53-T57 PolarHBondContact O-OG1 3.39Å; R53-V157 HydrophobicContact CG-CG1 3.97Å
54	Q	83.5	Confident	82.8	Confident	136 Å²	136	58.6 Å²	58.6	64%	0.636	32%	0.321	S	S	*	.	H	α-helix	trans	-65	-42.9	173.1	-73.8	173.4	-10.8	0	0	112.1	P50 T51 C52 T57 L58	P50-Q54 WeakPolarHBondContact O-CG 3.17Å; P50-Q54 PolarHBondContact O-N 3.03Å; T51-Q54 PolarHBondContact O-N 3.45Å; C52-Q54 PolarHBondContact O-N 3.46Å; Q54-T57 WeakPolarHBondContact O-CB 3.42Å; Q54-T57 PolarHBondContact O-N 3.28Å; Q54-L58 WeakPolarHBondContact O-CB 3.36Å; Q54-L58 PolarHBondContact O-N 3.17Å
55	A	84.5	Confident	82.9	Confident	42 Å²	42	62.2 Å²	62.2	35%	0.347	34%	0.343	S	S	.	.	H	α-helix	trans	-62.8	-50.8	176.7	0	0	0	0	0	111.8	T51 C52 T57 L58 F59	T51-A55 WeakPolarHBondContact O-CB 3.36Å; T51-A55 PolarHBondContact O-N 2.87Å; C52-A55 PolarHBondContact O-N 2.92Å; A55-T57 VanDerWaalsContact C-N 3.27Å; A55-T57 PolarHBondContact O-N 3.07Å; A55-L58 PolarHBondContact O-N 3.06Å; A55-L58 VanDerWaalsContact O-N 3.09Å; A55-F59 HydrophobicContact CB-CE2 4.49Å; A55-F59 WeakPolarHBondContact O-CB 3.39Å; A55-F59 WeakPolarHBondContact O-CD2 3.17Å; A55-F59 PolarHBondContact O-N 2.99Å
56	A	82.3	Confident	83.1	Confident	4 Å²	4	62.1 Å²	62.1	3%	0.033	34%	0.342	C	S	.	.	H	α-helix	trans	-59.9	-37.6	176.9	0	0	0	0	0	112.2	C52 L60 L345	C52-A56 WeakPolarHBondContact O-CB 3.3Å; C52-A56 PolarHBondContact O-N 3.17Å; A56-L60 WeakPolarHBondContact O-CB 3.47Å; A56-L60 WeakPolarHBondContact O-CG 3.48Å; A56-L60 PolarHBondContact O-N 2.8Å; A56-L345 HydrophobicContact CB-CD1 4.48Å; A56-L345 HydrophobicContact CB-CD2 3.8Å; A56-L345 HydrophobicContact CB-CG 3.85Å
57	T	81.9	Confident	83.1	Confident	27 Å²	27	57.8 Å²	57.8	17%	0.166	32%	0.321	C	S	.	.	H	α-helix	trans	-59.1	-50	170.8	-70.6	0	0	0	0	111.8	R53 Q54 A55 F59 L60 S61 L154 V158	R53-T57 WeakPolarHBondContact O-CB 3.44Å; R53-T57 PolarHBondContact O-N 3.24Å; R53-T57 PolarHBondContact O-OG1 3.39Å; Q54-T57 WeakPolarHBondContact O-CB 3.42Å; Q54-T57 PolarHBondContact O-N 3.28Å; A55-T57 VanDerWaalsContact C-N 3.27Å; A55-T57 PolarHBondContact O-N 3.07Å; T57-F59 VanDerWaalsContact C-N 3.34Å; T57-F59 PolarHBondContact O-N 3.44Å; T57-L60 PolarHBondContact O-N 3.25Å; T57-S61 WeakPolarHBondContact O-CB 3.45Å; T57-S61 PolarHBondContact O-N 3.33Å; T57-S61 PolarHBondContact O-OG 3.18Å; T57-L154 HydrophobicContact CG2-CD1 4.44Å; T57-V158 HydrophobicContact CG2-CB 4.33Å; T57-V158 HydrophobicContact CG2-CG1 4.04Å; T57-V158 HydrophobicContact CG2-CG2 3.3Å; T57-V158 WeakPolarHBondContact OG1-CG2 3.28Å
58	L	84.6	Confident	83.1	Confident	125 Å²	125	55.4 Å²	55.4	65%	0.654	31%	0.312	S	S	*	.	H	α-helix	trans	-65	-41.3	-178.3	-165.1	156.6	0	0	0	110.5	Q54 A55 S61 G62	Q54-L58 WeakPolarHBondContact O-CB 3.36Å; Q54-L58 PolarHBondContact O-N 3.17Å; A55-L58 PolarHBondContact O-N 3.06Å; A55-L58 VanDerWaalsContact O-N 3.09Å; L58-S61 WeakPolarHBondContact CA-OG 3.34Å; L58-S61 PolarHBondContact O-OG 3.43Å; L58-G62 PolarHBondContact O-N 3.08Å
59	F	83.1	Confident	83.3	Confident	114 Å²	114	59.8 Å²	59.8	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-58.7	-52.3	171.5	-80.7	-57.3	0	0	0	112.6	A55 T57 F63 L346 M353	A55-F59 HydrophobicContact CB-CE2 4.49Å; A55-F59 WeakPolarHBondContact O-CB 3.39Å; A55-F59 WeakPolarHBondContact O-CD2 3.17Å; A55-F59 PolarHBondContact O-N 2.99Å; T57-F59 VanDerWaalsContact C-N 3.34Å; T57-F59 PolarHBondContact O-N 3.44Å; F59-F63 WeakPolarHBondContact O-CB 3.45Å; F59-F63 PolarHBondContact O-N 2.84Å; F59-L346 HydrophobicContact CD2-CD1 4.34Å; F59-L346 HydrophobicContact CE2-CD1 4.48Å; F59-M353 VanDerWaalsContact C-CE 3.5Å; F59-M353 HydrophobicContact CB-CE 3.66Å; F59-M353 HydrophobicContact CD1-CE 4.48Å; F59-M353 HydrophobicContact CG-CE 4.45Å; F59-M353 VanDerWaalsContact O-CE 3.26Å; F59-M353 WeakPolarHBondContact O-CE 3.4Å
60	L	82.5	Confident	83.2	Confident	17 Å²	17	61.3 Å²	61.3	9%	0.089	34%	0.341	C	S	.	.	H	α-helix	trans	-66.4	-40.8	-179.4	-75.3	170.8	0	0	0	113.1	A56 T57 F64 L154 A349 H352	A56-L60 WeakPolarHBondContact O-CB 3.47Å; A56-L60 WeakPolarHBondContact O-CG 3.48Å; A56-L60 PolarHBondContact O-N 2.8Å; T57-L60 PolarHBondContact O-N 3.25Å; L60-F64 VanDerWaalsContact O-CB 3.26Å; L60-F64 WeakPolarHBondContact O-CB 3.34Å; L60-F64 PolarHBondContact O-N 2.97Å; L60-L154 HydrophobicContact CB-CD1 4.19Å; L60-A349 HydrophobicContact CD1-CB 4.26Å; L60-A349 HydrophobicContact CD2-CB 4.13Å; L60-A349 HydrophobicContact CG-CB 4.05Å; L60-H352 HydrophobicContact CD2-CB 4.29Å
61	S	85	Confident	83.1	Confident	38 Å²	38	57 Å²	57	27%	0.266	31%	0.313	S	S	.	.	H	α-helix	trans	-69.6	-44.9	177.9	51.1	0	0	0	0	112.7	T57 L58 F63 F64 V65	T57-S61 WeakPolarHBondContact O-CB 3.45Å; T57-S61 PolarHBondContact O-N 3.33Å; T57-S61 PolarHBondContact O-OG 3.18Å; L58-S61 WeakPolarHBondContact CA-OG 3.34Å; L58-S61 PolarHBondContact O-OG 3.43Å; S61-F63 VanDerWaalsContact C-N 3.3Å; S61-F63 PolarHBondContact O-N 3.31Å; S61-F64 PolarHBondContact O-N 3.34Å; S61-V65 WeakPolarHBondContact O-CG2 3.5Å; S61-V65 PolarHBondContact O-N 3Å
62	G	83.3	Confident	82.9	Confident	36 Å²	36	56 Å²	56	37%	0.371	30%	0.303	S	S	.	.	H	α-helix	trans	-59.5	-44	173.6	0	0	0	0	0	111.3	L58 V65 V66	L58-G62 PolarHBondContact O-N 3.08Å; G62-V65 PolarHBondContact O-N 2.86Å; G62-V66 WeakPolarHBondContact O-CB 3.49Å; G62-V66 VanDerWaalsContact O-CG2 3.3Å; G62-V66 WeakPolarHBondContact O-CG2 3.4Å; G62-V66 PolarHBondContact O-N 3.25Å
63	F	80.6	Confident	82.7	Confident	34 Å²	34	57.7 Å²	57.7	15%	0.149	31%	0.314	C	S	.	.	H	α-helix	trans	-67.9	-36.7	176.3	-172.7	-95.6	0	0	0	113.4	F59 S61 G67 L146 M353 C357	F59-F63 WeakPolarHBondContact O-CB 3.45Å; F59-F63 PolarHBondContact O-N 2.84Å; S61-F63 VanDerWaalsContact C-N 3.3Å; S61-F63 PolarHBondContact O-N 3.31Å; F63-G67 WeakPolarHBondContact O-CA 3.28Å; F63-G67 PolarHBondContact O-N 3.4Å; F63-L146 HydrophobicContact CD1-CD2 4.3Å; F63-L146 HydrophobicContact CE1-CD2 4.22Å; F63-M353 HydrophobicContact CB-CE 3.78Å; F63-M353 HydrophobicContact CB-CG 4.27Å; F63-M353 HydrophobicContact CB-SD 4.4Å; F63-M353 HydrophobicContact CD1-CB 4.36Å; F63-M353 HydrophobicContact CD1-CG 3.83Å; F63-M353 HydrophobicContact CD2-CB 4.24Å; F63-M353 HydrophobicContact CD2-CE 4.47Å; F63-M353 HydrophobicContact CD2-CG 3.82Å; F63-M353 HydrophobicContact CD2-SD 4.02Å; F63-M353 HydrophobicContact CE1-CB 4.06Å; F63-M353 HydrophobicContact CE1-CG 4.05Å; F63-M353 HydrophobicContact CE2-CB 3.94Å; F63-M353 HydrophobicContact CE2-CG 4.04Å; F63-M353 HydrophobicContact CG-CB 4.43Å; F63-M353 HydrophobicContact CG-CE 4.18Å; F63-M353 HydrophobicContact CG-CG 3.7Å; F63-M353 HydrophobicContact CG-SD 4.2Å; F63-M353 HydrophobicContact CZ-CB 3.82Å; F63-M353 HydrophobicContact CZ-CG 4.13Å; F63-M353 WeakPolarHBondContact CZ-O 3.5Å; F63-C357 HydrophobicContact CE2-CB 4.18Å; F63-C357 HydrophobicContact CZ-CB 4.18Å
64	F	84.5	Confident	82.3	Confident	42 Å²	42	53.3 Å²	53.3	18%	0.184	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-48.7	173.2	175.5	-97.2	0	0	0	111	L60 S61 G67 V68 L146 T150 L151	L60-F64 VanDerWaalsContact O-CB 3.26Å; L60-F64 WeakPolarHBondContact O-CB 3.34Å; L60-F64 PolarHBondContact O-N 2.97Å; S61-F64 PolarHBondContact O-N 3.34Å; F64-G67 PolarHBondContact O-N 3.07Å; F64-V68 HydrophobicContact CD2-CG2 4.29Å; F64-V68 HydrophobicContact CE1-CG2 4.31Å; F64-V68 HydrophobicContact CE2-CG2 3.95Å; F64-V68 HydrophobicContact CZ-CG2 3.95Å; F64-V68 WeakPolarHBondContact O-CB 3.33Å; F64-V68 VanDerWaalsContact O-CG2 3.27Å; F64-V68 WeakPolarHBondContact O-CG2 3.5Å; F64-V68 PolarHBondContact O-N 3.19Å; F64-L146 HydrophobicContact CD2-CB 4.15Å; F64-L146 HydrophobicContact CD2-CD2 4.31Å; F64-L146 HydrophobicContact CE2-CB 4.21Å; F64-T150 WeakPolarHBondContact CD2-OG1 3.37Å; F64-L151 HydrophobicContact CE2-CB 4Å; F64-L151 HydrophobicContact CE2-CD1 4.21Å; F64-L151 HydrophobicContact CZ-CB 4.38Å; F64-L151 HydrophobicContact CZ-CD1 3.8Å
65	V	85.4	Confident	82.1	Confident	78 Å²	78	48.2 Å²	48.2	47%	0.473	28%	0.276	S	S	.	.	H	α-helix	trans	-62.8	-50.5	178.7	172.4	0	0	0	0	111.1	S61 G62 G67 V68 L69	S61-V65 WeakPolarHBondContact O-CG2 3.5Å; S61-V65 PolarHBondContact O-N 3Å; G62-V65 PolarHBondContact O-N 2.86Å; V65-G67 PolarHBondContact O-N 2.97Å; V65-V68 PolarHBondContact O-N 3.5Å; V65-L69 HydrophobicContact CG1-CD1 3.73Å; V65-L69 HydrophobicContact CG1-CG 4.4Å; V65-L69 VanDerWaalsContact O-CB 3.29Å; V65-L69 WeakPolarHBondContact O-CB 3.37Å; V65-L69 VanDerWaalsContact O-CG 3.22Å; V65-L69 WeakPolarHBondContact O-CG 3.4Å; V65-L69 PolarHBondContact O-N 3.49Å
66	V	83.2	Confident	81.8	Confident	76 Å²	76	52.4 Å²	52.4	46%	0.461	29%	0.29	S	S	.	.	H	α-helix	trans	-63.5	-42.7	178.4	171.9	0	0	0	0	111.4	G62 L69 L70	G62-V66 WeakPolarHBondContact O-CB 3.49Å; G62-V66 VanDerWaalsContact O-CG2 3.3Å; G62-V66 WeakPolarHBondContact O-CG2 3.4Å; G62-V66 PolarHBondContact O-N 3.25Å; V66-L69 PolarHBondContact O-N 3.34Å; V66-L70 HydrophobicContact CG1-CD1 3.75Å; V66-L70 HydrophobicContact CG1-CG 4.36Å; V66-L70 WeakPolarHBondContact O-CB 3.42Å; V66-L70 VanDerWaalsContact O-CG 3.32Å; V66-L70 WeakPolarHBondContact O-CG 3.4Å; V66-L70 PolarHBondContact O-N 3.1Å
67	G	79.5	Confident	81.4	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-60.1	-49.8	177.8	0	0	0	0	0	112	F63 F64 V65 L70 I71	F63-G67 WeakPolarHBondContact O-CA 3.28Å; F63-G67 PolarHBondContact O-N 3.4Å; F64-G67 PolarHBondContact O-N 3.07Å; V65-G67 PolarHBondContact O-N 2.97Å; G67-L70 PolarHBondContact O-N 3.12Å; G67-I71 WeakPolarHBondContact O-CB 3.3Å; G67-I71 WeakPolarHBondContact O-CD1 3.27Å; G67-I71 WeakPolarHBondContact O-CG1 3.39Å; G67-I71 PolarHBondContact O-N 3.27Å
68	V	84	Confident	80.9	Confident	33 Å²	33	54.5 Å²	54.5	20%	0.2	30%	0.298	C	S	.	.	H	α-helix	trans	-63	-44.8	176.5	172.1	0	0	0	0	111.4	F64 V65 L70 I72 L143 L146	F64-V68 HydrophobicContact CD2-CG2 4.29Å; F64-V68 HydrophobicContact CE1-CG2 4.31Å; F64-V68 HydrophobicContact CE2-CG2 3.95Å; F64-V68 HydrophobicContact CZ-CG2 3.95Å; F64-V68 WeakPolarHBondContact O-CB 3.33Å; F64-V68 VanDerWaalsContact O-CG2 3.27Å; F64-V68 WeakPolarHBondContact O-CG2 3.5Å; F64-V68 PolarHBondContact O-N 3.19Å; V65-V68 PolarHBondContact O-N 3.5Å; V68-L70 VanDerWaalsContact C-N 3.28Å; V68-L70 PolarHBondContact O-N 2.67Å; V68-I72 HydrophobicContact CG1-CD1 3.58Å; V68-I72 HydrophobicContact CG1-CG1 4.28Å; V68-I72 WeakPolarHBondContact O-CB 3.37Å; V68-I72 WeakPolarHBondContact O-CG1 3.2Å; V68-I72 PolarHBondContact O-N 3.08Å; V68-I72 VanDerWaalsContact O-N 3.09Å; V68-L143 HydrophobicContact CG2-CD1 4.48Å; V68-L146 HydrophobicContact CG2-CD1 4.19Å
69	L	84.4	Confident	80.4	Confident	117 Å²	117	50.4 Å²	50.4	61%	0.613	28%	0.282	S	S	*	.	H	α-helix	trans	-65	-25.5	179.3	-75.1	174.3	0	0	0	114	V65 V66 P73	V65-L69 HydrophobicContact CG1-CD1 3.73Å; V65-L69 HydrophobicContact CG1-CG 4.4Å; V65-L69 VanDerWaalsContact O-CB 3.29Å; V65-L69 WeakPolarHBondContact O-CB 3.37Å; V65-L69 VanDerWaalsContact O-CG 3.22Å; V65-L69 WeakPolarHBondContact O-CG 3.4Å; V65-L69 PolarHBondContact O-N 3.49Å; V66-L69 PolarHBondContact O-N 3.34Å; L69-P73 WeakPolarHBondContact O-CD 3.39Å; L69-P73 WeakPolarHBondContact O-CG 3.5Å
70	L	80.6	Confident	79.8	Confident	58 Å²	58	46.8 Å²	46.8	30%	0.304	27%	0.273	S	S	.	.	H	α-helix	trans	-93.5	-39	176	-67	176.6	0	0	0	112.6	V66 G67 V68 A74 V360	V66-L70 HydrophobicContact CG1-CD1 3.75Å; V66-L70 HydrophobicContact CG1-CG 4.36Å; V66-L70 WeakPolarHBondContact O-CB 3.42Å; V66-L70 VanDerWaalsContact O-CG 3.32Å; V66-L70 WeakPolarHBondContact O-CG 3.4Å; V66-L70 PolarHBondContact O-N 3.1Å; G67-L70 PolarHBondContact O-N 3.12Å; V68-L70 VanDerWaalsContact C-N 3.28Å; V68-L70 PolarHBondContact O-N 2.67Å; L70-A74 VanDerWaalsContact O-CB 3.3Å; L70-A74 WeakPolarHBondContact O-CB 3.08Å; L70-A74 PolarHBondContact O-N 2.86Å; L70-V360 HydrophobicContact CB-CG2 4.34Å; L70-V360 HydrophobicContact CD1-CG1 3.73Å; L70-V360 HydrophobicContact CD1-CG2 4Å
71	I	81	Confident	79	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-71.5	-38.7	-176.8	-70.1	165.8	0	0	0	111.8	G67 A74 L75 C139 L143 L146 F359	G67-I71 WeakPolarHBondContact O-CB 3.3Å; G67-I71 WeakPolarHBondContact O-CD1 3.27Å; G67-I71 WeakPolarHBondContact O-CG1 3.39Å; G67-I71 PolarHBondContact O-N 3.27Å; I71-A74 PolarHBondContact O-N 3.41Å; I71-L75 HydrophobicContact CG2-CD1 4.09Å; I71-L75 WeakPolarHBondContact O-CB 3.45Å; I71-L75 PolarHBondContact O-N 3.21Å; I71-C139 HydrophobicContact CG2-CB 4.29Å; I71-L143 HydrophobicContact CG2-CB 4.05Å; I71-L143 HydrophobicContact CG2-CD1 4.4Å; I71-L146 HydrophobicContact CD1-CD1 3.68Å; I71-F359 HydrophobicContact CG1-CD1 3.81Å; I71-F359 HydrophobicContact CG1-CE1 4.15Å
72	I	81.8	Confident	78.2	Confident	75 Å²	75	47.4 Å²	47.4	39%	0.385	27%	0.273	S	S	.	.	H	α-helix	trans	-64.1	-51.1	-179.9	-68.8	177.6	0	0	0	111.6	V68 A74 L75 M76	V68-I72 HydrophobicContact CG1-CD1 3.58Å; V68-I72 HydrophobicContact CG1-CG1 4.28Å; V68-I72 WeakPolarHBondContact O-CB 3.37Å; V68-I72 WeakPolarHBondContact O-CG1 3.2Å; V68-I72 PolarHBondContact O-N 3.08Å; V68-I72 VanDerWaalsContact O-N 3.09Å; I72-A74 VanDerWaalsContact C-N 3.34Å; I72-A74 PolarHBondContact O-N 3.26Å; I72-L75 WeakPolarHBondContact O-CB 3.22Å; I72-L75 PolarHBondContact O-N 2.74Å; I72-M76 HydrophobicContact CG2-CG 4.5Å; I72-M76 HydrophobicContact CG2-SD 4.08Å; I72-M76 WeakPolarHBondContact O-CG 3.35Å; I72-M76 PolarHBondContact O-N 2.78Å
73	P	79.7	Confident	77.7	Confident	57 Å²	57	49.2 Å²	49.2	37%	0.37	28%	0.277	S	S	.	.	H	α-helix	trans	-59.7	-41.3	173.7	-27	37.4	0	0	0	112.9	L69 L75 M76 Q77	L69-P73 WeakPolarHBondContact O-CD 3.39Å; L69-P73 WeakPolarHBondContact O-CG 3.5Å; P73-L75 VanDerWaalsContact C-N 3.32Å; P73-L75 PolarHBondContact O-N 3.49Å; P73-M76 PolarHBondContact O-N 2.9Å; P73-Q77 WeakPolarHBondContact O-CB 3.35Å; P73-Q77 VanDerWaalsContact O-CG 3.23Å; P73-Q77 WeakPolarHBondContact O-CG 3.22Å; P73-Q77 PolarHBondContact O-N 3.3Å
74	A	73.2	Confident	77	Confident	9 Å²	9	53.5 Å²	53.5	7%	0.074	29%	0.292	C	S	.	.	H	α-helix	trans	-61.4	-38.5	176.3	0	0	0	0	0	112.3	L70 I71 I72 T78 F359 T363	L70-A74 VanDerWaalsContact O-CB 3.3Å; L70-A74 WeakPolarHBondContact O-CB 3.08Å; L70-A74 PolarHBondContact O-N 2.86Å; I71-A74 PolarHBondContact O-N 3.41Å; I72-A74 VanDerWaalsContact C-N 3.34Å; I72-A74 PolarHBondContact O-N 3.26Å; A74-T78 WeakPolarHBondContact O-CB 3.36Å; A74-T78 VanDerWaalsContact O-CG2 3.22Å; A74-T78 WeakPolarHBondContact O-CG2 3.4Å; A74-T78 PolarHBondContact O-N 3.25Å; A74-T78 PolarHBondContact O-OG1 2.99Å; A74-F359 HydrophobicContact CB-CE1 3.96Å; A74-F359 HydrophobicContact CB-CZ 4.17Å; A74-T363 HydrophobicContact CB-CG2 3.88Å
75	L	80	Confident	75.9	Confident	29 Å²	29	52.6 Å²	52.6	15%	0.152	29%	0.292	C	S	.	.	H	α-helix	trans	-62.5	-51	171.6	-99.2	163.7	0	0	0	112	I71 I72 P73 Q77 T78 A79 I136 C139 T140 L143	I71-L75 HydrophobicContact CG2-CD1 4.09Å; I71-L75 WeakPolarHBondContact O-CB 3.45Å; I71-L75 PolarHBondContact O-N 3.21Å; I72-L75 WeakPolarHBondContact O-CB 3.22Å; I72-L75 PolarHBondContact O-N 2.74Å; P73-L75 VanDerWaalsContact C-N 3.32Å; P73-L75 PolarHBondContact O-N 3.49Å; L75-Q77 VanDerWaalsContact C-N 3.34Å; L75-Q77 PolarHBondContact O-N 2.99Å; L75-T78 PolarHBondContact O-N 2.94Å; L75-T78 PolarHBondContact O-OG1 2.97Å; L75-T78 VanDerWaalsContact O-OG1 3.14Å; L75-A79 WeakPolarHBondContact O-CB 3.4Å; L75-A79 PolarHBondContact O-N 3.25Å; L75-I136 HydrophobicContact CD2-CG2 3.95Å; L75-C139 HydrophobicContact CD1-CB 3.83Å; L75-C139 HydrophobicContact CD2-CB 3.68Å; L75-C139 HydrophobicContact CG-CB 3.39Å; L75-T140 HydrophobicContact CD1-CG2 4.37Å; L75-T140 HydrophobicContact CD2-CG2 4.06Å; L75-L143 HydrophobicContact CD1-CD2 3.98Å
76	M	77.9	Confident	75	Confident	131 Å²	131	51 Å²	51	65%	0.645	29%	0.287	S	S	*	.	H	α-helix	trans	-61.4	-43.2	-178.7	-69.1	-179.5	71.6	0	0	111.5	I72 P73 A80	I72-M76 HydrophobicContact CG2-CG 4.5Å; I72-M76 HydrophobicContact CG2-SD 4.08Å; I72-M76 WeakPolarHBondContact O-CG 3.35Å; I72-M76 PolarHBondContact O-N 2.78Å; P73-M76 PolarHBondContact O-N 2.9Å; M76-A80 WeakPolarHBondContact O-CB 3.45Å; M76-A80 PolarHBondContact O-N 2.94Å
77	Q	73.5	Confident	74.4	Confident	65 Å²	65	51.9 Å²	51.9	30%	0.304	29%	0.286	S	S	.	.	H	α-helix	trans	-67.1	-43.3	178.2	-71.3	174.4	-6.6	0	0	112.6	P73 L75 A80 A81 Y437	P73-Q77 WeakPolarHBondContact O-CB 3.35Å; P73-Q77 VanDerWaalsContact O-CG 3.23Å; P73-Q77 WeakPolarHBondContact O-CG 3.22Å; P73-Q77 PolarHBondContact O-N 3.3Å; L75-Q77 VanDerWaalsContact C-N 3.34Å; L75-Q77 PolarHBondContact O-N 2.99Å; Q77-A80 PolarHBondContact O-N 3.33Å; Q77-A81 WeakPolarHBondContact O-CB 3.4Å; Q77-A81 PolarHBondContact O-N 2.94Å; Q77-Y437 PolarHBondContact NE2-OH 3.46Å; Q77-Y437 PolarHBondContact OE1-OH 2.92Å
78	T	71.6	Confident	73.5	Confident	10 Å²	10	55 Å²	55	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-70.3	-36.4	178.8	52.3	0	0	0	0	112.2	A74 L75 Y82 R135	A74-T78 WeakPolarHBondContact O-CB 3.36Å; A74-T78 VanDerWaalsContact O-CG2 3.22Å; A74-T78 WeakPolarHBondContact O-CG2 3.4Å; A74-T78 PolarHBondContact O-N 3.25Å; A74-T78 PolarHBondContact O-OG1 2.99Å; L75-T78 PolarHBondContact O-N 2.94Å; L75-T78 PolarHBondContact O-OG1 2.97Å; L75-T78 VanDerWaalsContact O-OG1 3.14Å; T78-Y82 WeakPolarHBondContact O-CB 3.49Å; T78-Y82 PolarHBondContact O-N 2.89Å; T78-R135 HydrophobicContact CG2-CG 4.03Å
79	A	74.1	Confident	72.1	Confident	38 Å²	38	60 Å²	60	31%	0.314	32%	0.318	S	S	.	.	H	α-helix	trans	-65.6	-44.9	171	0	0	0	0	0	112	L75 Y82 V83 I136	L75-A79 WeakPolarHBondContact O-CB 3.4Å; L75-A79 PolarHBondContact O-N 3.25Å; A79-Y82 WeakPolarHBondContact O-CB 3.44Å; A79-Y82 PolarHBondContact O-N 2.89Å; A79-V83 WeakPolarHBondContact O-CG2 3.31Å; A79-V83 PolarHBondContact O-N 3.32Å; A79-I136 HydrophobicContact CB-CD1 4.4Å
80	A	70.5	Confident	70.9	Confident	38 Å²	38	63.5 Å²	63.5	31%	0.314	32%	0.323	S	S	.	.	H	α-helix	trans	-61.7	-45.5	176.7	0	0	0	0	0	111.8	M76 Q77 Y82 V83 W84 W439	M76-A80 WeakPolarHBondContact O-CB 3.45Å; M76-A80 PolarHBondContact O-N 2.94Å; Q77-A80 PolarHBondContact O-N 3.33Å; A80-Y82 VanDerWaalsContact C-N 3.32Å; A80-Y82 PolarHBondContact O-N 3.09Å; A80-V83 PolarHBondContact O-N 2.75Å; A80-W84 VanDerWaalsContact O-CB 3.28Å; A80-W84 WeakPolarHBondContact O-CB 3.45Å; A80-W84 PolarHBondContact O-N 3.31Å; A80-W439 HydrophobicContact CB-CZ2 4.23Å
81	A	64.7	Low	69.6	Low	20 Å²	20	67 Å²	67	17%	0.165	34%	0.337	C	S	.	.	H	α-helix	trans	-60.1	-40.5	175.1	0	0	0	0	0	112.4	Q77 A85 F132	Q77-A81 WeakPolarHBondContact O-CB 3.4Å; Q77-A81 PolarHBondContact O-N 2.94Å; A81-A85 VanDerWaalsContact O-CB 3.27Å; A81-A85 WeakPolarHBondContact O-CB 3.44Å; A81-A85 PolarHBondContact O-N 2.69Å; A81-F132 HydrophobicContact CB-CD1 4.45Å; A81-F132 HydrophobicContact CB-CE1 3.87Å; A81-F132 HydrophobicContact CB-CZ 4.27Å
82	Y	69.3	Low	68.2	Low	49 Å²	49	70.2 Å²	70.2	19%	0.192	36%	0.36	C	S	.	.	H	α-helix	trans	-64.5	-42.6	175.3	173.9	-93.4	0	0	0	112.9	T78 A79 A80 A86 R129 F132 L133	T78-Y82 WeakPolarHBondContact O-CB 3.49Å; T78-Y82 PolarHBondContact O-N 2.89Å; A79-Y82 WeakPolarHBondContact O-CB 3.44Å; A79-Y82 PolarHBondContact O-N 2.89Å; A80-Y82 VanDerWaalsContact C-N 3.32Å; A80-Y82 PolarHBondContact O-N 3.09Å; Y82-A86 PolarHBondContact O-N 3.27Å; Y82-R129 HydrophobicContact CD2-CG 4.27Å; Y82-R129 HydrophobicContact CE2-CG 3.58Å; Y82-R129 PolarHBondContact OH-NE 3.43Å; Y82-R129 PolarHBondContact OH-NH2 3.47Å; Y82-F132 HydrophobicContact CD2-CB 3.91Å; Y82-F132 HydrophobicContact CG-CB 4.49Å; Y82-L133 HydrophobicContact CD2-CD2 4.41Å; Y82-L133 HydrophobicContact CD2-CG 4.2Å; Y82-L133 HydrophobicContact CE2-CD1 3.89Å; Y82-L133 HydrophobicContact CE2-CD2 3.77Å; Y82-L133 HydrophobicContact CE2-CG 3.59Å
83	V	73.2	Confident	66.9	Low	74 Å²	74	70.6 Å²	70.6	45%	0.448	37%	0.365	S	S	.	.	H	α-helix	trans	-67.9	-45.1	177.5	172.4	0	0	0	0	110.9	A79 A80 A85 A86 Q87	A79-V83 WeakPolarHBondContact O-CG2 3.31Å; A79-V83 PolarHBondContact O-N 3.32Å; A80-V83 PolarHBondContact O-N 2.75Å; V83-A85 PolarHBondContact O-N 3.45Å; V83-A86 CarbonylContact O-C 3.55Å; V83-A86 WeakPolarHBondContact O-CA 3.41Å; V83-A86 WeakPolarHBondContact O-CB 3.47Å; V83-A86 PolarHBondContact O-N 3.26Å; V83-Q87 HydrophobicContact CG1-CG 4.36Å; V83-Q87 WeakPolarHBondContact O-CG 3.46Å; V83-Q87 PolarHBondContact O-N 3.37Å
84	W	64.7	Low	65.5	Low	124 Å²	124	72.3 Å²	72.3	47%	0.47	38%	0.375	S	S	.	.	H	α-helix	trans	-60.8	-45.3	177.7	180	83.9	0	0	0	112.2	A80 A86 Q87 I88	A80-W84 VanDerWaalsContact O-CB 3.28Å; A80-W84 WeakPolarHBondContact O-CB 3.45Å; A80-W84 PolarHBondContact O-N 3.31Å; W84-A86 PolarHBondContact O-N 2.99Å; W84-Q87 PolarHBondContact O-N 3.47Å; W84-I88 HydrophobicContact CD2-CD1 3.85Å; W84-I88 HydrophobicContact CE3-CD1 4.09Å; W84-I88 HydrophobicContact CH2-CD1 3.51Å; W84-I88 HydrophobicContact CZ2-CD1 3.23Å; W84-I88 HydrophobicContact CZ2-CG1 4.5Å; W84-I88 HydrophobicContact CZ3-CD1 3.92Å; W84-I88 PolarHBondContact O-N 2.86Å
85	A	62.6	Low	64.4	Low	22 Å²	22	75.8 Å²	75.8	18%	0.182	40%	0.397	C	S	.	.	H	α-helix	trans	-61.5	-24.9	173	0	0	0	0	0	113	A81 V83 L124	A81-A85 VanDerWaalsContact O-CB 3.27Å; A81-A85 WeakPolarHBondContact O-CB 3.44Å; A81-A85 PolarHBondContact O-N 2.69Å; V83-A85 PolarHBondContact O-N 3.45Å; A85-L124 HydrophobicContact CB-CD2 4.41Å
86	A	66.2	Low	62.9	Low	45 Å²	45	78.7 Å²	78.7	37%	0.372	42%	0.416	S	S	.	.	H	α-helix	trans	-83.7	-27.9	171.8	0	0	0	0	0	113.5	Y82 V83 W84 R90	Y82-A86 PolarHBondContact O-N 3.27Å; V83-A86 CarbonylContact O-C 3.55Å; V83-A86 WeakPolarHBondContact O-CA 3.41Å; V83-A86 WeakPolarHBondContact O-CB 3.47Å; V83-A86 PolarHBondContact O-N 3.26Å; W84-A86 PolarHBondContact O-N 2.99Å; A86-R90 PolarHBondContact O-N 2.96Å
87	Q	69.4	Low	61.6	Low	94 Å²	94	76.1 Å²	76.1	44%	0.439	40%	0.402	S	S	.	.	H	α-helix	trans	-73.6	-49.7	176.2	-75.9	171.8	-51.6	0	0	112	V83 W84 R89 R90 E91	V83-Q87 HydrophobicContact CG1-CG 4.36Å; V83-Q87 WeakPolarHBondContact O-CG 3.46Å; V83-Q87 PolarHBondContact O-N 3.37Å; W84-Q87 PolarHBondContact O-N 3.47Å; Q87-R89 PolarHBondContact O-N 3.05Å; Q87-R89 VanDerWaalsContact O-N 3.13Å; Q87-R90 WeakPolarHBondContact O-CA 3.31Å; Q87-R90 WeakPolarHBondContact O-CB 3.03Å; Q87-R90 PolarHBondContact O-N 2.91Å; Q87-E91 PolarHBondContact O-N 3.42Å
88	I	61.5	Low	60.4	Low	66 Å²	66	78.6 Å²	78.6	34%	0.338	42%	0.417	S	S	.	.	H	α-helix	trans	-55.4	-35.6	174.3	-74.3	-179.4	0	0	0	111.1	W84 R90 E91 S92	W84-I88 HydrophobicContact CD2-CD1 3.85Å; W84-I88 HydrophobicContact CE3-CD1 4.09Å; W84-I88 HydrophobicContact CH2-CD1 3.51Å; W84-I88 HydrophobicContact CZ2-CD1 3.23Å; W84-I88 HydrophobicContact CZ2-CG1 4.5Å; W84-I88 HydrophobicContact CZ3-CD1 3.92Å; W84-I88 PolarHBondContact O-N 2.86Å; I88-R90 VanDerWaalsContact C-N 3.3Å; I88-R90 PolarHBondContact O-N 2.64Å; I88-E91 PolarHBondContact O-N 2.86Å; I88-S92 VanDerWaalsContact O-CB 3.3Å; I88-S92 WeakPolarHBondContact O-CB 3.23Å; I88-S92 PolarHBondContact O-N 2.9Å; I88-S92 PolarHBondContact O-OG 2.86Å
89	R	54.6	Low	59.4	Low	140 Å²	140	85.3 Å²	85.3	53%	0.528	45%	0.448	S	S	.	.	H	α-helix	trans	-66.9	-25.9	174.6	-178.9	176.3	171.8	-150.4	-9.2	113.9	Q87 V93	Q87-R89 PolarHBondContact O-N 3.05Å; Q87-R89 VanDerWaalsContact O-N 3.13Å; R89-V93 WeakPolarHBondContact O-CG2 3.39Å
90	R	58.3	Low	58.2	Low	190 Å²	190	89.4 Å²	89.4	72%	0.717	46%	0.46	S	S	*	.	H	α-helix	trans	-78.4	-47.1	171.3	-68.5	177.3	176.9	-170.1	-1.3	110.1	A86 Q87 I88 V93 T94	A86-R90 PolarHBondContact O-N 2.96Å; Q87-R90 WeakPolarHBondContact O-CA 3.31Å; Q87-R90 WeakPolarHBondContact O-CB 3.03Å; Q87-R90 PolarHBondContact O-N 2.91Å; I88-R90 VanDerWaalsContact C-N 3.3Å; I88-R90 PolarHBondContact O-N 2.64Å; R90-V93 PolarHBondContact O-N 3.26Å; R90-V93 VanDerWaalsContact O-N 3.16Å; R90-T94 WeakPolarHBondContact O-CB 3.47Å; R90-T94 PolarHBondContact O-N 3.05Å; R90-T94 PolarHBondContact O-OG1 3.35Å
91	E	54.8	Low	57.1	Low	130 Å²	130	91.1 Å²	91.1	61%	0.607	47%	0.47	S	S	*	.	H	α-helix	trans	-64.3	-46.3	-176.6	-72.5	162.4	-165.1	0	0	112.3	Q87 I88 V93 T94 P95	Q87-E91 PolarHBondContact O-N 3.42Å; I88-E91 PolarHBondContact O-N 2.86Å; E91-V93 PolarHBondContact O-N 3.43Å; E91-T94 PolarHBondContact O-N 3.43Å; E91-P95 WeakPolarHBondContact O-CD 3.15Å
92	S	51.9	Low	56.5	Low	69 Å²	69	98 Å²	98	48%	0.483	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-11	174.9	54.7	0	0	0	0	115.3	I88	I88-S92 VanDerWaalsContact O-CB 3.3Å; I88-S92 WeakPolarHBondContact O-CB 3.23Å; I88-S92 PolarHBondContact O-N 2.9Å; I88-S92 PolarHBondContact O-OG 2.86Å
93	V	52.6	Low	55.7	Low	82 Å²	82	104.1 Å²	104.1	50%	0.497	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-19.7	-178.6	171.8	0	0	0	0	112.9	R89 R90 E91	R89-V93 WeakPolarHBondContact O-CG2 3.39Å; R90-V93 PolarHBondContact O-N 3.26Å; R90-V93 VanDerWaalsContact O-N 3.16Å; E91-V93 PolarHBondContact O-N 3.43Å
94	T	50.4	Low	54.5	Low	94 Å²	94	104.9 Å²	104.9	58%	0.577	53%	0.525	S	S	*	.	S	Bend	trans	-101.6	-36.9	-156.7	-49.7	0	0	0	0	116.8	R90 E91	R90-T94 WeakPolarHBondContact O-CB 3.47Å; R90-T94 PolarHBondContact O-N 3.05Å; R90-T94 PolarHBondContact O-OG1 3.35Å; E91-T94 PolarHBondContact O-N 3.43Å
95	P	50.2	Low	53.7	Low	81 Å²	81	106.7 Å²	106.7	53%	0.526	54%	0.539	S	S	.	.	S	Bend	trans	-95.9	-56.8	-179.6	-8.2	27.2	0	0	0	115.4	E91	E91-P95 WeakPolarHBondContact O-CD 3.15Å
96	T	49.8	Very low	53.2	Low	90 Å²	90	110.6 Å²	110.6	55%	0.552	57%	0.565	S	S	*	*	H	α-helix	trans	-73.6	-36.3	-163	25.2	0	0	0	0	114.1	Q100	T96-Q100 PolarHBondContact O-N 3.21Å
97	Q	49.2	Very low	52.4	Low	78 Å²	78	113.8 Å²	113.8	36%	0.364	58%	0.575	S	S	.	*	H	α-helix	trans	-77	-24.9	-179	-61.6	-158	-17.3	0	0	113.3	S101	Q97-S101 WeakPolarHBondContact O-CB 3.47Å; Q97-S101 PolarHBondContact O-N 3.19Å
98	L	48.3	Very low	51.3	Low	117 Å²	117	112.5 Å²	112.5	61%	0.613	58%	0.576	S	S	*	*	H	α-helix	trans	-71.6	-36.3	174.6	-132.1	90.9	0	0	0	111.6	K102	L98-K102 PolarHBondContact O-N 3.43Å; L98-K102 VanDerWaalsContact O-N 3.16Å
99	Q	50.6	Low	50.9	Low	150 Å²	150	118.3 Å²	118.3	70%	0.701	60%	0.599	S	S	*	*	H	α-helix	trans	-71.1	-44.3	175.7	-73.6	-175.2	-19.1	0	0	112.1	S101 K102 K103	Q99-S101 PolarHBondContact O-N 3.22Å; Q99-K102 PolarHBondContact O-N 3.32Å; Q99-K103 PolarHBondContact O-N 2.97Å; Q99-K103 VanDerWaalsContact O-N 3.07Å
100	Q	50.1	Low	50.9	Low	124 Å²	124	117.3 Å²	117.3	58%	0.579	60%	0.604	S	S	*	*	H	α-helix	trans	-65.5	-36.2	173.8	-75.2	-177.3	-17.5	0	0	112.6	T96 K102 K103 N104	T96-Q100 PolarHBondContact O-N 3.21Å; Q100-K102 VanDerWaalsContact C-N 3.3Å; Q100-K102 PolarHBondContact O-N 2.91Å; Q100-K103 PolarHBondContact O-N 2.91Å; Q100-N104 WeakPolarHBondContact O-CB 3.38Å; Q100-N104 PolarHBondContact O-N 3.05Å
101	S	46.9	Very low	50.6	Low	75 Å²	75	111.8 Å²	111.8	52%	0.524	59%	0.589	S	S	.	*	H	α-helix	trans	-67.2	-26.7	175.3	-172.9	0	0	0	0	113.7	Q97 Q99	Q97-S101 WeakPolarHBondContact O-CB 3.47Å; Q97-S101 PolarHBondContact O-N 3.19Å; Q99-S101 PolarHBondContact O-N 3.22Å
102	K	51.1	Low	50.1	Low	163 Å²	163	108.6 Å²	108.6	71%	0.709	58%	0.581	S	S	*	*	H	α-helix	trans	-79.2	-32.8	171.3	-80.7	-173.2	172.5	-174.7	0	112.6	L98 Q99 Q100	L98-K102 PolarHBondContact O-N 3.43Å; L98-K102 VanDerWaalsContact O-N 3.16Å; Q99-K102 PolarHBondContact O-N 3.32Å; Q100-K102 VanDerWaalsContact C-N 3.3Å; Q100-K102 PolarHBondContact O-N 2.91Å
103	K	53.2	Low	50.2	Low	179 Å²	179	109.6 Å²	109.6	78%	0.778	58%	0.581	S	S	*	*	H	α-helix	trans	-80.4	-27.9	-178.5	-150.9	173.2	-175.5	-178.1	0	113.7	Q99 Q100	Q99-K103 PolarHBondContact O-N 2.97Å; Q99-K103 VanDerWaalsContact O-N 3.07Å; Q100-K103 PolarHBondContact O-N 2.91Å
104	N	48.3	Very low	50.3	Low	89 Å²	89	112.4 Å²	112.4	48%	0.476	59%	0.586	S	S	.	*	S	Bend	trans	-102	14.8	-176.8	-65.8	-9	0	0	0	114.1	Q100 S106 I107	Q100-N104 WeakPolarHBondContact O-CB 3.38Å; Q100-N104 PolarHBondContact O-N 3.05Å; N104-S106 PolarHBondContact O-N 2.68Å; N104-I107 PolarHBondContact O-N 2.77Å; N104-I107 VanDerWaalsContact O-N 3.1Å
105	Q	48.7	Very low	50.2	Low	162 Å²	162	111.8 Å²	111.8	76%	0.757	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-7.6	-173.1	-138	172.3	5.7	0	0	114.2
106	S	51.2	Low	50.2	Low	104 Å²	104	113.4 Å²	113.4	73%	0.727	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-9.6	173.7	51.4	0	0	0	0	114.9	N104	N104-S106 PolarHBondContact O-N 2.68Å
107	I	49.9	Very low	50.2	Low	112 Å²	112	116.5 Å²	116.5	57%	0.574	59%	0.585	S	S	*	*	S	Bend	trans	-119	100.8	-169.2	-56.1	-179.5	0	0	0	112.8	N104	N104-I107 PolarHBondContact O-N 2.77Å; N104-I107 VanDerWaalsContact O-N 3.1Å
108	S	46.1	Very low	50	Low	67 Å²	67	118.7 Å²	118.7	47%	0.469	60%	0.595	S	S	.	*			trans	55.5	113.4	156.4	-169.4	0	0	0	0	119.2	N110 N111	S108-N110 PolarHBondContact O-N 3.28Å; S108-N110 PolarHBondContact OG-N 3.48Å; S108-N111 PolarHBondContact O-N 3.1Å
109	K	53.5	Low	49.9	Very low	188 Å²	188	115.9 Å²	115.9	82%	0.817	58%	0.58	S	S	*	*	H	α-helix	trans	-50.7	-23.1	167.5	-81.9	178.1	174.4	172.9	0	114.3	S112	K109-S112 PolarHBondContact O-OG 3.03Å; K109-S112 VanDerWaalsContact O-OG 3.09Å
110	N	54	Low	49.3	Very low	120 Å²	120	117 Å²	117	64%	0.642	58%	0.578	S	S	*	*	H	α-helix	trans	-76.1	-25.5	-179.7	-76.8	-17.2	0	0	0	113.8	S108	S108-N110 PolarHBondContact O-N 3.28Å; S108-N110 PolarHBondContact OG-N 3.48Å
111	N	51.7	Low	48.8	Very low	73 Å²	73	119.7 Å²	119.7	39%	0.39	59%	0.588	S	S	.	*	H	α-helix	trans	-81.1	-29	-179.8	-82.5	-11	0	0	0	113.2	S108 N113 K114 I115	S108-N111 PolarHBondContact O-N 3.1Å; N111-N113 PolarHBondContact O-N 3.39Å; N111-K114 PolarHBondContact O-N 2.98Å; N111-K114 VanDerWaalsContact O-N 3.08Å; N111-I115 WeakPolarHBondContact O-CG1 3.4Å; N111-I115 PolarHBondContact O-N 3.3Å
112	S	45.4	Very low	48.5	Very low	63 Å²	63	124.1 Å²	124.1	44%	0.441	60%	0.6	S	S	.	*	H	α-helix	trans	-59.6	-35.5	174.5	70.9	0	0	0	0	112.2	K109 I115 Q116	K109-S112 PolarHBondContact O-OG 3.03Å; K109-S112 VanDerWaalsContact O-OG 3.09Å; S112-I115 PolarHBondContact O-N 3.01Å; S112-Q116 WeakPolarHBondContact O-CB 3.4Å; S112-Q116 PolarHBondContact O-N 3.46Å
113	N	52.9	Low	47.8	Very low	91 Å²	91	123 Å²	123	49%	0.487	59%	0.591	S	S	.	*	H	α-helix	trans	-69.3	-33.6	175.3	-78.5	-30.1	0	0	0	113.4	N111 K117	N111-N113 PolarHBondContact O-N 3.39Å; N113-K117 WeakPolarHBondContact O-CB 3.23Å; N113-K117 VanDerWaalsContact O-CG 3.27Å; N113-K117 WeakPolarHBondContact O-CG 3.16Å; N113-K117 PolarHBondContact O-N 3.42Å; N113-K117 VanDerWaalsContact O-N 3.15Å
114	K	54.1	Low	47.5	Very low	140 Å²	140	118.9 Å²	118.9	61%	0.609	58%	0.577	S	S	*	*	H	α-helix	trans	-70.2	-46	172.7	-75.9	-175.3	175.7	-179.6	0	110.8	N111 K117 Q118	N111-K114 PolarHBondContact O-N 2.98Å; N111-K114 VanDerWaalsContact O-N 3.08Å; K114-K117 CarbonylContact O-C 3.6Å; K114-K117 WeakPolarHBondContact O-CA 3.41Å; K114-K117 WeakPolarHBondContact O-CB 3.34Å; K114-K117 PolarHBondContact O-N 3.43Å; K114-K117 VanDerWaalsContact O-N 3.07Å; K114-Q118 PolarHBondContact O-N 3.07Å
115	I	49.8	Very low	47.7	Very low	81 Å²	81	118 Å²	118	42%	0.415	58%	0.576	S	S	.	*	H	α-helix	trans	-62.8	-45.4	178.5	-66.3	165.9	0	0	0	110.6	N111 S112 K117 Q118 I119	N111-I115 WeakPolarHBondContact O-CG1 3.4Å; N111-I115 PolarHBondContact O-N 3.3Å; S112-I115 PolarHBondContact O-N 3.01Å; I115-K117 VanDerWaalsContact C-N 3.29Å; I115-K117 PolarHBondContact O-N 2.95Å; I115-Q118 PolarHBondContact O-N 3.28Å; I115-Q118 VanDerWaalsContact O-N 3.13Å; I115-I119 HydrophobicContact CG2-CD1 3.7Å; I115-I119 HydrophobicContact CG2-CG1 4.41Å; I115-I119 WeakPolarHBondContact O-CD1 3.41Å; I115-I119 VanDerWaalsContact O-CG1 3.26Å; I115-I119 WeakPolarHBondContact O-CG1 3.4Å; I115-I119 PolarHBondContact O-N 3.02Å
116	Q	49.6	Very low	48	Very low	115 Å²	115	116.8 Å²	116.8	54%	0.537	57%	0.569	S	S	.	*	H	α-helix	trans	-59.6	-35.5	171.5	-84.3	-164.2	-3.2	0	0	113.4	S112 R120	S112-Q116 WeakPolarHBondContact O-CB 3.4Å; S112-Q116 PolarHBondContact O-N 3.46Å; Q116-R120 WeakPolarHBondContact O-CG 3.21Å; Q116-R120 PolarHBondContact O-N 3.43Å
117	K	48.8	Very low	47.9	Very low	155 Å²	155	115.1 Å²	115.1	67%	0.674	55%	0.549	S	S	*	.	H	α-helix	trans	-68.7	-36.7	174.6	-79.8	175.1	178.3	-179.1	0	111.9	N113 K114 I115 K121	N113-K117 WeakPolarHBondContact O-CB 3.23Å; N113-K117 VanDerWaalsContact O-CG 3.27Å; N113-K117 WeakPolarHBondContact O-CG 3.16Å; N113-K117 PolarHBondContact O-N 3.42Å; N113-K117 VanDerWaalsContact O-N 3.15Å; K114-K117 CarbonylContact O-C 3.6Å; K114-K117 WeakPolarHBondContact O-CA 3.41Å; K114-K117 WeakPolarHBondContact O-CB 3.34Å; K114-K117 PolarHBondContact O-N 3.43Å; K114-K117 VanDerWaalsContact O-N 3.07Å; I115-K117 VanDerWaalsContact C-N 3.29Å; I115-K117 PolarHBondContact O-N 2.95Å; K117-K121 PolarHBondContact O-N 3.27Å
118	Q	46.2	Very low	48.4	Very low	125 Å²	125	112.2 Å²	112.2	58%	0.584	54%	0.535	S	S	*	.	H	α-helix	trans	-68.2	-44.7	171.8	-90.3	168	-49.4	0	0	112.3	K114 I115 R120 K121 H122	K114-Q118 PolarHBondContact O-N 3.07Å; I115-Q118 PolarHBondContact O-N 3.28Å; I115-Q118 VanDerWaalsContact O-N 3.13Å; Q118-R120 PolarHBondContact O-N 3.26Å; Q118-K121 WeakPolarHBondContact O-CA 3.22Å; Q118-K121 WeakPolarHBondContact O-CB 3.33Å; Q118-K121 PolarHBondContact O-N 3.15Å; Q118-H122 PolarHBondContact O-N 2.67Å
119	I	44.8	Very low	49.3	Very low	57 Å²	57	115.6 Å²	115.6	29%	0.292	54%	0.538	S	S	.	.	H	α-helix	trans	-59.9	-33.6	175.4	-63.5	157.5	0	0	0	111.5	I115 K121 H122	I115-I119 HydrophobicContact CG2-CD1 3.7Å; I115-I119 HydrophobicContact CG2-CG1 4.41Å; I115-I119 WeakPolarHBondContact O-CD1 3.41Å; I115-I119 VanDerWaalsContact O-CG1 3.26Å; I115-I119 WeakPolarHBondContact O-CG1 3.4Å; I115-I119 PolarHBondContact O-N 3.02Å; I119-K121 VanDerWaalsContact C-N 3.3Å; I119-K121 PolarHBondContact O-N 2.85Å; I119-H122 PolarHBondContact O-N 3.42Å
120	R	39.8	Very low	49.9	Very low	173 Å²	173	107.4 Å²	107.4	65%	0.653	50%	0.503	S	S	*	.	H	α-helix	trans	-67.1	-26.3	172.1	-81.6	-175.6	-178.6	-172.6	2.9	113.8	Q116 Q118	Q116-R120 WeakPolarHBondContact O-CG 3.21Å; Q116-R120 PolarHBondContact O-N 3.43Å; Q118-R120 PolarHBondContact O-N 3.26Å
121	K	39.3	Very low	50.3	Low	181 Å²	181	103.1 Å²	103.1	79%	0.787	48%	0.48	S	S	*	.	H	α-helix	trans	-77	-29.9	175.5	-70.6	-176	174.5	-172.7	0	112.9	K117 Q118 I119 R123	K117-K121 PolarHBondContact O-N 3.27Å; Q118-K121 WeakPolarHBondContact O-CA 3.22Å; Q118-K121 WeakPolarHBondContact O-CB 3.33Å; Q118-K121 PolarHBondContact O-N 3.15Å; I119-K121 VanDerWaalsContact C-N 3.3Å; I119-K121 PolarHBondContact O-N 2.85Å; K121-R123 PolarHBondContact O-N 3.49Å
122	H	40.5	Very low	51.1	Low	168 Å²	168	102.1 Å²	102.1	78%	0.778	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	9.5	177.4	-96.1	-61.3	0	0	0	115.6	Q118 I119 L124	Q118-H122 PolarHBondContact O-N 2.67Å; I119-H122 PolarHBondContact O-N 3.42Å; H122-L124 PolarHBondContact O-N 2.92Å
123	R	36.5	Very low	52.5	Low	139 Å²	139	101.4 Å²	101.4	53%	0.525	46%	0.463	S	S	.	.	S	Bend	trans	-75.4	127.3	169.7	-65.6	178.8	175.4	-167.5	-4.2	108.2	K121	K121-R123 PolarHBondContact O-N 3.49Å
124	L	46.4	Very low	53.6	Low	93 Å²	93	98.9 Å²	98.9	49%	0.487	45%	0.448	S	S	.	.			trans	-44.7	132	157.1	-89	90.1	0	0	0	107.5	A85 H122 K126	A85-L124 HydrophobicContact CB-CD2 4.41Å; H122-L124 PolarHBondContact O-N 2.92Å; L124-K126 PolarHBondContact O-N 3.44Å
125	P	52	Low	54.5	Low	71 Å²	71	93.7 Å²	93.7	46%	0.461	42%	0.424	S	S	.	.			trans	-56.6	136	-175.6	23.2	-32.1	0	0	0	108.4	Q127 D128	P125-Q127 HydrophobicContact CB-CB 4.4Å; P125-Q127 PolarHBondContact O-N 2.85Å; P125-D128 WeakPolarHBondContact CD-OD2 3.41Å; P125-D128 WeakPolarHBondContact CG-OD2 3.24Å; P125-D128 PolarHBondContact O-N 2.88Å
126	K	55.9	Low	56	Low	136 Å²	136	91.6 Å²	91.6	59%	0.591	41%	0.413	S	S	*	.	H	α-helix	trans	-49.2	-32.6	-176.5	-74.1	-176.8	171.6	-171.7	0	112.3	L124 D128 R129 T130	L124-K126 PolarHBondContact O-N 3.44Å; K126-D128 PolarHBondContact O-N 2.89Å; K126-R129 PolarHBondContact O-N 2.94Å; K126-T130 PolarHBondContact O-N 2.85Å; K126-T130 PolarHBondContact O-OG1 2.87Å; K126-T130 VanDerWaalsContact O-OG1 3.05Å
127	Q	49.8	Very low	57.6	Low	69 Å²	69	87.8 Å²	87.8	32%	0.322	40%	0.396	S	S	.	.	H	α-helix	trans	-45.4	-48.2	172.1	-174	163.6	-10.4	0	0	114	P125 T130 L131 F220	P125-Q127 HydrophobicContact CB-CB 4.4Å; P125-Q127 PolarHBondContact O-N 2.85Å; Q127-T130 WeakPolarHBondContact CA-OG1 3.46Å; Q127-T130 PolarHBondContact O-N 3.24Å; Q127-T130 PolarHBondContact O-OG1 2.76Å; Q127-L131 WeakPolarHBondContact O-CB 3.43Å; Q127-L131 PolarHBondContact O-N 3.14Å; Q127-F220 HydrophobicContact CG-CD2 3.95Å; Q127-F220 HydrophobicContact CG-CE2 4.37Å
128	D	58.8	Low	58.9	Low	52 Å²	52	81.4 Å²	81.4	28%	0.278	37%	0.372	S	S	.	.	H	α-helix	trans	-66.5	-43.1	-177.1	-62.7	-8.9	0	0	0	111.4	P125 K126 T130 L131 F132	P125-D128 WeakPolarHBondContact CD-OD2 3.41Å; P125-D128 WeakPolarHBondContact CG-OD2 3.24Å; P125-D128 PolarHBondContact O-N 2.88Å; K126-D128 PolarHBondContact O-N 2.89Å; D128-T130 VanDerWaalsContact C-N 3.34Å; D128-T130 PolarHBondContact O-N 2.88Å; D128-L131 WeakPolarHBondContact O-CB 3.29Å; D128-L131 PolarHBondContact O-N 3.31Å; D128-F132 HydrophobicContact CB-CE2 4.48Å; D128-F132 WeakPolarHBondContact O-CD2 3.36Å; D128-F132 PolarHBondContact O-N 3.42Å
129	R	64.7	Low	60.5	Low	138 Å²	138	75.4 Å²	75.4	52%	0.521	35%	0.345	S	S	.	.	H	α-helix	trans	-61.7	-44.1	177.2	-171.9	-176.1	177.6	-155.8	-1.8	111.4	Y82 K126 L131 L133	Y82-R129 HydrophobicContact CD2-CG 4.27Å; Y82-R129 HydrophobicContact CE2-CG 3.58Å; Y82-R129 PolarHBondContact OH-NE 3.43Å; Y82-R129 PolarHBondContact OH-NH2 3.47Å; K126-R129 PolarHBondContact O-N 2.94Å; R129-L131 VanDerWaalsContact C-N 3.32Å; R129-L133 HydrophobicContact CG-CD1 4.4Å; R129-L133 WeakPolarHBondContact O-CG 3.32Å; R129-L133 PolarHBondContact O-N 3.2Å
130	T	67.2	Low	62.5	Low	16 Å²	16	75 Å²	75	10%	0.098	35%	0.345	C	S	.	.	H	α-helix	trans	-68.5	-31.6	177.6	42.3	0	0	0	0	112.5	K126 Q127 D128 Y134 F220 E221	K126-T130 PolarHBondContact O-N 2.85Å; K126-T130 PolarHBondContact O-OG1 2.87Å; K126-T130 VanDerWaalsContact O-OG1 3.05Å; Q127-T130 WeakPolarHBondContact CA-OG1 3.46Å; Q127-T130 PolarHBondContact O-N 3.24Å; Q127-T130 PolarHBondContact O-OG1 2.76Å; D128-T130 VanDerWaalsContact C-N 3.34Å; D128-T130 PolarHBondContact O-N 2.88Å; T130-Y134 WeakPolarHBondContact O-CB 3.29Å; T130-Y134 PolarHBondContact O-N 3.39Å; T130-F220 VanDerWaalsContact OG1-CB 3.22Å; T130-F220 WeakPolarHBondContact OG1-CB 3.45Å; T130-E221 HydrophobicContact CG2-CB 4.28Å
131	L	63.4	Low	64.6	Low	30 Å²	30	66.9 Å²	66.9	16%	0.157	32%	0.315	C	S	.	.	H	α-helix	trans	-65.3	-48.7	173.4	171	64.5	0	0	0	111.9	Q127 D128 R129 L133 Y134 R135 Q432	Q127-L131 WeakPolarHBondContact O-CB 3.43Å; Q127-L131 PolarHBondContact O-N 3.14Å; D128-L131 WeakPolarHBondContact O-CB 3.29Å; D128-L131 PolarHBondContact O-N 3.31Å; R129-L131 VanDerWaalsContact C-N 3.32Å; L131-L133 VanDerWaalsContact C-N 3.3Å; L131-L133 PolarHBondContact O-N 3.38Å; L131-Y134 PolarHBondContact O-N 2.84Å; L131-R135 PolarHBondContact O-N 3Å; L131-Q432 HydrophobicContact CD1-CB 3.62Å; L131-Q432 HydrophobicContact CD1-CG 3.5Å; L131-Q432 HydrophobicContact CD2-CB 4.36Å; L131-Q432 HydrophobicContact CD2-CG 3.74Å; L131-Q432 HydrophobicContact CG-CG 4.18Å
132	F	67.7	Low	66.7	Low	51 Å²	51	58.8 Å²	58.8	22%	0.224	28%	0.281	C	S	.	.	H	α-helix	trans	-58.4	-42.5	176.4	-74.6	-63.2	0	0	0	111.9	A81 Y82 D128 R135 I136	A81-F132 HydrophobicContact CB-CD1 4.45Å; A81-F132 HydrophobicContact CB-CE1 3.87Å; A81-F132 HydrophobicContact CB-CZ 4.27Å; Y82-F132 HydrophobicContact CD2-CB 3.91Å; Y82-F132 HydrophobicContact CG-CB 4.49Å; D128-F132 HydrophobicContact CB-CE2 4.48Å; D128-F132 WeakPolarHBondContact O-CD2 3.36Å; D128-F132 PolarHBondContact O-N 3.42Å; F132-R135 PolarHBondContact O-N 2.85Å; F132-I136 VanDerWaalsContact O-CG1 3.29Å; F132-I136 WeakPolarHBondContact O-CG1 3.5Å; F132-I136 PolarHBondContact O-N 2.87Å
133	L	75.6	Confident	68.9	Low	48 Å²	48	52.3 Å²	52.3	25%	0.251	25%	0.252	S	S	.	.	H	α-helix	trans	-64.5	-42.8	176.6	-73.1	166.4	0	0	0	112.5	Y82 R129 L131 L137 L224	Y82-L133 HydrophobicContact CD2-CD2 4.41Å; Y82-L133 HydrophobicContact CD2-CG 4.2Å; Y82-L133 HydrophobicContact CE2-CD1 3.89Å; Y82-L133 HydrophobicContact CE2-CD2 3.77Å; Y82-L133 HydrophobicContact CE2-CG 3.59Å; R129-L133 HydrophobicContact CG-CD1 4.4Å; R129-L133 WeakPolarHBondContact O-CG 3.32Å; R129-L133 PolarHBondContact O-N 3.2Å; L131-L133 VanDerWaalsContact C-N 3.3Å; L131-L133 PolarHBondContact O-N 3.38Å; L133-L137 WeakPolarHBondContact O-CB 3.35Å; L133-L137 PolarHBondContact O-N 3.37Å; L133-L224 HydrophobicContact CB-CD1 4.1Å; L133-L224 HydrophobicContact CB-CD2 3.92Å; L133-L224 HydrophobicContact CD1-CD2 3.78Å; L133-L224 HydrophobicContact CG-CD2 4.47Å
134	Y	74.6	Confident	71.4	Confident	39 Å²	39	48.8 Å²	48.8	15%	0.153	24%	0.243	C	C	.	.	H	α-helix	trans	-61.9	-41.7	173.7	173	-105	0	0	0	112	T130 L131 L137 A138 L191 P195 I223	T130-Y134 WeakPolarHBondContact O-CB 3.29Å; T130-Y134 PolarHBondContact O-N 3.39Å; L131-Y134 PolarHBondContact O-N 2.84Å; Y134-L137 WeakPolarHBondContact O-CB 3.44Å; Y134-L137 PolarHBondContact O-N 2.94Å; Y134-A138 WeakPolarHBondContact O-CB 3.48Å; Y134-A138 PolarHBondContact O-N 3.33Å; Y134-L191 PolarHBondContact OH-O 2.71Å; Y134-P195 HydrophobicContact CE2-CB 4.18Å; Y134-P195 HydrophobicContact CE2-CG 3.7Å; Y134-I223 HydrophobicContact CD2-CG2 3.47Å; Y134-I223 VanDerWaalsContact CD2-CG2 3.47Å; Y134-I223 HydrophobicContact CE2-CG2 3.69Å; Y134-I223 HydrophobicContact CG-CG2 4.26Å
135	R	73.6	Confident	73.2	Confident	31 Å²	31	44.4 Å²	44.4	12%	0.117	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-48.7	177.7	-168.9	170.2	-179.3	173.4	4.9	111.4	T78 L131 F132 L137 A138 C139 F359 S366 V435	T78-R135 HydrophobicContact CG2-CG 4.03Å; L131-R135 PolarHBondContact O-N 3Å; F132-R135 PolarHBondContact O-N 2.85Å; R135-L137 VanDerWaalsContact C-N 3.28Å; R135-L137 PolarHBondContact O-N 2.76Å; R135-A138 PolarHBondContact O-N 3.16Å; R135-C139 PolarHBondContact O-N 3.24Å; R135-C139 PolarHBondContact O-SG 3.18Å; R135-F359 HydrophobicContact CG-CE2 4.27Å; R135-S366 PolarHBondContact NH2-OG 2.96Å; R135-V435 PolarHBondContact NH1-O 2.95Å
136	I	80.8	Confident	74.8	Confident	37 Å²	37	41 Å²	41	19%	0.19	20%	0.198	C	C	.	.	H	α-helix	trans	-54.8	-46.3	174.6	-69.1	163.6	0	0	0	110.5	L75 A79 F132 C139 T140	L75-I136 HydrophobicContact CD2-CG2 3.95Å; A79-I136 HydrophobicContact CB-CD1 4.4Å; F132-I136 VanDerWaalsContact O-CG1 3.29Å; F132-I136 WeakPolarHBondContact O-CG1 3.5Å; F132-I136 PolarHBondContact O-N 2.87Å; I136-C139 WeakPolarHBondContact O-CB 3.32Å; I136-C139 PolarHBondContact O-N 2.97Å; I136-T140 WeakPolarHBondContact O-CG2 3.49Å; I136-T140 PolarHBondContact O-N 3.31Å; I136-T140 PolarHBondContact O-OG1 2.99Å
137	L	82.9	Confident	76.3	Confident	34 Å²	34	37.9 Å²	37.9	18%	0.178	19%	0.187	C	C	.	.	H	α-helix	trans	-59.3	-48.2	177.4	-177.8	76.3	0	0	0	112	L133 Y134 R135 C139 T140 A141 F187 L191	L133-L137 WeakPolarHBondContact O-CB 3.35Å; L133-L137 PolarHBondContact O-N 3.37Å; Y134-L137 WeakPolarHBondContact O-CB 3.44Å; Y134-L137 PolarHBondContact O-N 2.94Å; R135-L137 VanDerWaalsContact C-N 3.28Å; R135-L137 PolarHBondContact O-N 2.76Å; L137-C139 PolarHBondContact O-N 3.38Å; L137-T140 WeakPolarHBondContact CA-OG1 3.26Å; L137-T140 PolarHBondContact O-N 3.02Å; L137-T140 VanDerWaalsContact O-N 3.16Å; L137-T140 PolarHBondContact O-OG1 2.99Å; L137-A141 PolarHBondContact O-N 3.16Å; L137-F187 HydrophobicContact CD1-CZ 4.13Å; L137-L191 HydrophobicContact CD2-CD1 4.44Å; L137-L191 HydrophobicContact CD2-CD2 3.83Å; L137-L191 HydrophobicContact CG-CD1 4.32Å
138	A	77.7	Confident	78.1	Confident	21 Å²	21	38.9 Å²	38.9	17%	0.174	19%	0.191	C	C	.	.	H	α-helix	trans	-59.9	-44.7	176.9	0	0	0	0	0	111.6	Y134 R135 T140 A141 S142	Y134-A138 WeakPolarHBondContact O-CB 3.48Å; Y134-A138 PolarHBondContact O-N 3.33Å; R135-A138 PolarHBondContact O-N 3.16Å; A138-T140 VanDerWaalsContact C-N 3.32Å; A138-T140 PolarHBondContact O-N 3.46Å; A138-A141 WeakPolarHBondContact O-CB 3.21Å; A138-A141 PolarHBondContact O-N 3.06Å; A138-S142 PolarHBondContact O-N 2.87Å; A138-S142 PolarHBondContact O-OG 3.26Å
139	C	79.6	Confident	79.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-57	-45.7	173.6	-50	0	0	0	0	111.8	I71 L75 R135 I136 L137 A141 S142 L143 F359	I71-C139 HydrophobicContact CG2-CB 4.29Å; L75-C139 HydrophobicContact CD1-CB 3.83Å; L75-C139 HydrophobicContact CD2-CB 3.68Å; L75-C139 HydrophobicContact CG-CB 3.39Å; R135-C139 PolarHBondContact O-N 3.24Å; R135-C139 PolarHBondContact O-SG 3.18Å; I136-C139 WeakPolarHBondContact O-CB 3.32Å; I136-C139 PolarHBondContact O-N 2.97Å; L137-C139 PolarHBondContact O-N 3.38Å; C139-A141 VanDerWaalsContact C-N 3.31Å; C139-A141 PolarHBondContact O-N 2.88Å; C139-S142 PolarHBondContact O-N 2.79Å; C139-L143 WeakPolarHBondContact O-CB 3.45Å; C139-L143 PolarHBondContact O-N 3.17Å; C139-F359 HydrophobicContact CB-CE1 4.47Å; C139-F359 HydrophobicContact CB-CE2 4.41Å; C139-F359 HydrophobicContact CB-CZ 4.13Å; C139-F359 WeakPolarHBondContact SG-CE2 3.37Å; C139-F359 WeakPolarHBondContact SG-CZ 3.49Å
140	T	85.6	Confident	80.1	Confident	48 Å²	48	30 Å²	30	29%	0.294	15%	0.154	S	C	.	.	H	α-helix	trans	-64.9	-35.8	179.5	55.5	0	0	0	0	111.7	L75 I136 L137 A138 L143 L144	L75-T140 HydrophobicContact CD1-CG2 4.37Å; L75-T140 HydrophobicContact CD2-CG2 4.06Å; I136-T140 WeakPolarHBondContact O-CG2 3.49Å; I136-T140 PolarHBondContact O-N 3.31Å; I136-T140 PolarHBondContact O-OG1 2.99Å; L137-T140 WeakPolarHBondContact CA-OG1 3.26Å; L137-T140 PolarHBondContact O-N 3.02Å; L137-T140 VanDerWaalsContact O-N 3.16Å; L137-T140 PolarHBondContact O-OG1 2.99Å; A138-T140 VanDerWaalsContact C-N 3.32Å; A138-T140 PolarHBondContact O-N 3.46Å; T140-L143 PolarHBondContact O-N 3.19Å; T140-L144 WeakPolarHBondContact O-CB 3.26Å; T140-L144 WeakPolarHBondContact O-CG 3.33Å; T140-L144 PolarHBondContact O-N 3.4Å
141	A	84.2	Confident	80.9	Confident	3 Å²	3	32.5 Å²	32.5	3%	0.025	17%	0.166	C	C	.	.	H	α-helix	trans	-64.2	-48.5	175.5	0	0	0	0	0	112	L137 A138 C139 L143 L144 V145 F187 L191	L137-A141 PolarHBondContact O-N 3.16Å; A138-A141 WeakPolarHBondContact O-CB 3.21Å; A138-A141 PolarHBondContact O-N 3.06Å; C139-A141 VanDerWaalsContact C-N 3.31Å; C139-A141 PolarHBondContact O-N 2.88Å; A141-L143 VanDerWaalsContact C-N 3.34Å; A141-L143 PolarHBondContact O-N 3.07Å; A141-L144 PolarHBondContact O-N 3.03Å; A141-V145 PolarHBondContact O-N 3.12Å; A141-F187 HydrophobicContact CB-CD1 3.73Å; A141-F187 HydrophobicContact CB-CE1 3.65Å; A141-L191 HydrophobicContact CB-CD1 3.47Å; A141-L191 VanDerWaalsContact CB-CD1 3.47Å
142	S	84.4	Confident	81.5	Confident	10 Å²	10	31.9 Å²	31.9	7%	0.07	16%	0.163	C	C	.	.	H	α-helix	trans	-62.2	-40.4	175.3	-60.6	0	0	0	0	112	A138 C139 V145 L146 F355	A138-S142 PolarHBondContact O-N 2.87Å; A138-S142 PolarHBondContact O-OG 3.26Å; C139-S142 PolarHBondContact O-N 2.79Å; S142-V145 PolarHBondContact O-N 3.37Å; S142-L146 WeakPolarHBondContact O-CG 3.19Å; S142-L146 PolarHBondContact O-N 3.4Å; S142-F355 PolarHBondContact OG-O 3.36Å
143	L	86.6	Confident	81.8	Confident	33 Å²	33	30.8 Å²	30.8	17%	0.173	16%	0.159	C	C	.	.	H	α-helix	trans	-64.1	-39.9	175.6	-172.9	63.4	0	0	0	112.3	V68 I71 L75 C139 T140 A141 L146 I147	V68-L143 HydrophobicContact CG2-CD1 4.48Å; I71-L143 HydrophobicContact CG2-CB 4.05Å; I71-L143 HydrophobicContact CG2-CD1 4.4Å; L75-L143 HydrophobicContact CD1-CD2 3.98Å; C139-L143 WeakPolarHBondContact O-CB 3.45Å; C139-L143 PolarHBondContact O-N 3.17Å; T140-L143 PolarHBondContact O-N 3.19Å; A141-L143 VanDerWaalsContact C-N 3.34Å; A141-L143 PolarHBondContact O-N 3.07Å; L143-L146 PolarHBondContact O-N 3.22Å; L143-I147 HydrophobicContact CD1-CD1 4.06Å; L143-I147 HydrophobicContact CD1-CG1 4.46Å; L143-I147 HydrophobicContact CD2-CD1 4.47Å; L143-I147 HydrophobicContact CG-CD1 3.85Å; L143-I147 WeakPolarHBondContact O-CG1 3.4Å; L143-I147 PolarHBondContact O-N 2.95Å
144	L	87.7	Confident	81.8	Confident	65 Å²	65	30.2 Å²	30.2	34%	0.34	16%	0.156	S	C	.	.	H	α-helix	trans	-63.7	-41.4	175.1	-75	169.9	0	0	0	111.5	T140 A141 I147 F148 T184	T140-L144 WeakPolarHBondContact O-CB 3.26Å; T140-L144 WeakPolarHBondContact O-CG 3.33Å; T140-L144 PolarHBondContact O-N 3.4Å; A141-L144 PolarHBondContact O-N 3.03Å; L144-I147 PolarHBondContact O-N 3.38Å; L144-F148 HydrophobicContact CB-CD2 4.48Å; L144-F148 HydrophobicContact CD2-CD2 3.81Å; L144-F148 HydrophobicContact CD2-CE2 3.56Å; L144-F148 WeakPolarHBondContact O-CB 3.27Å; L144-F148 WeakPolarHBondContact O-CD2 3.46Å; L144-F148 PolarHBondContact O-N 3.44Å; L144-T184 HydrophobicContact CB-CG2 3.83Å
145	V	85.3	Confident	81.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.1	-44	172.8	173.7	0	0	0	0	111	A141 S142 I147 S149 T150 T184 A188 F355	A141-V145 PolarHBondContact O-N 3.12Å; S142-V145 PolarHBondContact O-N 3.37Å; V145-I147 PolarHBondContact O-N 3.39Å; V145-S149 WeakPolarHBondContact O-CA 3.45Å; V145-S149 WeakPolarHBondContact O-CB 3.21Å; V145-S149 PolarHBondContact O-N 2.92Å; V145-T150 PolarHBondContact O-N 3.32Å; V145-T150 VanDerWaalsContact O-N 3.08Å; V145-T184 WeakPolarHBondContact CG2-O 3.46Å; V145-A188 HydrophobicContact CG2-CB 3.57Å; V145-F355 HydrophobicContact CB-CB 4.42Å; V145-F355 HydrophobicContact CG1-CB 3.93Å; V145-F355 HydrophobicContact CG1-CD2 3.91Å; V145-F355 HydrophobicContact CG1-CG 4.1Å; V145-F355 HydrophobicContact CG2-CB 4.5Å
146	L	85.8	Confident	81.3	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.181	C	C	.	.	I	π-helix	trans	-58.7	-46.5	176.3	-72.3	174.4	0	0	0	111.8	F63 F64 V68 I71 S142 L143 T150 L151 S356	F63-L146 HydrophobicContact CD1-CD2 4.3Å; F63-L146 HydrophobicContact CE1-CD2 4.22Å; F64-L146 HydrophobicContact CD2-CB 4.15Å; F64-L146 HydrophobicContact CD2-CD2 4.31Å; F64-L146 HydrophobicContact CE2-CB 4.21Å; V68-L146 HydrophobicContact CG2-CD1 4.19Å; I71-L146 HydrophobicContact CD1-CD1 3.68Å; S142-L146 WeakPolarHBondContact O-CG 3.19Å; S142-L146 PolarHBondContact O-N 3.4Å; L143-L146 PolarHBondContact O-N 3.22Å; L146-T150 WeakPolarHBondContact CA-OG1 3.03Å; L146-T150 HydrophobicContact CD2-CG2 4.15Å; L146-T150 PolarHBondContact O-N 2.91Å; L146-T150 PolarHBondContact O-OG1 2.91Å; L146-L151 PolarHBondContact O-N 3.41Å; L146-S356 WeakPolarHBondContact CG-OG 3.43Å
147	I	87.6	Confident	80.4	Confident	71 Å²	71	35.2 Å²	35.2	36%	0.364	19%	0.192	S	C	.	.	I	π-helix	trans	-75	-38.5	-175.7	-67.1	170.9	0	0	0	113.4	L143 L144 V145 P152	L143-I147 HydrophobicContact CD1-CD1 4.06Å; L143-I147 HydrophobicContact CD1-CG1 4.46Å; L143-I147 HydrophobicContact CD2-CD1 4.47Å; L143-I147 HydrophobicContact CG-CD1 3.85Å; L143-I147 WeakPolarHBondContact O-CG1 3.4Å; L143-I147 PolarHBondContact O-N 2.95Å; L144-I147 PolarHBondContact O-N 3.38Å; V145-I147 PolarHBondContact O-N 3.39Å; I147-P152 WeakPolarHBondContact O-CD 3.35Å
148	F	87.1	Confident	79.2	Confident	90 Å²	90	37.3 Å²	37.3	40%	0.395	21%	0.206	S	C	.	.	I	π-helix	trans	-105.7	-20	-172.3	-69.7	-70.8	0	0	0	114.8	L144 P152 A180 T184	L144-F148 HydrophobicContact CB-CD2 4.48Å; L144-F148 HydrophobicContact CD2-CD2 3.81Å; L144-F148 HydrophobicContact CD2-CE2 3.56Å; L144-F148 WeakPolarHBondContact O-CB 3.27Å; L144-F148 WeakPolarHBondContact O-CD2 3.46Å; L144-F148 PolarHBondContact O-N 3.44Å; F148-P152 WeakPolarHBondContact O-CG 3.34Å; F148-A180 HydrophobicContact CB-CB 4.02Å; F148-A180 HydrophobicContact CD1-CB 3.8Å; F148-A180 HydrophobicContact CG-CB 4.13Å; F148-T184 HydrophobicContact CB-CG2 3.93Å; F148-T184 HydrophobicContact CD2-CG2 4.09Å; F148-T184 HydrophobicContact CG-CG2 4.36Å
149	S	83.5	Confident	77.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.225	C	C	.	.	I	π-helix	trans	-101.8	-61.3	174.5	-170	0	0	0	0	110.5	V145 Q153 D181 H352	V145-S149 WeakPolarHBondContact O-CA 3.45Å; V145-S149 WeakPolarHBondContact O-CB 3.21Å; V145-S149 PolarHBondContact O-N 2.92Å; S149-Q153 VanDerWaalsContact O-CD 3.25Å; S149-Q153 VanDerWaalsContact O-CG 3.23Å; S149-Q153 WeakPolarHBondContact O-CG 3.07Å; S149-Q153 PolarHBondContact O-N 2.93Å; S149-Q153 PolarHBondContact O-NE2 2.91Å; S149-Q153 VanDerWaalsContact O-NE2 3.16Å; S149-Q153 PolarHBondContact OG-NE2 3.34Å; S149-D181 WeakPolarHBondContact CA-OD1 3.49Å; S149-D181 VanDerWaalsContact CB-OD1 3.22Å; S149-D181 WeakPolarHBondContact CB-OD1 3.3Å; S149-D181 PolarHBondContact OG-OD1 3.21Å; S149-H352 PolarHBondContact OG-CE1 2.94Å; S149-H352 PolarHBondContact OG-ND1 3.45Å
150	T	82.1	Confident	76.6	Confident	4 Å²	4	42.9 Å²	42.9	3%	0.025	24%	0.239	C	C	.	.	I	π-helix	trans	-75.1	-36.8	-169.8	77.1	0	0	0	0	113.7	F64 V145 L146 L154 H352	F64-T150 WeakPolarHBondContact CD2-OG1 3.37Å; V145-T150 PolarHBondContact O-N 3.32Å; V145-T150 VanDerWaalsContact O-N 3.08Å; L146-T150 WeakPolarHBondContact CA-OG1 3.03Å; L146-T150 HydrophobicContact CD2-CG2 4.15Å; L146-T150 PolarHBondContact O-N 2.91Å; L146-T150 PolarHBondContact O-OG1 2.91Å; T150-L154 VanDerWaalsContact O-CB 3.32Å; T150-L154 WeakPolarHBondContact O-CB 3.44Å; T150-L154 PolarHBondContact O-N 3.24Å; T150-H352 HydrophobicContact CG2-CB 4.18Å
151	L	82.8	Confident	74.9	Confident	68 Å²	68	45.5 Å²	45.5	36%	0.356	26%	0.257	S	S	.	.	H	α-helix	trans	-67.9	-47.1	-179.9	177.6	160.7	0	0	0	112.6	F64 L146 Q153 L154 V155	F64-L151 HydrophobicContact CE2-CB 4Å; F64-L151 HydrophobicContact CE2-CD1 4.21Å; F64-L151 HydrophobicContact CZ-CB 4.38Å; F64-L151 HydrophobicContact CZ-CD1 3.8Å; L146-L151 PolarHBondContact O-N 3.41Å; L151-Q153 VanDerWaalsContact C-N 3.32Å; L151-Q153 PolarHBondContact O-N 3.41Å; L151-L154 PolarHBondContact O-N 3.02Å; L151-V155 HydrophobicContact CD2-CG2 4.09Å; L151-V155 WeakPolarHBondContact O-CG2 3.35Å; L151-V155 PolarHBondContact O-N 2.84Å
152	P	77	Confident	73.6	Confident	16 Å²	16	52.9 Å²	52.9	10%	0.104	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-39.3	175.5	-28.3	38.6	0	0	0	112.6	I147 F148 V155 I156 F177	I147-P152 WeakPolarHBondContact O-CD 3.35Å; F148-P152 WeakPolarHBondContact O-CG 3.34Å; P152-V155 PolarHBondContact O-N 3.09Å; P152-I156 WeakPolarHBondContact O-CB 3.31Å; P152-I156 WeakPolarHBondContact O-CD1 3.18Å; P152-I156 WeakPolarHBondContact O-CG1 3.37Å; P152-I156 PolarHBondContact O-N 3.17Å; P152-F177 HydrophobicContact CB-CD1 4.01Å; P152-F177 HydrophobicContact CB-CE1 4.41Å; P152-F177 HydrophobicContact CG-CD1 4.07Å; P152-F177 HydrophobicContact CG-CE1 4.35Å
153	Q	73.8	Confident	72.5	Confident	28 Å²	28	57 Å²	57	13%	0.131	31%	0.312	C	S	.	.	H	α-helix	trans	-62.5	-44.7	173.9	-69.3	166.1	31.6	0	0	111.5	S149 L151 V155 I156 V157 D181 Y348 H352	S149-Q153 VanDerWaalsContact O-CD 3.25Å; S149-Q153 VanDerWaalsContact O-CG 3.23Å; S149-Q153 WeakPolarHBondContact O-CG 3.07Å; S149-Q153 PolarHBondContact O-N 2.93Å; S149-Q153 PolarHBondContact O-NE2 2.91Å; S149-Q153 VanDerWaalsContact O-NE2 3.16Å; S149-Q153 PolarHBondContact OG-NE2 3.34Å; L151-Q153 VanDerWaalsContact C-N 3.32Å; L151-Q153 PolarHBondContact O-N 3.41Å; Q153-V155 PolarHBondContact O-N 3.39Å; Q153-I156 PolarHBondContact O-N 2.85Å; Q153-V157 VanDerWaalsContact O-CB 3.24Å; Q153-V157 WeakPolarHBondContact O-CB 3.1Å; Q153-V157 VanDerWaalsContact O-CG2 3.23Å; Q153-V157 WeakPolarHBondContact O-CG2 3.46Å; Q153-V157 PolarHBondContact O-N 3.44Å; Q153-D181 PolarHBondContact NE2-OD1 3.38Å; Q153-Y348 PolarHBondContact NE2-OH 3.17Å; Q153-H352 PolarHBondContact NE2-CE1 3.3Å; Q153-H352 PolarHBondContact NE2-NE2 3.06Å; Q153-H352 VanDerWaalsContact NE2-NE2 3.19Å; Q153-H352 PolarHBondContact OE1-CD2 3.31Å; Q153-H352 VanDerWaalsContact OE1-CD2 3.26Å; Q153-H352 PolarHBondContact OE1-NE2 2.66Å
154	L	74.8	Confident	71.3	Confident	36 Å²	36	60.2 Å²	60.2	19%	0.188	33%	0.332	C	S	.	.	H	α-helix	trans	-59.8	-47.2	174.7	-167.1	73.7	0	0	0	110.9	T57 L60 T150 L151 I156 V158	T57-L154 HydrophobicContact CG2-CD1 4.44Å; L60-L154 HydrophobicContact CB-CD1 4.19Å; T150-L154 VanDerWaalsContact O-CB 3.32Å; T150-L154 WeakPolarHBondContact O-CB 3.44Å; T150-L154 PolarHBondContact O-N 3.24Å; L151-L154 PolarHBondContact O-N 3.02Å; L154-I156 PolarHBondContact O-N 2.84Å; L154-V158 HydrophobicContact CD1-CG2 3.71Å; L154-V158 HydrophobicContact CG-CG2 4.05Å; L154-V158 WeakPolarHBondContact O-CB 3.42Å; L154-V158 WeakPolarHBondContact O-CG2 3.49Å; L154-V158 PolarHBondContact O-N 2.91Å
155	V	71.9	Confident	70.2	Confident	66 Å²	66	60.7 Å²	60.7	40%	0.4	34%	0.335	S	S	.	.	H	α-helix	trans	-62.9	-42.2	178.5	172.6	0	0	0	0	112	L151 P152 Q153 A159	L151-V155 HydrophobicContact CD2-CG2 4.09Å; L151-V155 WeakPolarHBondContact O-CG2 3.35Å; L151-V155 PolarHBondContact O-N 2.84Å; P152-V155 PolarHBondContact O-N 3.09Å; Q153-V155 PolarHBondContact O-N 3.39Å; V155-A159 HydrophobicContact CG1-CB 4.45Å; V155-A159 VanDerWaalsContact O-CB 3.23Å; V155-A159 WeakPolarHBondContact O-CB 3.23Å; V155-A159 PolarHBondContact O-N 3.43Å
156	I	66.6	Low	69.5	Low	77 Å²	77	61.1 Å²	61.1	40%	0.395	34%	0.338	S	S	.	.	H	α-helix	trans	-73.1	-40.6	-177.9	-67.9	165.7	0	0	0	111.6	P152 Q153 L154 D168	P152-I156 WeakPolarHBondContact O-CB 3.31Å; P152-I156 WeakPolarHBondContact O-CD1 3.18Å; P152-I156 WeakPolarHBondContact O-CG1 3.37Å; P152-I156 PolarHBondContact O-N 3.17Å; Q153-I156 PolarHBondContact O-N 2.85Å; L154-I156 PolarHBondContact O-N 2.84Å; I156-D168 HydrophobicContact CD1-CB 4.15Å; I156-D168 HydrophobicContact CG1-CB 4.4Å
157	V	61.7	Low	69	Low	70 Å²	70	65.3 Å²	65.3	42%	0.424	36%	0.36	S	S	.	.	H	α-helix	trans	-77.3	-31.8	-178.8	174.8	0	0	0	0	112.3	R53 Q153	R53-V157 HydrophobicContact CG-CG1 3.97Å; Q153-V157 VanDerWaalsContact O-CB 3.24Å; Q153-V157 WeakPolarHBondContact O-CB 3.1Å; Q153-V157 VanDerWaalsContact O-CG2 3.23Å; Q153-V157 WeakPolarHBondContact O-CG2 3.46Å; Q153-V157 PolarHBondContact O-N 3.44Å
158	V	57.6	Low	68.3	Low	77 Å²	77	63.5 Å²	63.5	47%	0.467	35%	0.351	S	S	.	.	H	α-helix	trans	-100.5	-43.3	-171.5	-174.1	0	0	0	0	113.4	T57 L154	T57-V158 HydrophobicContact CG2-CB 4.33Å; T57-V158 HydrophobicContact CG2-CG1 4.04Å; T57-V158 HydrophobicContact CG2-CG2 3.3Å; T57-V158 WeakPolarHBondContact OG1-CG2 3.28Å; L154-V158 HydrophobicContact CD1-CG2 3.71Å; L154-V158 HydrophobicContact CG-CG2 4.05Å; L154-V158 WeakPolarHBondContact O-CB 3.42Å; L154-V158 WeakPolarHBondContact O-CG2 3.49Å; L154-V158 PolarHBondContact O-N 2.91Å
159	A	50.7	Low	67.7	Low	70 Å²	70	62.8 Å²	62.8	58%	0.579	35%	0.348	S	S	*	.	S	Bend	trans	-93.8	-1.5	-161.9	0	0	0	0	0	115.1	V155	V155-A159 HydrophobicContact CG1-CB 4.45Å; V155-A159 VanDerWaalsContact O-CB 3.23Å; V155-A159 WeakPolarHBondContact O-CB 3.23Å; V155-A159 PolarHBondContact O-N 3.43Å
160	K	52.6	Low	67.6	Low	68 Å²	68	68.1 Å²	68.1	30%	0.296	37%	0.367	S	S	.	.			trans	-133.9	112.1	-169.8	-82.9	176.2	-179.4	154.7	0	114	D168	K160-D168 IonicContact NZ-OD1 3.53Å; K160-D168 PolarHBondContact NZ-OD1 3.43Å
161	P	50	Low	67.6	Low	104 Å²	104	72.6 Å²	72.6	68%	0.675	38%	0.384	S	S	*	.	S	Bend	trans	-51.2	148.4	136.4	26.8	-35.6	0	0	0	109.2	I163	P161-I163 PolarHBondContact O-N 2.89Å
162	Q	56	Low	67.5	Low	158 Å²	158	71 Å²	71	74%	0.738	39%	0.385	S	S	*	.			trans	-68.9	72.3	-172.7	-69.3	-177.8	-24.9	0	0	113.3
163	I	61.3	Low	67.9	Low	96 Å²	96	77 Å²	77	49%	0.492	41%	0.405	S	S	.	.			trans	-62.1	136.4	171.8	-60.8	166	0	0	0	108.3	P161 S166 K169	P161-I163 PolarHBondContact O-N 2.89Å; I163-S166 PolarHBondContact O-OG 3.26Å; I163-K169 PolarHBondContact O-NZ 3.13Å
164	V	61.3	Low	68.3	Low	100 Å²	100	76 Å²	76	61%	0.606	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-38.2	-174.4	-176.8	0	0	0	0	111.2	S166 K169	V164-S166 PolarHBondContact O-N 3.19Å; V164-K169 WeakPolarHBondContact O-CD 3.46Å
165	D	64.9	Low	68.8	Low	75 Å²	75	75.8 Å²	75.8	40%	0.401	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	24.8	-175.9	-58.2	-48	0	0	0	115	R170	D165-R170 PolarHBondContact O-NE 3.36Å
166	S	71	Confident	69.5	Low	9 Å²	9	74.9 Å²	74.9	6%	0.063	40%	0.398	C	S	.	.			trans	-60.4	139.7	-177.4	64.4	0	0	0	0	112	I163 V164 D168 K169	I163-S166 PolarHBondContact O-OG 3.26Å; V164-S166 PolarHBondContact O-N 3.19Å; S166-D168 VanDerWaalsContact CB-OD1 3.22Å; S166-D168 WeakPolarHBondContact CB-OD1 3.14Å; S166-D168 WeakPolarHBondContact CB-OD2 3.33Å; S166-D168 PolarHBondContact O-N 3.43Å; S166-D168 VanDerWaalsContact OG-CG 3.29Å; S166-D168 PolarHBondContact OG-OD1 3.46Å; S166-D168 PolarHBondContact OG-OD2 2.92Å; S166-K169 PolarHBondContact O-N 3.14Å; S166-K169 VanDerWaalsContact OG-CD 3.32Å; S166-K169 WeakPolarHBondContact OG-CD 3.47Å; S166-K169 WeakPolarHBondContact OG-CG 3.33Å
167	I	75.8	Confident	70.4	Confident	88 Å²	88	74.4 Å²	74.4	45%	0.451	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-56	-38.7	-173.4	-61.9	173.1	0	0	0	111.8	K169 R170 W173	I167-K169 PolarHBondContact O-N 3.32Å; I167-R170 WeakPolarHBondContact O-CB 3.49Å; I167-R170 PolarHBondContact O-N 3.01Å; I167-W173 HydrophobicContact CG2-CB 4.21Å; I167-W173 HydrophobicContact CG2-CD2 4Å; I167-W173 HydrophobicContact CG2-CG 3.81Å; I167-W173 VanDerWaalsContact O-CB 3.27Å; I167-W173 WeakPolarHBondContact O-CB 3.49Å
168	D	71.5	Confident	71.5	Confident	33 Å²	33	72.5 Å²	72.5	18%	0.176	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-53.7	-27.1	172.5	40.4	-75	0	0	0	114.8	I156 K160 S166 C174	I156-D168 HydrophobicContact CD1-CB 4.15Å; I156-D168 HydrophobicContact CG1-CB 4.4Å; K160-D168 IonicContact NZ-OD1 3.53Å; K160-D168 PolarHBondContact NZ-OD1 3.43Å; S166-D168 VanDerWaalsContact CB-OD1 3.22Å; S166-D168 WeakPolarHBondContact CB-OD1 3.14Å; S166-D168 WeakPolarHBondContact CB-OD2 3.33Å; S166-D168 PolarHBondContact O-N 3.43Å; S166-D168 VanDerWaalsContact OG-CG 3.29Å; S166-D168 PolarHBondContact OG-OD1 3.46Å; S166-D168 PolarHBondContact OG-OD2 2.92Å; D168-C174 WeakPolarHBondContact O-CA 3.41Å; D168-C174 VanDerWaalsContact O-CB 3.3Å; D168-C174 WeakPolarHBondContact O-CB 3.05Å
169	K	75.2	Confident	73	Confident	76 Å²	76	71.9 Å²	71.9	33%	0.33	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-92.8	-11.6	175.9	-65.4	173.1	-174.8	166.7	0	113.9	I163 V164 S166 I167 L257 C258	I163-K169 PolarHBondContact O-NZ 3.13Å; V164-K169 WeakPolarHBondContact O-CD 3.46Å; S166-K169 PolarHBondContact O-N 3.14Å; S166-K169 VanDerWaalsContact OG-CD 3.32Å; S166-K169 WeakPolarHBondContact OG-CD 3.47Å; S166-K169 WeakPolarHBondContact OG-CG 3.33Å; I167-K169 PolarHBondContact O-N 3.32Å; K169-L257 HydrophobicContact CB-CD2 3.89Å; K169-L257 CarbonylContact O-C 3.47Å; K169-L257 VanDerWaalsContact O-CA 3.27Å; K169-L257 WeakPolarHBondContact O-CA 3.42Å; K169-C258 PolarHBondContact O-N 3.48Å
170	R	81.1	Confident	74.8	Confident	111 Å²	111	69.6 Å²	69.6	42%	0.419	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-72.1	141.1	-176.9	-64.2	-176.7	-178.7	-158.9	-3.3	110.8	D165 I167 G172 W173 C174 C258	D165-R170 PolarHBondContact O-NE 3.36Å; I167-R170 WeakPolarHBondContact O-CB 3.49Å; I167-R170 PolarHBondContact O-N 3.01Å; R170-G172 PolarHBondContact O-N 3.32Å; R170-W173 PolarHBondContact O-N 3.46Å; R170-W173 VanDerWaalsContact O-N 3.12Å; R170-C174 PolarHBondContact O-N 2.91Å; R170-C258 PolarHBondContact O-SG 3.18Å
171	W	81.3	Confident	76.4	Confident	98 Å²	98	67.3 Å²	67.3	37%	0.371	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	135.7	175.9	-170.5	-101.8	0	0	0	111.6	W173 H175 E247 R248 C256	W171-W173 VanDerWaalsContact C-N 3.28Å; W171-W173 PolarHBondContact O-N 3.01Å; W171-H175 AromaticContact CE3-NE2 3.97Å; W171-H175 AromaticContact CH2-NE2 3.38Å; W171-H175 WeakPolarHBondContact CH2-NE2 3.46Å; W171-H175 AromaticContact CZ2-NE2 3.74Å; W171-H175 AromaticContact CZ3-NE2 3.5Å; W171-E247 VanDerWaalsContact CZ3-C 3.48Å; W171-E247 WeakPolarHBondContact CZ3-O 3.5Å; W171-R248 HydrophobicContact CD2-CB 4.07Å; W171-R248 HydrophobicContact CD2-CG 3.87Å; W171-R248 HydrophobicContact CE3-CB 3.81Å; W171-R248 HydrophobicContact CE3-CG 3.97Å; W171-R248 HydrophobicContact CG-CG 4.31Å; W171-R248 HydrophobicContact CH2-CB 3.83Å; W171-R248 HydrophobicContact CZ2-CB 4.07Å; W171-R248 HydrophobicContact CZ3-CB 3.69Å; W171-R248 HydrophobicContact CZ3-CG 4.37Å; W171-C256 HydrophobicContact CB-CB 4.07Å; W171-C256 WeakPolarHBondContact CB-O 3.43Å; W171-C256 PolarHBondContact N-O 3.41Å
172	G	82.6	Confident	78.1	Confident	36 Å²	36	62.4 Å²	62.4	37%	0.371	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	-48.5	-173.1	0	0	0	0	0	114.3	R170 H175 A176	R170-G172 PolarHBondContact O-N 3.32Å; G172-H175 PolarHBondContact O-N 2.75Å; G172-A176 WeakPolarHBondContact O-CB 3.42Å; G172-A176 PolarHBondContact O-N 3.27Å
173	W	84.1	Confident	79.8	Confident	142 Å²	142	55.7 Å²	55.7	54%	0.538	28%	0.282	S	S	.	.	H	α-helix	trans	-67.3	-40	-179.9	-77.4	103.9	0	0	0	112.7	I167 R170 W171 H175 A176 F177	I167-W173 HydrophobicContact CG2-CB 4.21Å; I167-W173 HydrophobicContact CG2-CD2 4Å; I167-W173 HydrophobicContact CG2-CG 3.81Å; I167-W173 VanDerWaalsContact O-CB 3.27Å; I167-W173 WeakPolarHBondContact O-CB 3.49Å; R170-W173 PolarHBondContact O-N 3.46Å; R170-W173 VanDerWaalsContact O-N 3.12Å; W171-W173 VanDerWaalsContact C-N 3.28Å; W171-W173 PolarHBondContact O-N 3.01Å; W173-H175 VanDerWaalsContact C-N 3.33Å; W173-H175 PolarHBondContact O-N 3.07Å; W173-A176 PolarHBondContact O-N 3.45Å; W173-F177 HydrophobicContact CB-CD2 4.48Å; W173-F177 HydrophobicContact CB-CE2 4.24Å; W173-F177 AromaticContact CE3-CE2 3.92Å; W173-F177 HydrophobicContact CE3-CE2 3.92Å; W173-F177 HydrophobicContact CE3-CZ 4Å; W173-F177 HydrophobicContact CZ3-CZ 4.44Å; W173-F177 WeakPolarHBondContact O-CD2 3.44Å; W173-F177 PolarHBondContact O-N 3.12Å
174	C	82.3	Confident	81.1	Confident	6 Å²	6	51.6 Å²	51.6	4%	0.041	26%	0.261	C	S	.	.	H	α-helix	trans	-56.2	-46.5	174.1	68.2	0	0	0	0	111.9	D168 R170 V178 Y246 C258	D168-C174 WeakPolarHBondContact O-CA 3.41Å; D168-C174 VanDerWaalsContact O-CB 3.3Å; D168-C174 WeakPolarHBondContact O-CB 3.05Å; R170-C174 PolarHBondContact O-N 2.91Å; C174-V178 WeakPolarHBondContact O-CG2 3.47Å; C174-V178 PolarHBondContact O-N 2.95Å; C174-V178 VanDerWaalsContact O-N 3.15Å; C174-Y246 HydrophobicContact CB-CE2 4.48Å; C174-C258 HydrophobicContact CB-CB 3.74Å; C174-C258 WeakPolarHBondContact CB-SG 3.41Å; C174-C258 WeakPolarHBondContact SG-CB 3.14Å; C174-C258 CovalentContact SG-SG 2.01Å; C174-C258 PolarHBondContact SG-SG 2.84Å
175	H	85.7	Confident	82.4	Confident	31 Å²	31	47 Å²	47	14%	0.144	23%	0.233	C	C	.	.	H	α-helix	trans	-63.9	-44.4	176.6	-62.6	-88.3	0	0	0	110.7	W171 G172 W173 F177 V178 Y179 V242 Y246	W171-H175 AromaticContact CE3-NE2 3.97Å; W171-H175 AromaticContact CH2-NE2 3.38Å; W171-H175 WeakPolarHBondContact CH2-NE2 3.46Å; W171-H175 AromaticContact CZ2-NE2 3.74Å; W171-H175 AromaticContact CZ3-NE2 3.5Å; G172-H175 PolarHBondContact O-N 2.75Å; W173-H175 VanDerWaalsContact C-N 3.33Å; W173-H175 PolarHBondContact O-N 3.07Å; H175-F177 PolarHBondContact O-N 3.12Å; H175-V178 PolarHBondContact O-N 3.4Å; H175-Y179 WeakPolarHBondContact O-CB 3.45Å; H175-Y179 PolarHBondContact O-N 3.48Å; H175-V242 HydrophobicContact CB-CG1 3.67Å; H175-V242 PolarHBondContact CE1-O 2.82Å; H175-V242 WeakPolarHBondContact ND1-CG1 3.43Å; H175-V242 PolarHBondContact ND1-O 3.04Å; H175-Y246 AromaticContact CE1-CD2 3.77Å; H175-Y246 AromaticContact ND1-CD2 3.71Å
176	A	86.9	Confident	83.5	Confident	47 Å²	47	43.4 Å²	43.4	39%	0.388	21%	0.214	S	C	.	.	H	α-helix	trans	-61	-43.9	-179.1	0	0	0	0	0	112.4	G172 W173 A180	G172-A176 WeakPolarHBondContact O-CB 3.42Å; G172-A176 PolarHBondContact O-N 3.27Å; W173-A176 PolarHBondContact O-N 3.45Å; A176-A180 WeakPolarHBondContact O-CB 3.44Å; A176-A180 PolarHBondContact O-N 2.86Å
177	F	85.7	Confident	84.4	Confident	68 Å²	68	44 Å²	44	30%	0.298	22%	0.215	S	C	.	.	H	α-helix	trans	-66.6	-49.6	177.7	-72.1	-59.9	0	0	0	112.2	P152 W173 H175 Y179 A180 D181	P152-F177 HydrophobicContact CB-CD1 4.01Å; P152-F177 HydrophobicContact CB-CE1 4.41Å; P152-F177 HydrophobicContact CG-CD1 4.07Å; P152-F177 HydrophobicContact CG-CE1 4.35Å; W173-F177 HydrophobicContact CB-CD2 4.48Å; W173-F177 HydrophobicContact CB-CE2 4.24Å; W173-F177 AromaticContact CE3-CE2 3.92Å; W173-F177 HydrophobicContact CE3-CE2 3.92Å; W173-F177 HydrophobicContact CE3-CZ 4Å; W173-F177 HydrophobicContact CZ3-CZ 4.44Å; W173-F177 WeakPolarHBondContact O-CD2 3.44Å; W173-F177 PolarHBondContact O-N 3.12Å; H175-F177 PolarHBondContact O-N 3.12Å; F177-Y179 PolarHBondContact O-N 3.01Å; F177-A180 PolarHBondContact O-N 3.18Å; F177-D181 VanDerWaalsContact O-CB 3.31Å; F177-D181 WeakPolarHBondContact O-CB 3.5Å; F177-D181 PolarHBondContact O-N 2.79Å
178	V	84	Confident	84.9	Confident	29 Å²	29	40.1 Å²	40.1	18%	0.176	20%	0.196	C	C	.	.	H	α-helix	trans	-67.1	-37.7	-179.4	176.6	0	0	0	0	111.9	C174 H175 H182 V242 Y246 F268	C174-V178 WeakPolarHBondContact O-CG2 3.47Å; C174-V178 PolarHBondContact O-N 2.95Å; C174-V178 VanDerWaalsContact O-N 3.15Å; H175-V178 PolarHBondContact O-N 3.4Å; V178-H182 WeakPolarHBondContact O-CB 3.32Å; V178-H182 PolarHBondContact O-N 2.89Å; V178-V242 HydrophobicContact CG1-CG2 4.27Å; V178-Y246 HydrophobicContact CG2-CE2 4.48Å; V178-Y246 WeakPolarHBondContact CG2-OH 3.3Å; V178-F268 HydrophobicContact CG1-CD2 4.49Å; V178-F268 HydrophobicContact CG1-CE2 3.63Å; V178-F268 HydrophobicContact CG1-CZ 3.93Å
179	Y	89.6	Confident	85.6	Confident	65 Å²	65	38.6 Å²	38.6	26%	0.255	19%	0.188	S	C	.	.	H	α-helix	trans	-64.1	-50	174.3	-179.9	-102.8	0	0	0	111.5	H175 F177 D181 H182 V183 L235 P238 I239 V242	H175-Y179 WeakPolarHBondContact O-CB 3.45Å; H175-Y179 PolarHBondContact O-N 3.48Å; F177-Y179 PolarHBondContact O-N 3.01Å; Y179-D181 VanDerWaalsContact C-N 3.34Å; Y179-D181 PolarHBondContact O-N 2.92Å; Y179-H182 PolarHBondContact O-N 2.95Å; Y179-V183 HydrophobicContact CD1-CG2 3.99Å; Y179-V183 HydrophobicContact CD2-CG2 4Å; Y179-V183 HydrophobicContact CE1-CG2 3.68Å; Y179-V183 HydrophobicContact CE2-CG2 3.67Å; Y179-V183 HydrophobicContact CG-CG2 4.14Å; Y179-V183 WeakPolarHBondContact O-CB 3.47Å; Y179-V183 WeakPolarHBondContact O-CG2 3.33Å; Y179-V183 PolarHBondContact O-N 3.09Å; Y179-L235 PolarHBondContact OH-O 3.42Å; Y179-P238 HydrophobicContact CD2-CB 3.79Å; Y179-P238 HydrophobicContact CE2-CB 3.94Å; Y179-I239 HydrophobicContact CE2-CG1 3.69Å; Y179-V242 HydrophobicContact CD2-CG2 4.44Å
180	A	88.7	Confident	86.3	Confident	21 Å²	21	35.7 Å²	35.7	17%	0.174	18%	0.175	C	C	.	.	H	α-helix	trans	-63	-40.1	-179.6	0	0	0	0	0	112.2	F148 A176 F177 T184	F148-A180 HydrophobicContact CB-CB 4.02Å; F148-A180 HydrophobicContact CD1-CB 3.8Å; F148-A180 HydrophobicContact CG-CB 4.13Å; A176-A180 WeakPolarHBondContact O-CB 3.44Å; A176-A180 PolarHBondContact O-N 2.86Å; F177-A180 PolarHBondContact O-N 3.18Å; A180-T184 WeakPolarHBondContact O-CB 3.42Å; A180-T184 VanDerWaalsContact O-CG2 3.31Å; A180-T184 WeakPolarHBondContact O-CG2 3.48Å; A180-T184 PolarHBondContact O-N 3.33Å; A180-T184 PolarHBondContact O-OG1 3.09Å
181	D	85.8	Confident	86.5	Confident	20 Å²	20	30.9 Å²	30.9	11%	0.107	16%	0.157	C	C	.	.	H	α-helix	trans	-58.4	-53.5	172.2	172.1	73.4	0	0	0	111.7	S149 Q153 F177 Y179 T184 R185	S149-D181 WeakPolarHBondContact CA-OD1 3.49Å; S149-D181 VanDerWaalsContact CB-OD1 3.22Å; S149-D181 WeakPolarHBondContact CB-OD1 3.3Å; S149-D181 PolarHBondContact OG-OD1 3.21Å; Q153-D181 PolarHBondContact NE2-OD1 3.38Å; F177-D181 VanDerWaalsContact O-CB 3.31Å; F177-D181 WeakPolarHBondContact O-CB 3.5Å; F177-D181 PolarHBondContact O-N 2.79Å; Y179-D181 VanDerWaalsContact C-N 3.34Å; Y179-D181 PolarHBondContact O-N 2.92Å; D181-T184 PolarHBondContact O-N 3.1Å; D181-T184 PolarHBondContact O-OG1 3.14Å; D181-R185 VanDerWaalsContact CG-NE 3.33Å; D181-R185 WeakPolarHBondContact O-CB 3.47Å; D181-R185 VanDerWaalsContact O-CG 3.32Å; D181-R185 WeakPolarHBondContact O-CG 3.31Å; D181-R185 PolarHBondContact O-N 2.71Å; D181-R185 IonicContact OD1-NE 2.69Å; D181-R185 PolarHBondContact OD1-NE 3.16Å; D181-R185 IonicContact OD2-CZ 3.96Å; D181-R185 IonicContact OD2-NE 3.13Å; D181-R185 PolarHBondContact OD2-NE 3.05Å; D181-R185 IonicContact OD2-NH2 3.06Å; D181-R185 PolarHBondContact OD2-NH2 2.86Å
182	H	86.5	Confident	86.5	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-68.2	-38.9	-178.3	-168.8	-42	0	0	0	112.6	V178 Y179 C186 P238 D272 T276	V178-H182 WeakPolarHBondContact O-CB 3.32Å; V178-H182 PolarHBondContact O-N 2.89Å; Y179-H182 PolarHBondContact O-N 2.95Å; H182-C186 WeakPolarHBondContact O-CB 3.43Å; H182-C186 PolarHBondContact O-N 2.88Å; H182-P238 HydrophobicContact CB-CB 4.24Å; H182-P238 HydrophobicContact CB-CG 4.3Å; H182-D272 IonicContact CD2-OD1 3.73Å; H182-D272 IonicContact NE2-OD1 3.38Å; H182-T276 VanDerWaalsContact CE1-CG2 3.46Å; H182-T276 WeakPolarHBondContact CE1-CG2 3.42Å
183	V	91	Very high	86.6	Confident	18 Å²	18	25.7 Å²	25.7	11%	0.109	13%	0.128	C	C	.	.	H	α-helix	trans	-59.9	-49.4	175.9	169.3	0	0	0	0	110.1	Y179 C186 F187 S234 L235 P238	Y179-V183 HydrophobicContact CD1-CG2 3.99Å; Y179-V183 HydrophobicContact CD2-CG2 4Å; Y179-V183 HydrophobicContact CE1-CG2 3.68Å; Y179-V183 HydrophobicContact CE2-CG2 3.67Å; Y179-V183 HydrophobicContact CG-CG2 4.14Å; Y179-V183 WeakPolarHBondContact O-CB 3.47Å; Y179-V183 WeakPolarHBondContact O-CG2 3.33Å; Y179-V183 PolarHBondContact O-N 3.09Å; V183-C186 PolarHBondContact O-N 3.08Å; V183-F187 VanDerWaalsContact O-CB 3.26Å; V183-F187 WeakPolarHBondContact O-CB 3.33Å; V183-F187 PolarHBondContact O-N 3.37Å; V183-S234 WeakPolarHBondContact CG2-O 3.44Å; V183-L235 HydrophobicContact CG1-CD2 3.78Å; V183-L235 HydrophobicContact CG1-CG 4.35Å; V183-L235 HydrophobicContact CG2-CD2 4.41Å; V183-P238 HydrophobicContact CG2-CB 4.41Å; V183-P238 HydrophobicContact CG2-CG 3.9Å
184	T	89.2	Confident	86.8	Confident	10 Å²	10	20.8 Å²	20.8	6%	0.061	11%	0.112	C	C	.	.	H	α-helix	trans	-70.8	-41.6	-175.3	54.6	0	0	0	0	112.7	L144 V145 F148 A180 D181 F187 A188	L144-T184 HydrophobicContact CB-CG2 3.83Å; V145-T184 WeakPolarHBondContact CG2-O 3.46Å; F148-T184 HydrophobicContact CB-CG2 3.93Å; F148-T184 HydrophobicContact CD2-CG2 4.09Å; F148-T184 HydrophobicContact CG-CG2 4.36Å; A180-T184 WeakPolarHBondContact O-CB 3.42Å; A180-T184 VanDerWaalsContact O-CG2 3.31Å; A180-T184 WeakPolarHBondContact O-CG2 3.48Å; A180-T184 PolarHBondContact O-N 3.33Å; A180-T184 PolarHBondContact O-OG1 3.09Å; D181-T184 PolarHBondContact O-N 3.1Å; D181-T184 PolarHBondContact O-OG1 3.14Å; T184-F187 PolarHBondContact O-N 2.86Å; T184-A188 WeakPolarHBondContact O-CB 3.22Å; T184-A188 PolarHBondContact O-N 3.05Å
185	R	87	Confident	86.7	Confident	3 Å²	3	20.7 Å²	20.7	1%	0.011	11%	0.112	C	C	.	.	H	α-helix	trans	-60.3	-46.2	172.2	-70.7	-172.3	-68.5	122.7	1.8	112.1	D181 A188 S189 D272 F355	D181-R185 VanDerWaalsContact CG-NE 3.33Å; D181-R185 WeakPolarHBondContact O-CB 3.47Å; D181-R185 VanDerWaalsContact O-CG 3.32Å; D181-R185 WeakPolarHBondContact O-CG 3.31Å; D181-R185 PolarHBondContact O-N 2.71Å; D181-R185 IonicContact OD1-NE 2.69Å; D181-R185 PolarHBondContact OD1-NE 3.16Å; D181-R185 IonicContact OD2-CZ 3.96Å; D181-R185 IonicContact OD2-NE 3.13Å; D181-R185 PolarHBondContact OD2-NE 3.05Å; D181-R185 IonicContact OD2-NH2 3.06Å; D181-R185 PolarHBondContact OD2-NH2 2.86Å; R185-A188 PolarHBondContact O-N 2.7Å; R185-S189 WeakPolarHBondContact O-CB 3.29Å; R185-S189 PolarHBondContact O-N 3.14Å; R185-S189 PolarHBondContact O-OG 3.07Å; R185-D272 IonicContact CZ-OD1 2.76Å; R185-D272 VanDerWaalsContact CZ-OD1 3.26Å; R185-D272 IonicContact NH1-OD1 2.87Å; R185-D272 PolarHBondContact NH1-OD1 3.36Å; R185-D272 IonicContact NH1-OD2 3.72Å; R185-D272 PolarHBondContact NH1-OD2 2.91Å; R185-D272 IonicContact NH2-OD1 2.61Å; R185-D272 PolarHBondContact NH2-OD1 3.09Å; R185-D272 IonicContact NH2-OD2 3.52Å; R185-F355 HydrophobicContact CB-CZ 4.37Å; R185-F355 HydrophobicContact CG-CE2 4.21Å
186	C	88.7	Confident	86.4	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-59.9	-50.3	176.6	-175.6	0	0	0	0	111	H182 V183 A188 S189 Y190	H182-C186 WeakPolarHBondContact O-CB 3.43Å; H182-C186 PolarHBondContact O-N 2.88Å; V183-C186 PolarHBondContact O-N 3.08Å; C186-A188 PolarHBondContact O-N 2.98Å; C186-S189 PolarHBondContact O-N 2.8Å; C186-Y190 VanDerWaalsContact O-CD2 3.28Å; C186-Y190 WeakPolarHBondContact O-CD2 3.07Å; C186-Y190 PolarHBondContact O-N 3.4Å
187	F	89.1	Confident	86.4	Confident	22 Å²	22	19.8 Å²	19.8	10%	0.096	10%	0.101	C	C	.	.	H	α-helix	trans	-56.1	-47.1	178.1	-175.3	-119.2	0	0	0	112.3	L137 A141 V183 T184 L191 I230 A231	L137-F187 HydrophobicContact CD1-CZ 4.13Å; A141-F187 HydrophobicContact CB-CD1 3.73Å; A141-F187 HydrophobicContact CB-CE1 3.65Å; V183-F187 VanDerWaalsContact O-CB 3.26Å; V183-F187 WeakPolarHBondContact O-CB 3.33Å; V183-F187 PolarHBondContact O-N 3.37Å; T184-F187 PolarHBondContact O-N 2.86Å; F187-L191 HydrophobicContact CD1-CD1 3.89Å; F187-L191 HydrophobicContact CD2-CD1 4.23Å; F187-L191 HydrophobicContact CD2-CG 4.49Å; F187-L191 HydrophobicContact CE1-CD1 3.51Å; F187-L191 HydrophobicContact CE2-CD1 3.85Å; F187-L191 HydrophobicContact CE2-CG 4.27Å; F187-L191 HydrophobicContact CG-CD1 4.24Å; F187-L191 HydrophobicContact CZ-CD1 3.49Å; F187-L191 VanDerWaalsContact CZ-CD1 3.49Å; F187-L191 HydrophobicContact CZ-CG 4.38Å; F187-L191 WeakPolarHBondContact O-CB 3.28Å; F187-L191 VanDerWaalsContact O-CG 3.3Å; F187-L191 WeakPolarHBondContact O-CG 3.43Å; F187-L191 PolarHBondContact O-N 3.19Å; F187-I230 HydrophobicContact CD2-CG2 4.03Å; F187-I230 HydrophobicContact CE2-CG2 4.42Å; F187-A231 HydrophobicContact CD2-CB 4.37Å; F187-A231 HydrophobicContact CE2-CB 3.88Å
188	A	86.2	Confident	86.2	Confident	6 Å²	6	18.1 Å²	18.1	5%	0.05	9%	0.094	C	C	.	.	H	α-helix	trans	-67.4	-45.1	178.7	0	0	0	0	0	113	V145 T184 R185 C186 Y190 L191 I192 F355	V145-A188 HydrophobicContact CG2-CB 3.57Å; T184-A188 WeakPolarHBondContact O-CB 3.22Å; T184-A188 PolarHBondContact O-N 3.05Å; R185-A188 PolarHBondContact O-N 2.7Å; C186-A188 PolarHBondContact O-N 2.98Å; A188-Y190 PolarHBondContact O-N 2.97Å; A188-L191 PolarHBondContact O-N 3.06Å; A188-I192 PolarHBondContact O-N 3.25Å; A188-F355 HydrophobicContact CB-CD1 3.58Å; A188-F355 HydrophobicContact CB-CE1 3.96Å; A188-F355 HydrophobicContact CB-CG 4.34Å
189	S	86.6	Confident	85.8	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-55.3	-50.9	175.4	-78	0	0	0	0	111.6	R185 C186 L191 I192 V193 T276 F355	R185-S189 WeakPolarHBondContact O-CB 3.29Å; R185-S189 PolarHBondContact O-N 3.14Å; R185-S189 PolarHBondContact O-OG 3.07Å; C186-S189 PolarHBondContact O-N 2.8Å; S189-L191 PolarHBondContact O-N 2.72Å; S189-I192 PolarHBondContact O-N 3.09Å; S189-I192 VanDerWaalsContact O-N 3.13Å; S189-V193 WeakPolarHBondContact O-CG2 3.39Å; S189-V193 PolarHBondContact O-N 3.19Å; S189-V193 VanDerWaalsContact O-N 3.08Å; S189-T276 PolarHBondContact OG-O 3.36Å; S189-F355 WeakPolarHBondContact OG-CE1 3.46Å
190	Y	89.2	Confident	85.3	Confident	16 Å²	16	15.7 Å²	15.7	6%	0.063	8%	0.084	C	C	.	.	H	α-helix	trans	-74.2	-24	-177.4	-75.5	-75.6	0	0	0	113.4	C186 A188 I192 V193 I194 F233 I275	C186-Y190 VanDerWaalsContact O-CD2 3.28Å; C186-Y190 WeakPolarHBondContact O-CD2 3.07Å; C186-Y190 PolarHBondContact O-N 3.4Å; A188-Y190 PolarHBondContact O-N 2.97Å; Y190-I192 PolarHBondContact O-N 3.48Å; Y190-V193 PolarHBondContact O-N 2.88Å; Y190-I194 HydrophobicContact CD1-CD1 4.4Å; Y190-I194 HydrophobicContact CD1-CG1 4.25Å; Y190-I194 WeakPolarHBondContact O-CB 3.32Å; Y190-I194 WeakPolarHBondContact O-CG1 3.44Å; Y190-I194 PolarHBondContact O-N 2.97Å; Y190-F233 HydrophobicContact CD2-CD1 4.3Å; Y190-F233 AromaticContact CD2-CE1 3.96Å; Y190-F233 HydrophobicContact CD2-CE1 3.96Å; Y190-F233 HydrophobicContact CE1-CE1 4.3Å; Y190-F233 HydrophobicContact CE2-CD1 4.3Å; Y190-F233 AromaticContact CE2-CE1 3.53Å; Y190-F233 HydrophobicContact CE2-CE1 3.53Å; Y190-F233 HydrophobicContact CE2-CZ 4.43Å; Y190-F233 AromaticContact CZ-CE1 3.7Å; Y190-I275 HydrophobicContact CE2-CG2 4.4Å; Y190-I275 PolarHBondContact OH-O 2.89Å
191	L	85.7	Confident	85	Confident	9 Å²	9	19.7 Å²	19.7	5%	0.047	10%	0.095	C	C	.	.	H	α-helix	trans	-69.9	-15.8	168	-79.7	177	0	0	0	114.1	Y134 L137 A141 F187 A188 S189 P195 I230	Y134-L191 PolarHBondContact OH-O 2.71Å; L137-L191 HydrophobicContact CD2-CD1 4.44Å; L137-L191 HydrophobicContact CD2-CD2 3.83Å; L137-L191 HydrophobicContact CG-CD1 4.32Å; A141-L191 HydrophobicContact CB-CD1 3.47Å; A141-L191 VanDerWaalsContact CB-CD1 3.47Å; F187-L191 HydrophobicContact CD1-CD1 3.89Å; F187-L191 HydrophobicContact CD2-CD1 4.23Å; F187-L191 HydrophobicContact CD2-CG 4.49Å; F187-L191 HydrophobicContact CE1-CD1 3.51Å; F187-L191 HydrophobicContact CE2-CD1 3.85Å; F187-L191 HydrophobicContact CE2-CG 4.27Å; F187-L191 HydrophobicContact CG-CD1 4.24Å; F187-L191 HydrophobicContact CZ-CD1 3.49Å; F187-L191 VanDerWaalsContact CZ-CD1 3.49Å; F187-L191 HydrophobicContact CZ-CG 4.38Å; F187-L191 WeakPolarHBondContact O-CB 3.28Å; F187-L191 VanDerWaalsContact O-CG 3.3Å; F187-L191 WeakPolarHBondContact O-CG 3.43Å; F187-L191 PolarHBondContact O-N 3.19Å; A188-L191 PolarHBondContact O-N 3.06Å; S189-L191 PolarHBondContact O-N 2.72Å; L191-P195 WeakPolarHBondContact O-CD 3.45Å; L191-P195 WeakPolarHBondContact O-CG 3.35Å; L191-I230 HydrophobicContact CD2-CD1 4.08Å; L191-I230 HydrophobicContact CG-CG2 4.42Å
192	I	82	Confident	84.5	Confident	26 Å²	26	19.2 Å²	19.2	13%	0.133	9%	0.092	C	C	.	.	H	α-helix	trans	-87.5	-48.7	167.8	-62.5	168.3	0	0	0	109.7	A188 S189 Y190 F196 F309 T358	A188-I192 PolarHBondContact O-N 3.25Å; S189-I192 PolarHBondContact O-N 3.09Å; S189-I192 VanDerWaalsContact O-N 3.13Å; Y190-I192 PolarHBondContact O-N 3.48Å; I192-F196 WeakPolarHBondContact O-CB 3.28Å; I192-F196 PolarHBondContact O-N 2.94Å; I192-F309 HydrophobicContact CD1-CB 4.41Å; I192-F309 HydrophobicContact CD1-CD1 4.25Å; I192-F309 HydrophobicContact CD1-CD2 3.62Å; I192-F309 HydrophobicContact CD1-CE1 4.41Å; I192-F309 HydrophobicContact CD1-CE2 3.83Å; I192-F309 HydrophobicContact CD1-CG 3.84Å; I192-F309 HydrophobicContact CD1-CZ 4.2Å; I192-F309 HydrophobicContact CG2-CD1 4.07Å; I192-F309 HydrophobicContact CG2-CG 4.38Å; I192-T358 HydrophobicContact CD1-CG2 4.47Å
193	V	85.5	Confident	83.7	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-67.3	-48.7	-172.8	178.2	0	0	0	0	113	S189 Y190 F196 L197 P280 F283 V284	S189-V193 WeakPolarHBondContact O-CG2 3.39Å; S189-V193 PolarHBondContact O-N 3.19Å; S189-V193 VanDerWaalsContact O-N 3.08Å; Y190-V193 PolarHBondContact O-N 2.88Å; V193-F196 PolarHBondContact O-N 3.5Å; V193-L197 WeakPolarHBondContact O-CB 3.27Å; V193-L197 PolarHBondContact O-N 3.47Å; V193-P280 HydrophobicContact CG2-CB 3.74Å; V193-P280 HydrophobicContact CG2-CG 4.44Å; V193-F283 HydrophobicContact CG1-CB 3.6Å; V193-F283 HydrophobicContact CG1-CD2 4.22Å; V193-F283 HydrophobicContact CG1-CG 4.13Å; V193-V284 HydrophobicContact CG2-CG2 4.09Å
194	I	86.3	Confident	83.2	Confident	39 Å²	39	21.2 Å²	21.2	20%	0.2	10%	0.101	C	C	.	.	H	α-helix	trans	-71	-41.7	-171.1	-60.3	-62.7	0	0	0	112.5	Y190 F196 L197 L198 I230	Y190-I194 HydrophobicContact CD1-CD1 4.4Å; Y190-I194 HydrophobicContact CD1-CG1 4.25Å; Y190-I194 WeakPolarHBondContact O-CB 3.32Å; Y190-I194 WeakPolarHBondContact O-CG1 3.44Å; Y190-I194 PolarHBondContact O-N 2.97Å; I194-F196 VanDerWaalsContact C-N 3.32Å; I194-F196 PolarHBondContact O-N 2.77Å; I194-L197 HydrophobicContact CD1-CD2 4.47Å; I194-L197 PolarHBondContact O-N 3.48Å; I194-L198 HydrophobicContact CG2-CD1 3.97Å; I194-L198 HydrophobicContact CG2-CG 4.29Å; I194-L198 WeakPolarHBondContact O-CB 3.43Å; I194-L198 WeakPolarHBondContact O-CG 3.33Å; I194-L198 PolarHBondContact O-N 3.37Å; I194-I230 HydrophobicContact CB-CD1 3.66Å; I194-I230 HydrophobicContact CB-CG1 4.41Å; I194-I230 HydrophobicContact CG1-CD1 3.87Å; I194-I230 HydrophobicContact CG1-CG1 4.11Å; I194-I230 HydrophobicContact CG2-CD1 3.89Å
195	P	80.5	Confident	82.6	Confident	4 Å²	4	21.6 Å²	21.6	3%	0.026	10%	0.102	C	C	.	.	H	α-helix	trans	-62.4	-39.3	172.7	-26.7	39.5	0	0	0	112.3	Y134 L191 L198 L199 I223	Y134-P195 HydrophobicContact CE2-CB 4.18Å; Y134-P195 HydrophobicContact CE2-CG 3.7Å; L191-P195 WeakPolarHBondContact O-CD 3.45Å; L191-P195 WeakPolarHBondContact O-CG 3.35Å; P195-L198 PolarHBondContact O-N 3.33Å; P195-L199 WeakPolarHBondContact O-CB 3.19Å; P195-L199 VanDerWaalsContact O-CG 3.25Å; P195-L199 WeakPolarHBondContact O-CG 3.37Å; P195-L199 PolarHBondContact O-N 3.38Å; P195-I223 HydrophobicContact CB-CD1 4.16Å; P195-I223 HydrophobicContact CB-CG1 4.3Å; P195-I223 HydrophobicContact CB-CG2 4.11Å; P195-I223 HydrophobicContact CG-CG2 3.93Å
196	F	81	Confident	81.6	Confident	7 Å²	7	24 Å²	24	3%	0.031	12%	0.119	C	C	.	.	H	α-helix	trans	-63.2	-41.4	175	-170.1	-129.6	0	0	0	112	I192 V193 I194 L199 F200 V284 I287 F291 V302 F303 P306	I192-F196 WeakPolarHBondContact O-CB 3.28Å; I192-F196 PolarHBondContact O-N 2.94Å; V193-F196 PolarHBondContact O-N 3.5Å; I194-F196 VanDerWaalsContact C-N 3.32Å; I194-F196 PolarHBondContact O-N 2.77Å; F196-L199 PolarHBondContact O-N 3.22Å; F196-F200 WeakPolarHBondContact O-CB 3.37Å; F196-F200 PolarHBondContact O-N 2.97Å; F196-V284 HydrophobicContact CE1-CG1 4.43Å; F196-I287 HydrophobicContact CD1-CB 3.84Å; F196-I287 HydrophobicContact CD1-CD1 3.91Å; F196-I287 HydrophobicContact CD1-CG2 3.51Å; F196-I287 HydrophobicContact CD2-CG2 4.42Å; F196-I287 HydrophobicContact CE1-CB 3.6Å; F196-I287 HydrophobicContact CE1-CG2 3.31Å; F196-I287 HydrophobicContact CE2-CG2 4.24Å; F196-I287 HydrophobicContact CG-CG2 4.08Å; F196-I287 HydrophobicContact CZ-CB 4.39Å; F196-I287 HydrophobicContact CZ-CG2 3.71Å; F196-F291 HydrophobicContact CD2-CE2 4.08Å; F196-F291 AromaticContact CE2-CD2 3.9Å; F196-F291 HydrophobicContact CE2-CD2 3.9Å; F196-F291 AromaticContact CE2-CE2 3.58Å; F196-F291 HydrophobicContact CE2-CE2 3.58Å; F196-F291 AromaticContact CZ-CD2 3.92Å; F196-F291 HydrophobicContact CZ-CD2 3.92Å; F196-F291 HydrophobicContact CZ-CE2 4Å; F196-V302 HydrophobicContact CE2-CG1 4.48Å; F196-F303 HydrophobicContact CE2-CD1 4.48Å; F196-F303 HydrophobicContact CZ-CD1 4.12Å; F196-F303 HydrophobicContact CZ-CE1 4.32Å; F196-P306 HydrophobicContact CD1-CB 4.2Å; F196-P306 HydrophobicContact CD1-CG 4.06Å; F196-P306 HydrophobicContact CD2-CG 3.75Å; F196-P306 HydrophobicContact CE1-CB 4.03Å; F196-P306 HydrophobicContact CE1-CG 4.11Å; F196-P306 HydrophobicContact CE2-CG 3.84Å; F196-P306 HydrophobicContact CG-CG 3.88Å; F196-P306 HydrophobicContact CZ-CB 4.21Å; F196-P306 HydrophobicContact CZ-CG 4.02Å
197	L	85.1	Confident	80.5	Confident	52 Å²	52	26.7 Å²	26.7	27%	0.272	13%	0.132	S	C	.	.	H	α-helix	trans	-63.9	-41.8	173.3	-178	64.9	0	0	0	112.5	V193 I194 F200 W201 I287	V193-L197 WeakPolarHBondContact O-CB 3.27Å; V193-L197 PolarHBondContact O-N 3.47Å; I194-L197 HydrophobicContact CD1-CD2 4.47Å; I194-L197 PolarHBondContact O-N 3.48Å; L197-F200 PolarHBondContact O-N 2.82Å; L197-W201 WeakPolarHBondContact O-CB 3.04Å; L197-W201 PolarHBondContact O-N 2.92Å; L197-I287 HydrophobicContact CB-CD1 3.74Å; L197-I287 HydrophobicContact CD1-CD1 3.81Å; L197-I287 HydrophobicContact CD1-CG1 3.99Å; L197-I287 HydrophobicContact CG-CD1 4.37Å
198	L	83	Confident	79.5	Confident	32 Å²	32	27.3 Å²	27.3	17%	0.168	14%	0.135	C	C	.	.	H	α-helix	trans	-69.6	-34.1	178.2	-73.1	172.4	0	0	0	112.5	I194 P195 N202 V222 I223	I194-L198 HydrophobicContact CG2-CD1 3.97Å; I194-L198 HydrophobicContact CG2-CG 4.29Å; I194-L198 WeakPolarHBondContact O-CB 3.43Å; I194-L198 WeakPolarHBondContact O-CG 3.33Å; I194-L198 PolarHBondContact O-N 3.37Å; P195-L198 PolarHBondContact O-N 3.33Å; L198-N202 WeakPolarHBondContact O-CB 3.39Å; L198-N202 PolarHBondContact O-N 2.83Å; L198-V222 HydrophobicContact CD1-CG1 4.26Å; L198-V222 HydrophobicContact CD2-CG1 4.18Å; L198-I223 HydrophobicContact CB-CG1 4.16Å; L198-I223 HydrophobicContact CD1-CB 4.47Å; L198-I223 HydrophobicContact CD1-CG1 3.73Å
199	L	74.4	Confident	78.7	Confident	22 Å²	22	30.8 Å²	30.8	12%	0.115	15%	0.153	C	C	.	.	H	α-helix	trans	-64.3	-46.9	170.4	-73.5	169.8	0	0	0	110.7	P195 F196 N202 F203 V219 F220 F291 L429	P195-L199 WeakPolarHBondContact O-CB 3.19Å; P195-L199 VanDerWaalsContact O-CG 3.25Å; P195-L199 WeakPolarHBondContact O-CG 3.37Å; P195-L199 PolarHBondContact O-N 3.38Å; F196-L199 PolarHBondContact O-N 3.22Å; L199-N202 PolarHBondContact O-N 2.85Å; L199-F203 WeakPolarHBondContact O-CB 3.33Å; L199-F203 PolarHBondContact O-N 3.31Å; L199-V219 HydrophobicContact CD2-CG1 4.26Å; L199-F220 HydrophobicContact CD2-CZ 4.15Å; L199-F291 HydrophobicContact CB-CZ 4.42Å; L199-L429 HydrophobicContact CD2-CD1 4.23Å; L199-L429 HydrophobicContact CD2-CD2 3.49Å; L199-L429 VanDerWaalsContact CD2-CD2 3.49Å
200	F	80.2	Confident	77.5	Confident	22 Å²	22	35.1 Å²	35.1	10%	0.096	18%	0.181	C	C	.	.	H	α-helix	trans	-63	-41.7	176	-178.6	-109.4	0	0	0	112.7	F196 L197 N202 F203 L204 I287 F291	F196-F200 WeakPolarHBondContact O-CB 3.37Å; F196-F200 PolarHBondContact O-N 2.97Å; L197-F200 PolarHBondContact O-N 2.82Å; F200-N202 PolarHBondContact O-N 3.35Å; F200-F203 HydrophobicContact CD2-CD1 4.34Å; F200-F203 HydrophobicContact CE2-CD1 4.4Å; F200-F203 WeakPolarHBondContact O-CB 3.37Å; F200-F203 PolarHBondContact O-N 2.9Å; F200-L204 VanDerWaalsContact O-CB 3.29Å; F200-L204 WeakPolarHBondContact O-CB 3.15Å; F200-L204 PolarHBondContact O-N 3.23Å; F200-I287 HydrophobicContact CB-CG2 3.52Å; F200-I287 HydrophobicContact CD1-CG2 4.38Å; F200-I287 HydrophobicContact CD2-CG2 4.18Å; F200-I287 HydrophobicContact CG-CG2 3.77Å; F200-F291 VanDerWaalsContact CA-CZ 3.44Å; F200-F291 HydrophobicContact CB-CD2 4.37Å; F200-F291 HydrophobicContact CB-CE2 3.62Å; F200-F291 HydrophobicContact CB-CZ 3.73Å; F200-F291 HydrophobicContact CD2-CD1 4.05Å; F200-F291 AromaticContact CD2-CD2 3.81Å; F200-F291 HydrophobicContact CD2-CD2 3.81Å; F200-F291 HydrophobicContact CD2-CE1 4.08Å; F200-F291 AromaticContact CD2-CE2 3.85Å; F200-F291 HydrophobicContact CD2-CE2 3.85Å; F200-F291 AromaticContact CD2-CG 3.92Å; F200-F291 HydrophobicContact CD2-CG 3.92Å; F200-F291 AromaticContact CD2-CZ 4Å; F200-F291 HydrophobicContact CD2-CZ 4Å; F200-F291 HydrophobicContact CG-CD2 4.48Å; F200-F291 HydrophobicContact CG-CE2 4.18Å; F200-F291 HydrophobicContact CG-CZ 4.38Å
201	W	82.6	Confident	76.2	Confident	105 Å²	105	38.5 Å²	38.5	40%	0.398	20%	0.197	S	C	.	.	H	α-helix	trans	-58	-48.3	174.4	-175	-86.9	0	0	0	111.2	L197 F203 L204 F205	L197-W201 WeakPolarHBondContact O-CB 3.04Å; L197-W201 PolarHBondContact O-N 2.92Å; W201-F203 VanDerWaalsContact C-N 3.32Å; W201-F203 PolarHBondContact O-N 3.48Å; W201-L204 PolarHBondContact O-N 2.9Å; W201-F205 AromaticContact CD1-CD2 3.87Å; W201-F205 HydrophobicContact CD2-CD2 4.01Å; W201-F205 AromaticContact CD2-CE2 3.67Å; W201-F205 HydrophobicContact CD2-CE2 3.67Å; W201-F205 AromaticContact CE2-CD2 3.68Å; W201-F205 AromaticContact CE2-CE2 3.31Å; W201-F205 HydrophobicContact CE3-CE2 4.02Å; W201-F205 HydrophobicContact CG-CD2 4.15Å; W201-F205 HydrophobicContact CG-CE2 4.29Å; W201-F205 AromaticContact CH2-CE2 3.76Å; W201-F205 HydrophobicContact CH2-CE2 3.76Å; W201-F205 HydrophobicContact CH2-CZ 4.22Å; W201-F205 HydrophobicContact CZ2-CD2 4.15Å; W201-F205 AromaticContact CZ2-CE2 3.38Å; W201-F205 HydrophobicContact CZ2-CE2 3.38Å; W201-F205 HydrophobicContact CZ2-CZ 4.04Å; W201-F205 HydrophobicContact CZ3-CE2 4.06Å; W201-F205 AromaticContact NE1-CD2 3.57Å; W201-F205 AromaticContact NE1-CE2 3.72Å; W201-F205 VanDerWaalsContact O-CD2 3.28Å; W201-F205 WeakPolarHBondContact O-CD2 3.45Å; W201-F205 PolarHBondContact O-N 2.78Å; W201-F205 VanDerWaalsContact O-N 3.07Å
202	N	74.6	Confident	75	Confident	9 Å²	9	45.2 Å²	45.2	5%	0.048	23%	0.228	C	C	.	.	H	α-helix	trans	-68	-31.7	178.5	-168.9	73.4	0	0	0	112.7	L198 L199 F200 S206 M216 V219	L198-N202 WeakPolarHBondContact O-CB 3.39Å; L198-N202 PolarHBondContact O-N 2.83Å; L199-N202 PolarHBondContact O-N 2.85Å; F200-N202 PolarHBondContact O-N 3.35Å; N202-S206 WeakPolarHBondContact O-CB 3.39Å; N202-S206 PolarHBondContact O-N 3.22Å; N202-S206 VanDerWaalsContact O-N 3.1Å; N202-M216 PolarHBondContact OD1-N 3.32Å; N202-V219 HydrophobicContact CB-CG2 3.9Å; N202-V219 VanDerWaalsContact CG-CG2 3.44Å; N202-V219 WeakPolarHBondContact ND2-CG2 3.31Å
203	F	70.4	Confident	74.3	Confident	21 Å²	21	51.3 Å²	51.3	9%	0.092	26%	0.255	C	S	.	.	H	α-helix	trans	-65.9	-51.9	172	174.7	-97	0	0	0	111.4	L199 F200 W201 F205 S206 E207 I208 F291 W294 L295	L199-F203 WeakPolarHBondContact O-CB 3.33Å; L199-F203 PolarHBondContact O-N 3.31Å; F200-F203 HydrophobicContact CD2-CD1 4.34Å; F200-F203 HydrophobicContact CE2-CD1 4.4Å; F200-F203 WeakPolarHBondContact O-CB 3.37Å; F200-F203 PolarHBondContact O-N 2.9Å; W201-F203 VanDerWaalsContact C-N 3.32Å; W201-F203 PolarHBondContact O-N 3.48Å; F203-F205 PolarHBondContact O-N 2.82Å; F203-S206 PolarHBondContact O-N 3.47Å; F203-E207 HydrophobicContact CE2-CB 4.48Å; F203-E207 WeakPolarHBondContact CE2-OE2 3.31Å; F203-E207 WeakPolarHBondContact O-CB 3.03Å; F203-E207 PolarHBondContact O-N 3.41Å; F203-I208 HydrophobicContact CD1-CD1 4.41Å; F203-I208 HydrophobicContact CE1-CD1 4.08Å; F203-F291 HydrophobicContact CB-CE1 3.78Å; F203-F291 HydrophobicContact CB-CZ 4.47Å; F203-F291 AromaticContact CD1-CD1 3.83Å; F203-F291 HydrophobicContact CD1-CD1 3.83Å; F203-F291 AromaticContact CD1-CE1 3.84Å; F203-F291 HydrophobicContact CD1-CE1 3.84Å; F203-F291 HydrophobicContact CD2-CD1 4.44Å; F203-F291 HydrophobicContact CD2-CE1 4.14Å; F203-F291 HydrophobicContact CE1-CD1 4.04Å; F203-F291 HydrophobicContact CE1-CE1 4.47Å; F203-F291 HydrophobicContact CG-CD1 4.05Å; F203-F291 AromaticContact CG-CE1 3.65Å; F203-F291 HydrophobicContact CG-CE1 3.65Å; F203-F291 HydrophobicContact CZ-CD1 4.45Å; F203-W294 HydrophobicContact CE1-CB 3.78Å; F203-W294 HydrophobicContact CZ-CB 3.9Å; F203-L295 HydrophobicContact CD2-CD1 4.37Å; F203-L295 HydrophobicContact CE2-CD1 3.65Å; F203-L295 HydrophobicContact CZ-CB 4.39Å; F203-L295 HydrophobicContact CZ-CD1 4.12Å
204	L	79.4	Confident	73.2	Confident	40 Å²	40	54 Å²	54	21%	0.209	27%	0.27	C	S	.	.	I	π-helix	trans	-51.3	-49.9	176.4	-179.3	73.2	0	0	0	111.7	F200 W201 S206 I208 L209	F200-L204 VanDerWaalsContact O-CB 3.29Å; F200-L204 WeakPolarHBondContact O-CB 3.15Å; F200-L204 PolarHBondContact O-N 3.23Å; W201-L204 PolarHBondContact O-N 2.9Å; L204-S206 PolarHBondContact O-N 2.96Å; L204-I208 HydrophobicContact CD1-CB 3.96Å; L204-I208 HydrophobicContact CD1-CD1 3.66Å; L204-I208 HydrophobicContact CD1-CG1 4.28Å; L204-I208 HydrophobicContact CD1-CG2 4.03Å; L204-I208 WeakPolarHBondContact O-CA 3.47Å; L204-I208 VanDerWaalsContact O-CB 3.29Å; L204-I208 WeakPolarHBondContact O-CB 3.41Å; L204-I208 PolarHBondContact O-N 3.37Å; L204-L209 PolarHBondContact O-N 3.41Å
205	F	76.4	Confident	72	Confident	19 Å²	19	54.5 Å²	54.5	8%	0.083	27%	0.272	C	S	.	.	I	π-helix	trans	-81.5	-8.2	179.8	-69.6	-69.3	0	0	0	115.2	W201 F203 L209 H211 L214 I215	W201-F205 AromaticContact CD1-CD2 3.87Å; W201-F205 HydrophobicContact CD2-CD2 4.01Å; W201-F205 AromaticContact CD2-CE2 3.67Å; W201-F205 HydrophobicContact CD2-CE2 3.67Å; W201-F205 AromaticContact CE2-CD2 3.68Å; W201-F205 AromaticContact CE2-CE2 3.31Å; W201-F205 HydrophobicContact CE3-CE2 4.02Å; W201-F205 HydrophobicContact CG-CD2 4.15Å; W201-F205 HydrophobicContact CG-CE2 4.29Å; W201-F205 AromaticContact CH2-CE2 3.76Å; W201-F205 HydrophobicContact CH2-CE2 3.76Å; W201-F205 HydrophobicContact CH2-CZ 4.22Å; W201-F205 HydrophobicContact CZ2-CD2 4.15Å; W201-F205 AromaticContact CZ2-CE2 3.38Å; W201-F205 HydrophobicContact CZ2-CE2 3.38Å; W201-F205 HydrophobicContact CZ2-CZ 4.04Å; W201-F205 HydrophobicContact CZ3-CE2 4.06Å; W201-F205 AromaticContact NE1-CD2 3.57Å; W201-F205 AromaticContact NE1-CE2 3.72Å; W201-F205 VanDerWaalsContact O-CD2 3.28Å; W201-F205 WeakPolarHBondContact O-CD2 3.45Å; W201-F205 PolarHBondContact O-N 2.78Å; W201-F205 VanDerWaalsContact O-N 3.07Å; F203-F205 PolarHBondContact O-N 2.82Å; F205-L209 CarbonylContact C-O 3.57Å; F205-L209 WeakPolarHBondContact CA-O 3.36Å; F205-L209 HydrophobicContact CD1-CB 4.15Å; F205-L209 HydrophobicContact CE1-CB 4.29Å; F205-L209 HydrophobicContact CE1-CD1 4.32Å; F205-L209 VanDerWaalsContact O-O 3.07Å; F205-H211 HydrophobicContact CD1-CB 4.15Å; F205-L214 HydrophobicContact CB-CB 4.2Å; F205-L214 HydrophobicContact CD1-CB 3.94Å; F205-L214 HydrophobicContact CD1-CD1 3.67Å; F205-L214 HydrophobicContact CD1-CG 4.44Å; F205-L214 HydrophobicContact CD2-CB 4.23Å; F205-L214 HydrophobicContact CE1-CB 4.42Å; F205-L214 HydrophobicContact CE1-CD1 3.35Å; F205-L214 HydrophobicContact CE2-CD1 4.37Å; F205-L214 HydrophobicContact CG-CB 3.83Å; F205-L214 HydrophobicContact CG-CD1 4.29Å; F205-L214 HydrophobicContact CZ-CD1 3.75Å; F205-I215 HydrophobicContact CB-CG1 4.36Å; F205-I215 WeakPolarHBondContact O-CD1 3.47Å; F205-I215 VanDerWaalsContact O-CG1 3.31Å; F205-I215 WeakPolarHBondContact O-CG1 3.14Å
206	S	65.6	Low	71.2	Confident	52 Å²	52	57.6 Å²	57.6	36%	0.364	29%	0.287	S	S	.	.	I	π-helix	trans	-99.2	-21.2	175	-173.4	0	0	0	0	113.9	N202 F203 L204	N202-S206 WeakPolarHBondContact O-CB 3.39Å; N202-S206 PolarHBondContact O-N 3.22Å; N202-S206 VanDerWaalsContact O-N 3.1Å; F203-S206 PolarHBondContact O-N 3.47Å; L204-S206 PolarHBondContact O-N 2.96Å
207	E	66.1	Low	70.2	Confident	58 Å²	58	68.8 Å²	68.8	27%	0.271	33%	0.329	S	S	.	.	I	π-helix	trans	-123.9	-40.6	-173.5	-177.7	133.4	-136.2	0	0	113.4	F203 R422	F203-E207 HydrophobicContact CE2-CB 4.48Å; F203-E207 WeakPolarHBondContact CE2-OE2 3.31Å; F203-E207 WeakPolarHBondContact O-CB 3.03Å; F203-E207 PolarHBondContact O-N 3.41Å; E207-R422 IonicContact OE1-CZ 2.64Å; E207-R422 IonicContact OE1-NE 2.67Å; E207-R422 IonicContact OE1-NH1 3.47Å; E207-R422 PolarHBondContact OE1-NH1 3.28Å; E207-R422 IonicContact OE1-NH2 2.68Å
208	I	69.4	Low	69.3	Low	34 Å²	34	69 Å²	69	17%	0.174	33%	0.331	C	S	.	.	I	π-helix	trans	-95.6	-48.3	-168.1	-54.5	-178.2	0	0	0	111.2	F203 L204 W294	F203-I208 HydrophobicContact CD1-CD1 4.41Å; F203-I208 HydrophobicContact CE1-CD1 4.08Å; L204-I208 HydrophobicContact CD1-CB 3.96Å; L204-I208 HydrophobicContact CD1-CD1 3.66Å; L204-I208 HydrophobicContact CD1-CG1 4.28Å; L204-I208 HydrophobicContact CD1-CG2 4.03Å; L204-I208 WeakPolarHBondContact O-CA 3.47Å; L204-I208 VanDerWaalsContact O-CB 3.29Å; L204-I208 WeakPolarHBondContact O-CB 3.41Å; L204-I208 PolarHBondContact O-N 3.37Å; I208-W294 HydrophobicContact CB-CE3 4.32Å; I208-W294 HydrophobicContact CB-CH2 4.25Å; I208-W294 HydrophobicContact CB-CZ3 4.03Å; I208-W294 HydrophobicContact CD1-CB 4.22Å; I208-W294 HydrophobicContact CD1-CD2 3.36Å; I208-W294 HydrophobicContact CD1-CE3 3.68Å; I208-W294 HydrophobicContact CD1-CG 3.63Å; I208-W294 HydrophobicContact CD1-CH2 4.37Å; I208-W294 HydrophobicContact CD1-CZ2 4.1Å; I208-W294 HydrophobicContact CD1-CZ3 4.17Å; I208-W294 HydrophobicContact CG1-CD2 3.77Å; I208-W294 HydrophobicContact CG1-CE3 3.48Å; I208-W294 VanDerWaalsContact CG1-CE3 3.48Å; I208-W294 HydrophobicContact CG1-CG 4.38Å; I208-W294 HydrophobicContact CG1-CH2 4.21Å; I208-W294 HydrophobicContact CG1-CZ2 4.44Å; I208-W294 HydrophobicContact CG1-CZ3 3.72Å; I208-W294 HydrophobicContact CG2-CE3 4.24Å; I208-W294 HydrophobicContact CG2-CH2 3.32Å; I208-W294 HydrophobicContact CG2-CZ2 3.73Å; I208-W294 HydrophobicContact CG2-CZ3 3.59Å
209	L	69.5	Low	68.6	Low	79 Å²	79	68 Å²	68	41%	0.414	33%	0.326	S	S	.	.	S	Bend	trans	-124.6	96.7	-179.9	-75.1	169.3	0	0	0	108.1	L204 F205 H211	L204-L209 PolarHBondContact O-N 3.41Å; F205-L209 CarbonylContact C-O 3.57Å; F205-L209 WeakPolarHBondContact CA-O 3.36Å; F205-L209 HydrophobicContact CD1-CB 4.15Å; F205-L209 HydrophobicContact CE1-CB 4.29Å; F205-L209 HydrophobicContact CE1-CD1 4.32Å; F205-L209 VanDerWaalsContact O-O 3.07Å; L209-H211 PolarHBondContact O-N 3.29Å
210	P	61.3	Low	68.1	Low	92 Å²	92	67.5 Å²	67.5	60%	0.597	32%	0.323	S	S	*	.			trans	-73.6	51.6	-173	31.1	-36.6	0	0	0	113.8	H212	P210-H212 VanDerWaalsContact C-N 3.34Å; P210-H212 PolarHBondContact O-N 2.97Å
211	H	61.5	Low	67.8	Low	86 Å²	86	69.5 Å²	69.5	40%	0.398	33%	0.332	S	S	.	.			trans	-80.4	82.4	170.3	-68.3	92	0	0	0	108.8	F205 L209 H213 L214	F205-H211 HydrophobicContact CD1-CB 4.15Å; L209-H211 PolarHBondContact O-N 3.29Å; H211-H213 AromaticContact CD2-CE1 3.83Å; H211-H213 PolarHBondContact O-N 3.46Å; H211-L214 HydrophobicContact CB-CD1 4.1Å; H211-L214 HydrophobicContact CB-CG 4.41Å; H211-L214 PolarHBondContact O-N 3.43Å
212	H	60.7	Low	67.7	Low	150 Å²	150	66.7 Å²	66.7	69%	0.694	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-16.5	-176.3	-65	-43.2	0	0	0	115.3	P210 I215	P210-H212 VanDerWaalsContact C-N 3.34Å; P210-H212 PolarHBondContact O-N 2.97Å; H212-I215 WeakPolarHBondContact ND1-CD1 3.39Å
213	H	66.2	Low	67.8	Low	154 Å²	154	66.4 Å²	66.4	71%	0.713	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-21.6	174.5	71.5	-92	0	0	0	114.1	H211	H211-H213 AromaticContact CD2-CE1 3.83Å; H211-H213 PolarHBondContact O-N 3.46Å
214	L	62.7	Low	68.4	Low	58 Å²	58	67.6 Å²	67.6	30%	0.304	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-7.4	177.6	-64.2	173	0	0	0	113.4	F205 H211 M216	F205-L214 HydrophobicContact CB-CB 4.2Å; F205-L214 HydrophobicContact CD1-CB 3.94Å; F205-L214 HydrophobicContact CD1-CD1 3.67Å; F205-L214 HydrophobicContact CD1-CG 4.44Å; F205-L214 HydrophobicContact CD2-CB 4.23Å; F205-L214 HydrophobicContact CE1-CB 4.42Å; F205-L214 HydrophobicContact CE1-CD1 3.35Å; F205-L214 HydrophobicContact CE2-CD1 4.37Å; F205-L214 HydrophobicContact CG-CB 3.83Å; F205-L214 HydrophobicContact CG-CD1 4.29Å; F205-L214 HydrophobicContact CZ-CD1 3.75Å; H211-L214 HydrophobicContact CB-CD1 4.1Å; H211-L214 HydrophobicContact CB-CG 4.41Å; H211-L214 PolarHBondContact O-N 3.43Å; L214-M216 PolarHBondContact O-N 2.79Å
215	I	62	Low	68.7	Low	48 Å²	48	71.4 Å²	71.4	25%	0.246	35%	0.347	C	S	.	.	S	Bend	trans	-71.2	121.1	177.9	-59.8	179.6	0	0	0	109.8	F205 H212 R217	F205-I215 HydrophobicContact CB-CG1 4.36Å; F205-I215 WeakPolarHBondContact O-CD1 3.47Å; F205-I215 VanDerWaalsContact O-CG1 3.31Å; F205-I215 WeakPolarHBondContact O-CG1 3.14Å; H212-I215 WeakPolarHBondContact ND1-CD1 3.39Å; I215-R217 PolarHBondContact O-N 3.5Å; I215-R217 VanDerWaalsContact O-N 3.12Å
216	M	63.3	Low	69.2	Low	69 Å²	69	71.4 Å²	71.4	34%	0.34	35%	0.349	S	S	.	.			trans	-75.8	104.1	-177.9	-66.1	-63.5	178.2	0	0	110.1	N202 L214 N218 V219 V222	N202-M216 PolarHBondContact OD1-N 3.32Å; L214-M216 PolarHBondContact O-N 2.79Å; M216-N218 PolarHBondContact O-N 2.83Å; M216-V219 HydrophobicContact CB-CG2 4.21Å; M216-V222 HydrophobicContact CB-CG2 4.34Å; M216-V222 HydrophobicContact CG-CG2 4.3Å; M216-V222 HydrophobicContact SD-CG2 3.85Å
217	R	60.2	Low	70.2	Confident	243 Å²	243	69.4 Å²	69.4	92%	0.917	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-34.1	-178.2	-69.4	-177	178	176.8	-0.2	113.9	I215	I215-R217 PolarHBondContact O-N 3.5Å; I215-R217 VanDerWaalsContact O-N 3.12Å
218	N	66.3	Low	71.4	Confident	56 Å²	56	71.8 Å²	71.8	30%	0.299	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.9	82.8	175	-66.5	-19.8	0	0	0	109.7	M216 F220 E221 V222	M216-N218 PolarHBondContact O-N 2.83Å; N218-F220 PolarHBondContact O-N 3.26Å; N218-F220 VanDerWaalsContact O-N 3.16Å; N218-E221 HydrophobicContact CB-CB 3.61Å; N218-E221 PolarHBondContact ND2-OE2 3.44Å; N218-E221 WeakPolarHBondContact O-CB 3.26Å; N218-E221 PolarHBondContact O-N 3.43Å; N218-V222 PolarHBondContact O-N 3.04Å
219	V	67.4	Low	72.4	Confident	11 Å²	11	75.9 Å²	75.9	7%	0.067	37%	0.37	C	S	.	.	H	α-helix	trans	-50.3	-42.7	-179.5	-169.9	0	0	0	0	112.2	L199 N202 M216 E221 V222 I223	L199-V219 HydrophobicContact CD2-CG1 4.26Å; N202-V219 HydrophobicContact CB-CG2 3.9Å; N202-V219 VanDerWaalsContact CG-CG2 3.44Å; N202-V219 WeakPolarHBondContact ND2-CG2 3.31Å; M216-V219 HydrophobicContact CB-CG2 4.21Å; V219-E221 VanDerWaalsContact C-N 3.34Å; V219-E221 PolarHBondContact O-N 2.87Å; V219-V222 WeakPolarHBondContact O-CA 3.48Å; V219-V222 WeakPolarHBondContact O-CB 3.2Å; V219-V222 PolarHBondContact O-N 2.85Å; V219-V222 VanDerWaalsContact O-N 3.09Å; V219-I223 HydrophobicContact CG1-CD1 3.91Å; V219-I223 HydrophobicContact CG1-CG1 4.42Å; V219-I223 WeakPolarHBondContact O-CG1 3.41Å; V219-I223 PolarHBondContact O-N 3Å
220	F	65	Low	73.4	Confident	12 Å²	12	72.6 Å²	72.6	5%	0.053	35%	0.353	C	S	.	.	H	α-helix	trans	-69.8	-26.3	-179.4	-59.5	-72.6	0	0	0	114.5	Q127 T130 L199 N218 V222 I223 L224 L429 Q432	Q127-F220 HydrophobicContact CG-CD2 3.95Å; Q127-F220 HydrophobicContact CG-CE2 4.37Å; T130-F220 VanDerWaalsContact OG1-CB 3.22Å; T130-F220 WeakPolarHBondContact OG1-CB 3.45Å; L199-F220 HydrophobicContact CD2-CZ 4.15Å; N218-F220 PolarHBondContact O-N 3.26Å; N218-F220 VanDerWaalsContact O-N 3.16Å; F220-V222 VanDerWaalsContact C-N 3.35Å; F220-I223 HydrophobicContact CD1-CD1 3.95Å; F220-I223 HydrophobicContact CE1-CD1 3.87Å; F220-L224 VanDerWaalsContact O-CB 3.32Å; F220-L224 WeakPolarHBondContact O-CB 3.3Å; F220-L224 PolarHBondContact O-N 3.45Å; F220-L429 HydrophobicContact CE2-CD2 4.38Å; F220-L429 HydrophobicContact CZ-CD2 3.66Å; F220-Q432 VanDerWaalsContact CE1-CD 3.49Å
221	E	74	Confident	74.7	Confident	63 Å²	63	69.6 Å²	69.6	29%	0.294	34%	0.336	S	S	.	.	H	α-helix	trans	-72.6	-33.5	171.2	-166.4	-174	145	0	0	110.7	T130 N218 V219 K225	T130-E221 HydrophobicContact CG2-CB 4.28Å; N218-E221 HydrophobicContact CB-CB 3.61Å; N218-E221 PolarHBondContact ND2-OE2 3.44Å; N218-E221 WeakPolarHBondContact O-CB 3.26Å; N218-E221 PolarHBondContact O-N 3.43Å; V219-E221 VanDerWaalsContact C-N 3.34Å; V219-E221 PolarHBondContact O-N 2.87Å; E221-K225 WeakPolarHBondContact O-CB 3.34Å; E221-K225 VanDerWaalsContact O-CG 3.29Å; E221-K225 WeakPolarHBondContact O-CG 3.16Å; E221-K225 PolarHBondContact O-N 3.43Å; E221-K225 VanDerWaalsContact O-N 3.07Å; E221-K225 WeakPolarHBondContact OE1-CE 3.17Å; E221-K225 IonicContact OE1-NZ 3.4Å; E221-K225 PolarHBondContact OE1-NZ 3.41Å
222	V	79.2	Confident	76.2	Confident	46 Å²	46	70.3 Å²	70.3	28%	0.279	34%	0.342	S	S	.	.	H	α-helix	trans	-72	-43.4	174.5	-178.2	0	0	0	0	110.6	L198 M216 N218 V219 F220 L224 K225 S226	L198-V222 HydrophobicContact CD1-CG1 4.26Å; L198-V222 HydrophobicContact CD2-CG1 4.18Å; M216-V222 HydrophobicContact CB-CG2 4.34Å; M216-V222 HydrophobicContact CG-CG2 4.3Å; M216-V222 HydrophobicContact SD-CG2 3.85Å; N218-V222 PolarHBondContact O-N 3.04Å; V219-V222 WeakPolarHBondContact O-CA 3.48Å; V219-V222 WeakPolarHBondContact O-CB 3.2Å; V219-V222 PolarHBondContact O-N 2.85Å; V219-V222 VanDerWaalsContact O-N 3.09Å; F220-V222 VanDerWaalsContact C-N 3.35Å; V222-L224 PolarHBondContact O-N 3.38Å; V222-K225 PolarHBondContact O-N 2.95Å; V222-S226 WeakPolarHBondContact O-CB 3.34Å; V222-S226 PolarHBondContact O-N 3.13Å
223	I	78.1	Confident	77.7	Confident	3 Å²	3	67 Å²	67	2%	0.015	33%	0.325	C	S	.	.	H	α-helix	trans	-56.9	-48.8	173.5	-70.4	165.4	0	0	0	110.7	Y134 P195 L198 V219 F220 K225 S226 S227	Y134-I223 HydrophobicContact CD2-CG2 3.47Å; Y134-I223 VanDerWaalsContact CD2-CG2 3.47Å; Y134-I223 HydrophobicContact CE2-CG2 3.69Å; Y134-I223 HydrophobicContact CG-CG2 4.26Å; P195-I223 HydrophobicContact CB-CD1 4.16Å; P195-I223 HydrophobicContact CB-CG1 4.3Å; P195-I223 HydrophobicContact CB-CG2 4.11Å; P195-I223 HydrophobicContact CG-CG2 3.93Å; L198-I223 HydrophobicContact CB-CG1 4.16Å; L198-I223 HydrophobicContact CD1-CB 4.47Å; L198-I223 HydrophobicContact CD1-CG1 3.73Å; V219-I223 HydrophobicContact CG1-CD1 3.91Å; V219-I223 HydrophobicContact CG1-CG1 4.42Å; V219-I223 WeakPolarHBondContact O-CG1 3.41Å; V219-I223 PolarHBondContact O-N 3Å; F220-I223 HydrophobicContact CD1-CD1 3.95Å; F220-I223 HydrophobicContact CE1-CD1 3.87Å; I223-K225 VanDerWaalsContact C-N 3.3Å; I223-K225 PolarHBondContact O-N 2.99Å; I223-S226 WeakPolarHBondContact CA-OG 3.38Å; I223-S226 PolarHBondContact O-N 3.25Å; I223-S226 VanDerWaalsContact O-N 3.14Å; I223-S226 PolarHBondContact O-OG 3.3Å; I223-S227 PolarHBondContact O-N 3.47Å
224	L	81.3	Confident	78.8	Confident	47 Å²	47	59.8 Å²	59.8	25%	0.246	29%	0.293	C	S	.	.	H	α-helix	trans	-68	-25.4	179.1	-171.6	66.3	0	0	0	113.6	L133 F220 V222 S227	L133-L224 HydrophobicContact CB-CD1 4.1Å; L133-L224 HydrophobicContact CB-CD2 3.92Å; L133-L224 HydrophobicContact CD1-CD2 3.78Å; L133-L224 HydrophobicContact CG-CD2 4.47Å; F220-L224 VanDerWaalsContact O-CB 3.32Å; F220-L224 WeakPolarHBondContact O-CB 3.3Å; F220-L224 PolarHBondContact O-N 3.45Å; V222-L224 PolarHBondContact O-N 3.38Å; L224-S227 PolarHBondContact O-OG 3.37Å
225	K	87	Confident	80.2	Confident	120 Å²	120	60.7 Å²	60.7	52%	0.522	30%	0.297	S	S	.	.	H	α-helix	trans	-78	-37	169.9	-73.8	171.9	-171.2	170.4	0	111.6	E221 V222 I223 S227 I228	E221-K225 WeakPolarHBondContact O-CB 3.34Å; E221-K225 VanDerWaalsContact O-CG 3.29Å; E221-K225 WeakPolarHBondContact O-CG 3.16Å; E221-K225 PolarHBondContact O-N 3.43Å; E221-K225 VanDerWaalsContact O-N 3.07Å; E221-K225 WeakPolarHBondContact OE1-CE 3.17Å; E221-K225 IonicContact OE1-NZ 3.4Å; E221-K225 PolarHBondContact OE1-NZ 3.41Å; V222-K225 PolarHBondContact O-N 2.95Å; I223-K225 VanDerWaalsContact C-N 3.3Å; I223-K225 PolarHBondContact O-N 2.99Å; K225-S227 VanDerWaalsContact C-N 3.26Å; K225-S227 PolarHBondContact O-N 2.92Å; K225-I228 PolarHBondContact O-N 3.43Å
226	S	87.3	Confident	81.7	Confident	18 Å²	18	62.1 Å²	62.1	13%	0.126	31%	0.31	C	S	.	.	H	α-helix	trans	-64.7	-29.8	177.5	76	0	0	0	0	112.2	V222 I223 I228 I229 I230	V222-S226 WeakPolarHBondContact O-CB 3.34Å; V222-S226 PolarHBondContact O-N 3.13Å; I223-S226 WeakPolarHBondContact CA-OG 3.38Å; I223-S226 PolarHBondContact O-N 3.25Å; I223-S226 VanDerWaalsContact O-N 3.14Å; I223-S226 PolarHBondContact O-OG 3.3Å; S226-I228 PolarHBondContact O-N 3.43Å; S226-I229 CarbonylContact O-C 3.59Å; S226-I229 WeakPolarHBondContact O-CA 3.34Å; S226-I229 WeakPolarHBondContact O-CB 3.25Å; S226-I229 PolarHBondContact O-N 3.47Å; S226-I230 WeakPolarHBondContact O-CG1 3.43Å; S226-I230 PolarHBondContact O-N 3.46Å
227	S	86.2	Confident	82.8	Confident	10 Å²	10	60 Å²	60	7%	0.07	30%	0.3	C	S	.	.	H	α-helix	trans	-62.2	-25.4	176.7	65.6	0	0	0	0	114.5	I223 L224 K225 A231	I223-S227 PolarHBondContact O-N 3.47Å; L224-S227 PolarHBondContact O-OG 3.37Å; K225-S227 VanDerWaalsContact C-N 3.26Å; K225-S227 PolarHBondContact O-N 2.92Å; S227-A231 VanDerWaalsContact O-CB 3.3Å; S227-A231 WeakPolarHBondContact O-CB 3.12Å; S227-A231 PolarHBondContact O-N 2.88Å
228	I	90	Very high	84.1	Confident	109 Å²	109	48.4 Å²	48.4	56%	0.559	26%	0.257	S	S	*	.	H	α-helix	trans	-67.8	-43.8	172.4	-58	173.4	0	0	0	109.7	K225 S226 A231 L232	K225-I228 PolarHBondContact O-N 3.43Å; S226-I228 PolarHBondContact O-N 3.43Å; I228-A231 PolarHBondContact O-N 2.97Å; I228-L232 HydrophobicContact CG2-CD1 4.29Å; I228-L232 WeakPolarHBondContact O-CG 3.48Å; I228-L232 PolarHBondContact O-N 3.44Å
229	I	91.8	Very high	85.1	Confident	120 Å²	120	49.2 Å²	49.2	62%	0.615	26%	0.26	S	S	*	.	H	α-helix	trans	-66.6	-41	176.9	-58	173.2	0	0	0	110.2	S226 L232 F233	S226-I229 CarbonylContact O-C 3.59Å; S226-I229 WeakPolarHBondContact O-CA 3.34Å; S226-I229 WeakPolarHBondContact O-CB 3.25Å; S226-I229 PolarHBondContact O-N 3.47Å; I229-L232 PolarHBondContact O-N 2.9Å; I229-F233 VanDerWaalsContact O-CB 3.22Å; I229-F233 WeakPolarHBondContact O-CB 3.47Å; I229-F233 PolarHBondContact O-N 3.32Å
230	I	89.5	Confident	85.8	Confident	10 Å²	10	52.1 Å²	52.1	5%	0.051	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-44.2	174.9	-62.4	165.2	0	0	0	110.8	F187 L191 I194 S226 F233 S234	F187-I230 HydrophobicContact CD2-CG2 4.03Å; F187-I230 HydrophobicContact CE2-CG2 4.42Å; L191-I230 HydrophobicContact CD2-CD1 4.08Å; L191-I230 HydrophobicContact CG-CG2 4.42Å; I194-I230 HydrophobicContact CB-CD1 3.66Å; I194-I230 HydrophobicContact CB-CG1 4.41Å; I194-I230 HydrophobicContact CG1-CD1 3.87Å; I194-I230 HydrophobicContact CG1-CG1 4.11Å; I194-I230 HydrophobicContact CG2-CD1 3.89Å; S226-I230 WeakPolarHBondContact O-CG1 3.43Å; S226-I230 PolarHBondContact O-N 3.46Å; I230-F233 PolarHBondContact O-N 3.29Å; I230-S234 VanDerWaalsContact O-CB 3.31Å; I230-S234 WeakPolarHBondContact O-CB 3.36Å; I230-S234 PolarHBondContact O-N 3.03Å; I230-S234 PolarHBondContact O-OG 3.35Å; I230-S234 VanDerWaalsContact O-OG 3.1Å
231	A	90.2	Very high	86.7	Confident	29 Å²	29	52.1 Å²	52.1	24%	0.24	28%	0.279	C	S	.	.	H	α-helix	trans	-60.7	-49	176.3	0	0	0	0	0	111.5	F187 S227 I228 F233 S234 L235	F187-A231 HydrophobicContact CD2-CB 4.37Å; F187-A231 HydrophobicContact CE2-CB 3.88Å; S227-A231 VanDerWaalsContact O-CB 3.3Å; S227-A231 WeakPolarHBondContact O-CB 3.12Å; S227-A231 PolarHBondContact O-N 2.88Å; I228-A231 PolarHBondContact O-N 2.97Å; A231-F233 PolarHBondContact O-N 3.35Å; A231-S234 WeakPolarHBondContact CA-OG 3.46Å; A231-S234 PolarHBondContact O-N 2.94Å; A231-S234 PolarHBondContact O-OG 3.39Å; A231-L235 WeakPolarHBondContact O-CB 3.34Å; A231-L235 VanDerWaalsContact O-CG 3.32Å; A231-L235 WeakPolarHBondContact O-CG 3.33Å; A231-L235 PolarHBondContact O-N 2.85Å
232	L	92.5	Very high	87.2	Confident	100 Å²	100	49.4 Å²	49.4	52%	0.524	27%	0.267	S	S	.	.	H	α-helix	trans	-59.7	-44.7	176.1	-70.8	170.9	0	0	0	112.1	I228 I229 L235 C236	I228-L232 HydrophobicContact CG2-CD1 4.29Å; I228-L232 WeakPolarHBondContact O-CG 3.48Å; I228-L232 PolarHBondContact O-N 3.44Å; I229-L232 PolarHBondContact O-N 2.9Å; L232-L235 PolarHBondContact O-N 3.1Å; L232-C236 WeakPolarHBondContact O-CB 3.28Å; L232-C236 PolarHBondContact O-N 2.83Å; L232-C236 PolarHBondContact O-SG 3.38Å
233	F	91.6	Very high	87.4	Confident	81 Å²	81	52.7 Å²	52.7	36%	0.355	28%	0.282	S	S	.	.	H	α-helix	trans	-59.5	-49.8	175.6	-178.9	-92.5	0	0	0	111.2	Y190 I229 I230 A231 L235 C236 I237	Y190-F233 HydrophobicContact CD2-CD1 4.3Å; Y190-F233 AromaticContact CD2-CE1 3.96Å; Y190-F233 HydrophobicContact CD2-CE1 3.96Å; Y190-F233 HydrophobicContact CE1-CE1 4.3Å; Y190-F233 HydrophobicContact CE2-CD1 4.3Å; Y190-F233 AromaticContact CE2-CE1 3.53Å; Y190-F233 HydrophobicContact CE2-CE1 3.53Å; Y190-F233 HydrophobicContact CE2-CZ 4.43Å; Y190-F233 AromaticContact CZ-CE1 3.7Å; I229-F233 VanDerWaalsContact O-CB 3.22Å; I229-F233 WeakPolarHBondContact O-CB 3.47Å; I229-F233 PolarHBondContact O-N 3.32Å; I230-F233 PolarHBondContact O-N 3.29Å; A231-F233 PolarHBondContact O-N 3.35Å; F233-L235 VanDerWaalsContact C-N 3.29Å; F233-L235 PolarHBondContact O-N 3.3Å; F233-C236 PolarHBondContact O-N 3.46Å; F233-I237 HydrophobicContact CD1-CD1 3.82Å; F233-I237 HydrophobicContact CD2-CD1 3.69Å; F233-I237 HydrophobicContact CE1-CD1 3.43Å; F233-I237 VanDerWaalsContact CE1-CD1 3.43Å; F233-I237 HydrophobicContact CE2-CD1 3.31Å; F233-I237 HydrophobicContact CG-CD1 3.94Å; F233-I237 HydrophobicContact CZ-CD1 3.18Å; F233-I237 WeakPolarHBondContact O-CB 3.42Å; F233-I237 PolarHBondContact O-N 2.61Å; F233-I237 VanDerWaalsContact O-N 3.13Å
234	S	90.4	Very high	87.6	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-66.1	-27.2	-179.6	68.2	0	0	0	0	114.1	V183 I230 A231 P238	V183-S234 WeakPolarHBondContact CG2-O 3.44Å; I230-S234 VanDerWaalsContact O-CB 3.31Å; I230-S234 WeakPolarHBondContact O-CB 3.36Å; I230-S234 PolarHBondContact O-N 3.03Å; I230-S234 PolarHBondContact O-OG 3.35Å; I230-S234 VanDerWaalsContact O-OG 3.1Å; A231-S234 WeakPolarHBondContact CA-OG 3.46Å; A231-S234 PolarHBondContact O-N 2.94Å; A231-S234 PolarHBondContact O-OG 3.39Å; S234-P238 WeakPolarHBondContact O-CD 3.31Å; S234-P238 WeakPolarHBondContact O-CG 3.1Å
235	L	91.8	Very high	87.6	Confident	76 Å²	76	59 Å²	59	40%	0.398	30%	0.303	S	S	.	.	H	α-helix	trans	-81.9	-45.6	174.8	-74.1	165.7	0	0	0	112.3	Y179 V183 A231 L232 F233 P238 I239	Y179-L235 PolarHBondContact OH-O 3.42Å; V183-L235 HydrophobicContact CG1-CD2 3.78Å; V183-L235 HydrophobicContact CG1-CG 4.35Å; V183-L235 HydrophobicContact CG2-CD2 4.41Å; A231-L235 WeakPolarHBondContact O-CB 3.34Å; A231-L235 VanDerWaalsContact O-CG 3.32Å; A231-L235 WeakPolarHBondContact O-CG 3.33Å; A231-L235 PolarHBondContact O-N 2.85Å; L232-L235 PolarHBondContact O-N 3.1Å; F233-L235 VanDerWaalsContact C-N 3.29Å; F233-L235 PolarHBondContact O-N 3.3Å; L235-P238 WeakPolarHBondContact O-CD 3.46Å; L235-I239 WeakPolarHBondContact O-CG1 3.33Å
236	C	91.9	Very high	87.4	Confident	78 Å²	78	55.5 Å²	55.5	53%	0.527	29%	0.287	S	S	.	.	H	α-helix	trans	-73	-34.7	-174	-69.9	0	0	0	0	113.3	L232 F233 P240	L232-C236 WeakPolarHBondContact O-CB 3.28Å; L232-C236 PolarHBondContact O-N 2.83Å; L232-C236 PolarHBondContact O-SG 3.38Å; F233-C236 PolarHBondContact O-N 3.46Å; C236-P240 WeakPolarHBondContact O-CD 3.29Å
237	I	87.9	Confident	87.2	Confident	25 Å²	25	60.1 Å²	60.1	13%	0.128	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-44.3	-173.4	-91.9	173.8	0	0	0	115	F233 I239 P240 Y271	F233-I237 HydrophobicContact CD1-CD1 3.82Å; F233-I237 HydrophobicContact CD2-CD1 3.69Å; F233-I237 HydrophobicContact CE1-CD1 3.43Å; F233-I237 VanDerWaalsContact CE1-CD1 3.43Å; F233-I237 HydrophobicContact CE2-CD1 3.31Å; F233-I237 HydrophobicContact CG-CD1 3.94Å; F233-I237 HydrophobicContact CZ-CD1 3.18Å; F233-I237 WeakPolarHBondContact O-CB 3.42Å; F233-I237 PolarHBondContact O-N 2.61Å; F233-I237 VanDerWaalsContact O-N 3.13Å; I237-I239 VanDerWaalsContact C-N 3.26Å; I237-I239 PolarHBondContact O-N 3.02Å; I237-P240 VanDerWaalsContact O-CD 3.32Å; I237-P240 WeakPolarHBondContact O-CD 3.29Å; I237-P240 WeakPolarHBondContact O-CG 3.34Å; I237-Y271 WeakPolarHBondContact CG1-OH 3.45Å; I237-Y271 HydrophobicContact CG2-CE1 3.44Å; I237-Y271 VanDerWaalsContact CG2-CE1 3.44Å; I237-Y271 WeakPolarHBondContact CG2-OH 3.38Å
238	P	86.4	Confident	87	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-20.2	-175.8	-22.7	37	0	0	0	113.5	Y179 H182 V183 S234 L235 I241 V242	Y179-P238 HydrophobicContact CD2-CB 3.79Å; Y179-P238 HydrophobicContact CE2-CB 3.94Å; H182-P238 HydrophobicContact CB-CB 4.24Å; H182-P238 HydrophobicContact CB-CG 4.3Å; V183-P238 HydrophobicContact CG2-CB 4.41Å; V183-P238 HydrophobicContact CG2-CG 3.9Å; S234-P238 WeakPolarHBondContact O-CD 3.31Å; S234-P238 WeakPolarHBondContact O-CG 3.1Å; L235-P238 WeakPolarHBondContact O-CD 3.46Å; P238-I241 PolarHBondContact O-N 2.87Å; P238-V242 WeakPolarHBondContact O-CG2 3.35Å; P238-V242 PolarHBondContact O-N 2.81Å
239	I	87.6	Confident	86.6	Confident	73 Å²	73	67 Å²	67	37%	0.374	33%	0.33	S	S	.	.	H	α-helix	trans	-53.5	-60.6	-176.4	-59	175.5	0	0	0	112.9	Y179 L235 I237 I241 V242 I243	Y179-I239 HydrophobicContact CE2-CG1 3.69Å; L235-I239 WeakPolarHBondContact O-CG1 3.33Å; I237-I239 VanDerWaalsContact C-N 3.26Å; I237-I239 PolarHBondContact O-N 3.02Å; I239-I241 PolarHBondContact O-N 3.41Å; I239-I241 VanDerWaalsContact O-N 3.12Å; I239-V242 PolarHBondContact O-N 2.81Å; I239-I243 HydrophobicContact CG2-CD1 3.66Å; I239-I243 WeakPolarHBondContact O-CD1 3.47Å; I239-I243 VanDerWaalsContact O-CG1 3.26Å; I239-I243 WeakPolarHBondContact O-CG1 3.22Å; I239-I243 PolarHBondContact O-N 3.43Å; I239-I243 VanDerWaalsContact O-N 3.14Å
240	P	83.2	Confident	86	Confident	72 Å²	72	64.4 Å²	64.4	47%	0.468	32%	0.321	S	S	.	.	H	α-helix	trans	-61.6	-23	-177.4	23.5	-36	0	0	0	114.2	C236 I237 R244	C236-P240 WeakPolarHBondContact O-CD 3.29Å; I237-P240 VanDerWaalsContact O-CD 3.32Å; I237-P240 WeakPolarHBondContact O-CD 3.29Å; I237-P240 WeakPolarHBondContact O-CG 3.34Å; P240-R244 WeakPolarHBondContact O-CG 3.38Å
241	I	82.7	Confident	85.1	Confident	11 Å²	11	69.3 Å²	69.3	6%	0.056	35%	0.352	C	S	.	.	H	α-helix	trans	-83.9	-51.6	-176.8	-53.8	159.5	0	0	0	109.4	P238 I239 I243 R244 Q245 F268 Y271	P238-I241 PolarHBondContact O-N 2.87Å; I239-I241 PolarHBondContact O-N 3.41Å; I239-I241 VanDerWaalsContact O-N 3.12Å; I241-I243 PolarHBondContact O-N 3.23Å; I241-R244 PolarHBondContact O-N 3.1Å; I241-Q245 WeakPolarHBondContact O-CB 3.3Å; I241-Q245 PolarHBondContact O-N 3.47Å; I241-F268 HydrophobicContact CG2-CB 3.73Å; I241-F268 HydrophobicContact CG2-CD2 3.73Å; I241-F268 HydrophobicContact CG2-CG 4.21Å; I241-Y271 HydrophobicContact CD1-CD1 3.15Å; I241-Y271 HydrophobicContact CD1-CD2 3.87Å; I241-Y271 HydrophobicContact CD1-CE1 3.36Å; I241-Y271 HydrophobicContact CD1-CE2 4.04Å; I241-Y271 HydrophobicContact CD1-CG 3.42Å; I241-Y271 VanDerWaalsContact CD1-CG 3.42Å; I241-Y271 HydrophobicContact CG1-CD1 4.42Å; I241-Y271 HydrophobicContact CG1-CD2 4.5Å; I241-Y271 HydrophobicContact CG1-CG 4.31Å
242	V	84.5	Confident	84.1	Confident	7 Å²	7	71.1 Å²	71.1	4%	0.042	36%	0.363	C	S	.	.	H	α-helix	trans	-62.6	-29.1	179.2	172.5	0	0	0	0	111.9	H175 V178 Y179 P238 I239	H175-V242 HydrophobicContact CB-CG1 3.67Å; H175-V242 PolarHBondContact CE1-O 2.82Å; H175-V242 WeakPolarHBondContact ND1-CG1 3.43Å; H175-V242 PolarHBondContact ND1-O 3.04Å; V178-V242 HydrophobicContact CG1-CG2 4.27Å; Y179-V242 HydrophobicContact CD2-CG2 4.44Å; P238-V242 WeakPolarHBondContact O-CG2 3.35Å; P238-V242 PolarHBondContact O-N 2.81Å; I239-V242 PolarHBondContact O-N 2.81Å
243	I	83.1	Confident	83	Confident	115 Å²	115	74.6 Å²	74.6	59%	0.59	38%	0.382	S	S	*	.	H	α-helix	trans	-68.5	-37.2	172.8	-69.8	169.4	0	0	0	111.9	I239 I241	I239-I243 HydrophobicContact CG2-CD1 3.66Å; I239-I243 WeakPolarHBondContact O-CD1 3.47Å; I239-I243 VanDerWaalsContact O-CG1 3.26Å; I239-I243 WeakPolarHBondContact O-CG1 3.22Å; I239-I243 PolarHBondContact O-N 3.43Å; I239-I243 VanDerWaalsContact O-N 3.14Å; I241-I243 PolarHBondContact O-N 3.23Å
244	R	82.2	Confident	82.1	Confident	173 Å²	173	80.1 Å²	80.1	65%	0.653	41%	0.406	S	S	*	.	H	α-helix	trans	-85	-19.6	-178	-71.8	-179.4	176.8	-170.5	-0.2	114	P240 I241 Y246 T261	P240-R244 WeakPolarHBondContact O-CG 3.38Å; I241-R244 PolarHBondContact O-N 3.1Å; R244-Y246 PolarHBondContact O-N 3.07Å; R244-T261 PolarHBondContact O-OG1 2.92Å
245	Q	82.3	Confident	81.3	Confident	10 Å²	10	82.6 Å²	82.6	5%	0.047	42%	0.418	C	S	.	.	H	α-helix	trans	-70.5	-27.4	-173.4	-173.4	174.9	9.7	0	0	114.6	I241 T261 I265	I241-Q245 WeakPolarHBondContact O-CB 3.3Å; I241-Q245 PolarHBondContact O-N 3.47Å; Q245-T261 PolarHBondContact O-N 3.27Å; Q245-T261 PolarHBondContact O-OG1 2.97Å; Q245-I265 HydrophobicContact CG-CG1 4.26Å
246	Y	83.3	Confident	80.8	Confident	45 Å²	45	80 Å²	80	18%	0.176	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	133.9	-173.1	-59.9	-72.8	0	0	0	113.2	C174 H175 V178 R244 C258 G259	C174-Y246 HydrophobicContact CB-CE2 4.48Å; H175-Y246 AromaticContact CE1-CD2 3.77Å; H175-Y246 AromaticContact ND1-CD2 3.71Å; V178-Y246 HydrophobicContact CG2-CE2 4.48Å; V178-Y246 WeakPolarHBondContact CG2-OH 3.3Å; R244-Y246 PolarHBondContact O-N 3.07Å; Y246-C258 HydrophobicContact CD1-CB 3.68Å; Y246-C258 HydrophobicContact CE1-CB 4.23Å; Y246-C258 HydrophobicContact CG-CB 4.05Å; Y246-G259 CarbonylContact C-O 3.55Å; Y246-G259 VanDerWaalsContact CA-O 3.31Å; Y246-G259 WeakPolarHBondContact CA-O 3.4Å
247	E	82.3	Confident	80.2	Confident	116 Å²	116	77.7 Å²	77.7	54%	0.542	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	152.3	166.7	-89.9	163.6	-147.6	0	0	110.7	W171 M249 G259 T261	W171-E247 VanDerWaalsContact CZ3-C 3.48Å; W171-E247 WeakPolarHBondContact CZ3-O 3.5Å; E247-M249 PolarHBondContact O-N 2.9Å; E247-G259 PolarHBondContact N-O 3.43Å; E247-G259 WeakPolarHBondContact O-CA 3.27Å; E247-G259 PolarHBondContact O-N 2.94Å; E247-T261 HydrophobicContact CB-CG2 3.89Å; E247-T261 HydrophobicContact CG-CG2 3.48Å; E247-T261 VanDerWaalsContact CG-CG2 3.48Å; E247-T261 VanDerWaalsContact OE1-CG2 3.31Å; E247-T261 WeakPolarHBondContact OE1-CG2 3.28Å
248	R	82.8	Confident	79.9	Confident	160 Å²	160	77.5 Å²	77.5	60%	0.604	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	101.2	-176.8	-175.2	178.4	170.4	-177	-3.1	110.6	W171 C250 C256	W171-R248 HydrophobicContact CD2-CB 4.07Å; W171-R248 HydrophobicContact CD2-CG 3.87Å; W171-R248 HydrophobicContact CE3-CB 3.81Å; W171-R248 HydrophobicContact CE3-CG 3.97Å; W171-R248 HydrophobicContact CG-CG 4.31Å; W171-R248 HydrophobicContact CH2-CB 3.83Å; W171-R248 HydrophobicContact CZ2-CB 4.07Å; W171-R248 HydrophobicContact CZ3-CB 3.69Å; W171-R248 HydrophobicContact CZ3-CG 4.37Å; R248-C250 PolarHBondContact NE-SG 2.98Å; R248-C256 HydrophobicContact CG-CB 4.03Å; R248-C256 PolarHBondContact NE-SG 3.33Å; R248-C256 VanDerWaalsContact NE-SG 3.35Å; R248-C256 PolarHBondContact NH2-SG 2.96Å; R248-C256 VanDerWaalsContact NH2-SG 3.36Å
249	M	81	Confident	79.4	Confident	104 Å²	104	77.6 Å²	77.6	51%	0.512	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	104	175.4	-70.5	-173.8	172.9	0	0	110.6	E247 L257	E247-M249 PolarHBondContact O-N 2.9Å; M249-L257 PolarHBondContact N-O 2.9Å; M249-L257 PolarHBondContact O-N 3.44Å
250	C	78.8	Confident	79	Confident	64 Å²	64	77.4 Å²	77.4	43%	0.432	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	104.5	175.4	-55	0	0	0	0	110.3	R248 S252 C256	R248-C250 PolarHBondContact NE-SG 2.98Å; C250-S252 VanDerWaalsContact C-N 3.3Å; C250-C256 HydrophobicContact CB-CB 4.09Å; C250-C256 WeakPolarHBondContact CB-SG 3.12Å; C250-C256 WeakPolarHBondContact SG-CB 3.26Å; C250-C256 CovalentContact SG-SG 2.04Å; C250-C256 PolarHBondContact SG-SG 3.3Å
251	T	71.4	Confident	78.9	Confident	113 Å²	113	74.8 Å²	74.8	69%	0.693	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	-17.3	174.3	51.4	0	0	0	0	112.6
252	S	68.7	Low	78.6	Confident	68 Å²	68	78.6 Å²	78.6	48%	0.476	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	154.8	175.6	-177.1	0	0	0	0	110.2	C250 K254 I255	C250-S252 VanDerWaalsContact C-N 3.3Å; S252-K254 PolarHBondContact O-N 3.48Å; S252-I255 PolarHBondContact O-N 3.03Å; S252-I255 VanDerWaalsContact O-N 3.11Å; S252-I255 VanDerWaalsContact O-O 3.11Å
253	N	68.8	Low	78.4	Confident	173 Å²	173	84.2 Å²	84.2	93%	0.925	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-15.3	179.5	-74.9	-4	0	0	0	114.8
254	K	72.9	Confident	78.2	Confident	197 Å²	197	78.9 Å²	78.9	86%	0.857	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-16.3	-179.3	-64.6	-175.4	179.7	179.7	0	114.8	S252	S252-K254 PolarHBondContact O-N 3.48Å
255	I	73.4	Confident	78.1	Confident	55 Å²	55	72.3 Å²	72.3	28%	0.282	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	115.4	-174.7	-53.9	179.9	0	0	0	109.1	S252 L257	S252-I255 PolarHBondContact O-N 3.03Å; S252-I255 VanDerWaalsContact O-N 3.11Å; S252-I255 VanDerWaalsContact O-O 3.11Å; I255-L257 HydrophobicContact CG2-CD2 4.22Å; I255-L257 HydrophobicContact CG2-CG 4.29Å
256	C	81	Confident	78	Confident	21 Å²	21	72 Å²	72	14%	0.142	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.7	168.8	-58.1	0	0	0	0	109.2	W171 R248 C250	W171-C256 HydrophobicContact CB-CB 4.07Å; W171-C256 WeakPolarHBondContact CB-O 3.43Å; W171-C256 PolarHBondContact N-O 3.41Å; R248-C256 HydrophobicContact CG-CB 4.03Å; R248-C256 PolarHBondContact NE-SG 3.33Å; R248-C256 VanDerWaalsContact NE-SG 3.35Å; R248-C256 PolarHBondContact NH2-SG 2.96Å; R248-C256 VanDerWaalsContact NH2-SG 3.36Å; C250-C256 HydrophobicContact CB-CB 4.09Å; C250-C256 WeakPolarHBondContact CB-SG 3.12Å; C250-C256 WeakPolarHBondContact SG-CB 3.26Å; C250-C256 CovalentContact SG-SG 2.04Å; C250-C256 PolarHBondContact SG-SG 3.3Å
257	L	81	Confident	78	Confident	29 Å²	29	72.1 Å²	72.1	15%	0.152	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	158	180	-62	165.1	0	0	0	109.2	K169 M249 I255 G259	K169-L257 HydrophobicContact CB-CD2 3.89Å; K169-L257 CarbonylContact O-C 3.47Å; K169-L257 VanDerWaalsContact O-CA 3.27Å; K169-L257 WeakPolarHBondContact O-CA 3.42Å; M249-L257 PolarHBondContact N-O 2.9Å; M249-L257 PolarHBondContact O-N 3.44Å; I255-L257 HydrophobicContact CG2-CD2 4.22Å; I255-L257 HydrophobicContact CG2-CG 4.29Å; L257-G259 PolarHBondContact O-N 3.13Å
258	C	80.8	Confident	78	Confident	21 Å²	21	68 Å²	68	14%	0.142	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	106.9	174.4	-52.8	0	0	0	0	109.7	K169 R170 C174 Y246	K169-C258 PolarHBondContact O-N 3.48Å; R170-C258 PolarHBondContact O-SG 3.18Å; C174-C258 HydrophobicContact CB-CB 3.74Å; C174-C258 WeakPolarHBondContact CB-SG 3.41Å; C174-C258 WeakPolarHBondContact SG-CB 3.14Å; C174-C258 CovalentContact SG-SG 2.01Å; C174-C258 PolarHBondContact SG-SG 2.84Å; Y246-C258 HydrophobicContact CD1-CB 3.68Å; Y246-C258 HydrophobicContact CE1-CB 4.23Å; Y246-C258 HydrophobicContact CG-CB 4.05Å
259	G	76.5	Confident	78	Confident	2 Å²	2	62 Å²	62	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	127.4	169.3	0	0	0	0	0	109.8	Y246 E247 L257	Y246-G259 CarbonylContact C-O 3.55Å; Y246-G259 VanDerWaalsContact CA-O 3.31Å; Y246-G259 WeakPolarHBondContact CA-O 3.4Å; E247-G259 PolarHBondContact N-O 3.43Å; E247-G259 WeakPolarHBondContact O-CA 3.27Å; E247-G259 PolarHBondContact O-N 2.94Å; L257-G259 PolarHBondContact O-N 3.13Å
260	P	78.2	Confident	78.2	Confident	70 Å²	70	61.5 Å²	61.5	46%	0.455	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	132.5	174.7	27	-32.7	0	0	0	111.3	I265	P260-I265 HydrophobicContact CB-CD1 3.38Å; P260-I265 HydrophobicContact CB-CG1 4.43Å
261	T	81.3	Confident	78.5	Confident	17 Å²	17	61.7 Å²	61.7	10%	0.104	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-92.4	130.3	168.9	75.8	0	0	0	0	109.4	R244 Q245 E247 H263 G264 I265	R244-T261 PolarHBondContact O-OG1 2.92Å; Q245-T261 PolarHBondContact O-N 3.27Å; Q245-T261 PolarHBondContact O-OG1 2.97Å; E247-T261 HydrophobicContact CB-CG2 3.89Å; E247-T261 HydrophobicContact CG-CG2 3.48Å; E247-T261 VanDerWaalsContact CG-CG2 3.48Å; E247-T261 VanDerWaalsContact OE1-CG2 3.31Å; E247-T261 WeakPolarHBondContact OE1-CG2 3.28Å; T261-H263 PolarHBondContact O-N 3.45Å; T261-G264 PolarHBondContact O-N 2.85Å; T261-G264 VanDerWaalsContact OG1-CA 3.23Å; T261-G264 WeakPolarHBondContact OG1-CA 3.42Å; T261-G264 PolarHBondContact OG1-N 2.81Å; T261-G264 VanDerWaalsContact OG1-N 3.11Å; T261-I265 WeakPolarHBondContact O-CG1 3.47Å; T261-I265 PolarHBondContact O-N 3.22Å
262	M	77.3	Confident	79.1	Confident	91 Å²	91	56.8 Å²	56.8	45%	0.448	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-46.9	-176.1	-60.9	-51.9	-174.5	0	0	111.4	I34 D35 I38 G264 I265 A266	I34-M262 HydrophobicContact CG2-CB 4.32Å; D35-M262 WeakPolarHBondContact OD1-CG 3.38Å; I38-M262 HydrophobicContact CB-SD 4.45Å; I38-M262 HydrophobicContact CD1-CB 3.85Å; I38-M262 HydrophobicContact CD1-CG 4.33Å; I38-M262 VanDerWaalsContact CD1-O 3.27Å; I38-M262 WeakPolarHBondContact CD1-O 3.49Å; I38-M262 HydrophobicContact CD1-SD 3.66Å; I38-M262 HydrophobicContact CG2-SD 3.98Å; M262-G264 VanDerWaalsContact C-N 3.35Å; M262-G264 PolarHBondContact O-N 3.45Å; M262-I265 PolarHBondContact O-N 3.42Å; M262-A266 PolarHBondContact O-N 2.86Å
263	H	79.6	Confident	79.9	Confident	125 Å²	125	54.6 Å²	54.6	58%	0.579	27%	0.273	S	S	*	.	H	α-helix	trans	-65.5	-35.4	177.4	-171.9	67.1	0	0	0	113.1	T261 T267	T261-H263 PolarHBondContact O-N 3.45Å; H263-T267 WeakPolarHBondContact O-CB 3.32Å; H263-T267 PolarHBondContact O-N 2.83Å; H263-T267 PolarHBondContact O-OG1 3.37Å
264	G	79.4	Confident	80.8	Confident	3 Å²	3	49.4 Å²	49.4	3%	0.031	25%	0.247	C	C	.	.	H	α-helix	trans	-71.3	-40.4	178	0	0	0	0	0	112.9	T261 M262 T267 F268	T261-G264 PolarHBondContact O-N 2.85Å; T261-G264 VanDerWaalsContact OG1-CA 3.23Å; T261-G264 WeakPolarHBondContact OG1-CA 3.42Å; T261-G264 PolarHBondContact OG1-N 2.81Å; T261-G264 VanDerWaalsContact OG1-N 3.11Å; M262-G264 VanDerWaalsContact C-N 3.35Å; M262-G264 PolarHBondContact O-N 3.45Å; G264-T267 PolarHBondContact O-N 3.43Å; G264-F268 WeakPolarHBondContact O-CB 3.42Å; G264-F268 PolarHBondContact O-N 2.85Å
265	I	79.5	Confident	81.4	Confident	34 Å²	34	41 Å²	41	17%	0.174	21%	0.211	C	C	.	.	H	α-helix	trans	-62.8	-47.9	173	-73.1	176.3	0	0	0	111.1	I38 Q245 P260 T261 M262 T267 F268 I269	I38-I265 HydrophobicContact CD1-CB 4.08Å; I38-I265 HydrophobicContact CD1-CG2 4.01Å; I38-I265 HydrophobicContact CG1-CG2 4.02Å; Q245-I265 HydrophobicContact CG-CG1 4.26Å; P260-I265 HydrophobicContact CB-CD1 3.38Å; P260-I265 HydrophobicContact CB-CG1 4.43Å; T261-I265 WeakPolarHBondContact O-CG1 3.47Å; T261-I265 PolarHBondContact O-N 3.22Å; M262-I265 PolarHBondContact O-N 3.42Å; I265-T267 VanDerWaalsContact C-N 3.32Å; I265-T267 PolarHBondContact O-N 2.99Å; I265-F268 WeakPolarHBondContact O-CB 3.11Å; I265-F268 PolarHBondContact O-N 2.74Å; I265-F268 VanDerWaalsContact O-N 3.16Å; I265-I269 HydrophobicContact CG2-CD1 3.58Å; I265-I269 HydrophobicContact CG2-CG1 4.27Å; I265-I269 WeakPolarHBondContact O-CG1 3.37Å; I265-I269 PolarHBondContact O-N 3.12Å
266	A	81	Confident	81.9	Confident	3 Å²	3	38.4 Å²	38.4	3%	0.025	20%	0.198	C	C	.	.	H	α-helix	trans	-59.4	-46.2	178.7	0	0	0	0	0	111.2	I34 M262 F268 I269 Y270	I34-A266 HydrophobicContact CD1-CB 4.44Å; I34-A266 HydrophobicContact CG1-CB 4.22Å; I34-A266 HydrophobicContact CG2-CB 3.72Å; M262-A266 PolarHBondContact O-N 2.86Å; A266-F268 VanDerWaalsContact C-N 3.33Å; A266-F268 PolarHBondContact O-N 3.08Å; A266-I269 PolarHBondContact O-N 3.49Å; A266-Y270 WeakPolarHBondContact O-CD2 3.15Å; A266-Y270 PolarHBondContact O-N 3.34Å; A266-Y270 VanDerWaalsContact O-N 3.08Å
267	T	81.9	Confident	82.2	Confident	49 Å²	49	37.6 Å²	37.6	30%	0.301	19%	0.192	S	C	.	.	H	α-helix	trans	-58.9	-43.2	175.2	-57	0	0	0	0	111.6	H263 G264 I265 Y271	H263-T267 WeakPolarHBondContact O-CB 3.32Å; H263-T267 PolarHBondContact O-N 2.83Å; H263-T267 PolarHBondContact O-OG1 3.37Å; G264-T267 PolarHBondContact O-N 3.43Å; I265-T267 VanDerWaalsContact C-N 3.32Å; I265-T267 PolarHBondContact O-N 2.99Å; T267-Y271 WeakPolarHBondContact O-CB 3.43Å; T267-Y271 PolarHBondContact O-N 3.45Å
268	F	83.9	Confident	82.6	Confident	30 Å²	30	38.2 Å²	38.2	13%	0.132	20%	0.195	C	C	.	.	H	α-helix	trans	-60.5	-47.8	175.7	171	-89.6	0	0	0	112	V178 I241 G264 I265 A266 Y271 D272	V178-F268 HydrophobicContact CG1-CD2 4.49Å; V178-F268 HydrophobicContact CG1-CE2 3.63Å; V178-F268 HydrophobicContact CG1-CZ 3.93Å; I241-F268 HydrophobicContact CG2-CB 3.73Å; I241-F268 HydrophobicContact CG2-CD2 3.73Å; I241-F268 HydrophobicContact CG2-CG 4.21Å; G264-F268 WeakPolarHBondContact O-CB 3.42Å; G264-F268 PolarHBondContact O-N 2.85Å; I265-F268 WeakPolarHBondContact O-CB 3.11Å; I265-F268 PolarHBondContact O-N 2.74Å; I265-F268 VanDerWaalsContact O-N 3.16Å; A266-F268 VanDerWaalsContact C-N 3.33Å; A266-F268 PolarHBondContact O-N 3.08Å; F268-Y271 PolarHBondContact O-N 3.4Å; F268-D272 VanDerWaalsContact O-CB 3.24Å; F268-D272 WeakPolarHBondContact O-CB 3.42Å; F268-D272 PolarHBondContact O-N 3.17Å
269	I	82.5	Confident	83.1	Confident	34 Å²	34	39.7 Å²	39.7	17%	0.174	20%	0.201	C	C	.	.	H	α-helix	trans	-60.5	-52.2	-179.1	-67.4	161	0	0	0	110.8	L41 I265 A266 Y271 F273	L41-I269 HydrophobicContact CD1-CD1 3.57Å; I265-I269 HydrophobicContact CG2-CD1 3.58Å; I265-I269 HydrophobicContact CG2-CG1 4.27Å; I265-I269 WeakPolarHBondContact O-CG1 3.37Å; I265-I269 PolarHBondContact O-N 3.12Å; A266-I269 PolarHBondContact O-N 3.49Å; I269-Y271 VanDerWaalsContact C-N 3.3Å; I269-Y271 PolarHBondContact O-N 3.12Å; I269-F273 VanDerWaalsContact O-CB 3.28Å; I269-F273 WeakPolarHBondContact O-CB 3.34Å; I269-F273 PolarHBondContact O-N 2.97Å
270	Y	84.4	Confident	83.7	Confident	92 Å²	92	39.6 Å²	39.6	36%	0.361	20%	0.2	S	C	.	.	H	α-helix	trans	-62	-38.9	178.8	-74.7	-67.3	0	0	0	112.1	L37 A266 V274 H324 H327	L37-Y270 HydrophobicContact CD2-CE2 4.33Å; A266-Y270 WeakPolarHBondContact O-CD2 3.15Å; A266-Y270 PolarHBondContact O-N 3.34Å; A266-Y270 VanDerWaalsContact O-N 3.08Å; Y270-V274 WeakPolarHBondContact O-CB 3.23Å; Y270-V274 WeakPolarHBondContact O-CG2 3.13Å; Y270-V274 PolarHBondContact O-N 2.9Å; Y270-H324 AromaticContact CD1-CE1 3.47Å; Y270-H324 VanDerWaalsContact CD1-CE1 3.47Å; Y270-H324 WeakPolarHBondContact CD1-CE1 3.25Å; Y270-H324 AromaticContact CD1-ND1 3.98Å; Y270-H324 AromaticContact CE1-CE1 3.29Å; Y270-H324 WeakPolarHBondContact CE1-CE1 3.32Å; Y270-H324 AromaticContact CE1-ND1 3.33Å; Y270-H324 VanDerWaalsContact CE1-ND1 3.33Å; Y270-H324 WeakPolarHBondContact CE1-ND1 3.26Å; Y270-H324 AromaticContact CZ-ND1 4Å; Y270-H327 PolarHBondContact OH-CE1 3.41Å; Y270-H327 PolarHBondContact OH-ND1 2.59Å; Y270-H327 VanDerWaalsContact OH-ND1 3.11Å
271	Y	84.4	Confident	84.2	Confident	69 Å²	69	36.8 Å²	36.8	27%	0.271	18%	0.182	S	C	.	.	H	α-helix	trans	-69.9	-48.5	-179.9	-166.5	-77	0	0	0	112.3	I237 I241 T267 F268 I269 F273 V274 I275	I237-Y271 WeakPolarHBondContact CG1-OH 3.45Å; I237-Y271 HydrophobicContact CG2-CE1 3.44Å; I237-Y271 VanDerWaalsContact CG2-CE1 3.44Å; I237-Y271 WeakPolarHBondContact CG2-OH 3.38Å; I241-Y271 HydrophobicContact CD1-CD1 3.15Å; I241-Y271 HydrophobicContact CD1-CD2 3.87Å; I241-Y271 HydrophobicContact CD1-CE1 3.36Å; I241-Y271 HydrophobicContact CD1-CE2 4.04Å; I241-Y271 HydrophobicContact CD1-CG 3.42Å; I241-Y271 VanDerWaalsContact CD1-CG 3.42Å; I241-Y271 HydrophobicContact CG1-CD1 4.42Å; I241-Y271 HydrophobicContact CG1-CD2 4.5Å; I241-Y271 HydrophobicContact CG1-CG 4.31Å; T267-Y271 WeakPolarHBondContact O-CB 3.43Å; T267-Y271 PolarHBondContact O-N 3.45Å; F268-Y271 PolarHBondContact O-N 3.4Å; I269-Y271 VanDerWaalsContact C-N 3.3Å; I269-Y271 PolarHBondContact O-N 3.12Å; Y271-F273 VanDerWaalsContact C-N 3.31Å; Y271-F273 PolarHBondContact O-N 3.24Å; Y271-V274 PolarHBondContact O-N 3.31Å; Y271-I275 HydrophobicContact CD1-CB 4.02Å; Y271-I275 HydrophobicContact CD1-CG1 3.78Å; Y271-I275 HydrophobicContact CD2-CG1 4.39Å; Y271-I275 HydrophobicContact CE1-CB 3.72Å; Y271-I275 HydrophobicContact CE1-CD1 3.9Å; Y271-I275 HydrophobicContact CE1-CG1 3.4Å; Y271-I275 VanDerWaalsContact CE1-CG1 3.4Å; Y271-I275 HydrophobicContact CE1-CG2 3.91Å; Y271-I275 HydrophobicContact CE2-CD1 4.17Å; Y271-I275 HydrophobicContact CE2-CG1 4.07Å; Y271-I275 HydrophobicContact CG-CG1 4.26Å; Y271-I275 WeakPolarHBondContact O-CB 3.32Å; Y271-I275 PolarHBondContact O-N 3.47Å; Y271-I275 WeakPolarHBondContact OH-CD1 3.22Å
272	D	84.3	Confident	84.7	Confident	10 Å²	10	41 Å²	41	5%	0.053	20%	0.203	C	C	.	.	H	α-helix	trans	-57.4	-45.4	178	-175.9	69.4	0	0	0	110.4	H182 R185 F268 T276 R277	H182-D272 IonicContact CD2-OD1 3.73Å; H182-D272 IonicContact NE2-OD1 3.38Å; R185-D272 IonicContact CZ-OD1 2.76Å; R185-D272 VanDerWaalsContact CZ-OD1 3.26Å; R185-D272 IonicContact NH1-OD1 2.87Å; R185-D272 PolarHBondContact NH1-OD1 3.36Å; R185-D272 IonicContact NH1-OD2 3.72Å; R185-D272 PolarHBondContact NH1-OD2 2.91Å; R185-D272 IonicContact NH2-OD1 2.61Å; R185-D272 PolarHBondContact NH2-OD1 3.09Å; R185-D272 IonicContact NH2-OD2 3.52Å; F268-D272 VanDerWaalsContact O-CB 3.24Å; F268-D272 WeakPolarHBondContact O-CB 3.42Å; F268-D272 PolarHBondContact O-N 3.17Å; D272-T276 WeakPolarHBondContact O-CB 3.37Å; D272-T276 PolarHBondContact O-N 3.07Å; D272-T276 PolarHBondContact O-OG1 3.13Å; D272-R277 IonicContact OD2-CZ 2.66Å; D272-R277 VanDerWaalsContact OD2-CZ 3.28Å; D272-R277 IonicContact OD2-NH1 3.15Å; D272-R277 PolarHBondContact OD2-NH1 3.33Å; D272-R277 VanDerWaalsContact OD2-NH1 3.13Å; D272-R277 IonicContact OD2-NH2 3.96Å; D272-R277 PolarHBondContact OD2-NH2 3.44Å
273	F	85.4	Confident	85.4	Confident	22 Å²	22	40.6 Å²	40.6	10%	0.096	20%	0.199	C	C	.	.	I	π-helix	trans	-59.1	-52.3	174.6	174.1	-121.9	0	0	0	113	I269 Y271 R277 I278 V317 E320 V321 H324	I269-F273 VanDerWaalsContact O-CB 3.28Å; I269-F273 WeakPolarHBondContact O-CB 3.34Å; I269-F273 PolarHBondContact O-N 2.97Å; Y271-F273 VanDerWaalsContact C-N 3.31Å; Y271-F273 PolarHBondContact O-N 3.24Å; F273-R277 WeakPolarHBondContact O-CB 3.19Å; F273-R277 PolarHBondContact O-N 3.26Å; F273-I278 HydrophobicContact CD1-CG1 4.21Å; F273-I278 HydrophobicContact CD2-CG1 4Å; F273-I278 HydrophobicContact CE1-CD1 4.28Å; F273-I278 HydrophobicContact CE1-CG1 3.82Å; F273-I278 HydrophobicContact CE2-CD1 3.72Å; F273-I278 HydrophobicContact CE2-CG1 3.61Å; F273-I278 HydrophobicContact CG-CG1 4.31Å; F273-I278 HydrophobicContact CZ-CD1 3.55Å; F273-I278 HydrophobicContact CZ-CG1 3.51Å; F273-I278 PolarHBondContact O-N 3.19Å; F273-V317 HydrophobicContact CE2-CG1 4.37Å; F273-E320 HydrophobicContact CD2-CB 3.88Å; F273-E320 VanDerWaalsContact CD2-OE2 3.23Å; F273-E320 WeakPolarHBondContact CD2-OE2 3.24Å; F273-E320 HydrophobicContact CE2-CB 3.78Å; F273-V321 HydrophobicContact CE2-CG2 4.26Å; F273-V321 HydrophobicContact CZ-CG2 3.76Å; F273-H324 AromaticContact CD1-CD2 3.65Å; F273-H324 AromaticContact CD1-NE2 3.44Å; F273-H324 WeakPolarHBondContact CD1-NE2 3.48Å; F273-H324 AromaticContact CE1-CD2 3.51Å; F273-H324 AromaticContact CE1-NE2 3.84Å; F273-H324 AromaticContact CG-NE2 3.83Å; F273-H324 AromaticContact CZ-CD2 3.96Å
274	V	88	Confident	85.8	Confident	63 Å²	63	34.7 Å²	34.7	38%	0.382	17%	0.172	S	C	.	.	I	π-helix	trans	-67.1	-48.7	-177.2	171.8	0	0	0	0	111.6	Y270 Y271 I278 I279	Y270-V274 WeakPolarHBondContact O-CB 3.23Å; Y270-V274 WeakPolarHBondContact O-CG2 3.13Å; Y270-V274 PolarHBondContact O-N 2.9Å; Y271-V274 PolarHBondContact O-N 3.31Å; V274-I278 PolarHBondContact O-N 2.77Å; V274-I279 HydrophobicContact CG1-CD1 3.79Å; V274-I279 HydrophobicContact CG1-CG1 4.14Å; V274-I279 WeakPolarHBondContact O-CB 3.31Å; V274-I279 VanDerWaalsContact O-CG1 3.31Å; V274-I279 WeakPolarHBondContact O-CG1 3.46Å; V274-I279 PolarHBondContact O-N 3.49Å
275	I	86.6	Confident	86.3	Confident	22 Å²	22	38 Å²	38	11%	0.113	19%	0.188	C	C	.	.	I	π-helix	trans	-83.1	-42.6	-168.8	-65.8	-103	0	0	0	112	Y190 Y271 I279 P280	Y190-I275 HydrophobicContact CE2-CG2 4.4Å; Y190-I275 PolarHBondContact OH-O 2.89Å; Y271-I275 HydrophobicContact CD1-CB 4.02Å; Y271-I275 HydrophobicContact CD1-CG1 3.78Å; Y271-I275 HydrophobicContact CD2-CG1 4.39Å; Y271-I275 HydrophobicContact CE1-CB 3.72Å; Y271-I275 HydrophobicContact CE1-CD1 3.9Å; Y271-I275 HydrophobicContact CE1-CG1 3.4Å; Y271-I275 VanDerWaalsContact CE1-CG1 3.4Å; Y271-I275 HydrophobicContact CE1-CG2 3.91Å; Y271-I275 HydrophobicContact CE2-CD1 4.17Å; Y271-I275 HydrophobicContact CE2-CG1 4.07Å; Y271-I275 HydrophobicContact CG-CG1 4.26Å; Y271-I275 WeakPolarHBondContact O-CB 3.32Å; Y271-I275 PolarHBondContact O-N 3.47Å; Y271-I275 WeakPolarHBondContact OH-CD1 3.22Å; I275-I279 HydrophobicContact CD1-CD1 4.29Å; I275-P280 WeakPolarHBondContact O-CD 3.36Å
276	T	83	Confident	86.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.21	C	C	.	.	I	π-helix	trans	-89.1	-16.3	-174.2	77.7	0	0	0	0	113.8	H182 S189 D272	H182-T276 VanDerWaalsContact CE1-CG2 3.46Å; H182-T276 WeakPolarHBondContact CE1-CG2 3.42Å; S189-T276 PolarHBondContact OG-O 3.36Å; D272-T276 WeakPolarHBondContact O-CB 3.37Å; D272-T276 PolarHBondContact O-N 3.07Å; D272-T276 PolarHBondContact O-OG1 3.13Å
277	R	87.2	Confident	87.1	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.015	21%	0.209	C	C	.	.	I	π-helix	trans	-124.8	-65.3	-176	-46.2	-174.9	-177.4	91.8	16.2	113.6	D272 F273 I279 P280 A281 M313 H316 V317 E320 Y351	D272-R277 IonicContact OD2-CZ 2.66Å; D272-R277 VanDerWaalsContact OD2-CZ 3.28Å; D272-R277 IonicContact OD2-NH1 3.15Å; D272-R277 PolarHBondContact OD2-NH1 3.33Å; D272-R277 VanDerWaalsContact OD2-NH1 3.13Å; D272-R277 IonicContact OD2-NH2 3.96Å; D272-R277 PolarHBondContact OD2-NH2 3.44Å; F273-R277 WeakPolarHBondContact O-CB 3.19Å; F273-R277 PolarHBondContact O-N 3.26Å; R277-I279 PolarHBondContact O-N 2.9Å; R277-P280 WeakPolarHBondContact O-CD 3.41Å; R277-A281 VanDerWaalsContact O-CB 3.31Å; R277-A281 WeakPolarHBondContact O-CB 3.35Å; R277-A281 PolarHBondContact O-N 2.88Å; R277-M313 HydrophobicContact CB-SD 4.28Å; R277-H316 PolarHBondContact NE-CD2 2.88Å; R277-H316 VanDerWaalsContact NE-CD2 3.33Å; R277-V317 HydrophobicContact CB-CG2 3.74Å; R277-V317 HydrophobicContact CG-CG2 4.5Å; R277-E320 WeakPolarHBondContact CD-OE2 3.27Å; R277-E320 IonicContact CZ-OE1 2.74Å; R277-E320 IonicContact CZ-OE2 3.29Å; R277-E320 IonicContact NE-OE2 2.79Å; R277-E320 PolarHBondContact NE-OE2 3.49Å; R277-E320 IonicContact NH1-OE1 3.26Å; R277-E320 PolarHBondContact NH1-OE1 3.06Å; R277-E320 IonicContact NH1-OE2 2.83Å; R277-E320 PolarHBondContact NH1-OE2 3.11Å; R277-E320 IonicContact NH2-OE1 2.85Å; R277-Y351 HydrophobicContact CG-CE2 4.36Å
278	I	90.3	Very high	87.3	Confident	42 Å²	42	41.4 Å²	41.4	22%	0.215	20%	0.199	C	C	.	.	I	π-helix	trans	-62.3	-48.9	-171.5	-67.7	-68.6	0	0	0	112.2	F273 V274 A281 I282 V317	F273-I278 HydrophobicContact CD1-CG1 4.21Å; F273-I278 HydrophobicContact CD2-CG1 4Å; F273-I278 HydrophobicContact CE1-CD1 4.28Å; F273-I278 HydrophobicContact CE1-CG1 3.82Å; F273-I278 HydrophobicContact CE2-CD1 3.72Å; F273-I278 HydrophobicContact CE2-CG1 3.61Å; F273-I278 HydrophobicContact CG-CG1 4.31Å; F273-I278 HydrophobicContact CZ-CD1 3.55Å; F273-I278 HydrophobicContact CZ-CG1 3.51Å; F273-I278 PolarHBondContact O-N 3.19Å; V274-I278 PolarHBondContact O-N 2.77Å; I278-A281 PolarHBondContact O-N 2.79Å; I278-I282 HydrophobicContact CG2-CD1 3.59Å; I278-I282 HydrophobicContact CG2-CG1 4.35Å; I278-I282 WeakPolarHBondContact O-CB 3.48Å; I278-I282 VanDerWaalsContact O-CG1 3.31Å; I278-I282 WeakPolarHBondContact O-CG1 3.46Å; I278-I282 PolarHBondContact O-N 2.52Å; I278-V317 HydrophobicContact CD1-CG1 3.71Å
279	I	91.1	Very high	87.5	Confident	52 Å²	52	45.1 Å²	45.1	27%	0.267	22%	0.219	S	C	.	.	H	α-helix	trans	-60.9	-52	179.2	-72.8	172.4	0	0	0	111	V274 I275 R277 A281 I282 F283	V274-I279 HydrophobicContact CG1-CD1 3.79Å; V274-I279 HydrophobicContact CG1-CG1 4.14Å; V274-I279 WeakPolarHBondContact O-CB 3.31Å; V274-I279 VanDerWaalsContact O-CG1 3.31Å; V274-I279 WeakPolarHBondContact O-CG1 3.46Å; V274-I279 PolarHBondContact O-N 3.49Å; I275-I279 HydrophobicContact CD1-CD1 4.29Å; R277-I279 PolarHBondContact O-N 2.9Å; I279-A281 PolarHBondContact O-N 3.12Å; I279-I282 PolarHBondContact O-N 3.05Å; I279-F283 HydrophobicContact CG2-CD2 3.69Å; I279-F283 HydrophobicContact CG2-CE2 3.53Å; I279-F283 VanDerWaalsContact O-CD2 3.24Å; I279-F283 WeakPolarHBondContact O-CD2 3.44Å; I279-F283 PolarHBondContact O-N 3.11Å
280	P	89	Confident	87.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-52.1	-46.8	170.8	-34.1	39.6	0	0	0	115	V193 I275 R277 F283 V284 M313	V193-P280 HydrophobicContact CG2-CB 3.74Å; V193-P280 HydrophobicContact CG2-CG 4.44Å; I275-P280 WeakPolarHBondContact O-CD 3.36Å; R277-P280 WeakPolarHBondContact O-CD 3.41Å; P280-F283 PolarHBondContact O-N 3.37Å; P280-V284 WeakPolarHBondContact O-CG2 3.17Å; P280-V284 PolarHBondContact O-N 3.16Å; P280-M313 HydrophobicContact CB-CE 4.21Å
281	A	88.9	Confident	87.4	Confident	11 Å²	11	40.2 Å²	40.2	9%	0.091	20%	0.202	C	C	.	.	H	α-helix	trans	-62	-47.8	-179.8	0	0	0	0	0	112.1	R277 I278 I279 F283 V284 I285 L310 M313	R277-A281 VanDerWaalsContact O-CB 3.31Å; R277-A281 WeakPolarHBondContact O-CB 3.35Å; R277-A281 PolarHBondContact O-N 2.88Å; I278-A281 PolarHBondContact O-N 2.79Å; I279-A281 PolarHBondContact O-N 3.12Å; A281-F283 PolarHBondContact O-N 3.22Å; A281-V284 PolarHBondContact O-N 3.45Å; A281-I285 WeakPolarHBondContact O-CB 3.43Å; A281-I285 WeakPolarHBondContact O-CD1 3.43Å; A281-I285 VanDerWaalsContact O-CG1 3.25Å; A281-I285 WeakPolarHBondContact O-CG1 3.07Å; A281-I285 PolarHBondContact O-N 3.43Å; A281-L310 HydrophobicContact CB-CD1 4.17Å; A281-M313 HydrophobicContact CB-SD 3.85Å
282	I	92.1	Very high	87.3	Confident	104 Å²	104	41.4 Å²	41.4	53%	0.533	21%	0.212	S	C	.	.	H	α-helix	trans	-60.5	-45	178.5	-69.9	170.4	0	0	0	110.6	I278 I279 I285 F286	I278-I282 HydrophobicContact CG2-CD1 3.59Å; I278-I282 HydrophobicContact CG2-CG1 4.35Å; I278-I282 WeakPolarHBondContact O-CB 3.48Å; I278-I282 VanDerWaalsContact O-CG1 3.31Å; I278-I282 WeakPolarHBondContact O-CG1 3.46Å; I278-I282 PolarHBondContact O-N 2.52Å; I279-I282 PolarHBondContact O-N 3.05Å; I282-I285 PolarHBondContact O-N 3.24Å; I282-F286 VanDerWaalsContact O-CB 3.28Å; I282-F286 WeakPolarHBondContact O-CB 3.28Å; I282-F286 PolarHBondContact O-N 3.22Å
283	F	91.5	Very high	87.3	Confident	84 Å²	84	50.8 Å²	50.8	37%	0.368	25%	0.246	S	C	.	.	H	α-helix	trans	-61.6	-48.9	176.6	-81.3	-59	0	0	0	111.9	V193 I279 P280 A281 I285 F286 I287	V193-F283 HydrophobicContact CG1-CB 3.6Å; V193-F283 HydrophobicContact CG1-CD2 4.22Å; V193-F283 HydrophobicContact CG1-CG 4.13Å; I279-F283 HydrophobicContact CG2-CD2 3.69Å; I279-F283 HydrophobicContact CG2-CE2 3.53Å; I279-F283 VanDerWaalsContact O-CD2 3.24Å; I279-F283 WeakPolarHBondContact O-CD2 3.44Å; I279-F283 PolarHBondContact O-N 3.11Å; P280-F283 PolarHBondContact O-N 3.37Å; A281-F283 PolarHBondContact O-N 3.22Å; F283-I285 VanDerWaalsContact C-N 3.34Å; F283-I285 PolarHBondContact O-N 3.03Å; F283-F286 PolarHBondContact O-N 3.15Å; F283-I287 HydrophobicContact CB-CD1 4.33Å; F283-I287 WeakPolarHBondContact O-CB 3.32Å; F283-I287 VanDerWaalsContact O-CD1 3.23Å; F283-I287 WeakPolarHBondContact O-CD1 3.5Å; F283-I287 WeakPolarHBondContact O-CG1 3.42Å; F283-I287 PolarHBondContact O-N 3.19Å
284	V	87.7	Confident	86.8	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-60.2	-43.5	178.8	171	0	0	0	0	111.4	V193 F196 P280 A281 S288 P306 L310	V193-V284 HydrophobicContact CG2-CG2 4.09Å; F196-V284 HydrophobicContact CE1-CG1 4.43Å; P280-V284 WeakPolarHBondContact O-CG2 3.17Å; P280-V284 PolarHBondContact O-N 3.16Å; A281-V284 PolarHBondContact O-N 3.45Å; V284-S288 WeakPolarHBondContact O-CB 3.44Å; V284-S288 PolarHBondContact O-N 2.95Å; V284-S288 PolarHBondContact O-OG 3.49Å; V284-P306 HydrophobicContact CG1-CB 3.76Å; V284-L310 HydrophobicContact CG1-CB 4.34Å; V284-L310 HydrophobicContact CG1-CD2 4.39Å
285	I	90.2	Very high	86.1	Confident	73 Å²	73	53.3 Å²	53.3	37%	0.374	25%	0.25	S	C	.	.	H	α-helix	trans	-63.3	-50.2	177.7	-69.6	165.1	0	0	0	110.8	A281 I282 F283 I287 S288 I289 L310	A281-I285 WeakPolarHBondContact O-CB 3.43Å; A281-I285 WeakPolarHBondContact O-CD1 3.43Å; A281-I285 VanDerWaalsContact O-CG1 3.25Å; A281-I285 WeakPolarHBondContact O-CG1 3.07Å; A281-I285 PolarHBondContact O-N 3.43Å; I282-I285 PolarHBondContact O-N 3.24Å; F283-I285 VanDerWaalsContact C-N 3.34Å; F283-I285 PolarHBondContact O-N 3.03Å; I285-I287 PolarHBondContact O-N 3.41Å; I285-S288 PolarHBondContact O-N 3.49Å; I285-I289 HydrophobicContact CG2-CD1 3.74Å; I285-I289 HydrophobicContact CG2-CG1 4.48Å; I285-I289 WeakPolarHBondContact O-CG1 3.42Å; I285-I289 PolarHBondContact O-N 2.98Å; I285-L310 HydrophobicContact CD1-CD1 4.17Å; I285-L310 HydrophobicContact CD1-CD2 4.4Å; I285-L310 HydrophobicContact CG1-CD1 4.09Å; I285-L310 HydrophobicContact CG1-CD2 3.7Å
286	F	90.7	Very high	85.4	Confident	144 Å²	144	55.4 Å²	55.4	63%	0.632	27%	0.265	S	S	*	.	H	α-helix	trans	-61.6	-45.4	-178.6	-177.3	-96	0	0	0	112.1	I282 F283 S288 I289 G290	I282-F286 VanDerWaalsContact O-CB 3.28Å; I282-F286 WeakPolarHBondContact O-CB 3.28Å; I282-F286 PolarHBondContact O-N 3.22Å; F283-F286 PolarHBondContact O-N 3.15Å; F286-S288 VanDerWaalsContact C-N 3.34Å; F286-I289 PolarHBondContact O-N 3.47Å; F286-G290 PolarHBondContact O-N 3.29Å
287	I	87	Confident	84.8	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64.3	-40.2	176.2	-62.8	159.1	0	0	0	110.8	F196 L197 F200 F283 I285 G290 F291	F196-I287 HydrophobicContact CD1-CB 3.84Å; F196-I287 HydrophobicContact CD1-CD1 3.91Å; F196-I287 HydrophobicContact CD1-CG2 3.51Å; F196-I287 HydrophobicContact CD2-CG2 4.42Å; F196-I287 HydrophobicContact CE1-CB 3.6Å; F196-I287 HydrophobicContact CE1-CG2 3.31Å; F196-I287 HydrophobicContact CE2-CG2 4.24Å; F196-I287 HydrophobicContact CG-CG2 4.08Å; F196-I287 HydrophobicContact CZ-CB 4.39Å; F196-I287 HydrophobicContact CZ-CG2 3.71Å; L197-I287 HydrophobicContact CB-CD1 3.74Å; L197-I287 HydrophobicContact CD1-CD1 3.81Å; L197-I287 HydrophobicContact CD1-CG1 3.99Å; L197-I287 HydrophobicContact CG-CD1 4.37Å; F200-I287 HydrophobicContact CB-CG2 3.52Å; F200-I287 HydrophobicContact CD1-CG2 4.38Å; F200-I287 HydrophobicContact CD2-CG2 4.18Å; F200-I287 HydrophobicContact CG-CG2 3.77Å; F283-I287 HydrophobicContact CB-CD1 4.33Å; F283-I287 WeakPolarHBondContact O-CB 3.32Å; F283-I287 VanDerWaalsContact O-CD1 3.23Å; F283-I287 WeakPolarHBondContact O-CD1 3.5Å; F283-I287 WeakPolarHBondContact O-CG1 3.42Å; F283-I287 PolarHBondContact O-N 3.19Å; I285-I287 PolarHBondContact O-N 3.41Å; I287-G290 CarbonylContact O-C 3.58Å; I287-G290 WeakPolarHBondContact O-CA 3.42Å; I287-G290 PolarHBondContact O-N 2.97Å; I287-F291 HydrophobicContact CG2-CD2 3.74Å; I287-F291 HydrophobicContact CG2-CE2 3.64Å; I287-F291 WeakPolarHBondContact O-CD2 3.45Å; I287-F291 PolarHBondContact O-N 3.41Å
288	S	85.9	Confident	83.8	Confident	13 Å²	13	73.7 Å²	73.7	9%	0.091	34%	0.341	C	S	.	.	H	α-helix	trans	-64.9	-45.1	179.1	-60.2	0	0	0	0	111.9	V284 I285 F286 G290 F291 I292	V284-S288 WeakPolarHBondContact O-CB 3.44Å; V284-S288 PolarHBondContact O-N 2.95Å; V284-S288 PolarHBondContact O-OG 3.49Å; I285-S288 PolarHBondContact O-N 3.49Å; F286-S288 VanDerWaalsContact C-N 3.34Å; S288-G290 VanDerWaalsContact C-N 3.26Å; S288-G290 PolarHBondContact O-N 2.99Å; S288-F291 PolarHBondContact O-N 3.02Å; S288-I292 WeakPolarHBondContact O-CB 3.39Å; S288-I292 WeakPolarHBondContact O-CD1 3.23Å; S288-I292 WeakPolarHBondContact O-CG1 3Å; S288-I292 PolarHBondContact O-N 3.42Å
289	I	87.7	Confident	82.6	Confident	107 Å²	107	72.8 Å²	72.8	55%	0.549	34%	0.337	S	S	.	.	H	α-helix	trans	-59.2	-41.7	171.9	-66.1	164.9	0	0	0	110.3	I285 F286 I292 R293	I285-I289 HydrophobicContact CG2-CD1 3.74Å; I285-I289 HydrophobicContact CG2-CG1 4.48Å; I285-I289 WeakPolarHBondContact O-CG1 3.42Å; I285-I289 PolarHBondContact O-N 2.98Å; F286-I289 PolarHBondContact O-N 3.47Å; I289-I292 PolarHBondContact O-N 2.97Å; I289-R293 PolarHBondContact O-N 2.83Å
290	G	83.8	Confident	81.7	Confident	13 Å²	13	74.1 Å²	74.1	13%	0.134	34%	0.339	C	S	.	.	H	α-helix	trans	-56	-48.1	174.9	0	0	0	0	0	113	F286 I287 S288	F286-G290 PolarHBondContact O-N 3.29Å; I287-G290 CarbonylContact O-C 3.58Å; I287-G290 WeakPolarHBondContact O-CA 3.42Å; I287-G290 PolarHBondContact O-N 2.97Å; S288-G290 VanDerWaalsContact C-N 3.26Å; S288-G290 PolarHBondContact O-N 2.99Å
291	F	80.5	Confident	80.7	Confident	10 Å²	10	74.7 Å²	74.7	4%	0.044	35%	0.345	C	S	.	.	H	α-helix	trans	-72.5	-43.1	175.4	-78.1	-71	0	0	0	112.7	F196 L199 F200 F203 I287 S288 R293 W294 L295 F303	F196-F291 HydrophobicContact CD2-CE2 4.08Å; F196-F291 AromaticContact CE2-CD2 3.9Å; F196-F291 HydrophobicContact CE2-CD2 3.9Å; F196-F291 AromaticContact CE2-CE2 3.58Å; F196-F291 HydrophobicContact CE2-CE2 3.58Å; F196-F291 AromaticContact CZ-CD2 3.92Å; F196-F291 HydrophobicContact CZ-CD2 3.92Å; F196-F291 HydrophobicContact CZ-CE2 4Å; L199-F291 HydrophobicContact CB-CZ 4.42Å; F200-F291 VanDerWaalsContact CA-CZ 3.44Å; F200-F291 HydrophobicContact CB-CD2 4.37Å; F200-F291 HydrophobicContact CB-CE2 3.62Å; F200-F291 HydrophobicContact CB-CZ 3.73Å; F200-F291 HydrophobicContact CD2-CD1 4.05Å; F200-F291 AromaticContact CD2-CD2 3.81Å; F200-F291 HydrophobicContact CD2-CD2 3.81Å; F200-F291 HydrophobicContact CD2-CE1 4.08Å; F200-F291 AromaticContact CD2-CE2 3.85Å; F200-F291 HydrophobicContact CD2-CE2 3.85Å; F200-F291 AromaticContact CD2-CG 3.92Å; F200-F291 HydrophobicContact CD2-CG 3.92Å; F200-F291 AromaticContact CD2-CZ 4Å; F200-F291 HydrophobicContact CD2-CZ 4Å; F200-F291 HydrophobicContact CG-CD2 4.48Å; F200-F291 HydrophobicContact CG-CE2 4.18Å; F200-F291 HydrophobicContact CG-CZ 4.38Å; F203-F291 HydrophobicContact CB-CE1 3.78Å; F203-F291 HydrophobicContact CB-CZ 4.47Å; F203-F291 AromaticContact CD1-CD1 3.83Å; F203-F291 HydrophobicContact CD1-CD1 3.83Å; F203-F291 AromaticContact CD1-CE1 3.84Å; F203-F291 HydrophobicContact CD1-CE1 3.84Å; F203-F291 HydrophobicContact CD2-CD1 4.44Å; F203-F291 HydrophobicContact CD2-CE1 4.14Å; F203-F291 HydrophobicContact CE1-CD1 4.04Å; F203-F291 HydrophobicContact CE1-CE1 4.47Å; F203-F291 HydrophobicContact CG-CD1 4.05Å; F203-F291 AromaticContact CG-CE1 3.65Å; F203-F291 HydrophobicContact CG-CE1 3.65Å; F203-F291 HydrophobicContact CZ-CD1 4.45Å; I287-F291 HydrophobicContact CG2-CD2 3.74Å; I287-F291 HydrophobicContact CG2-CE2 3.64Å; I287-F291 WeakPolarHBondContact O-CD2 3.45Å; I287-F291 PolarHBondContact O-N 3.41Å; S288-F291 PolarHBondContact O-N 3.02Å; F291-R293 PolarHBondContact O-N 3.44Å; F291-R293 VanDerWaalsContact O-N 3.1Å; F291-W294 PolarHBondContact O-N 3.01Å; F291-L295 HydrophobicContact CB-CB 4.46Å; F291-L295 HydrophobicContact CD1-CD2 4.44Å; F291-L295 WeakPolarHBondContact O-CB 3.12Å; F291-L295 PolarHBondContact O-N 3.32Å; F291-F303 HydrophobicContact CB-CE1 3.5Å; F291-F303 HydrophobicContact CB-CZ 3.31Å; F291-F303 HydrophobicContact CD2-CE1 4.12Å; F291-F303 HydrophobicContact CG-CE1 4.17Å; F291-F303 HydrophobicContact CG-CZ 4.29Å
292	I	83.3	Confident	79.6	Confident	94 Å²	94	74.6 Å²	74.6	48%	0.482	34%	0.343	S	S	.	.	H	α-helix	trans	-56.5	-31.7	-177.9	-72.8	164.7	0	0	0	112	S288 I289 F303	S288-I292 WeakPolarHBondContact O-CB 3.39Å; S288-I292 WeakPolarHBondContact O-CD1 3.23Å; S288-I292 WeakPolarHBondContact O-CG1 3Å; S288-I292 PolarHBondContact O-N 3.42Å; I289-I292 PolarHBondContact O-N 2.97Å; I292-F303 HydrophobicContact CG1-CE1 4.37Å; I292-F303 HydrophobicContact CG1-CE2 4.13Å; I292-F303 HydrophobicContact CG1-CZ 3.74Å
293	R	83.3	Confident	78.9	Confident	207 Å²	207	70.4 Å²	70.4	78%	0.781	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-18.2	178.9	-178.9	176.6	-177.8	103.6	2.6	114.3	I289 F291	I289-R293 PolarHBondContact O-N 2.83Å; F291-R293 PolarHBondContact O-N 3.44Å; F291-R293 VanDerWaalsContact O-N 3.1Å
294	W	75	Confident	78.1	Confident	126 Å²	126	72.3 Å²	72.3	48%	0.477	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.8	-19.9	-169	-62.5	80.7	0	0	0	115.1	F203 I208 F291	F203-W294 HydrophobicContact CE1-CB 3.78Å; F203-W294 HydrophobicContact CZ-CB 3.9Å; I208-W294 HydrophobicContact CB-CE3 4.32Å; I208-W294 HydrophobicContact CB-CH2 4.25Å; I208-W294 HydrophobicContact CB-CZ3 4.03Å; I208-W294 HydrophobicContact CD1-CB 4.22Å; I208-W294 HydrophobicContact CD1-CD2 3.36Å; I208-W294 HydrophobicContact CD1-CE3 3.68Å; I208-W294 HydrophobicContact CD1-CG 3.63Å; I208-W294 HydrophobicContact CD1-CH2 4.37Å; I208-W294 HydrophobicContact CD1-CZ2 4.1Å; I208-W294 HydrophobicContact CD1-CZ3 4.17Å; I208-W294 HydrophobicContact CG1-CD2 3.77Å; I208-W294 HydrophobicContact CG1-CE3 3.48Å; I208-W294 VanDerWaalsContact CG1-CE3 3.48Å; I208-W294 HydrophobicContact CG1-CG 4.38Å; I208-W294 HydrophobicContact CG1-CH2 4.21Å; I208-W294 HydrophobicContact CG1-CZ2 4.44Å; I208-W294 HydrophobicContact CG1-CZ3 3.72Å; I208-W294 HydrophobicContact CG2-CE3 4.24Å; I208-W294 HydrophobicContact CG2-CH2 3.32Å; I208-W294 HydrophobicContact CG2-CZ2 3.73Å; I208-W294 HydrophobicContact CG2-CZ3 3.59Å; F291-W294 PolarHBondContact O-N 3.01Å
295	L	72.7	Confident	77.4	Confident	13 Å²	13	74.3 Å²	74.3	7%	0.068	34%	0.336	C	S	.	.	S	Bend	trans	-88.8	135.8	-177	-166.8	73.9	0	0	0	110.4	F203 F291 D299 Y300 F303 I426	F203-L295 HydrophobicContact CD2-CD1 4.37Å; F203-L295 HydrophobicContact CE2-CD1 3.65Å; F203-L295 HydrophobicContact CZ-CB 4.39Å; F203-L295 HydrophobicContact CZ-CD1 4.12Å; F291-L295 HydrophobicContact CB-CB 4.46Å; F291-L295 HydrophobicContact CD1-CD2 4.44Å; F291-L295 WeakPolarHBondContact O-CB 3.12Å; F291-L295 PolarHBondContact O-N 3.32Å; L295-D299 HydrophobicContact CD1-CB 4.03Å; L295-D299 HydrophobicContact CD2-CB 4Å; L295-D299 HydrophobicContact CG-CB 3.91Å; L295-Y300 HydrophobicContact CD2-CD1 4.23Å; L295-Y300 WeakPolarHBondContact O-CE1 3.32Å; L295-F303 HydrophobicContact CD2-CE2 4.13Å; L295-F303 HydrophobicContact CD2-CZ 4.33Å; L295-I426 HydrophobicContact CD1-CD1 4.41Å
296	P	71.7	Confident	76.9	Confident	66 Å²	66	71.2 Å²	71.2	43%	0.429	32%	0.32	S	S	.	.			trans	-67.4	151.3	173.9	28.3	-34.4	0	0	0	111.8	E298 D299 Y300	P296-E298 PolarHBondContact O-N 3.37Å; P296-E298 VanDerWaalsContact O-N 3.11Å; P296-D299 PolarHBondContact O-N 3.35Å; P296-Y300 WeakPolarHBondContact O-CD1 3.13Å
297	R	71.8	Confident	76.5	Confident	213 Å²	213	67.7 Å²	67.7	80%	0.804	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-58.2	-27.7	-174.1	-67.6	-177.5	179	-178.9	-0.5	114.5	D299 Y300	R297-D299 PolarHBondContact O-N 2.92Å; R297-Y300 HydrophobicContact CB-CE2 4.39Å; R297-Y300 HydrophobicContact CG-CE2 4.08Å; R297-Y300 PolarHBondContact O-N 3.08Å
298	E	65.1	Low	76.4	Confident	175 Å²	175	69.6 Å²	69.6	82%	0.818	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-63.5	-27.7	179.1	-65.3	172.3	-160.4	0	0	112.5	P296	P296-E298 PolarHBondContact O-N 3.37Å; P296-E298 VanDerWaalsContact O-N 3.11Å
299	D	65.1	Low	76.3	Confident	23 Å²	23	69.1 Å²	69.1	12%	0.123	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-99.2	7.7	-173	-72.9	-40	0	0	0	114.2	L295 P296 R297 G301 V302 I426 Q430	L295-D299 HydrophobicContact CD1-CB 4.03Å; L295-D299 HydrophobicContact CD2-CB 4Å; L295-D299 HydrophobicContact CG-CB 3.91Å; P296-D299 PolarHBondContact O-N 3.35Å; R297-D299 PolarHBondContact O-N 2.92Å; D299-G301 PolarHBondContact O-N 2.9Å; D299-V302 PolarHBondContact O-N 3.29Å; D299-I426 HydrophobicContact CB-CG2 3.73Å; D299-I426 WeakPolarHBondContact OD1-CG2 3.38Å; D299-I426 VanDerWaalsContact OD2-CD1 3.31Å; D299-I426 WeakPolarHBondContact OD2-CD1 3.26Å; D299-Q430 PolarHBondContact OD1-NE2 3.48Å
300	Y	72.9	Confident	76.3	Confident	80 Å²	80	65.1 Å²	65.1	31%	0.314	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-62.5	-6.1	177.9	-72.5	8.7	0	0	0	113.6	L295 P296 R297 V302 F303	L295-Y300 HydrophobicContact CD2-CD1 4.23Å; L295-Y300 WeakPolarHBondContact O-CE1 3.32Å; P296-Y300 WeakPolarHBondContact O-CD1 3.13Å; R297-Y300 HydrophobicContact CB-CE2 4.39Å; R297-Y300 HydrophobicContact CG-CE2 4.08Å; R297-Y300 PolarHBondContact O-N 3.08Å; Y300-V302 PolarHBondContact O-N 2.9Å; Y300-V302 VanDerWaalsContact O-N 3.13Å; Y300-F303 HydrophobicContact CD1-CD2 4.17Å; Y300-F303 AromaticContact CD1-CE2 3.63Å; Y300-F303 HydrophobicContact CD1-CE2 3.63Å; Y300-F303 HydrophobicContact CE1-CE2 4.08Å; Y300-F303 HydrophobicContact CG-CD2 4.04Å; Y300-F303 AromaticContact CG-CE2 3.94Å; Y300-F303 HydrophobicContact CG-CE2 3.94Å; Y300-F303 WeakPolarHBondContact O-CD2 3.5Å; Y300-F303 PolarHBondContact O-N 3.11Å
301	G	67	Low	76.6	Confident	12 Å²	12	67.3 Å²	67.3	12%	0.124	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-52.6	-24.6	168	0	0	0	0	0	115.4	D299 F303 Y304	D299-G301 PolarHBondContact O-N 2.9Å; G301-F303 VanDerWaalsContact C-N 3.29Å; G301-F303 PolarHBondContact O-N 2.93Å; G301-Y304 WeakPolarHBondContact O-CD2 3.41Å
302	V	66.8	Low	76.9	Confident	8 Å²	8	69.7 Å²	69.7	5%	0.048	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-72.7	-21	178.1	-178.1	0	0	0	0	112.5	F196 D299 Y300 L429 F433	F196-V302 HydrophobicContact CE2-CG1 4.48Å; D299-V302 PolarHBondContact O-N 3.29Å; Y300-V302 PolarHBondContact O-N 2.9Å; Y300-V302 VanDerWaalsContact O-N 3.13Å; V302-L429 HydrophobicContact CG2-CB 4.47Å; V302-F433 HydrophobicContact CG1-CE2 4.44Å
303	F	77	Confident	77.2	Confident	16 Å²	16	65.3 Å²	65.3	7%	0.07	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-81.3	-21.1	-176.2	-65	-62.4	0	0	0	115.2	F196 F291 I292 L295 Y300 G301 E305 P306 T307	F196-F303 HydrophobicContact CE2-CD1 4.48Å; F196-F303 HydrophobicContact CZ-CD1 4.12Å; F196-F303 HydrophobicContact CZ-CE1 4.32Å; F291-F303 HydrophobicContact CB-CE1 3.5Å; F291-F303 HydrophobicContact CB-CZ 3.31Å; F291-F303 HydrophobicContact CD2-CE1 4.12Å; F291-F303 HydrophobicContact CG-CE1 4.17Å; F291-F303 HydrophobicContact CG-CZ 4.29Å; I292-F303 HydrophobicContact CG1-CE1 4.37Å; I292-F303 HydrophobicContact CG1-CE2 4.13Å; I292-F303 HydrophobicContact CG1-CZ 3.74Å; L295-F303 HydrophobicContact CD2-CE2 4.13Å; L295-F303 HydrophobicContact CD2-CZ 4.33Å; Y300-F303 HydrophobicContact CD1-CD2 4.17Å; Y300-F303 AromaticContact CD1-CE2 3.63Å; Y300-F303 HydrophobicContact CD1-CE2 3.63Å; Y300-F303 HydrophobicContact CE1-CE2 4.08Å; Y300-F303 HydrophobicContact CG-CD2 4.04Å; Y300-F303 AromaticContact CG-CE2 3.94Å; Y300-F303 HydrophobicContact CG-CE2 3.94Å; Y300-F303 WeakPolarHBondContact O-CD2 3.5Å; Y300-F303 PolarHBondContact O-N 3.11Å; G301-F303 VanDerWaalsContact C-N 3.29Å; G301-F303 PolarHBondContact O-N 2.93Å; F303-E305 PolarHBondContact O-N 2.83Å; F303-P306 VanDerWaalsContact O-CD 3.32Å; F303-P306 WeakPolarHBondContact O-CD 3.49Å; F303-T307 VanDerWaalsContact O-CB 3.25Å; F303-T307 WeakPolarHBondContact O-CB 3.26Å; F303-T307 PolarHBondContact O-N 2.96Å; F303-T307 PolarHBondContact O-OG1 3.34Å
304	Y	74.9	Confident	77.5	Confident	125 Å²	125	59 Å²	59	49%	0.49	28%	0.282	S	S	.	.	H	α-helix	trans	-54.7	-48.6	-167.7	-75.7	-70.8	0	0	0	112.7	G301 T307 I308	G301-Y304 WeakPolarHBondContact O-CD2 3.41Å; Y304-T307 PolarHBondContact O-N 2.95Å; Y304-I308 VanDerWaalsContact O-CB 3.32Å; Y304-I308 WeakPolarHBondContact O-CB 3.47Å; Y304-I308 VanDerWaalsContact O-CD1 3.24Å; Y304-I308 WeakPolarHBondContact O-CD1 3.23Å; Y304-I308 WeakPolarHBondContact O-CG1 3.21Å; Y304-I308 PolarHBondContact O-N 3.36Å
305	E	72.5	Confident	78.3	Confident	43 Å²	43	54.6 Å²	54.6	20%	0.201	27%	0.27	C	S	.	.	H	α-helix	trans	-63.6	-55.1	-179.9	-75.7	177	-159.7	0	0	113.4	F303 T307 I308 F309 A362 F433	F303-E305 PolarHBondContact O-N 2.83Å; E305-T307 VanDerWaalsContact C-N 3.31Å; E305-T307 PolarHBondContact O-N 3.16Å; E305-I308 PolarHBondContact O-N 3.36Å; E305-F309 WeakPolarHBondContact O-CB 3.39Å; E305-F309 PolarHBondContact O-N 3.35Å; E305-A362 WeakPolarHBondContact OE1-CB 3.48Å; E305-F433 WeakPolarHBondContact OE1-CD1 3.31Å; E305-F433 WeakPolarHBondContact OE1-CE1 3.39Å; E305-F433 WeakPolarHBondContact OE2-CE1 3.36Å
306	P	80	Confident	79.1	Confident	7 Å²	7	54.2 Å²	54.2	5%	0.045	27%	0.268	C	S	.	.	H	α-helix	trans	-60.9	-35.6	176.2	-24.3	33.1	0	0	0	113.9	F196 V284 F303 L310	F196-P306 HydrophobicContact CD1-CB 4.2Å; F196-P306 HydrophobicContact CD1-CG 4.06Å; F196-P306 HydrophobicContact CD2-CG 3.75Å; F196-P306 HydrophobicContact CE1-CB 4.03Å; F196-P306 HydrophobicContact CE1-CG 4.11Å; F196-P306 HydrophobicContact CE2-CG 3.84Å; F196-P306 HydrophobicContact CG-CG 3.88Å; F196-P306 HydrophobicContact CZ-CB 4.21Å; F196-P306 HydrophobicContact CZ-CG 4.02Å; V284-P306 HydrophobicContact CG1-CB 3.76Å; F303-P306 VanDerWaalsContact O-CD 3.32Å; F303-P306 WeakPolarHBondContact O-CD 3.49Å; P306-L310 VanDerWaalsContact O-CB 3.24Å; P306-L310 WeakPolarHBondContact O-CB 3.34Å; P306-L310 PolarHBondContact O-N 3.32Å
307	T	83	Confident	80	Confident	71 Å²	71	52 Å²	52	44%	0.436	25%	0.253	S	S	.	.	H	α-helix	trans	-69.2	-40.5	177.6	-62	0	0	0	0	111.9	F303 Y304 E305 L310 A311	F303-T307 VanDerWaalsContact O-CB 3.25Å; F303-T307 WeakPolarHBondContact O-CB 3.26Å; F303-T307 PolarHBondContact O-N 2.96Å; F303-T307 PolarHBondContact O-OG1 3.34Å; Y304-T307 PolarHBondContact O-N 2.95Å; E305-T307 VanDerWaalsContact C-N 3.31Å; E305-T307 PolarHBondContact O-N 3.16Å; T307-L310 PolarHBondContact O-N 2.04Å; T307-A311 VanDerWaalsContact O-CB 3.26Å; T307-A311 WeakPolarHBondContact O-CB 3.17Å; T307-A311 PolarHBondContact O-N 3.32Å
308	I	83.7	Confident	81	Confident	40 Å²	40	46.3 Å²	46.3	21%	0.205	24%	0.238	C	C	.	.	H	α-helix	trans	-65.9	-43.6	175.3	-71.6	159.4	0	0	0	110.7	Y304 E305 L310 A311 F312 T358 L361	Y304-I308 VanDerWaalsContact O-CB 3.32Å; Y304-I308 WeakPolarHBondContact O-CB 3.47Å; Y304-I308 VanDerWaalsContact O-CD1 3.24Å; Y304-I308 WeakPolarHBondContact O-CD1 3.23Å; Y304-I308 WeakPolarHBondContact O-CG1 3.21Å; Y304-I308 PolarHBondContact O-N 3.36Å; E305-I308 PolarHBondContact O-N 3.36Å; I308-L310 VanDerWaalsContact C-N 3.35Å; I308-L310 PolarHBondContact O-N 3.14Å; I308-A311 PolarHBondContact O-N 3.25Å; I308-F312 HydrophobicContact CG2-CD2 3.76Å; I308-F312 HydrophobicContact CG2-CE2 3.52Å; I308-F312 VanDerWaalsContact O-CD2 3.27Å; I308-F312 WeakPolarHBondContact O-CD2 3.35Å; I308-F312 PolarHBondContact O-N 3.45Å; I308-F312 VanDerWaalsContact O-N 3.13Å; I308-T358 HydrophobicContact CG2-CG2 4.41Å; I308-L361 HydrophobicContact CD1-CD1 3.63Å; I308-L361 HydrophobicContact CG1-CD1 4.44Å; I308-L361 HydrophobicContact CG2-CD1 4.1Å
309	F	84.9	Confident	82.2	Confident	2 Å²	2	38 Å²	38	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-56.1	-49.5	173.7	179.9	-120.9	0	0	0	111.6	I192 E305 F312 M313 S354 F355 T358	I192-F309 HydrophobicContact CD1-CB 4.41Å; I192-F309 HydrophobicContact CD1-CD1 4.25Å; I192-F309 HydrophobicContact CD1-CD2 3.62Å; I192-F309 HydrophobicContact CD1-CE1 4.41Å; I192-F309 HydrophobicContact CD1-CE2 3.83Å; I192-F309 HydrophobicContact CD1-CG 3.84Å; I192-F309 HydrophobicContact CD1-CZ 4.2Å; I192-F309 HydrophobicContact CG2-CD1 4.07Å; I192-F309 HydrophobicContact CG2-CG 4.38Å; E305-F309 WeakPolarHBondContact O-CB 3.39Å; E305-F309 PolarHBondContact O-N 3.35Å; F309-F312 PolarHBondContact O-N 3.25Å; F309-M313 HydrophobicContact CD1-CE 4.2Å; F309-M313 HydrophobicContact CE1-CE 3.34Å; F309-M313 HydrophobicContact CE2-CE 3.98Å; F309-M313 HydrophobicContact CZ-CE 3.21Å; F309-M313 WeakPolarHBondContact O-CB 3.07Å; F309-M313 PolarHBondContact O-N 3.12Å; F309-S354 WeakPolarHBondContact CD2-OG 3.28Å; F309-F355 AromaticContact CE2-CD1 3.99Å; F309-F355 HydrophobicContact CE2-CD1 3.99Å; F309-F355 AromaticContact CE2-CE1 3.68Å; F309-F355 HydrophobicContact CE2-CE1 3.68Å; F309-F355 HydrophobicContact CE2-CZ 4.31Å; F309-F355 HydrophobicContact CZ-CE1 4.13Å; F309-T358 HydrophobicContact CB-CG2 3.83Å
310	L	88.2	Confident	83.2	Confident	24 Å²	24	38 Å²	38	13%	0.126	20%	0.198	C	C	.	.	H	α-helix	trans	-63.5	-41.9	178.6	-174.5	68.2	0	0	0	112.1	A281 V284 I285 P306 T307 I308 F312 M313 I314	A281-L310 HydrophobicContact CB-CD1 4.17Å; V284-L310 HydrophobicContact CG1-CB 4.34Å; V284-L310 HydrophobicContact CG1-CD2 4.39Å; I285-L310 HydrophobicContact CD1-CD1 4.17Å; I285-L310 HydrophobicContact CD1-CD2 4.4Å; I285-L310 HydrophobicContact CG1-CD1 4.09Å; I285-L310 HydrophobicContact CG1-CD2 3.7Å; P306-L310 VanDerWaalsContact O-CB 3.24Å; P306-L310 WeakPolarHBondContact O-CB 3.34Å; P306-L310 PolarHBondContact O-N 3.32Å; T307-L310 PolarHBondContact O-N 2.04Å; I308-L310 VanDerWaalsContact C-N 3.35Å; I308-L310 PolarHBondContact O-N 3.14Å; L310-F312 VanDerWaalsContact C-N 3.33Å; L310-F312 PolarHBondContact O-N 2.97Å; L310-M313 PolarHBondContact O-N 2.91Å; L310-I314 HydrophobicContact CD1-CD1 4.06Å; L310-I314 HydrophobicContact CD1-CG1 4.04Å; L310-I314 HydrophobicContact CD2-CD1 4.22Å; L310-I314 HydrophobicContact CG-CD1 3.69Å; L310-I314 HydrophobicContact CG-CG1 4.11Å; L310-I314 WeakPolarHBondContact O-CB 3.04Å; L310-I314 VanDerWaalsContact O-CG1 3.29Å; L310-I314 WeakPolarHBondContact O-CG1 3.45Å; L310-I314 PolarHBondContact O-N 3.5Å
311	A	88.3	Confident	84	Confident	58 Å²	58	36.5 Å²	36.5	48%	0.479	20%	0.198	S	C	.	.	H	α-helix	trans	-62.3	-36.6	179.7	0	0	0	0	0	113	T307 I308 P315	T307-A311 VanDerWaalsContact O-CB 3.26Å; T307-A311 WeakPolarHBondContact O-CB 3.17Å; T307-A311 PolarHBondContact O-N 3.32Å; I308-A311 PolarHBondContact O-N 3.25Å; A311-P315 WeakPolarHBondContact O-CD 3.32Å
312	F	88.7	Confident	85.1	Confident	61 Å²	61	39.1 Å²	39.1	27%	0.268	21%	0.208	S	C	.	.	H	α-helix	trans	-81.7	-26.4	174.3	-69.6	-52.8	0	0	0	113.6	I308 F309 L310 L350 C357	I308-F312 HydrophobicContact CG2-CD2 3.76Å; I308-F312 HydrophobicContact CG2-CE2 3.52Å; I308-F312 VanDerWaalsContact O-CD2 3.27Å; I308-F312 WeakPolarHBondContact O-CD2 3.35Å; I308-F312 PolarHBondContact O-N 3.45Å; I308-F312 VanDerWaalsContact O-N 3.13Å; F309-F312 PolarHBondContact O-N 3.25Å; L310-F312 VanDerWaalsContact C-N 3.33Å; L310-F312 PolarHBondContact O-N 2.97Å; F312-L350 HydrophobicContact CD1-CB 4.34Å; F312-L350 HydrophobicContact CD1-CD2 4.24Å; F312-L350 HydrophobicContact CE1-CD2 4.25Å; F312-C357 HydrophobicContact CE2-CB 4.02Å
313	M	88.9	Confident	86.1	Confident	1 Å²	1	39 Å²	39	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-76	-41.4	176.4	-174.8	-166.7	-71.8	0	0	112.9	R277 P280 A281 F309 L310 H316 V317 Y351	R277-M313 HydrophobicContact CB-SD 4.28Å; P280-M313 HydrophobicContact CB-CE 4.21Å; A281-M313 HydrophobicContact CB-SD 3.85Å; F309-M313 HydrophobicContact CD1-CE 4.2Å; F309-M313 HydrophobicContact CE1-CE 3.34Å; F309-M313 HydrophobicContact CE2-CE 3.98Å; F309-M313 HydrophobicContact CZ-CE 3.21Å; F309-M313 WeakPolarHBondContact O-CB 3.07Å; F309-M313 PolarHBondContact O-N 3.12Å; L310-M313 PolarHBondContact O-N 2.91Å; M313-H316 PolarHBondContact O-N 3.14Å; M313-H316 VanDerWaalsContact O-N 3.15Å; M313-V317 HydrophobicContact CG-CG2 3.72Å; M313-V317 PolarHBondContact O-N 2.69Å; M313-V317 HydrophobicContact SD-CG2 4.15Å; M313-Y351 HydrophobicContact CB-CD2 4.38Å; M313-Y351 HydrophobicContact CE-CE2 4.4Å; M313-Y351 HydrophobicContact CG-CD2 4.13Å; M313-Y351 HydrophobicContact CG-CE2 4.26Å
314	I	90.4	Very high	86.4	Confident	74 Å²	74	39.7 Å²	39.7	38%	0.379	21%	0.211	S	C	.	.	H	α-helix	trans	-52	-49.1	-173.7	-80.3	169.4	0	0	0	113.3	L310 H316 V317 L318	L310-I314 HydrophobicContact CD1-CD1 4.06Å; L310-I314 HydrophobicContact CD1-CG1 4.04Å; L310-I314 HydrophobicContact CD2-CD1 4.22Å; L310-I314 HydrophobicContact CG-CD1 3.69Å; L310-I314 HydrophobicContact CG-CG1 4.11Å; L310-I314 WeakPolarHBondContact O-CB 3.04Å; L310-I314 VanDerWaalsContact O-CG1 3.29Å; L310-I314 WeakPolarHBondContact O-CG1 3.45Å; L310-I314 PolarHBondContact O-N 3.5Å; I314-H316 PolarHBondContact O-N 3.03Å; I314-V317 PolarHBondContact O-N 2.66Å; I314-L318 HydrophobicContact CG2-CD1 3.68Å; I314-L318 HydrophobicContact CG2-CG 4.14Å; I314-L318 WeakPolarHBondContact O-CG 3.37Å; I314-L318 PolarHBondContact O-N 3.36Å
315	P	91.2	Very high	87	Confident	35 Å²	35	38.6 Å²	38.6	23%	0.227	21%	0.212	C	C	.	.	H	α-helix	trans	-57.3	-37.3	-178.3	-27.4	35.8	0	0	0	113.2	A311 C319	A311-P315 WeakPolarHBondContact O-CD 3.32Å; P315-C319 PolarHBondContact O-N 2.85Å; P315-C319 PolarHBondContact O-SG 3.33Å
316	H	89.9	Confident	87.7	Confident	5 Å²	5	39.8 Å²	39.8	2%	0.023	22%	0.217	C	C	.	.	H	α-helix	trans	-75.8	-43.7	179.2	-173.9	60.1	0	0	0	111.9	R277 M313 I314 L318 C319 E320 M344 S347 Y348	R277-H316 PolarHBondContact NE-CD2 2.88Å; R277-H316 VanDerWaalsContact NE-CD2 3.33Å; M313-H316 PolarHBondContact O-N 3.14Å; M313-H316 VanDerWaalsContact O-N 3.15Å; I314-H316 PolarHBondContact O-N 3.03Å; H316-L318 VanDerWaalsContact C-N 3.27Å; H316-L318 PolarHBondContact O-N 2.86Å; H316-C319 WeakPolarHBondContact O-CB 3.39Å; H316-C319 PolarHBondContact O-N 2.92Å; H316-E320 IonicContact NE2-OE1 3.81Å; H316-E320 PolarHBondContact O-N 3.44Å; H316-E320 VanDerWaalsContact O-N 3.12Å; H316-M344 PolarHBondContact CE1-O 3.41Å; H316-S347 PolarHBondContact CE1-OG 3.18Å; H316-Y348 PolarHBondContact CE1-N 2.87Å; H316-Y348 AromaticContact NE2-CD2 3.48Å; H316-Y348 WeakPolarHBondContact NE2-CD2 3.09Å
317	V	90.5	Very high	87.9	Confident	18 Å²	18	40.2 Å²	40.2	11%	0.109	22%	0.218	C	C	.	.	H	α-helix	trans	-57.9	-40	173.9	168.9	0	0	0	0	111.6	F273 R277 I278 M313 I314 C319 E320 V321	F273-V317 HydrophobicContact CE2-CG1 4.37Å; R277-V317 HydrophobicContact CB-CG2 3.74Å; R277-V317 HydrophobicContact CG-CG2 4.5Å; I278-V317 HydrophobicContact CD1-CG1 3.71Å; M313-V317 HydrophobicContact CG-CG2 3.72Å; M313-V317 PolarHBondContact O-N 2.69Å; M313-V317 HydrophobicContact SD-CG2 4.15Å; I314-V317 PolarHBondContact O-N 2.66Å; V317-C319 PolarHBondContact O-N 3.49Å; V317-E320 PolarHBondContact O-N 3.36Å; V317-V321 HydrophobicContact CG1-CG2 4.26Å; V317-V321 WeakPolarHBondContact O-CB 3.42Å; V317-V321 VanDerWaalsContact O-CG2 3.26Å; V317-V321 WeakPolarHBondContact O-CG2 3.24Å; V317-V321 PolarHBondContact O-N 2.85Å
318	L	92.1	Very high	88	Confident	95 Å²	95	47.2 Å²	47.2	50%	0.497	24%	0.236	S	C	.	.	H	α-helix	trans	-63.6	-38.4	175.5	-70.8	173	0	0	0	112.4	I314 H316 V321 I322	I314-L318 HydrophobicContact CG2-CD1 3.68Å; I314-L318 HydrophobicContact CG2-CG 4.14Å; I314-L318 WeakPolarHBondContact O-CG 3.37Å; I314-L318 PolarHBondContact O-N 3.36Å; H316-L318 VanDerWaalsContact C-N 3.27Å; H316-L318 PolarHBondContact O-N 2.86Å; L318-V321 PolarHBondContact O-N 3.5Å; L318-I322 WeakPolarHBondContact O-CD1 3.21Å; L318-I322 VanDerWaalsContact O-CG1 3.23Å; L318-I322 WeakPolarHBondContact O-CG1 3.34Å; L318-I322 PolarHBondContact O-N 3.34Å
319	C	89.8	Confident	88.2	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-60.8	-45.4	174.4	-63.2	0	0	0	0	111.4	P315 H316 V317 I322 I323 F340 F343 M344 S347	P315-C319 PolarHBondContact O-N 2.85Å; P315-C319 PolarHBondContact O-SG 3.33Å; H316-C319 WeakPolarHBondContact O-CB 3.39Å; H316-C319 PolarHBondContact O-N 2.92Å; V317-C319 PolarHBondContact O-N 3.49Å; C319-I322 WeakPolarHBondContact O-CB 3.23Å; C319-I322 PolarHBondContact O-N 3.34Å; C319-I323 WeakPolarHBondContact O-CG1 3.21Å; C319-I323 PolarHBondContact O-N 3.16Å; C319-F340 HydrophobicContact CB-CZ 4.26Å; C319-F343 VanDerWaalsContact SG-CD1 3.55Å; C319-F343 WeakPolarHBondContact SG-CE1 3.34Å; C319-M344 HydrophobicContact CB-CG 4.34Å; C319-S347 PolarHBondContact SG-OG 3.47Å
320	E	87	Confident	88.1	Confident	21 Å²	21	53 Å²	53	10%	0.098	27%	0.271	C	S	.	.	H	α-helix	trans	-71.6	-36.4	-179.2	-65	-174.4	141.7	0	0	112.6	F273 R277 H316 V317 I322 I323 H324	F273-E320 HydrophobicContact CD2-CB 3.88Å; F273-E320 VanDerWaalsContact CD2-OE2 3.23Å; F273-E320 WeakPolarHBondContact CD2-OE2 3.24Å; F273-E320 HydrophobicContact CE2-CB 3.78Å; R277-E320 WeakPolarHBondContact CD-OE2 3.27Å; R277-E320 IonicContact CZ-OE1 2.74Å; R277-E320 IonicContact CZ-OE2 3.29Å; R277-E320 IonicContact NE-OE2 2.79Å; R277-E320 PolarHBondContact NE-OE2 3.49Å; R277-E320 IonicContact NH1-OE1 3.26Å; R277-E320 PolarHBondContact NH1-OE1 3.06Å; R277-E320 IonicContact NH1-OE2 2.83Å; R277-E320 PolarHBondContact NH1-OE2 3.11Å; R277-E320 IonicContact NH2-OE1 2.85Å; H316-E320 IonicContact NE2-OE1 3.81Å; H316-E320 PolarHBondContact O-N 3.44Å; H316-E320 VanDerWaalsContact O-N 3.12Å; V317-E320 PolarHBondContact O-N 3.36Å; E320-I322 VanDerWaalsContact C-N 3.33Å; E320-I322 PolarHBondContact O-N 2.97Å; E320-I323 PolarHBondContact O-N 3.01Å; E320-H324 PolarHBondContact O-CD2 3.03Å; E320-H324 PolarHBondContact O-N 3.26Å
321	V	89.1	Confident	88	Confident	50 Å²	50	55.1 Å²	55.1	30%	0.303	28%	0.282	S	S	.	.	H	α-helix	trans	-59	-44	169.5	168.8	0	0	0	0	110.9	F273 V317 L318 H324 I325	F273-V321 HydrophobicContact CE2-CG2 4.26Å; F273-V321 HydrophobicContact CZ-CG2 3.76Å; V317-V321 HydrophobicContact CG1-CG2 4.26Å; V317-V321 WeakPolarHBondContact O-CB 3.42Å; V317-V321 VanDerWaalsContact O-CG2 3.26Å; V317-V321 WeakPolarHBondContact O-CG2 3.24Å; V317-V321 PolarHBondContact O-N 2.85Å; L318-V321 PolarHBondContact O-N 3.5Å; V321-H324 PolarHBondContact O-N 3.16Å; V321-I325 HydrophobicContact CG1-CD1 3.68Å; V321-I325 HydrophobicContact CG1-CG1 4.41Å; V321-I325 VanDerWaalsContact O-CG1 3.25Å; V321-I325 WeakPolarHBondContact O-CG1 3.47Å; V321-I325 PolarHBondContact O-N 3.24Å
322	I	90.6	Very high	87.7	Confident	66 Å²	66	52.5 Å²	52.5	34%	0.338	26%	0.26	S	S	.	.	H	α-helix	trans	-61.4	-45.8	175.6	-70.8	161.9	0	0	0	110.8	L318 C319 E320 H324 I325 F326 L335 F340	L318-I322 WeakPolarHBondContact O-CD1 3.21Å; L318-I322 VanDerWaalsContact O-CG1 3.23Å; L318-I322 WeakPolarHBondContact O-CG1 3.34Å; L318-I322 PolarHBondContact O-N 3.34Å; C319-I322 WeakPolarHBondContact O-CB 3.23Å; C319-I322 PolarHBondContact O-N 3.34Å; E320-I322 VanDerWaalsContact C-N 3.33Å; E320-I322 PolarHBondContact O-N 2.97Å; I322-H324 PolarHBondContact O-N 3.28Å; I322-I325 PolarHBondContact O-N 3.12Å; I322-F326 HydrophobicContact CG2-CD2 3.9Å; I322-F326 HydrophobicContact CG2-CE2 3.95Å; I322-F326 WeakPolarHBondContact O-CB 3.22Å; I322-F326 VanDerWaalsContact O-CD2 3.28Å; I322-F326 WeakPolarHBondContact O-CD2 3.32Å; I322-F326 PolarHBondContact O-N 3.46Å; I322-L335 HydrophobicContact CG2-CD1 3.74Å; I322-L335 HydrophobicContact CG2-CD2 4.23Å; I322-F340 HydrophobicContact CG2-CE2 4.09Å; I322-F340 HydrophobicContact CG2-CZ 4.36Å
323	I	86.9	Confident	87.3	Confident	7 Å²	7	54.9 Å²	54.9	4%	0.036	28%	0.275	C	S	.	.	H	α-helix	trans	-57.7	-47.8	176.3	-68.8	161.2	0	0	0	110.8	L37 L41 C319 E320 I325 F326 H327 L335 F340 M344	L37-I323 HydrophobicContact CD1-CG2 3.94Å; L41-I323 HydrophobicContact CD2-CD1 4.14Å; L41-I323 HydrophobicContact CD2-CG2 4.24Å; C319-I323 WeakPolarHBondContact O-CG1 3.21Å; C319-I323 PolarHBondContact O-N 3.16Å; E320-I323 PolarHBondContact O-N 3.01Å; I323-I325 PolarHBondContact O-N 2.62Å; I323-F326 PolarHBondContact O-N 3.32Å; I323-H327 WeakPolarHBondContact O-CB 3.41Å; I323-H327 PolarHBondContact O-N 2.88Å; I323-L335 HydrophobicContact CB-CD2 4.29Å; I323-L335 HydrophobicContact CG1-CD2 3.55Å; I323-F340 HydrophobicContact CD1-CE1 4.16Å; I323-F340 HydrophobicContact CD1-CZ 4.22Å; I323-F340 HydrophobicContact CG1-CE1 4.06Å; I323-F340 HydrophobicContact CG1-CZ 3.98Å; I323-M344 HydrophobicContact CD1-CE 3.38Å; I323-M344 HydrophobicContact CD1-SD 3.73Å
324	H	84.5	Confident	87	Confident	30 Å²	30	62.6 Å²	62.6	14%	0.139	31%	0.309	C	S	.	.	H	α-helix	trans	-66.3	-33.7	179.1	-72.4	-50.6	0	0	0	113.6	Y270 F273 E320 V321 I322 R328	Y270-H324 AromaticContact CD1-CE1 3.47Å; Y270-H324 VanDerWaalsContact CD1-CE1 3.47Å; Y270-H324 WeakPolarHBondContact CD1-CE1 3.25Å; Y270-H324 AromaticContact CD1-ND1 3.98Å; Y270-H324 AromaticContact CE1-CE1 3.29Å; Y270-H324 WeakPolarHBondContact CE1-CE1 3.32Å; Y270-H324 AromaticContact CE1-ND1 3.33Å; Y270-H324 VanDerWaalsContact CE1-ND1 3.33Å; Y270-H324 WeakPolarHBondContact CE1-ND1 3.26Å; Y270-H324 AromaticContact CZ-ND1 4Å; F273-H324 AromaticContact CD1-CD2 3.65Å; F273-H324 AromaticContact CD1-NE2 3.44Å; F273-H324 WeakPolarHBondContact CD1-NE2 3.48Å; F273-H324 AromaticContact CE1-CD2 3.51Å; F273-H324 AromaticContact CE1-NE2 3.84Å; F273-H324 AromaticContact CG-NE2 3.83Å; F273-H324 AromaticContact CZ-CD2 3.96Å; E320-H324 PolarHBondContact O-CD2 3.03Å; E320-H324 PolarHBondContact O-N 3.26Å; V321-H324 PolarHBondContact O-N 3.16Å; I322-H324 PolarHBondContact O-N 3.28Å; H324-R328 WeakPolarHBondContact O-CB 3.27Å; H324-R328 PolarHBondContact O-N 3.45Å
325	I	87.4	Confident	86.7	Confident	101 Å²	101	59.6 Å²	59.6	52%	0.518	29%	0.293	S	S	.	.	H	α-helix	trans	-67.9	-46.8	173.4	-70	165.9	0	0	0	110.6	V321 I322 I323 R328 A329	V321-I325 HydrophobicContact CG1-CD1 3.68Å; V321-I325 HydrophobicContact CG1-CG1 4.41Å; V321-I325 VanDerWaalsContact O-CG1 3.25Å; V321-I325 WeakPolarHBondContact O-CG1 3.47Å; V321-I325 PolarHBondContact O-N 3.24Å; I322-I325 PolarHBondContact O-N 3.12Å; I323-I325 PolarHBondContact O-N 2.62Å; I325-R328 PolarHBondContact O-N 2.9Å; I325-A329 WeakPolarHBondContact O-CB 3.33Å; I325-A329 PolarHBondContact O-N 3.13Å
326	F	87	Confident	86.2	Confident	69 Å²	69	60.2 Å²	60.2	30%	0.303	29%	0.294	S	S	.	.	H	α-helix	trans	-69	-34.2	-179.3	-85.8	-120.4	0	0	0	112.4	I322 I323 A329 H330 I331 I332 L335	I322-F326 HydrophobicContact CG2-CD2 3.9Å; I322-F326 HydrophobicContact CG2-CE2 3.95Å; I322-F326 WeakPolarHBondContact O-CB 3.22Å; I322-F326 VanDerWaalsContact O-CD2 3.28Å; I322-F326 WeakPolarHBondContact O-CD2 3.32Å; I322-F326 PolarHBondContact O-N 3.46Å; I323-F326 PolarHBondContact O-N 3.32Å; F326-A329 PolarHBondContact O-N 3.47Å; F326-H330 PolarHBondContact O-N 2.84Å; F326-I331 HydrophobicContact CD1-CG2 4.49Å; F326-I331 PolarHBondContact O-N 3.42Å; F326-I332 PolarHBondContact O-N 3.01Å; F326-L335 HydrophobicContact CB-CD2 4.43Å; F326-L335 HydrophobicContact CD1-CB 4.14Å; F326-L335 HydrophobicContact CD1-CD1 4.34Å; F326-L335 HydrophobicContact CE1-CD1 4.35Å
327	H	84.8	Confident	86.1	Confident	15 Å²	15	63.8 Å²	63.8	7%	0.069	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-53	169.7	171.7	-116.6	0	0	0	111.5	S33 L37 Y270 I323 A329 H330	S33-H327 PolarHBondContact O-CD2 3.42Å; S33-H327 PolarHBondContact O-NE2 3.19Å; L37-H327 HydrophobicContact CD1-CB 4.16Å; Y270-H327 PolarHBondContact OH-CE1 3.41Å; Y270-H327 PolarHBondContact OH-ND1 2.59Å; Y270-H327 VanDerWaalsContact OH-ND1 3.11Å; I323-H327 WeakPolarHBondContact O-CB 3.41Å; I323-H327 PolarHBondContact O-N 2.88Å; H327-A329 PolarHBondContact O-N 3.19Å; H327-A329 VanDerWaalsContact O-N 3.16Å; H327-H330 PolarHBondContact O-N 3.12Å
328	R	84.7	Confident	85.9	Confident	219 Å²	219	65.6 Å²	65.6	83%	0.826	32%	0.324	S	S	*	.	H	α-helix	trans	-61.8	-24.2	177.1	-174.2	174.3	179.6	-175.9	0.1	113.3	H324 I325	H324-R328 WeakPolarHBondContact O-CB 3.27Å; H324-R328 PolarHBondContact O-N 3.45Å; I325-R328 PolarHBondContact O-N 2.9Å
329	A	87	Confident	85.8	Confident	50 Å²	50	67 Å²	67	41%	0.413	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-4.7	174.6	0	0	0	0	0	114.1	I325 F326 H327 I331	I325-A329 WeakPolarHBondContact O-CB 3.33Å; I325-A329 PolarHBondContact O-N 3.13Å; F326-A329 PolarHBondContact O-N 3.47Å; H327-A329 PolarHBondContact O-N 3.19Å; H327-A329 VanDerWaalsContact O-N 3.16Å; A329-I331 HydrophobicContact CB-CB 4.46Å; A329-I331 HydrophobicContact CB-CD1 4.09Å; A329-I331 HydrophobicContact CB-CG1 4.42Å; A329-I331 WeakPolarHBondContact O-CG1 3.22Å; A329-I331 PolarHBondContact O-N 3.21Å
330	H	82.6	Confident	85.7	Confident	112 Å²	112	68.4 Å²	68.4	52%	0.519	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	31.9	-170.7	-62.3	-80.6	0	0	0	114.3	E36 F326 H327	E36-H330 IonicContact OE2-CE1 3.74Å; E36-H330 IonicContact OE2-CG 3.86Å; E36-H330 IonicContact OE2-ND1 2.84Å; E36-H330 PolarHBondContact OE2-ND1 3.32Å; F326-H330 PolarHBondContact O-N 2.84Å; H327-H330 PolarHBondContact O-N 3.12Å
331	I	86.6	Confident	85.6	Confident	70 Å²	70	67.5 Å²	67.5	36%	0.359	33%	0.334	S	S	.	.			trans	-120.3	19	-176.1	-62.6	161.9	0	0	0	110.9	F326 A329 N333 K334	F326-I331 HydrophobicContact CD1-CG2 4.49Å; F326-I331 PolarHBondContact O-N 3.42Å; A329-I331 HydrophobicContact CB-CB 4.46Å; A329-I331 HydrophobicContact CB-CD1 4.09Å; A329-I331 HydrophobicContact CB-CG1 4.42Å; A329-I331 WeakPolarHBondContact O-CG1 3.22Å; A329-I331 PolarHBondContact O-N 3.21Å; I331-N333 PolarHBondContact O-N 3.37Å; I331-K334 HydrophobicContact CG2-CB 3.89Å; I331-K334 HydrophobicContact CG2-CD 3.39Å; I331-K334 HydrophobicContact CG2-CG 3.59Å; I331-K334 PolarHBondContact O-N 3.13Å
332	I	81.4	Confident	85.6	Confident	3 Å²	3	66.5 Å²	66.5	2%	0.015	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-55.1	-31.3	-176.3	-161	170.1	0	0	0	113.5	L37 F326 K334 L335	L37-I332 HydrophobicContact CD1-CD1 3.8Å; F326-I332 PolarHBondContact O-N 3.01Å; I332-K334 PolarHBondContact O-N 3.29Å; I332-L335 WeakPolarHBondContact O-CB 3.5Å; I332-L335 PolarHBondContact O-N 2.93Å
333	N	80.4	Confident	85.5	Confident	110 Å²	110	68.7 Å²	68.7	59%	0.588	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-60.8	-24.9	176.8	-67	-22.9	0	0	0	114	I331 L335 I336	I331-N333 PolarHBondContact O-N 3.37Å; N333-L335 VanDerWaalsContact C-N 3.26Å; N333-L335 PolarHBondContact O-N 2.99Å; N333-I336 HydrophobicContact CB-CD1 4.44Å; N333-I336 PolarHBondContact O-N 2.65Å
334	K	83	Confident	85.6	Confident	164 Å²	164	69.7 Å²	69.7	71%	0.713	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-75	-14.5	173.5	-65.7	-169.9	-166.2	173.6	0	113.5	I331 I332	I331-K334 HydrophobicContact CG2-CB 3.89Å; I331-K334 HydrophobicContact CG2-CD 3.39Å; I331-K334 HydrophobicContact CG2-CG 3.59Å; I331-K334 PolarHBondContact O-N 3.13Å; I332-K334 PolarHBondContact O-N 3.29Å
335	L	83.8	Confident	85.6	Confident	11 Å²	11	69.7 Å²	69.7	6%	0.058	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-85.8	-13.5	178.6	-160.2	64.4	0	0	0	112.3	I44 I322 I323 F326 I332 N333 N337 F340	I44-L335 HydrophobicContact CD1-CD2 4.27Å; I44-L335 HydrophobicContact CD1-CG 4.38Å; I322-L335 HydrophobicContact CG2-CD1 3.74Å; I322-L335 HydrophobicContact CG2-CD2 4.23Å; I323-L335 HydrophobicContact CB-CD2 4.29Å; I323-L335 HydrophobicContact CG1-CD2 3.55Å; F326-L335 HydrophobicContact CB-CD2 4.43Å; F326-L335 HydrophobicContact CD1-CB 4.14Å; F326-L335 HydrophobicContact CD1-CD1 4.34Å; F326-L335 HydrophobicContact CE1-CD1 4.35Å; I332-L335 WeakPolarHBondContact O-CB 3.5Å; I332-L335 PolarHBondContact O-N 2.93Å; N333-L335 VanDerWaalsContact C-N 3.26Å; N333-L335 PolarHBondContact O-N 2.99Å; L335-N337 VanDerWaalsContact C-N 3.28Å; L335-N337 PolarHBondContact O-N 2.9Å; L335-F340 HydrophobicContact CD1-CD1 3.94Å; L335-F340 HydrophobicContact CD1-CD2 3.77Å; L335-F340 HydrophobicContact CD1-CE1 3.99Å; L335-F340 HydrophobicContact CD1-CE2 3.81Å; L335-F340 HydrophobicContact CD1-CG 3.84Å; L335-F340 HydrophobicContact CD1-CZ 3.92Å; L335-F340 HydrophobicContact CD2-CD1 4.23Å; L335-F340 HydrophobicContact CD2-CE1 3.65Å; L335-F340 HydrophobicContact CD2-CZ 3.83Å; L335-F340 HydrophobicContact CG-CD1 3.65Å; L335-F340 HydrophobicContact CG-CD2 4.4Å; L335-F340 HydrophobicContact CG-CE1 3.61Å; L335-F340 HydrophobicContact CG-CE2 4.37Å; L335-F340 HydrophobicContact CG-CG 4.07Å; L335-F340 HydrophobicContact CG-CZ 3.99Å
336	I	82.3	Confident	85.6	Confident	47 Å²	47	68.1 Å²	68.1	24%	0.241	33%	0.332	C	S	.	.			trans	-71.1	85	174.9	-55	172.1	0	0	0	108.5	H43 I44 E47 N333	H43-I336 HydrophobicContact CB-CD1 3.78Å; H43-I336 HydrophobicContact CB-CG1 4.21Å; H43-I336 HydrophobicContact CB-CG2 4.16Å; I44-I336 HydrophobicContact CG1-CG1 4.29Å; E47-I336 HydrophobicContact CG-CG2 3.74Å; N333-I336 HydrophobicContact CB-CD1 4.44Å; N333-I336 PolarHBondContact O-N 2.65Å
337	N	86.3	Confident	85.6	Confident	80 Å²	80	64.9 Å²	64.9	43%	0.428	32%	0.318	S	S	.	.			trans	-142.3	136.4	178.6	-174.2	-42.5	0	0	0	108.9	L335 N339 F340 S341	L335-N337 VanDerWaalsContact C-N 3.28Å; L335-N337 PolarHBondContact O-N 2.9Å; N337-N339 PolarHBondContact O-N 2.85Å; N337-N339 WeakPolarHBondContact OD1-CB 3.37Å; N337-N339 PolarHBondContact OD1-N 2.83Å; N337-F340 PolarHBondContact O-N 2.74Å; N337-F340 VanDerWaalsContact O-N 3.14Å; N337-S341 WeakPolarHBondContact O-CB 3.42Å; N337-S341 PolarHBondContact O-N 2.66Å; N337-S341 PolarHBondContact O-OG 2.89Å
338	V	86.9	Confident	85.6	Confident	57 Å²	57	67 Å²	67	35%	0.345	33%	0.326	S	S	.	.	H	α-helix	trans	-51.2	-39.4	177.1	179.7	0	0	0	0	111.9	S341 N342	V338-S341 PolarHBondContact O-N 2.79Å; V338-N342 WeakPolarHBondContact CG1-ND2 3.3Å; V338-N342 VanDerWaalsContact O-CB 3.26Å; V338-N342 WeakPolarHBondContact O-CB 3.27Å; V338-N342 PolarHBondContact O-N 3.31Å; V338-N342 PolarHBondContact O-ND2 3.4Å
339	N	89.3	Confident	85.6	Confident	123 Å²	123	56.7 Å²	56.7	66%	0.658	29%	0.288	S	S	*	.	H	α-helix	trans	-65.7	-45.2	179.7	-72.1	-15.9	0	0	0	112.6	N337 F343	N337-N339 PolarHBondContact O-N 2.85Å; N337-N339 WeakPolarHBondContact OD1-CB 3.37Å; N337-N339 PolarHBondContact OD1-N 2.83Å; N339-F343 WeakPolarHBondContact O-CB 3.49Å; N339-F343 PolarHBondContact O-N 2.97Å
340	F	89	Confident	85.5	Confident	32 Å²	32	57 Å²	57	14%	0.14	28%	0.282	C	S	.	.	H	α-helix	trans	-67.2	-43	177.1	-178.1	-96.2	0	0	0	110.9	I44 C319 I322 I323 L335 N337 N342 F343 M344	I44-F340 HydrophobicContact CD1-CE1 4.42Å; C319-F340 HydrophobicContact CB-CZ 4.26Å; I322-F340 HydrophobicContact CG2-CE2 4.09Å; I322-F340 HydrophobicContact CG2-CZ 4.36Å; I323-F340 HydrophobicContact CD1-CE1 4.16Å; I323-F340 HydrophobicContact CD1-CZ 4.22Å; I323-F340 HydrophobicContact CG1-CE1 4.06Å; I323-F340 HydrophobicContact CG1-CZ 3.98Å; L335-F340 HydrophobicContact CD1-CD1 3.94Å; L335-F340 HydrophobicContact CD1-CD2 3.77Å; L335-F340 HydrophobicContact CD1-CE1 3.99Å; L335-F340 HydrophobicContact CD1-CE2 3.81Å; L335-F340 HydrophobicContact CD1-CG 3.84Å; L335-F340 HydrophobicContact CD1-CZ 3.92Å; L335-F340 HydrophobicContact CD2-CD1 4.23Å; L335-F340 HydrophobicContact CD2-CE1 3.65Å; L335-F340 HydrophobicContact CD2-CZ 3.83Å; L335-F340 HydrophobicContact CG-CD1 3.65Å; L335-F340 HydrophobicContact CG-CD2 4.4Å; L335-F340 HydrophobicContact CG-CE1 3.61Å; L335-F340 HydrophobicContact CG-CE2 4.37Å; L335-F340 HydrophobicContact CG-CG 4.07Å; L335-F340 HydrophobicContact CG-CZ 3.99Å; N337-F340 PolarHBondContact O-N 2.74Å; N337-F340 VanDerWaalsContact O-N 3.14Å; F340-N342 PolarHBondContact O-N 3.42Å; F340-F343 PolarHBondContact O-N 2.9Å; F340-M344 HydrophobicContact CE1-SD 4.25Å; F340-M344 WeakPolarHBondContact O-CB 3.24Å; F340-M344 PolarHBondContact O-N 3.45Å
341	S	84.8	Confident	85.7	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.007	26%	0.257	C	S	.	.	H	α-helix	trans	-62	-43.8	179.8	-50	0	0	0	0	112.1	I44 N337 V338 M344 L345	I44-S341 VanDerWaalsContact O-CB 3.31Å; I44-S341 WeakPolarHBondContact O-CB 3.21Å; I44-S341 PolarHBondContact O-OG 3.4Å; N337-S341 WeakPolarHBondContact O-CB 3.42Å; N337-S341 PolarHBondContact O-N 2.66Å; N337-S341 PolarHBondContact O-OG 2.89Å; V338-S341 PolarHBondContact O-N 2.79Å; S341-M344 PolarHBondContact O-N 3.37Å; S341-L345 PolarHBondContact O-N 3.32Å
342	N	87.7	Confident	85.4	Confident	30 Å²	30	48.3 Å²	48.3	16%	0.16	24%	0.24	C	C	.	.	H	α-helix	trans	-65.1	-42.9	174.2	-69.9	-19	0	0	0	112	S49 C52 V338 F340 L345 L346	S49-N342 WeakPolarHBondContact CB-OD1 3.47Å; S49-N342 PolarHBondContact N-OD1 3.38Å; C52-N342 HydrophobicContact CB-CB 4.04Å; C52-N342 VanDerWaalsContact CB-OD1 3.3Å; C52-N342 WeakPolarHBondContact CB-OD1 3.04Å; C52-N342 VanDerWaalsContact SG-CB 3.58Å; V338-N342 WeakPolarHBondContact CG1-ND2 3.3Å; V338-N342 VanDerWaalsContact O-CB 3.26Å; V338-N342 WeakPolarHBondContact O-CB 3.27Å; V338-N342 PolarHBondContact O-N 3.31Å; V338-N342 PolarHBondContact O-ND2 3.4Å; F340-N342 PolarHBondContact O-N 3.42Å; N342-L345 PolarHBondContact O-N 2.92Å; N342-L346 PolarHBondContact O-N 3.49Å
343	F	90.3	Very high	85.3	Confident	112 Å²	112	49.3 Å²	49.3	49%	0.491	25%	0.245	S	C	.	.	H	α-helix	trans	-65.2	-39.5	177.4	-177.6	-103.6	0	0	0	112.1	C319 N339 F340 L346 S347	C319-F343 VanDerWaalsContact SG-CD1 3.55Å; C319-F343 WeakPolarHBondContact SG-CE1 3.34Å; N339-F343 WeakPolarHBondContact O-CB 3.49Å; N339-F343 PolarHBondContact O-N 2.97Å; F340-F343 PolarHBondContact O-N 2.9Å; F343-L346 PolarHBondContact O-N 2.9Å; F343-S347 WeakPolarHBondContact O-CB 3.21Å; F343-S347 PolarHBondContact O-N 3.2Å; F343-S347 PolarHBondContact O-OG 2.91Å
344	M	88.1	Confident	85.5	Confident	28 Å²	28	44.1 Å²	44.1	14%	0.138	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-41.7	175.7	-171.6	-177.3	-175	0	0	112	I44 H316 C319 I323 F340 S341 S347 Y348	I44-M344 HydrophobicContact CG2-SD 4.02Å; H316-M344 PolarHBondContact CE1-O 3.41Å; C319-M344 HydrophobicContact CB-CG 4.34Å; I323-M344 HydrophobicContact CD1-CE 3.38Å; I323-M344 HydrophobicContact CD1-SD 3.73Å; F340-M344 HydrophobicContact CE1-SD 4.25Å; F340-M344 WeakPolarHBondContact O-CB 3.24Å; F340-M344 PolarHBondContact O-N 3.45Å; S341-M344 PolarHBondContact O-N 3.37Å; M344-S347 PolarHBondContact O-OG 3.41Å; M344-S347 VanDerWaalsContact O-OG 3.07Å; M344-Y348 VanDerWaalsContact O-CB 3.26Å; M344-Y348 WeakPolarHBondContact O-CB 3.4Å; M344-Y348 PolarHBondContact O-N 3.28Å
345	L	84.7	Confident	85.2	Confident	29 Å²	29	36.3 Å²	36.3	15%	0.152	18%	0.183	C	C	.	.	H	α-helix	trans	-64.1	-42.6	174.7	179.7	62.6	0	0	0	111.8	I48 A56 S341 N342 Y348 A349	I48-L345 HydrophobicContact CD1-CB 4.35Å; I48-L345 HydrophobicContact CD1-CD2 4.39Å; I48-L345 HydrophobicContact CG2-CD2 3.64Å; A56-L345 HydrophobicContact CB-CD1 4.48Å; A56-L345 HydrophobicContact CB-CD2 3.8Å; A56-L345 HydrophobicContact CB-CG 3.85Å; S341-L345 PolarHBondContact O-N 3.32Å; N342-L345 PolarHBondContact O-N 2.92Å; L345-Y348 PolarHBondContact O-N 3.41Å; L345-A349 PolarHBondContact O-N 3.17Å
346	L	86.6	Confident	84.6	Confident	68 Å²	68	35.8 Å²	35.8	36%	0.356	18%	0.181	S	C	.	.	H	α-helix	trans	-67.8	-41.4	179	-173.9	63.8	0	0	0	111.9	F59 N342 F343 A349 L350	F59-L346 HydrophobicContact CD2-CD1 4.34Å; F59-L346 HydrophobicContact CE2-CD1 4.48Å; N342-L346 PolarHBondContact O-N 3.49Å; F343-L346 PolarHBondContact O-N 2.9Å; L346-A349 PolarHBondContact O-N 2.97Å; L346-L350 WeakPolarHBondContact O-CG 3.02Å; L346-L350 PolarHBondContact O-N 3.1Å
347	S	88.5	Confident	84	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.007	18%	0.176	C	C	.	.	H	α-helix	trans	-67.1	-36.9	176.8	70.5	0	0	0	0	112	H316 C319 F343 M344 L350 Y351	H316-S347 PolarHBondContact CE1-OG 3.18Å; C319-S347 PolarHBondContact SG-OG 3.47Å; F343-S347 WeakPolarHBondContact O-CB 3.21Å; F343-S347 PolarHBondContact O-N 3.2Å; F343-S347 PolarHBondContact O-OG 2.91Å; M344-S347 PolarHBondContact O-OG 3.41Å; M344-S347 VanDerWaalsContact O-OG 3.07Å; S347-L350 PolarHBondContact O-N 2.99Å; S347-Y351 WeakPolarHBondContact O-CB 3.41Å; S347-Y351 PolarHBondContact O-N 2.89Å
348	Y	84.9	Confident	83.2	Confident	61 Å²	61	31.1 Å²	31.1	24%	0.239	16%	0.158	C	C	.	.	H	α-helix	trans	-63.3	-42.2	171.7	-175.7	-105.1	0	0	0	112.2	Q153 H316 M344 L345 Y351 H352	Q153-Y348 PolarHBondContact NE2-OH 3.17Å; H316-Y348 PolarHBondContact CE1-N 2.87Å; H316-Y348 AromaticContact NE2-CD2 3.48Å; H316-Y348 WeakPolarHBondContact NE2-CD2 3.09Å; M344-Y348 VanDerWaalsContact O-CB 3.26Å; M344-Y348 WeakPolarHBondContact O-CB 3.4Å; M344-Y348 PolarHBondContact O-N 3.28Å; L345-Y348 PolarHBondContact O-N 3.41Å; Y348-Y351 WeakPolarHBondContact O-CB 3.35Å; Y348-Y351 PolarHBondContact O-N 2.93Å; Y348-H352 AromaticContact CD1-CD2 3.8Å; Y348-H352 AromaticContact CD1-NE2 3.91Å; Y348-H352 AromaticContact CE1-CD2 3.54Å; Y348-H352 AromaticContact CE1-NE2 3.22Å; Y348-H352 WeakPolarHBondContact CE1-NE2 3.46Å; Y348-H352 AromaticContact CE2-NE2 3.53Å; Y348-H352 AromaticContact CZ-CD2 3.78Å; Y348-H352 AromaticContact CZ-NE2 3.01Å; Y348-H352 PolarHBondContact O-CD2 3.41Å; Y348-H352 VanDerWaalsContact O-CD2 3.24Å; Y348-H352 PolarHBondContact O-N 2.81Å; Y348-H352 VanDerWaalsContact O-N 3.12Å; Y348-H352 PolarHBondContact OH-NE2 3.33Å; Y348-H352 VanDerWaalsContact OH-NE2 3.12Å
349	A	83.3	Confident	82.1	Confident	2 Å²	2	29.2 Å²	29.2	2%	0.017	15%	0.145	C	C	.	.	H	α-helix	trans	-62	-43.6	174.2	0	0	0	0	0	112	L60 L345 L346 H352 M353	L60-A349 HydrophobicContact CD1-CB 4.26Å; L60-A349 HydrophobicContact CD2-CB 4.13Å; L60-A349 HydrophobicContact CG-CB 4.05Å; L345-A349 PolarHBondContact O-N 3.17Å; L346-A349 PolarHBondContact O-N 2.97Å; A349-H352 PolarHBondContact O-N 2.01Å; A349-M353 WeakPolarHBondContact O-CG 3.33Å; A349-M353 PolarHBondContact O-N 3.5Å
350	L	85.8	Confident	80.8	Confident	56 Å²	56	24.1 Å²	24.1	29%	0.293	12%	0.118	S	C	.	.	H	α-helix	trans	-63.2	-38.9	174.8	-70.2	171.5	0	0	0	112.6	F312 L346 S347 H352 M353 S354	F312-L350 HydrophobicContact CD1-CB 4.34Å; F312-L350 HydrophobicContact CD1-CD2 4.24Å; F312-L350 HydrophobicContact CE1-CD2 4.25Å; L346-L350 WeakPolarHBondContact O-CG 3.02Å; L346-L350 PolarHBondContact O-N 3.1Å; S347-L350 PolarHBondContact O-N 2.99Å; L350-H352 VanDerWaalsContact C-N 3.34Å; L350-H352 PolarHBondContact O-N 2.94Å; L350-M353 HydrophobicContact CD2-SD 4.33Å; L350-M353 WeakPolarHBondContact O-CB 3.16Å; L350-M353 PolarHBondContact O-N 3.02Å; L350-M353 VanDerWaalsContact O-N 3.16Å; L350-S354 PolarHBondContact O-N 2.87Å
351	Y	86.1	Confident	79.5	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59.3	-43.1	174.1	165.8	-104.7	0	0	0	111.8	R277 M313 S347 Y348 M353 S354 F355	R277-Y351 HydrophobicContact CG-CE2 4.36Å; M313-Y351 HydrophobicContact CB-CD2 4.38Å; M313-Y351 HydrophobicContact CE-CE2 4.4Å; M313-Y351 HydrophobicContact CG-CD2 4.13Å; M313-Y351 HydrophobicContact CG-CE2 4.26Å; S347-Y351 WeakPolarHBondContact O-CB 3.41Å; S347-Y351 PolarHBondContact O-N 2.89Å; Y348-Y351 WeakPolarHBondContact O-CB 3.35Å; Y348-Y351 PolarHBondContact O-N 2.93Å; Y351-M353 VanDerWaalsContact C-N 3.35Å; Y351-M353 PolarHBondContact O-N 2.99Å; Y351-S354 WeakPolarHBondContact O-CB 3.24Å; Y351-S354 PolarHBondContact O-N 3.09Å; Y351-S354 VanDerWaalsContact O-N 3.16Å; Y351-S354 PolarHBondContact O-OG 3.41Å; Y351-F355 HydrophobicContact CD1-CE2 4.5Å; Y351-F355 AromaticContact CE1-CE2 3.92Å; Y351-F355 HydrophobicContact CE1-CE2 3.92Å; Y351-F355 HydrophobicContact CE1-CZ 4.43Å; Y351-F355 HydrophobicContact CE2-CE2 4.04Å; Y351-F355 AromaticContact CE2-CZ 3.98Å; Y351-F355 HydrophobicContact CE2-CZ 3.98Å; Y351-F355 AromaticContact CZ-CE2 3.67Å; Y351-F355 AromaticContact CZ-CZ 3.73Å
352	H	81.3	Confident	78.4	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66.2	-35.7	173.7	-76.3	-64.1	0	0	0	113.4	L60 S149 T150 Q153 Y348 A349 L350 S354 F355	L60-H352 HydrophobicContact CD2-CB 4.29Å; S149-H352 PolarHBondContact OG-CE1 2.94Å; S149-H352 PolarHBondContact OG-ND1 3.45Å; T150-H352 HydrophobicContact CG2-CB 4.18Å; Q153-H352 PolarHBondContact NE2-CE1 3.3Å; Q153-H352 PolarHBondContact NE2-NE2 3.06Å; Q153-H352 VanDerWaalsContact NE2-NE2 3.19Å; Q153-H352 PolarHBondContact OE1-CD2 3.31Å; Q153-H352 VanDerWaalsContact OE1-CD2 3.26Å; Q153-H352 PolarHBondContact OE1-NE2 2.66Å; Y348-H352 AromaticContact CD1-CD2 3.8Å; Y348-H352 AromaticContact CD1-NE2 3.91Å; Y348-H352 AromaticContact CE1-CD2 3.54Å; Y348-H352 AromaticContact CE1-NE2 3.22Å; Y348-H352 WeakPolarHBondContact CE1-NE2 3.46Å; Y348-H352 AromaticContact CE2-NE2 3.53Å; Y348-H352 AromaticContact CZ-CD2 3.78Å; Y348-H352 AromaticContact CZ-NE2 3.01Å; Y348-H352 PolarHBondContact O-CD2 3.41Å; Y348-H352 VanDerWaalsContact O-CD2 3.24Å; Y348-H352 PolarHBondContact O-N 2.81Å; Y348-H352 VanDerWaalsContact O-N 3.12Å; Y348-H352 PolarHBondContact OH-NE2 3.33Å; Y348-H352 VanDerWaalsContact OH-NE2 3.12Å; A349-H352 PolarHBondContact O-N 2.01Å; L350-H352 VanDerWaalsContact C-N 3.34Å; L350-H352 PolarHBondContact O-N 2.94Å; H352-S354 PolarHBondContact O-N 2.86Å; H352-F355 PolarHBondContact O-N 3.39Å
353	M	79.4	Confident	77.1	Confident	24 Å²	24	25.2 Å²	25.2	12%	0.118	13%	0.127	C	C	.	.	H	α-helix	trans	-61.7	-32.2	172.5	-67.1	-174.2	-177.2	0	0	112.4	F59 F63 A349 L350 Y351 F355 S356 C357	F59-M353 VanDerWaalsContact C-CE 3.5Å; F59-M353 HydrophobicContact CB-CE 3.66Å; F59-M353 HydrophobicContact CD1-CE 4.48Å; F59-M353 HydrophobicContact CG-CE 4.45Å; F59-M353 VanDerWaalsContact O-CE 3.26Å; F59-M353 WeakPolarHBondContact O-CE 3.4Å; F63-M353 HydrophobicContact CB-CE 3.78Å; F63-M353 HydrophobicContact CB-CG 4.27Å; F63-M353 HydrophobicContact CB-SD 4.4Å; F63-M353 HydrophobicContact CD1-CB 4.36Å; F63-M353 HydrophobicContact CD1-CG 3.83Å; F63-M353 HydrophobicContact CD2-CB 4.24Å; F63-M353 HydrophobicContact CD2-CE 4.47Å; F63-M353 HydrophobicContact CD2-CG 3.82Å; F63-M353 HydrophobicContact CD2-SD 4.02Å; F63-M353 HydrophobicContact CE1-CB 4.06Å; F63-M353 HydrophobicContact CE1-CG 4.05Å; F63-M353 HydrophobicContact CE2-CB 3.94Å; F63-M353 HydrophobicContact CE2-CG 4.04Å; F63-M353 HydrophobicContact CG-CB 4.43Å; F63-M353 HydrophobicContact CG-CE 4.18Å; F63-M353 HydrophobicContact CG-CG 3.7Å; F63-M353 HydrophobicContact CG-SD 4.2Å; F63-M353 HydrophobicContact CZ-CB 3.82Å; F63-M353 HydrophobicContact CZ-CG 4.13Å; F63-M353 WeakPolarHBondContact CZ-O 3.5Å; A349-M353 WeakPolarHBondContact O-CG 3.33Å; A349-M353 PolarHBondContact O-N 3.5Å; L350-M353 HydrophobicContact CD2-SD 4.33Å; L350-M353 WeakPolarHBondContact O-CB 3.16Å; L350-M353 PolarHBondContact O-N 3.02Å; L350-M353 VanDerWaalsContact O-N 3.16Å; Y351-M353 VanDerWaalsContact C-N 3.35Å; Y351-M353 PolarHBondContact O-N 2.99Å; M353-F355 PolarHBondContact O-N 2.74Å; M353-F355 VanDerWaalsContact O-N 3.12Å; M353-S356 PolarHBondContact O-N 2.96Å; M353-S356 VanDerWaalsContact O-N 3.17Å; M353-C357 WeakPolarHBondContact O-CB 3.31Å; M353-C357 PolarHBondContact O-N 3.36Å
354	S	82.7	Confident	75.5	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-52.4	-38.7	-178.5	81.8	0	0	0	0	113.3	F309 L350 Y351 H352 S356 T358	F309-S354 WeakPolarHBondContact CD2-OG 3.28Å; L350-S354 PolarHBondContact O-N 2.87Å; Y351-S354 WeakPolarHBondContact O-CB 3.24Å; Y351-S354 PolarHBondContact O-N 3.09Å; Y351-S354 VanDerWaalsContact O-N 3.16Å; Y351-S354 PolarHBondContact O-OG 3.41Å; H352-S354 PolarHBondContact O-N 2.86Å; S354-S356 PolarHBondContact O-N 2.84Å; S354-T358 WeakPolarHBondContact O-CG2 3.41Å; S354-T358 PolarHBondContact O-N 2.9Å; S354-T358 PolarHBondContact O-OG1 3.34Å; S354-T358 VanDerWaalsContact O-OG1 3.12Å
355	F	76.8	Confident	74.2	Confident	1 Å²	1	26.4 Å²	26.4	0%	0.004	13%	0.132	C	C	.	.	H	α-helix	trans	-70.8	-24.3	-175.7	-66.4	-65.2	0	0	0	115.3	S142 V145 R185 A188 S189 F309 Y351 H352 M353	S142-F355 PolarHBondContact OG-O 3.36Å; V145-F355 HydrophobicContact CB-CB 4.42Å; V145-F355 HydrophobicContact CG1-CB 3.93Å; V145-F355 HydrophobicContact CG1-CD2 3.91Å; V145-F355 HydrophobicContact CG1-CG 4.1Å; V145-F355 HydrophobicContact CG2-CB 4.5Å; R185-F355 HydrophobicContact CB-CZ 4.37Å; R185-F355 HydrophobicContact CG-CE2 4.21Å; A188-F355 HydrophobicContact CB-CD1 3.58Å; A188-F355 HydrophobicContact CB-CE1 3.96Å; A188-F355 HydrophobicContact CB-CG 4.34Å; S189-F355 WeakPolarHBondContact OG-CE1 3.46Å; F309-F355 AromaticContact CE2-CD1 3.99Å; F309-F355 HydrophobicContact CE2-CD1 3.99Å; F309-F355 AromaticContact CE2-CE1 3.68Å; F309-F355 HydrophobicContact CE2-CE1 3.68Å; F309-F355 HydrophobicContact CE2-CZ 4.31Å; F309-F355 HydrophobicContact CZ-CE1 4.13Å; Y351-F355 HydrophobicContact CD1-CE2 4.5Å; Y351-F355 AromaticContact CE1-CE2 3.92Å; Y351-F355 HydrophobicContact CE1-CE2 3.92Å; Y351-F355 HydrophobicContact CE1-CZ 4.43Å; Y351-F355 HydrophobicContact CE2-CE2 4.04Å; Y351-F355 AromaticContact CE2-CZ 3.98Å; Y351-F355 HydrophobicContact CE2-CZ 3.98Å; Y351-F355 AromaticContact CZ-CE2 3.67Å; Y351-F355 AromaticContact CZ-CZ 3.73Å; H352-F355 PolarHBondContact O-N 3.39Å; M353-F355 PolarHBondContact O-N 2.74Å; M353-F355 VanDerWaalsContact O-N 3.12Å
356	S	71.6	Confident	72.8	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-110	-21.2	175.6	-41.6	0	0	0	0	112.3	L146 M353 S354 F359 V360	L146-S356 WeakPolarHBondContact CG-OG 3.43Å; M353-S356 PolarHBondContact O-N 2.96Å; M353-S356 VanDerWaalsContact O-N 3.17Å; S354-S356 PolarHBondContact O-N 2.84Å; S356-F359 PolarHBondContact O-N 2.71Å; S356-V360 WeakPolarHBondContact O-CB 3.47Å; S356-V360 VanDerWaalsContact O-CG2 3.28Å; S356-V360 WeakPolarHBondContact O-CG2 3.43Å; S356-V360 PolarHBondContact O-N 2.98Å
357	C	70.5	Confident	71	Confident	21 Å²	21	24.5 Å²	24.5	14%	0.142	12%	0.121	C	C	.	.	H	α-helix	trans	-70.5	-38.8	179.8	-169.1	0	0	0	0	111.3	F63 F312 M353 F359 V360 L361	F63-C357 HydrophobicContact CE2-CB 4.18Å; F63-C357 HydrophobicContact CZ-CB 4.18Å; F312-C357 HydrophobicContact CE2-CB 4.02Å; M353-C357 WeakPolarHBondContact O-CB 3.31Å; M353-C357 PolarHBondContact O-N 3.36Å; C357-F359 VanDerWaalsContact C-N 3.34Å; C357-F359 PolarHBondContact O-N 2.98Å; C357-V360 PolarHBondContact O-N 3.3Å; C357-L361 VanDerWaalsContact O-CB 3.28Å; C357-L361 WeakPolarHBondContact O-CB 3.42Å; C357-L361 VanDerWaalsContact O-CG 3.27Å; C357-L361 WeakPolarHBondContact O-CG 3.1Å; C357-L361 PolarHBondContact O-N 3.48Å; C357-L361 VanDerWaalsContact SG-CD1 3.6Å
358	T	68	Low	69.3	Low	8 Å²	8	29.3 Å²	29.3	5%	0.049	15%	0.146	C	C	.	.	H	α-helix	trans	-52.9	-51.1	169.8	46.9	0	0	0	0	111.5	I192 I308 F309 S354 L361 A362	I192-T358 HydrophobicContact CD1-CG2 4.47Å; I308-T358 HydrophobicContact CG2-CG2 4.41Å; F309-T358 HydrophobicContact CB-CG2 3.83Å; S354-T358 WeakPolarHBondContact O-CG2 3.41Å; S354-T358 PolarHBondContact O-N 2.9Å; S354-T358 PolarHBondContact O-OG1 3.34Å; S354-T358 VanDerWaalsContact O-OG1 3.12Å; T358-L361 PolarHBondContact O-N 2.96Å; T358-A362 WeakPolarHBondContact O-CB 3.34Å; T358-A362 PolarHBondContact O-N 3.15Å
359	F	65	Low	67.9	Low	16 Å²	16	27.7 Å²	27.7	7%	0.07	14%	0.143	C	C	.	.	H	α-helix	trans	-71	-40	-179.2	-174.2	-92.5	0	0	0	113.3	I71 A74 R135 C139 S356 C357 L361 A362 T363	I71-F359 HydrophobicContact CG1-CD1 3.81Å; I71-F359 HydrophobicContact CG1-CE1 4.15Å; A74-F359 HydrophobicContact CB-CE1 3.96Å; A74-F359 HydrophobicContact CB-CZ 4.17Å; R135-F359 HydrophobicContact CG-CE2 4.27Å; C139-F359 HydrophobicContact CB-CE1 4.47Å; C139-F359 HydrophobicContact CB-CE2 4.41Å; C139-F359 HydrophobicContact CB-CZ 4.13Å; C139-F359 WeakPolarHBondContact SG-CE2 3.37Å; C139-F359 WeakPolarHBondContact SG-CZ 3.49Å; S356-F359 PolarHBondContact O-N 2.71Å; C357-F359 VanDerWaalsContact C-N 3.34Å; C357-F359 PolarHBondContact O-N 2.98Å; F359-L361 VanDerWaalsContact C-N 3.33Å; F359-L361 PolarHBondContact O-N 3.3Å; F359-A362 WeakPolarHBondContact O-CB 3.5Å; F359-A362 PolarHBondContact O-N 2.89Å; F359-T363 HydrophobicContact CD1-CG2 4.08Å; F359-T363 HydrophobicContact CE1-CG2 3.37Å; F359-T363 HydrophobicContact CE2-CG2 4.32Å; F359-T363 HydrophobicContact CZ-CG2 3.47Å; F359-T363 VanDerWaalsContact CZ-CG2 3.47Å; F359-T363 PolarHBondContact O-N 3.42Å; F359-T363 PolarHBondContact O-OG1 3.05Å
360	V	61	Low	66.5	Low	17 Å²	17	29.9 Å²	29.9	10%	0.103	15%	0.153	C	C	.	.	H	α-helix	trans	-60	-45.1	173.7	164.4	0	0	0	0	110.1	L70 S356 C357 A362 T363 L364	L70-V360 HydrophobicContact CB-CG2 4.34Å; L70-V360 HydrophobicContact CD1-CG1 3.73Å; L70-V360 HydrophobicContact CD1-CG2 4Å; S356-V360 WeakPolarHBondContact O-CB 3.47Å; S356-V360 VanDerWaalsContact O-CG2 3.28Å; S356-V360 WeakPolarHBondContact O-CG2 3.43Å; S356-V360 PolarHBondContact O-N 2.98Å; C357-V360 PolarHBondContact O-N 3.3Å; V360-A362 PolarHBondContact O-N 3.4Å; V360-T363 PolarHBondContact O-N 2.98Å; V360-T363 PolarHBondContact O-OG1 3.15Å; V360-L364 HydrophobicContact CG1-CD1 3.77Å; V360-L364 HydrophobicContact CG1-CG 4.32Å; V360-L364 WeakPolarHBondContact O-CB 3.39Å; V360-L364 WeakPolarHBondContact O-CG 3.38Å; V360-L364 PolarHBondContact O-N 2.89Å
361	L	62.7	Low	64.6	Low	69 Å²	69	31 Å²	31	36%	0.361	16%	0.159	S	C	.	.	H	α-helix	trans	-69.1	-31.7	176.9	-68.7	169.8	0	0	0	112.6	I308 C357 T358 F359 L364 R365	I308-L361 HydrophobicContact CD1-CD1 3.63Å; I308-L361 HydrophobicContact CG1-CD1 4.44Å; I308-L361 HydrophobicContact CG2-CD1 4.1Å; C357-L361 VanDerWaalsContact O-CB 3.28Å; C357-L361 WeakPolarHBondContact O-CB 3.42Å; C357-L361 VanDerWaalsContact O-CG 3.27Å; C357-L361 WeakPolarHBondContact O-CG 3.1Å; C357-L361 PolarHBondContact O-N 3.48Å; C357-L361 VanDerWaalsContact SG-CD1 3.6Å; T358-L361 PolarHBondContact O-N 2.96Å; F359-L361 VanDerWaalsContact C-N 3.33Å; F359-L361 PolarHBondContact O-N 3.3Å; L361-L364 HydrophobicContact CD2-CD1 4.34Å; L361-R365 WeakPolarHBondContact O-CB 3.49Å; L361-R365 PolarHBondContact O-N 3.2Å
362	A	62.6	Low	63.4	Low	12 Å²	12	36.5 Å²	36.5	10%	0.099	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-48.1	168.4	0	0	0	0	0	111.6	E305 T358 F359 V360 S366	E305-A362 WeakPolarHBondContact OE1-CB 3.48Å; T358-A362 WeakPolarHBondContact O-CB 3.34Å; T358-A362 PolarHBondContact O-N 3.15Å; F359-A362 WeakPolarHBondContact O-CB 3.5Å; F359-A362 PolarHBondContact O-N 2.89Å; V360-A362 PolarHBondContact O-N 3.4Å; A362-S366 WeakPolarHBondContact O-CB 3.15Å; A362-S366 PolarHBondContact O-N 2.69Å
363	T	58.8	Low	62.4	Low	4 Å²	4	40.6 Å²	40.6	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-67.1	-40.3	177.8	58	0	0	0	0	112.9	A74 F359 V360 S366 M367	A74-T363 HydrophobicContact CB-CG2 3.88Å; F359-T363 HydrophobicContact CD1-CG2 4.08Å; F359-T363 HydrophobicContact CE1-CG2 3.37Å; F359-T363 HydrophobicContact CE2-CG2 4.32Å; F359-T363 HydrophobicContact CZ-CG2 3.47Å; F359-T363 VanDerWaalsContact CZ-CG2 3.47Å; F359-T363 PolarHBondContact O-N 3.42Å; F359-T363 PolarHBondContact O-OG1 3.05Å; V360-T363 PolarHBondContact O-N 2.98Å; V360-T363 PolarHBondContact O-OG1 3.15Å; T363-S366 CarbonylContact O-C 3.59Å; T363-S366 WeakPolarHBondContact O-CB 3.2Å; T363-S366 PolarHBondContact O-N 3.33Å; T363-M367 WeakPolarHBondContact O-CG 3.48Å; T363-M367 PolarHBondContact O-N 3.48Å
364	L	57.1	Low	61.1	Low	70 Å²	70	43.1 Å²	43.1	37%	0.366	22%	0.215	S	C	.	.	H	α-helix	trans	-67.6	-45.3	176.6	-73	171.8	0	0	0	111.8	V360 L361 S366 M367 L368	V360-L364 HydrophobicContact CG1-CD1 3.77Å; V360-L364 HydrophobicContact CG1-CG 4.32Å; V360-L364 WeakPolarHBondContact O-CB 3.39Å; V360-L364 WeakPolarHBondContact O-CG 3.38Å; V360-L364 PolarHBondContact O-N 2.89Å; L361-L364 HydrophobicContact CD2-CD1 4.34Å; L364-S366 PolarHBondContact O-N 3.13Å; L364-M367 PolarHBondContact O-N 3.46Å; L364-M367 VanDerWaalsContact O-N 3.17Å; L364-L368 WeakPolarHBondContact O-CB 3.29Å; L364-L368 VanDerWaalsContact O-CG 3.28Å; L364-L368 WeakPolarHBondContact O-CG 3.16Å; L364-L368 PolarHBondContact O-N 2.8Å
365	R	61.4	Low	59.6	Low	96 Å²	96	51.9 Å²	51.9	36%	0.362	25%	0.248	S	C	.	.	H	α-helix	trans	-54.7	-44.5	172.3	-176.4	-177	-174	96.3	1.3	110.1	L361 L368 S369	L361-R365 WeakPolarHBondContact O-CB 3.49Å; L361-R365 PolarHBondContact O-N 3.2Å; R365-L368 PolarHBondContact O-N 2.88Å; R365-S369 PolarHBondContact O-N 3.27Å; R365-S369 PolarHBondContact O-OG 3.3Å
366	S	54.6	Low	59	Low	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.7	-31.8	179.4	-179.6	0	0	0	0	114.7	R135 A362 T363 L364 S369 S434 V435 A436	R135-S366 PolarHBondContact NH2-OG 2.96Å; A362-S366 WeakPolarHBondContact O-CB 3.15Å; A362-S366 PolarHBondContact O-N 2.69Å; T363-S366 CarbonylContact O-C 3.59Å; T363-S366 WeakPolarHBondContact O-CB 3.2Å; T363-S366 PolarHBondContact O-N 3.33Å; L364-S366 PolarHBondContact O-N 3.13Å; S366-S369 PolarHBondContact O-OG 2.76Å; S366-S434 WeakPolarHBondContact CA-O 3.49Å; S366-S434 VanDerWaalsContact O-O 3.06Å; S366-S434 PolarHBondContact OG-O 2.87Å; S366-V435 PolarHBondContact OG-N 3.38Å; S366-A436 WeakPolarHBondContact OG-CB 3.34Å; S366-A436 PolarHBondContact OG-N 3.28Å
367	M	49.9	Very low	58.7	Low	56 Å²	56	64.9 Å²	64.9	28%	0.276	30%	0.3	S	S	.	.	H	α-helix	trans	-76.1	-39.3	169.2	-69.5	-178.5	-123.8	0	0	111.6	T363 L364 E370 I371 Y437	T363-M367 WeakPolarHBondContact O-CG 3.48Å; T363-M367 PolarHBondContact O-N 3.48Å; L364-M367 PolarHBondContact O-N 3.46Å; L364-M367 VanDerWaalsContact O-N 3.17Å; M367-E370 WeakPolarHBondContact O-CB 3.42Å; M367-E370 PolarHBondContact O-N 2.9Å; M367-I371 WeakPolarHBondContact O-CD1 3.33Å; M367-I371 VanDerWaalsContact O-CG1 3.26Å; M367-I371 WeakPolarHBondContact O-CG1 3.42Å; M367-I371 PolarHBondContact O-N 3.35Å; M367-Y437 HydrophobicContact CG-CE2 4.09Å
368	L	52.9	Low	57.8	Low	102 Å²	102	71.2 Å²	71.2	53%	0.534	32%	0.321	S	S	.	.	H	α-helix	trans	-66.3	-40.4	-179.4	-73.2	169.3	0	0	0	112.6	L364 R365 I371 Q372	L364-L368 WeakPolarHBondContact O-CB 3.29Å; L364-L368 VanDerWaalsContact O-CG 3.28Å; L364-L368 WeakPolarHBondContact O-CG 3.16Å; L364-L368 PolarHBondContact O-N 2.8Å; R365-L368 PolarHBondContact O-N 2.88Å; L368-I371 PolarHBondContact O-N 3.16Å; L368-Q372 WeakPolarHBondContact O-CB 3.47Å; L368-Q372 VanDerWaalsContact O-CG 3.26Å; L368-Q372 WeakPolarHBondContact O-CG 3.47Å; L368-Q372 PolarHBondContact O-N 3.42Å
369	S	55.2	Low	57.4	Low	27 Å²	27	73.5 Å²	73.5	19%	0.189	34%	0.338	C	S	.	.	H	α-helix	trans	-67.7	-34.6	174.3	41.1	0	0	0	0	112.8	R365 S366 Q372 E373 S434	R365-S369 PolarHBondContact O-N 3.27Å; R365-S369 PolarHBondContact O-OG 3.3Å; S366-S369 PolarHBondContact O-OG 2.76Å; S369-Q372 PolarHBondContact O-N 3.03Å; S369-E373 WeakPolarHBondContact O-CB 3.24Å; S369-E373 PolarHBondContact O-N 3.39Å; S369-S434 WeakPolarHBondContact OG-CA 3.44Å; S369-S434 VanDerWaalsContact OG-CB 3.27Å; S369-S434 WeakPolarHBondContact OG-CB 3.31Å; S369-S434 PolarHBondContact OG-O 2.83Å
370	E	52.8	Low	57.1	Low	49 Å²	49	78.8 Å²	78.8	23%	0.229	36%	0.364	C	S	.	.	H	α-helix	trans	-64.2	-49.5	171.1	-175.2	-152.4	174.8	0	0	110.7	M367 Q372 E373 E374 Y437	M367-E370 WeakPolarHBondContact O-CB 3.42Å; M367-E370 PolarHBondContact O-N 2.9Å; E370-Q372 PolarHBondContact O-N 3.29Å; E370-E373 CarbonylContact O-C 3.44Å; E370-E373 PolarHBondContact O-N 3.42Å; E370-E374 WeakPolarHBondContact O-CB 3.44Å; E370-E374 PolarHBondContact O-N 3.5Å; E370-Y437 VanDerWaalsContact CD-CB 3.4Å; E370-Y437 WeakPolarHBondContact OE1-CB 3.45Å; E370-Y437 WeakPolarHBondContact OE2-CB 3.49Å; E370-Y437 WeakPolarHBondContact OE2-CD2 3.25Å
371	I	46.7	Very low	56.9	Low	80 Å²	80	83.6 Å²	83.6	41%	0.41	39%	0.388	S	S	.	.	H	α-helix	trans	-57.2	-37.5	175.9	-68.3	162.5	0	0	0	110.9	M367 L368 R375	M367-I371 WeakPolarHBondContact O-CD1 3.33Å; M367-I371 VanDerWaalsContact O-CG1 3.26Å; M367-I371 WeakPolarHBondContact O-CG1 3.42Å; M367-I371 PolarHBondContact O-N 3.35Å; L368-I371 PolarHBondContact O-N 3.16Å; I371-R375 WeakPolarHBondContact O-CB 3.32Å; I371-R375 WeakPolarHBondContact O-CG 3.33Å; I371-R375 PolarHBondContact O-N 3.04Å
372	Q	60.1	Low	56.5	Low	115 Å²	115	83.8 Å²	83.8	54%	0.537	39%	0.389	S	S	.	.	H	α-helix	trans	-69.9	-39.7	173.9	-74	174.7	1	0	0	112.9	L368 S369 E370 R375 R376	L368-Q372 WeakPolarHBondContact O-CB 3.47Å; L368-Q372 VanDerWaalsContact O-CG 3.26Å; L368-Q372 WeakPolarHBondContact O-CG 3.47Å; L368-Q372 PolarHBondContact O-N 3.42Å; S369-Q372 PolarHBondContact O-N 3.03Å; E370-Q372 PolarHBondContact O-N 3.29Å; Q372-R375 PolarHBondContact O-N 2.93Å; Q372-R376 WeakPolarHBondContact O-CB 3.49Å; Q372-R376 WeakPolarHBondContact O-CG 3.46Å; Q372-R376 PolarHBondContact O-N 3.42Å
373	E	61.6	Low	56	Low	86 Å²	86	92 Å²	92	40%	0.402	42%	0.419	S	S	.	.	H	α-helix	trans	-69.7	-40.3	177	-165.6	-179.7	142.8	0	0	111.4	S369 E370 R376 K377	S369-E373 WeakPolarHBondContact O-CB 3.24Å; S369-E373 PolarHBondContact O-N 3.39Å; E370-E373 CarbonylContact O-C 3.44Å; E370-E373 PolarHBondContact O-N 3.42Å; E373-R376 PolarHBondContact O-N 2.75Å; E373-K377 WeakPolarHBondContact O-CG 3.31Å; E373-K377 PolarHBondContact O-N 3.07Å; E373-K377 WeakPolarHBondContact OE1-CE 3.31Å; E373-K377 IonicContact OE1-NZ 3.87Å; E373-K377 PolarHBondContact OE1-NZ 3.45Å
374	E	51.7	Low	55.7	Low	76 Å²	76	96.5 Å²	96.5	36%	0.355	44%	0.443	S	S	.	.	H	α-helix	trans	-59.9	-47.8	169.5	-79.8	-128.6	138.7	0	0	111.5	E370 R376 K377 R378	E370-E374 WeakPolarHBondContact O-CB 3.44Å; E370-E374 PolarHBondContact O-N 3.5Å; E374-R376 VanDerWaalsContact C-N 3.33Å; E374-R376 PolarHBondContact O-N 3.01Å; E374-K377 PolarHBondContact O-N 2.92Å; E374-R378 WeakPolarHBondContact O-CB 3.49Å; E374-R378 VanDerWaalsContact O-CG 3.23Å; E374-R378 WeakPolarHBondContact O-CG 3.23Å; E374-R378 PolarHBondContact O-N 2.91Å; E374-R378 IonicContact OE2-CZ 2.78Å; E374-R378 IonicContact OE2-NE 2.69Å; E374-R378 IonicContact OE2-NH2 3.46Å; E374-R378 PolarHBondContact OE2-NH2 2.87Å
375	R	50.2	Low	55.2	Low	184 Å²	184	97.1 Å²	97.1	69%	0.694	44%	0.444	S	S	*	.	H	α-helix	trans	-58.6	-43.7	175.2	-79.1	177	-175.6	-152.2	1.9	111.5	I371 Q372 R378 S379	I371-R375 WeakPolarHBondContact O-CB 3.32Å; I371-R375 WeakPolarHBondContact O-CG 3.33Å; I371-R375 PolarHBondContact O-N 3.04Å; Q372-R375 PolarHBondContact O-N 2.93Å; R375-R378 PolarHBondContact O-N 3.48Å; R375-S379 PolarHBondContact O-N 3.42Å; R375-S379 PolarHBondContact O-OG 2.82Å
376	R	65.8	Low	54.6	Low	164 Å²	164	96.8 Å²	96.8	62%	0.619	45%	0.453	S	S	*	.	H	α-helix	trans	-62.9	-41.8	175.9	-77.1	176.5	-178.9	174.3	1.5	112.9	Q372 E373 E374 S379 M380	Q372-R376 WeakPolarHBondContact O-CB 3.49Å; Q372-R376 WeakPolarHBondContact O-CG 3.46Å; Q372-R376 PolarHBondContact O-N 3.42Å; E373-R376 PolarHBondContact O-N 2.75Å; E374-R376 VanDerWaalsContact C-N 3.33Å; E374-R376 PolarHBondContact O-N 3.01Å; R376-S379 WeakPolarHBondContact CA-OG 3.31Å; R376-S379 PolarHBondContact O-N 3.28Å; R376-S379 PolarHBondContact O-OG 3.11Å; R376-M380 VanDerWaalsContact O-CG 3.31Å; R376-M380 WeakPolarHBondContact O-CG 3.28Å; R376-M380 PolarHBondContact O-N 3Å
377	K	63.9	Low	54.3	Low	111 Å²	111	101 Å²	101	48%	0.483	48%	0.479	S	S	.	.	H	α-helix	trans	-67.5	-42.6	176.3	-74.1	172.4	-174.6	164.8	0	111.7	E373 E374 S379 M380 L381	E373-K377 WeakPolarHBondContact O-CG 3.31Å; E373-K377 PolarHBondContact O-N 3.07Å; E373-K377 WeakPolarHBondContact OE1-CE 3.31Å; E373-K377 IonicContact OE1-NZ 3.87Å; E373-K377 PolarHBondContact OE1-NZ 3.45Å; E374-K377 PolarHBondContact O-N 2.92Å; K377-S379 VanDerWaalsContact C-N 3.34Å; K377-S379 PolarHBondContact O-N 3.42Å; K377-M380 PolarHBondContact O-N 2.98Å; K377-L381 WeakPolarHBondContact O-CG 3.2Å; K377-L381 PolarHBondContact O-N 3.48Å
378	R	52.2	Low	54	Low	153 Å²	153	103.9 Å²	103.9	58%	0.577	49%	0.492	S	S	*	.	H	α-helix	trans	-63	-38.8	174.6	-68	172.5	-167	-145.9	8.2	111.6	E374 R375 L382	E374-R378 WeakPolarHBondContact O-CB 3.49Å; E374-R378 VanDerWaalsContact O-CG 3.23Å; E374-R378 WeakPolarHBondContact O-CG 3.23Å; E374-R378 PolarHBondContact O-N 2.91Å; E374-R378 IonicContact OE2-CZ 2.78Å; E374-R378 IonicContact OE2-NE 2.69Å; E374-R378 IonicContact OE2-NH2 3.46Å; E374-R378 PolarHBondContact OE2-NH2 2.87Å; R375-R378 PolarHBondContact O-N 3.48Å; R378-L382 WeakPolarHBondContact O-CB 3.34Å; R378-L382 WeakPolarHBondContact O-CG 3.32Å; R378-L382 PolarHBondContact O-N 2.94Å
379	S	59.3	Low	53.4	Low	57 Å²	57	103.4 Å²	103.4	40%	0.399	49%	0.49	S	S	.	.	H	α-helix	trans	-69.3	-37.2	173.8	61.3	0	0	0	0	112.9	R375 R376 K377 L382 Y383	R375-S379 PolarHBondContact O-N 3.42Å; R375-S379 PolarHBondContact O-OG 2.82Å; R376-S379 WeakPolarHBondContact CA-OG 3.31Å; R376-S379 PolarHBondContact O-N 3.28Å; R376-S379 PolarHBondContact O-OG 3.11Å; K377-S379 VanDerWaalsContact C-N 3.34Å; K377-S379 PolarHBondContact O-N 3.42Å; S379-L382 PolarHBondContact O-N 3.24Å; S379-Y383 WeakPolarHBondContact O-CD2 3.47Å; S379-Y383 PolarHBondContact O-N 2.98Å
380	M	58.5	Low	52.7	Low	126 Å²	126	107.1 Å²	107.1	62%	0.621	52%	0.516	S	S	*	.	H	α-helix	trans	-64	-45.3	173.4	-73.4	172.9	-169	0	0	111.6	R376 K377 L382 Y383 D384	R376-M380 VanDerWaalsContact O-CG 3.31Å; R376-M380 WeakPolarHBondContact O-CG 3.28Å; R376-M380 PolarHBondContact O-N 3Å; K377-M380 PolarHBondContact O-N 2.98Å; M380-L382 VanDerWaalsContact C-N 3.33Å; M380-L382 PolarHBondContact O-N 3.19Å; M380-Y383 PolarHBondContact O-N 3.06Å; M380-Y383 VanDerWaalsContact O-N 3.15Å; M380-D384 PolarHBondContact O-N 3.07Å
381	L	56.1	Low	52	Low	118 Å²	118	107.9 Å²	107.9	62%	0.618	53%	0.526	S	S	*	.	H	α-helix	trans	-62.2	-38.3	176.8	-72.8	168.2	0	0	0	112.4	K377 Y383 D384 E385	K377-L381 WeakPolarHBondContact O-CG 3.2Å; K377-L381 PolarHBondContact O-N 3.48Å; L381-Y383 VanDerWaalsContact C-N 3.34Å; L381-D384 PolarHBondContact O-N 3.42Å; L381-E385 VanDerWaalsContact O-CB 3.3Å; L381-E385 WeakPolarHBondContact O-CB 3.37Å; L381-E385 PolarHBondContact O-N 3.37Å
382	L	55.4	Low	51.5	Low	73 Å²	73	111.6 Å²	111.6	38%	0.382	54%	0.539	S	S	.	.	H	α-helix	trans	-66.1	-33.9	174	-80.8	164.4	0	0	0	113	R378 S379 M380 T386	R378-L382 WeakPolarHBondContact O-CB 3.34Å; R378-L382 WeakPolarHBondContact O-CG 3.32Å; R378-L382 PolarHBondContact O-N 2.94Å; S379-L382 PolarHBondContact O-N 3.24Å; M380-L382 VanDerWaalsContact C-N 3.33Å; M380-L382 PolarHBondContact O-N 3.19Å; L382-T386 WeakPolarHBondContact O-CG2 3.46Å; L382-T386 PolarHBondContact O-N 3.34Å; L382-T386 PolarHBondContact O-OG1 3.33Å
383	Y	52.1	Low	50.2	Low	185 Å²	185	115 Å²	115	73%	0.725	56%	0.555	S	S	*	*	H	α-helix	trans	-71.1	-47.7	172.4	-97.8	-89.6	0	0	0	111.7	S379 M380 L381 E385 T386 T387	S379-Y383 WeakPolarHBondContact O-CD2 3.47Å; S379-Y383 PolarHBondContact O-N 2.98Å; M380-Y383 PolarHBondContact O-N 3.06Å; M380-Y383 VanDerWaalsContact O-N 3.15Å; L381-Y383 VanDerWaalsContact C-N 3.34Å; Y383-E385 VanDerWaalsContact C-N 3.32Å; Y383-E385 PolarHBondContact O-N 3.45Å; Y383-T386 PolarHBondContact O-N 3.05Å; Y383-T386 PolarHBondContact O-OG1 2.89Å; Y383-T387 PolarHBondContact O-N 3.23Å; Y383-T387 PolarHBondContact O-OG1 3.4Å
384	D	51.2	Low	48.7	Very low	99 Å²	99	119.9 Å²	119.9	53%	0.529	58%	0.578	S	S	.	*	H	α-helix	trans	-61.1	-41.6	-179.3	-112.5	-19.1	0	0	0	111.5	M380 L381 T386 T387 H388	M380-D384 PolarHBondContact O-N 3.07Å; L381-D384 PolarHBondContact O-N 3.42Å; D384-T386 PolarHBondContact O-N 3.39Å; D384-T387 PolarHBondContact O-N 3.06Å; D384-T387 PolarHBondContact O-OG1 3.26Å; D384-T387 VanDerWaalsContact O-OG1 3.05Å; D384-H388 WeakPolarHBondContact O-CB 3.26Å; D384-H388 PolarHBondContact O-N 3.12Å
385	E	48.2	Very low	47.6	Very low	82 Å²	82	121.5 Å²	121.5	38%	0.383	60%	0.598	S	S	.	*	H	α-helix	trans	-68	-33.4	-178.5	-156.9	176.4	-155.1	0	0	112.8	L381 Y383 H388 D389 R502	L381-E385 VanDerWaalsContact O-CB 3.3Å; L381-E385 WeakPolarHBondContact O-CB 3.37Å; L381-E385 PolarHBondContact O-N 3.37Å; Y383-E385 VanDerWaalsContact C-N 3.32Å; Y383-E385 PolarHBondContact O-N 3.45Å; E385-H388 PolarHBondContact O-N 2.65Å; E385-D389 PolarHBondContact O-N 3.3Å; E385-D389 VanDerWaalsContact O-N 3.08Å; E385-R502 VanDerWaalsContact CD-NH2 3.3Å; E385-R502 IonicContact OE1-CZ 3.28Å; E385-R502 IonicContact OE1-NH1 3.32Å; E385-R502 PolarHBondContact OE1-NH1 2.85Å; E385-R502 IonicContact OE1-NH2 3.99Å; E385-R502 PolarHBondContact OE1-NH2 2.75Å; E385-R502 IonicContact OE2-CZ 3.2Å; E385-R502 IonicContact OE2-NH1 3.27Å; E385-R502 PolarHBondContact OE2-NH1 3.29Å; E385-R502 IonicContact OE2-NH2 2.84Å
386	T	47.6	Very low	46.6	Very low	90 Å²	90	118.5 Å²	118.5	55%	0.552	61%	0.605	S	S	*	*	H	α-helix	trans	-70.9	-32.5	174	53.2	0	0	0	0	112.7	L382 Y383 D384 S390	L382-T386 WeakPolarHBondContact O-CG2 3.46Å; L382-T386 PolarHBondContact O-N 3.34Å; L382-T386 PolarHBondContact O-OG1 3.33Å; Y383-T386 PolarHBondContact O-N 3.05Å; Y383-T386 PolarHBondContact O-OG1 2.89Å; D384-T386 PolarHBondContact O-N 3.39Å; T386-S390 PolarHBondContact O-OG 2.74Å
387	T	49.8	Very low	45	Very low	89 Å²	89	116.2 Å²	116.2	55%	0.546	61%	0.614	S	S	.	*	H	α-helix	trans	-74.2	-30.1	168.6	23.1	0	0	0	0	113.7	Y383 D384 S391	Y383-T387 PolarHBondContact O-N 3.23Å; Y383-T387 PolarHBondContact O-OG1 3.4Å; D384-T387 PolarHBondContact O-N 3.06Å; D384-T387 PolarHBondContact O-OG1 3.26Å; D384-T387 VanDerWaalsContact O-OG1 3.05Å; T387-S391 WeakPolarHBondContact O-CB 3.48Å; T387-S391 PolarHBondContact O-OG 3.14Å
388	H	42.2	Very low	43.6	Very low	116 Å²	116	115.6 Å²	115.6	54%	0.537	62%	0.624	S	S	.	*	H	α-helix	trans	-85	-24.6	-176	-105.5	-55.4	0	0	0	115.9	D384 E385 S391	D384-H388 WeakPolarHBondContact O-CB 3.26Å; D384-H388 PolarHBondContact O-N 3.12Å; E385-H388 PolarHBondContact O-N 2.65Å; H388-S391 WeakPolarHBondContact CA-OG 3.4Å; H388-S391 PolarHBondContact O-OG 3.21Å
389	D	40.7	Very low	42.7	Very low	92 Å²	92	119.5 Å²	119.5	49%	0.492	64%	0.639	S	S	.	*	H	α-helix	trans	-88	-18.7	172.4	-80.5	-20.6	0	0	0	113.2	E385 S391 K392	E385-D389 PolarHBondContact O-N 3.3Å; E385-D389 VanDerWaalsContact O-N 3.08Å; D389-S391 VanDerWaalsContact C-N 3.34Å; D389-K392 IonicContact OD1-NZ 2.8Å; D389-K392 PolarHBondContact OD1-NZ 3.31Å
390	S	41	Very low	41.4	Very low	105 Å²	105	124.5 Å²	124.5	73%	0.734	66%	0.661	S	S	*	*	S	Bend	trans	-79	-13.2	170.4	-53.9	0	0	0	0	113.8	T386	T386-S390 PolarHBondContact O-OG 2.74Å
391	S	37.5	Very low	40.2	Very low	65 Å²	65	128 Å²	128	46%	0.455	67%	0.673	S	S	.	*	S	Bend	trans	-104.8	4.1	-171.6	48.3	0	0	0	0	115.3	T387 H388 D389 Q393	T387-S391 WeakPolarHBondContact O-CB 3.48Å; T387-S391 PolarHBondContact O-OG 3.14Å; H388-S391 WeakPolarHBondContact CA-OG 3.4Å; H388-S391 PolarHBondContact O-OG 3.21Å; D389-S391 VanDerWaalsContact C-N 3.34Å; S391-Q393 VanDerWaalsContact C-N 3.29Å; S391-Q393 PolarHBondContact O-N 2.88Å
392	K	36.3	Very low	39	Very low	157 Å²	157	127.8 Å²	127.8	68%	0.683	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	13	179.6	-76.3	173.6	-171	148.2	0	115.5	D389	D389-K392 IonicContact OD1-NZ 2.8Å; D389-K392 PolarHBondContact OD1-NZ 3.31Å
393	Q	32.6	Very low	37.8	Very low	188 Å²	188	130.6 Å²	130.6	88%	0.879	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.1	10	178.9	-121.1	176	1.3	0	0	116.1	S391	S391-Q393 VanDerWaalsContact C-N 3.29Å; S391-Q393 PolarHBondContact O-N 2.88Å
394	Q	30.2	Very low	36.9	Very low	187 Å²	187	129.3 Å²	129.3	87%	0.874	70%	0.701	S	S	*	*			trans	-132.1	74.5	167.6	-82.5	-176.4	-19.5	0	0	111.5
395	S	28	Very low	35.8	Very low	110 Å²	110	134.9 Å²	134.9	77%	0.769	71%	0.714	S	S	*	*			trans	-71.8	133.8	161.1	51	0	0	0	0	110.4
396	S	29.9	Very low	35	Very low	121 Å²	121	139.8 Å²	139.8	85%	0.846	74%	0.741	S	S	*	*			trans	72.9	100.9	174.6	70.8	0	0	0	0	118.4
397	S	32.2	Very low	34.2	Very low	117 Å²	117	138.8 Å²	138.8	82%	0.818	74%	0.742	S	S	*	*				177.1	144.5	129.2	-170.6	0	0	0	0	112.5
398	S	34.8	Very low	33.3	Very low	97 Å²	97	142 Å²	142	68%	0.678	76%	0.756	S	S	*	*			trans	38.5	121.7	150.5	-165.6	0	0	0	0	120.2
399	R	34	Very low	32.8	Very low	236 Å²	236	143.9 Å²	143.9	89%	0.891	77%	0.77	S	S	*	*			cis	70	66.8	23.9	-138	-168.1	-138.8	175.6	8.7	116.7
400	N	30.4	Very low	32.3	Very low	162 Å²	162	146.3 Å²	146.3	87%	0.866	78%	0.783	S	S	*	*			trans	-169.5	167.8	143.4	-102.3	-30.3	0	0	0	114
401	K	34.7	Very low	31.7	Very low	199 Å²	199	148.7 Å²	148.7	87%	0.865	79%	0.788	S	S	*	*			trans	71.2	128.9	-174.9	-89.8	-176	176.1	174	0	115.8
402	T	31.2	Very low	31.4	Very low	113 Å²	113	151.7 Å²	151.7	69%	0.693	80%	0.803	S	S	*	*			cis	-147.2	128.7	-1.9	-45.7	0	0	0	0	111.9	I404	T402-I404 PolarHBondContact O-N 3.08Å
403	T	29.6	Very low	31.1	Very low	133 Å²	133	150.1 Å²	150.1	82%	0.816	81%	0.807	S	S	*	*			trans	-76.6	111.2	171.5	-53.2	0	0	0	0	111
404	I	32.8	Very low	30.9	Very low	158 Å²	158	148.1 Å²	148.1	81%	0.81	80%	0.802	S	S	*	*			trans	-99.6	92.5	160.6	-62.6	-176.5	0	0	0	108.9	T402	T402-I404 PolarHBondContact O-N 3.08Å
405	R	28.9	Very low	30.9	Very low	215 Å²	215	147.9 Å²	147.9	81%	0.811	80%	0.801	S	S	*	*			trans	25.7	108.1	153.6	-66.8	179.4	176.8	160.3	-0.2	118.3	A407	R405-A407 PolarHBondContact O-N 3.46Å; R405-A407 VanDerWaalsContact O-N 3.16Å
406	I	31.6	Very low	31.1	Very low	185 Å²	185	150.6 Å²	150.6	95%	0.949	80%	0.804	S	S	*	*			trans	-59.8	105.3	141.6	-62.6	164.7	0	0	0	107.7
407	A	29	Very low	31.1	Very low	70 Å²	70	155 Å²	155	58%	0.579	81%	0.81	S	S	*	*			trans	-157.6	96.6	166.4	0	0	0	0	0	108	R405	R405-A407 PolarHBondContact O-N 3.46Å; R405-A407 VanDerWaalsContact O-N 3.16Å
408	D	31.3	Very low	31.4	Very low	157 Å²	157	150.7 Å²	150.7	84%	0.84	79%	0.785	S	S	*	*			trans	167	74.2	145.8	-84.2	-9.5	0	0	0	109.1
409	N	31.2	Very low	31.7	Very low	154 Å²	154	150 Å²	150	82%	0.824	78%	0.777	S	S	*	*			trans	-76.9	137.1	152.2	-95.2	-23.8	0	0	0	107.6
410	N	30.4	Very low	31.8	Very low	144 Å²	144	147.2 Å²	147.2	77%	0.77	77%	0.771	S	S	*	*	S	Bend	trans	87.8	135.6	178.9	-48.5	-34.5	0	0	0	115.5
411	N	28.5	Very low	32.1	Very low	155 Å²	155	150 Å²	150	83%	0.829	77%	0.77	S	S	*	*			trans	74.7	70.3	173.4	-55.1	-18.4	0	0	0	118
412	T	33	Very low	32.3	Very low	127 Å²	127	144.8 Å²	144.8	78%	0.779	74%	0.744	S	S	*	*			trans	-165.6	74.6	131.5	16.7	0	0	0	0	111.7
413	T	28.2	Very low	32.7	Very low	125 Å²	125	143.5 Å²	143.5	77%	0.767	74%	0.737	S	S	*	*			trans	-56.4	137.2	144.3	44.1	0	0	0	0	108.4
414	N	30	Very low	33.2	Very low	145 Å²	145	142.9 Å²	142.9	78%	0.775	73%	0.728	S	S	*	*	S	Bend	trans	85.5	57.6	174.1	-43.7	-34	0	0	0	118.5
415	Q	28.5	Very low	33.6	Very low	182 Å²	182	138.7 Å²	138.7	85%	0.85	71%	0.707	S	S	*	*	S	Bend	trans	-166.8	145.7	148.7	-105.4	152.9	62.9	0	0	111.7
416	M	32.1	Very low	34.2	Very low	168 Å²	168	129.2 Å²	129.2	83%	0.828	67%	0.672	S	S	*	*			trans	100.4	3.2	178.1	-63.4	-155.7	174.9	0	0	121	G418	M416-G418 PolarHBondContact O-N 3.05Å
417	H	30.4	Very low	34.6	Very low	212 Å²	212	126 Å²	126	98%	0.981	65%	0.653	S	S	*	*	S	Bend	trans	-81.7	80.5	166.7	-107.9	11	0	0	0	112.2
418	G	38.9	Very low	35.2	Very low	27 Å²	27	123.4 Å²	123.4	28%	0.278	63%	0.634	S	S	.	*	S	Bend	trans	173.5	-48.2	169.2	0	0	0	0	0	116.4	M416 R421 R422	M416-G418 PolarHBondContact O-N 3.05Å; G418-R421 PolarHBondContact O-N 2.74Å; G418-R422 WeakPolarHBondContact O-CG 3.23Å; G418-R422 PolarHBondContact O-N 2.95Å; G418-R422 VanDerWaalsContact O-N 3.14Å
419	T	40.8	Very low	35.8	Very low	84 Å²	84	116.8 Å²	116.8	52%	0.515	60%	0.598	S	S	.	*	H	α-helix	trans	-64	-48	-163.9	48.4	0	0	0	0	114.8	R421 R422 T423	T419-R421 PolarHBondContact O-N 3.02Å; T419-R422 WeakPolarHBondContact O-CB 3.35Å; T419-R422 PolarHBondContact O-N 3.39Å; T419-R422 VanDerWaalsContact O-N 3.09Å; T419-T423 PolarHBondContact O-N 3.26Å; T419-T423 VanDerWaalsContact O-N 3.1Å; T419-T423 PolarHBondContact O-OG1 3.19Å
420	K	35.8	Very low	36.3	Very low	177 Å²	177	112.1 Å²	112.1	77%	0.77	57%	0.571	S	S	*	*	H	α-helix	trans	-63.6	-20.1	177.2	-81	-175.3	175.3	177.6	0	114.5	N424	K420-N424 PolarHBondContact O-ND2 3.02Å
421	R	36.9	Very low	37.1	Very low	220 Å²	220	110 Å²	110	83%	0.83	56%	0.555	S	S	*	*	H	α-helix	trans	-86.8	-32.1	174.5	-159.2	178.7	-174.2	-167.9	0.6	111.4	G418 T419 L425	G418-R421 PolarHBondContact O-N 2.74Å; T419-R421 PolarHBondContact O-N 3.02Å; R421-L425 PolarHBondContact O-N 2.9Å; R421-L425 VanDerWaalsContact O-N 3.08Å
422	R	39.5	Very low	37.7	Very low	89 Å²	89	103.6 Å²	103.6	34%	0.336	52%	0.52	S	S	.	.	H	α-helix	trans	-65.1	-52.3	175.1	-70.8	172.9	-177.3	-166.8	-10.4	111.6	E207 G418 T419 N424 L425 I426	E207-R422 IonicContact OE1-CZ 2.64Å; E207-R422 IonicContact OE1-NE 2.67Å; E207-R422 IonicContact OE1-NH1 3.47Å; E207-R422 PolarHBondContact OE1-NH1 3.28Å; E207-R422 IonicContact OE1-NH2 2.68Å; G418-R422 WeakPolarHBondContact O-CG 3.23Å; G418-R422 PolarHBondContact O-N 2.95Å; G418-R422 VanDerWaalsContact O-N 3.14Å; T419-R422 WeakPolarHBondContact O-CB 3.35Å; T419-R422 PolarHBondContact O-N 3.39Å; T419-R422 VanDerWaalsContact O-N 3.09Å; R422-N424 VanDerWaalsContact C-N 3.33Å; R422-N424 PolarHBondContact O-N 3.2Å; R422-L425 PolarHBondContact O-N 3.48Å; R422-L425 VanDerWaalsContact O-N 3.09Å; R422-I426 WeakPolarHBondContact O-CG1 3.33Å; R422-I426 PolarHBondContact O-N 2.78Å
423	T	40.2	Very low	38	Very low	87 Å²	87	99 Å²	99	53%	0.534	49%	0.49	S	S	.	.	H	α-helix	trans	-59.5	-41.3	178.5	48.5	0	0	0	0	112.4	T419 L425 I426 H427	T419-T423 PolarHBondContact O-N 3.26Å; T419-T423 VanDerWaalsContact O-N 3.1Å; T419-T423 PolarHBondContact O-OG1 3.19Å; T423-L425 PolarHBondContact O-N 2.99Å; T423-I426 PolarHBondContact O-N 2.98Å; T423-H427 WeakPolarHBondContact O-CB 3.27Å; T423-H427 PolarHBondContact O-N 3.24Å
424	N	39.5	Very low	38.5	Very low	120 Å²	120	94.3 Å²	94.3	64%	0.642	46%	0.462	S	S	*	.	H	α-helix	trans	-67.5	-32.6	175.7	-79.4	-48.6	0	0	0	114	K420 R422 G428	K420-N424 PolarHBondContact O-ND2 3.02Å; R422-N424 VanDerWaalsContact C-N 3.33Å; R422-N424 PolarHBondContact O-N 3.2Å; N424-G428 WeakPolarHBondContact O-CA 3.44Å; N424-G428 PolarHBondContact O-N 3.48Å
425	L	41	Very low	38.8	Very low	70 Å²	70	90.2 Å²	90.2	37%	0.366	44%	0.442	S	S	.	.	H	α-helix	trans	-68.2	-48.4	173.5	-168.4	98.3	0	0	0	110	R421 R422 T423 G428 L429	R421-L425 PolarHBondContact O-N 2.9Å; R421-L425 VanDerWaalsContact O-N 3.08Å; R422-L425 PolarHBondContact O-N 3.48Å; R422-L425 VanDerWaalsContact O-N 3.09Å; T423-L425 PolarHBondContact O-N 2.99Å; L425-G428 CarbonylContact O-C 3.54Å; L425-G428 VanDerWaalsContact O-CA 3.23Å; L425-G428 WeakPolarHBondContact O-CA 3.29Å; L425-G428 PolarHBondContact O-N 3.47Å; L425-G428 VanDerWaalsContact O-N 3.12Å; L425-L429 HydrophobicContact CD2-CD1 4.41Å; L425-L429 WeakPolarHBondContact O-CG 3.17Å; L425-L429 PolarHBondContact O-N 2.82Å
426	I	40.7	Very low	39	Very low	15 Å²	15	82.4 Å²	82.4	8%	0.077	41%	0.408	C	S	.	.	H	α-helix	trans	-78.3	-39	-172.5	-49.9	165.7	0	0	0	111.7	L295 D299 R422 T423 G428 L429 Q430	L295-I426 HydrophobicContact CD1-CD1 4.41Å; D299-I426 HydrophobicContact CB-CG2 3.73Å; D299-I426 WeakPolarHBondContact OD1-CG2 3.38Å; D299-I426 VanDerWaalsContact OD2-CD1 3.31Å; D299-I426 WeakPolarHBondContact OD2-CD1 3.26Å; R422-I426 WeakPolarHBondContact O-CG1 3.33Å; R422-I426 PolarHBondContact O-N 2.78Å; T423-I426 PolarHBondContact O-N 2.98Å; I426-G428 PolarHBondContact O-N 2.95Å; I426-L429 CarbonylContact O-C 3.46Å; I426-L429 WeakPolarHBondContact O-CA 3.47Å; I426-L429 WeakPolarHBondContact O-CB 3.26Å; I426-L429 PolarHBondContact O-N 3.24Å; I426-Q430 WeakPolarHBondContact O-CG 3.46Å; I426-Q430 PolarHBondContact O-N 3.05Å
427	H	41.6	Very low	39.1	Very low	117 Å²	117	78.4 Å²	78.4	54%	0.542	39%	0.385	S	S	.	.	H	α-helix	trans	-61	-28.7	165	-168.5	-50.8	0	0	0	111.2	T423 K431	T423-H427 WeakPolarHBondContact O-CB 3.27Å; T423-H427 PolarHBondContact O-N 3.24Å; H427-K431 WeakPolarHBondContact O-CB 3.3Å; H427-K431 PolarHBondContact O-N 2.99Å
428	G	41.1	Very low	39.1	Very low	17 Å²	17	75.7 Å²	75.7	18%	0.175	37%	0.366	C	S	.	.	H	α-helix	trans	-62.4	-52.2	167	0	0	0	0	0	112.1	N424 L425 I426 K431 Q432	N424-G428 WeakPolarHBondContact O-CA 3.44Å; N424-G428 PolarHBondContact O-N 3.48Å; L425-G428 CarbonylContact O-C 3.54Å; L425-G428 VanDerWaalsContact O-CA 3.23Å; L425-G428 WeakPolarHBondContact O-CA 3.29Å; L425-G428 PolarHBondContact O-N 3.47Å; L425-G428 VanDerWaalsContact O-N 3.12Å; I426-G428 PolarHBondContact O-N 2.95Å; G428-K431 WeakPolarHBondContact O-CA 3.44Å; G428-K431 VanDerWaalsContact O-CB 3.24Å; G428-K431 WeakPolarHBondContact O-CB 3.42Å; G428-K431 PolarHBondContact O-N 3.1Å; G428-K431 VanDerWaalsContact O-N 3.12Å; G428-Q432 WeakPolarHBondContact O-CG 3.45Å; G428-Q432 PolarHBondContact O-N 3.2Å; G428-Q432 VanDerWaalsContact O-N 3.07Å
429	L	44.6	Very low	38.7	Very low	17 Å²	17	81.6 Å²	81.6	9%	0.089	38%	0.38	C	S	.	.	H	α-helix	trans	-62	-40.8	176.3	-64.1	174.6	0	0	0	112.3	L199 F220 V302 L425 I426 K431 Q432 F433	L199-L429 HydrophobicContact CD2-CD1 4.23Å; L199-L429 HydrophobicContact CD2-CD2 3.49Å; L199-L429 VanDerWaalsContact CD2-CD2 3.49Å; F220-L429 HydrophobicContact CE2-CD2 4.38Å; F220-L429 HydrophobicContact CZ-CD2 3.66Å; V302-L429 HydrophobicContact CG2-CB 4.47Å; L425-L429 HydrophobicContact CD2-CD1 4.41Å; L425-L429 WeakPolarHBondContact O-CG 3.17Å; L425-L429 PolarHBondContact O-N 2.82Å; I426-L429 CarbonylContact O-C 3.46Å; I426-L429 WeakPolarHBondContact O-CA 3.47Å; I426-L429 WeakPolarHBondContact O-CB 3.26Å; I426-L429 PolarHBondContact O-N 3.24Å; L429-K431 VanDerWaalsContact C-N 3.31Å; L429-K431 PolarHBondContact O-N 3.27Å; L429-Q432 VanDerWaalsContact O-CB 3.31Å; L429-Q432 WeakPolarHBondContact O-CB 3.26Å; L429-Q432 PolarHBondContact O-N 3.01Å; L429-F433 VanDerWaalsContact O-CD2 3.28Å; L429-F433 WeakPolarHBondContact O-CD2 3.5Å; L429-F433 PolarHBondContact O-N 3.29Å
430	Q	41.2	Very low	38.1	Very low	57 Å²	57	83.7 Å²	83.7	27%	0.266	38%	0.382	S	S	.	.	H	α-helix	trans	-60.5	-41.6	171.9	-68.2	-179.1	5.1	0	0	110.7	D299 I426 Q432 F433 S434	D299-Q430 PolarHBondContact OD1-NE2 3.48Å; I426-Q430 WeakPolarHBondContact O-CG 3.46Å; I426-Q430 PolarHBondContact O-N 3.05Å; Q430-Q432 PolarHBondContact O-N 3.49Å; Q430-F433 PolarHBondContact O-N 3.48Å; Q430-S434 WeakPolarHBondContact O-CB 3.5Å; Q430-S434 PolarHBondContact O-N 3.49Å; Q430-S434 PolarHBondContact O-OG 3.44Å; Q430-S434 VanDerWaalsContact O-OG 3.13Å
431	K	46.7	Very low	37.9	Very low	98 Å²	98	80.2 Å²	80.2	43%	0.426	38%	0.378	S	S	.	.	H	α-helix	trans	-58.5	-31.4	170.2	-95.1	-158.1	159	-175.4	0	113.5	H427 G428 L429 F433 S434 V435	H427-K431 WeakPolarHBondContact O-CB 3.3Å; H427-K431 PolarHBondContact O-N 2.99Å; G428-K431 WeakPolarHBondContact O-CA 3.44Å; G428-K431 VanDerWaalsContact O-CB 3.24Å; G428-K431 WeakPolarHBondContact O-CB 3.42Å; G428-K431 PolarHBondContact O-N 3.1Å; G428-K431 VanDerWaalsContact O-N 3.12Å; L429-K431 VanDerWaalsContact C-N 3.31Å; L429-K431 PolarHBondContact O-N 3.27Å; K431-F433 VanDerWaalsContact C-N 3.28Å; K431-F433 PolarHBondContact O-N 2.93Å; K431-S434 WeakPolarHBondContact CA-OG 3.34Å; K431-S434 PolarHBondContact O-N 3.31Å; K431-S434 VanDerWaalsContact O-N 3.14Å; K431-V435 HydrophobicContact CB-CG2 3.83Å; K431-V435 HydrophobicContact CD-CG2 3.71Å; K431-V435 HydrophobicContact CG-CG2 3.5Å; K431-V435 WeakPolarHBondContact O-CB 3.5Å; K431-V435 WeakPolarHBondContact O-CG2 3.28Å; K431-V435 PolarHBondContact O-N 3.37Å
432	Q	41.3	Very low	37.5	Very low	22 Å²	22	75.2 Å²	75.2	10%	0.103	37%	0.367	C	S	.	.	H	α-helix	trans	-67.8	-30.6	-179.9	-63.7	-174.5	-27.7	0	0	113	L131 F220 G428 L429 Q430	L131-Q432 HydrophobicContact CD1-CB 3.62Å; L131-Q432 HydrophobicContact CD1-CG 3.5Å; L131-Q432 HydrophobicContact CD2-CB 4.36Å; L131-Q432 HydrophobicContact CD2-CG 3.74Å; L131-Q432 HydrophobicContact CG-CG 4.18Å; F220-Q432 VanDerWaalsContact CE1-CD 3.49Å; G428-Q432 WeakPolarHBondContact O-CG 3.45Å; G428-Q432 PolarHBondContact O-N 3.2Å; G428-Q432 VanDerWaalsContact O-N 3.07Å; L429-Q432 VanDerWaalsContact O-CB 3.31Å; L429-Q432 WeakPolarHBondContact O-CB 3.26Å; L429-Q432 PolarHBondContact O-N 3.01Å; Q430-Q432 PolarHBondContact O-N 3.49Å
433	F	39.8	Very low	37	Very low	30 Å²	30	75.6 Å²	75.6	13%	0.132	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	2.4	174	-56.8	-61.2	0	0	0	113.1	V302 E305 L429 Q430 K431	V302-F433 HydrophobicContact CG1-CE2 4.44Å; E305-F433 WeakPolarHBondContact OE1-CD1 3.31Å; E305-F433 WeakPolarHBondContact OE1-CE1 3.39Å; E305-F433 WeakPolarHBondContact OE2-CE1 3.36Å; L429-F433 VanDerWaalsContact O-CD2 3.28Å; L429-F433 WeakPolarHBondContact O-CD2 3.5Å; L429-F433 PolarHBondContact O-N 3.29Å; Q430-F433 PolarHBondContact O-N 3.48Å; K431-F433 VanDerWaalsContact C-N 3.28Å; K431-F433 PolarHBondContact O-N 2.93Å
434	S	38.2	Very low	36.8	Very low	27 Å²	27	76.5 Å²	76.5	19%	0.189	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.3	-10.4	-170.2	89.6	0	0	0	0	116.4	S366 S369 Q430 K431	S366-S434 WeakPolarHBondContact CA-O 3.49Å; S366-S434 VanDerWaalsContact O-O 3.06Å; S366-S434 PolarHBondContact OG-O 2.87Å; S369-S434 WeakPolarHBondContact OG-CA 3.44Å; S369-S434 VanDerWaalsContact OG-CB 3.27Å; S369-S434 WeakPolarHBondContact OG-CB 3.31Å; S369-S434 PolarHBondContact OG-O 2.83Å; Q430-S434 WeakPolarHBondContact O-CB 3.5Å; Q430-S434 PolarHBondContact O-N 3.49Å; Q430-S434 PolarHBondContact O-OG 3.44Å; Q430-S434 VanDerWaalsContact O-OG 3.13Å; K431-S434 WeakPolarHBondContact CA-OG 3.34Å; K431-S434 PolarHBondContact O-N 3.31Å; K431-S434 VanDerWaalsContact O-N 3.14Å
435	V	36.8	Very low	36.4	Very low	59 Å²	59	76.8 Å²	76.8	36%	0.358	38%	0.379	S	S	.	.			trans	-105.9	108.5	-176.7	-178.6	0	0	0	0	112.6	R135 S366 K431	R135-V435 PolarHBondContact NH1-O 2.95Å; S366-V435 PolarHBondContact OG-N 3.38Å; K431-V435 HydrophobicContact CB-CG2 3.83Å; K431-V435 HydrophobicContact CD-CG2 3.71Å; K431-V435 HydrophobicContact CG-CG2 3.5Å; K431-V435 WeakPolarHBondContact O-CB 3.5Å; K431-V435 WeakPolarHBondContact O-CG2 3.28Å; K431-V435 PolarHBondContact O-N 3.37Å
436	A	32.4	Very low	36.2	Very low	17 Å²	17	81.3 Å²	81.3	14%	0.14	40%	0.398	C	S	.	.			trans	-126.2	159	157.7	0	0	0	0	0	106	S366	S366-A436 WeakPolarHBondContact OG-CB 3.34Å; S366-A436 PolarHBondContact OG-N 3.28Å
437	Y	33.7	Very low	35.9	Very low	85 Å²	85	85.2 Å²	85.2	33%	0.333	42%	0.416	S	S	.	.			trans	56.4	100.1	-178.2	-52.7	-91.5	0	0	0	115.8	Q77 M367 E370 W439	Q77-Y437 PolarHBondContact NE2-OH 3.46Å; Q77-Y437 PolarHBondContact OE1-OH 2.92Å; M367-Y437 HydrophobicContact CG-CE2 4.09Å; E370-Y437 VanDerWaalsContact CD-CB 3.4Å; E370-Y437 WeakPolarHBondContact OE1-CB 3.45Å; E370-Y437 WeakPolarHBondContact OE2-CB 3.49Å; E370-Y437 WeakPolarHBondContact OE2-CD2 3.25Å; Y437-W439 HydrophobicContact CD1-CB 4.35Å
438	R	30.6	Very low	35.6	Very low	154 Å²	154	83.4 Å²	83.4	58%	0.581	41%	0.413	S	S	*	.			trans	-112.3	73	136.9	-171.3	176.4	177.4	172.6	-0	106.1	E447	R438-E447 IonicContact CZ-OE1 2.67Å; R438-E447 IonicContact CZ-OE2 3.58Å; R438-E447 IonicContact NH2-OE1 3.62Å; R438-E447 PolarHBondContact NH2-OE1 3.47Å; R438-E447 IonicContact NH2-OE2 3.37Å; R438-E447 PolarHBondContact NH2-OE2 3.47Å
439	W	30.7	Very low	35.3	Very low	151 Å²	151	84.6 Å²	84.6	57%	0.572	43%	0.426	S	S	*	.			trans	-116.7	89.9	179.5	-91	93.3	0	0	0	110	A80 Y437	A80-W439 HydrophobicContact CB-CZ2 4.23Å; Y437-W439 HydrophobicContact CD1-CB 4.35Å
440	K	28.5	Very low	34.7	Very low	128 Å²	128	91.9 Å²	91.9	56%	0.557	46%	0.457	S	S	*	.			trans	-130.8	122.9	157.6	-110.1	-168.4	173.9	-166.9	0	107.7	D442 F443	K440-D442 PolarHBondContact O-N 3.38Å; K440-F443 HydrophobicContact CB-CD2 3.87Å; K440-F443 HydrophobicContact CB-CE2 4.04Å; K440-F443 HydrophobicContact CD-CE2 4.47Å
441	P	30.6	Very low	34.5	Very low	105 Å²	105	94.9 Å²	94.9	68%	0.682	47%	0.473	S	S	*	.	S	Bend	trans	-64.4	-20.2	170.1	-20.8	34.2	0	0	0	112.8	F443	P441-F443 VanDerWaalsContact C-N 3.28Å; P441-F443 PolarHBondContact O-N 2.94Å
442	D	28.2	Very low	34.1	Very low	115 Å²	115	93.9 Å²	93.9	62%	0.615	48%	0.479	S	S	*	.			trans	-87.5	27.4	-167.8	-38	-50	0	0	0	114.2	K440 T444	K440-D442 PolarHBondContact O-N 3.38Å; D442-T444 VanDerWaalsContact C-N 3.3Å
443	F	29.1	Very low	33.8	Very low	96 Å²	96	94.7 Å²	94.7	42%	0.421	49%	0.493	S	S	.	.			trans	-91.4	13.5	174.1	-92.7	-79.3	0	0	0	113.4	K440 P441 D445 E447	K440-F443 HydrophobicContact CB-CD2 3.87Å; K440-F443 HydrophobicContact CB-CE2 4.04Å; K440-F443 HydrophobicContact CD-CE2 4.47Å; P441-F443 VanDerWaalsContact C-N 3.28Å; P441-F443 PolarHBondContact O-N 2.94Å; F443-D445 PolarHBondContact O-N 3.26Å; F443-E447 HydrophobicContact CD1-CG 4.27Å; F443-E447 HydrophobicContact CE1-CG 4.45Å
444	T	35.6	Very low	33.6	Very low	107 Å²	107	99.2 Å²	99.2	66%	0.656	52%	0.515	S	S	*	.	S	Bend	trans	-79.7	96.9	164	51.4	0	0	0	0	109.3	D442	D442-T444 VanDerWaalsContact C-N 3.3Å
445	D	31.6	Very low	33.6	Very low	125 Å²	125	103.8 Å²	103.8	67%	0.668	54%	0.536	S	S	*	.	S	Bend	trans	152.3	-41.4	143.5	-74.8	-10.3	0	0	0	110.8	F443 T448 G449	F443-D445 PolarHBondContact O-N 3.26Å; D445-T448 WeakPolarHBondContact CA-OG1 3.38Å; D445-T448 PolarHBondContact N-OG1 2.98Å; D445-T448 PolarHBondContact O-OG1 3.35Å; D445-G449 PolarHBondContact O-N 3.5Å
446	E	36.1	Very low	33.8	Very low	166 Å²	166	105.9 Å²	105.9	78%	0.776	55%	0.546	S	S	*	.	H	α-helix	trans	-76.4	-46.4	-174.7	-65.1	-175.2	166.3	0	0	114.7	T448 G449 F450	E446-T448 VanDerWaalsContact C-N 3.27Å; E446-T448 PolarHBondContact O-N 2.9Å; E446-G449 PolarHBondContact O-N 3.21Å; E446-F450 PolarHBondContact O-N 3.16Å; E446-F450 VanDerWaalsContact O-N 3.08Å
447	E	34.5	Very low	34.2	Very low	96 Å²	96	111.1 Å²	111.1	45%	0.449	57%	0.567	S	S	.	*	H	α-helix	trans	-70.4	-24.5	174.3	-90.6	-174.7	151.2	0	0	111.9	R438 F443 I451	R438-E447 IonicContact CZ-OE1 2.67Å; R438-E447 IonicContact CZ-OE2 3.58Å; R438-E447 IonicContact NH2-OE1 3.62Å; R438-E447 PolarHBondContact NH2-OE1 3.47Å; R438-E447 IonicContact NH2-OE2 3.37Å; R438-E447 PolarHBondContact NH2-OE2 3.47Å; F443-E447 HydrophobicContact CD1-CG 4.27Å; F443-E447 HydrophobicContact CE1-CG 4.45Å; E447-I451 WeakPolarHBondContact O-CD1 3.35Å; E447-I451 WeakPolarHBondContact O-CG1 3.29Å; E447-I451 PolarHBondContact O-N 3.35Å
448	T	37	Very low	34.4	Very low	79 Å²	79	112.4 Å²	112.4	49%	0.485	58%	0.579	S	S	.	*	H	α-helix	trans	-73.2	-37	168.9	31.8	0	0	0	0	112.3	D445 E446 F450 I451 S452	D445-T448 WeakPolarHBondContact CA-OG1 3.38Å; D445-T448 PolarHBondContact N-OG1 2.98Å; D445-T448 PolarHBondContact O-OG1 3.35Å; E446-T448 VanDerWaalsContact C-N 3.27Å; E446-T448 PolarHBondContact O-N 2.9Å; T448-F450 VanDerWaalsContact C-N 3.34Å; T448-F450 PolarHBondContact O-N 3.3Å; T448-I451 PolarHBondContact O-N 2.98Å; T448-S452 PolarHBondContact O-N 2.92Å
449	G	34.9	Very low	34.8	Very low	43 Å²	43	108.1 Å²	108.1	44%	0.443	57%	0.573	S	S	.	*	H	α-helix	trans	-60.3	-41.4	172.6	0	0	0	0	0	112.3	D445 E446 I451 S452 G453	D445-G449 PolarHBondContact O-N 3.5Å; E446-G449 PolarHBondContact O-N 3.21Å; G449-I451 VanDerWaalsContact C-N 3.32Å; G449-I451 PolarHBondContact O-N 3.1Å; G449-S452 PolarHBondContact O-N 3.39Å; G449-G453 PolarHBondContact O-N 3.4Å
450	F	32	Very low	35.2	Very low	169 Å²	169	106.9 Å²	106.9	74%	0.741	58%	0.575	S	S	*	*	H	α-helix	trans	-64.8	-32.6	175.3	-116.7	-86.5	0	0	0	113.6	E446 T448 Q454	E446-F450 PolarHBondContact O-N 3.16Å; E446-F450 VanDerWaalsContact O-N 3.08Å; T448-F450 VanDerWaalsContact C-N 3.34Å; T448-F450 PolarHBondContact O-N 3.3Å; F450-Q454 PolarHBondContact O-N 2.9Å
451	I	36.1	Very low	35.7	Very low	120 Å²	120	107.9 Å²	107.9	62%	0.615	58%	0.582	S	S	*	*	H	α-helix	trans	-77.8	-31.9	177.9	-66.5	167.4	0	0	0	111.7	E447 T448 G449	E447-I451 WeakPolarHBondContact O-CD1 3.35Å; E447-I451 WeakPolarHBondContact O-CG1 3.29Å; E447-I451 PolarHBondContact O-N 3.35Å; T448-I451 PolarHBondContact O-N 2.98Å; G449-I451 VanDerWaalsContact C-N 3.32Å; G449-I451 PolarHBondContact O-N 3.1Å
452	S	37.7	Very low	36.2	Very low	78 Å²	78	111.5 Å²	111.5	55%	0.545	59%	0.59	S	S	.	*	H	α-helix	trans	-73.4	-47.6	170.9	-88.6	0	0	0	0	112.4	T448 G449 Q454 L455 D456	T448-S452 PolarHBondContact O-N 2.92Å; G449-S452 PolarHBondContact O-N 3.39Å; S452-Q454 VanDerWaalsContact C-N 3.35Å; S452-Q454 PolarHBondContact O-N 3.13Å; S452-L455 WeakPolarHBondContact O-CB 3.5Å; S452-L455 PolarHBondContact O-N 3.46Å; S452-D456 PolarHBondContact O-N 3.18Å
453	G	35.9	Very low	36.7	Very low	39 Å²	39	110.1 Å²	110.1	40%	0.402	59%	0.589	S	S	.	*	H	α-helix	trans	-60.7	-39.7	-176.9	0	0	0	0	0	113.5	G449 L455 D456 E457	G449-G453 PolarHBondContact O-N 3.4Å; G453-L455 PolarHBondContact O-N 3.11Å; G453-D456 PolarHBondContact O-N 3.35Å; G453-E457 PolarHBondContact O-N 3.15Å
454	Q	35.3	Very low	36.9	Very low	124 Å²	124	110.6 Å²	110.6	58%	0.579	60%	0.6	S	S	*	*	H	α-helix	trans	-73.8	-13.3	177.2	-164.4	165.7	50.5	0	0	113.4	F450 S452 L458	F450-Q454 PolarHBondContact O-N 2.9Å; S452-Q454 VanDerWaalsContact C-N 3.35Å; S452-Q454 PolarHBondContact O-N 3.13Å; Q454-L458 WeakPolarHBondContact O-CG 3.2Å
455	L	39.4	Very low	36.7	Very low	123 Å²	123	112.8 Å²	112.8	64%	0.644	61%	0.607	S	S	*	*	H	α-helix	trans	-82.3	-37.5	170.8	-146.8	82.9	0	0	0	111.4	S452 G453 S459	S452-L455 WeakPolarHBondContact O-CB 3.5Å; S452-L455 PolarHBondContact O-N 3.46Å; G453-L455 PolarHBondContact O-N 3.11Å; L455-S459 PolarHBondContact O-N 3.47Å
456	D	40.2	Very low	36.9	Very low	104 Å²	104	115.3 Å²	115.3	56%	0.556	62%	0.615	S	S	*	*	H	α-helix	trans	-70.8	-38.6	176.7	-70.7	-23.7	0	0	0	111.5	S452 G453 L458 S459 M460	S452-D456 PolarHBondContact O-N 3.18Å; G453-D456 PolarHBondContact O-N 3.35Å; D456-L458 PolarHBondContact O-N 2.99Å; D456-S459 WeakPolarHBondContact O-CA 3.25Å; D456-S459 WeakPolarHBondContact O-CB 3.23Å; D456-S459 PolarHBondContact O-N 3.2Å; D456-S459 PolarHBondContact O-OG 3.48Å; D456-M460 PolarHBondContact O-N 3.05Å
457	E	40.9	Very low	36.7	Very low	127 Å²	127	113.9 Å²	113.9	59%	0.593	61%	0.613	S	S	*	*	H	α-helix	trans	-59.5	-43.6	175.2	-162.7	169.8	-141.6	0	0	111.7	G453 S459 M460 E461	G453-E457 PolarHBondContact O-N 3.15Å; E457-S459 PolarHBondContact O-N 3.11Å; E457-M460 PolarHBondContact O-N 2.76Å; E457-E461 PolarHBondContact O-N 3.19Å; E457-E461 VanDerWaalsContact O-N 3.12Å
458	L	37.1	Very low	36.5	Very low	111 Å²	111	115.8 Å²	115.8	58%	0.581	63%	0.625	S	S	*	*	H	α-helix	trans	-70.2	-12.9	173.6	-73.6	172.1	0	0	0	114.3	Q454 D456	Q454-L458 WeakPolarHBondContact O-CG 3.2Å; D456-L458 PolarHBondContact O-N 2.99Å
459	S	39.6	Very low	36.1	Very low	64 Å²	64	117.1 Å²	117.1	45%	0.448	64%	0.637	S	S	.	*	H	α-helix	trans	-90.5	-32.4	173.2	80.4	0	0	0	0	112.5	L455 D456 E457 Q462	L455-S459 PolarHBondContact O-N 3.47Å; D456-S459 WeakPolarHBondContact O-CA 3.25Å; D456-S459 WeakPolarHBondContact O-CB 3.23Å; D456-S459 PolarHBondContact O-N 3.2Å; D456-S459 PolarHBondContact O-OG 3.48Å; E457-S459 PolarHBondContact O-N 3.11Å; S459-Q462 PolarHBondContact O-N 2.98Å
460	M	39.1	Very low	35.9	Very low	125 Å²	125	119.3 Å²	119.3	62%	0.616	65%	0.646	S	S	*	*	H	α-helix	trans	-76.6	-31.8	177.2	-75.1	-77.3	-77.5	0	0	113.2	D456 E457 Q462 S463 T464	D456-M460 PolarHBondContact O-N 3.05Å; E457-M460 PolarHBondContact O-N 2.76Å; M460-Q462 PolarHBondContact O-N 2.71Å; M460-S463 PolarHBondContact O-N 3.01Å; M460-S463 PolarHBondContact O-OG 2.9Å; M460-T464 PolarHBondContact O-OG1 3.14Å
461	E	39.9	Very low	35.8	Very low	149 Å²	149	118.8 Å²	118.8	70%	0.696	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-18.1	173	-75.2	-166.9	139	0	0	113.1	E457	E457-E461 PolarHBondContact O-N 3.19Å; E457-E461 VanDerWaalsContact O-N 3.12Å
462	Q	40	Very low	35.6	Very low	182 Å²	182	119 Å²	119	85%	0.85	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-8.3	-179.3	-145.6	170.1	16.9	0	0	114.1	S459 M460	S459-Q462 PolarHBondContact O-N 2.98Å; M460-Q462 PolarHBondContact O-N 2.71Å
463	S	38.6	Very low	35.3	Very low	85 Å²	85	121.4 Å²	121.4	59%	0.594	66%	0.658	S	S	*	*	S	Bend	trans	-103.7	-5.7	-178	50.9	0	0	0	0	115.3	M460	M460-S463 PolarHBondContact O-N 3.01Å; M460-S463 PolarHBondContact O-OG 2.9Å
464	T	33.1	Very low	35	Very low	106 Å²	106	126.1 Å²	126.1	65%	0.65	67%	0.674	S	S	*	*			trans	-115.2	70.2	-163.2	-41.2	0	0	0	0	112.4	M460	M460-T464 PolarHBondContact O-OG1 3.14Å
465	N	32.1	Very low	34.8	Very low	154 Å²	154	128.3 Å²	128.3	82%	0.824	68%	0.684	S	S	*	*			trans	-140.9	71.5	177.1	-106.2	-31.1	0	0	0	111.1
466	Q	34.7	Very low	34.3	Very low	177 Å²	177	126.3 Å²	126.3	83%	0.827	68%	0.68	S	S	*	*			trans	-169.2	136.7	160.3	-110.3	155.7	27.1	0	0	112.5
467	N	32.1	Very low	33.8	Very low	136 Å²	136	128.3 Å²	128.3	73%	0.727	69%	0.691	S	S	*	*			trans	70.4	138.8	162.6	-49.4	-21.9	0	0	0	117.9
468	I	30.3	Very low	33.3	Very low	137 Å²	137	127.2 Å²	127.2	70%	0.703	69%	0.693	S	S	*	*			cis	166.2	124.1	-27.8	-100.7	161.7	0	0	0	104.5
469	S	28.6	Very low	32.8	Very low	107 Å²	107	130.2 Å²	130.2	75%	0.748	70%	0.702	S	S	*	*			trans	58.3	156.8	159.8	72.6	0	0	0	0	118.9
470	S	30.8	Very low	32.2	Very low	88 Å²	88	133.3 Å²	133.3	62%	0.615	71%	0.713	S	S	*	*			cis	-169.5	151	9.6	22.9	0	0	0	0	110.6
471	I	31.4	Very low	31.8	Very low	159 Å²	159	135.1 Å²	135.1	82%	0.815	72%	0.724	S	S	*	*			trans	66.2	151.2	142.6	-65.7	163.3	0	0	0	118.3
472	N	29.9	Very low	31.2	Very low	125 Å²	125	136.2 Å²	136.2	67%	0.668	73%	0.729	S	S	*	*			cis	-170.9	171.9	-46.3	-140.6	51	0	0	0	106.8
473	D	31.7	Very low	30.6	Very low	128 Å²	128	135.7 Å²	135.7	68%	0.684	73%	0.732	S	S	*	*			trans	69.2	148.8	158.6	-50.6	-31.1	0	0	0	119.2
474	N	29.5	Very low	30.1	Very low	138 Å²	138	139.5 Å²	139.5	74%	0.738	74%	0.741	S	S	*	*			cis	-162.9	172.7	-37.6	-145.2	-2.6	0	0	0	109.6
475	E	31.2	Very low	29.8	Very low	170 Å²	170	139.8 Å²	139.8	79%	0.794	74%	0.742	S	S	*	*			trans	65.7	153.1	161.8	-66	178.3	167.6	0	0	119.9
476	S	29.6	Very low	29.6	Very low	80 Å²	80	139.6 Å²	139.6	56%	0.559	74%	0.741	S	S	*	*			cis	176.9	159	-40.9	55.9	0	0	0	0	108.7
477	N	30	Very low	29.4	Very low	146 Å²	146	140.1 Å²	140.1	78%	0.781	74%	0.744	S	S	*	*			trans	75.1	155.9	160.1	-58.2	-32.1	0	0	0	117.4
478	V	29.2	Very low	29.5	Very low	105 Å²	105	142.8 Å²	142.8	64%	0.636	75%	0.749	S	S	*	*			cis	-164.7	131.1	-12.8	128	0	0	0	0	109.7
479	F	27.7	Very low	29.5	Very low	173 Å²	173	142.9 Å²	142.9	76%	0.759	76%	0.76	S	S	*	*			trans	58.1	163.7	147.6	-73.4	-120.9	0	0	0	120.2
480	D	26.3	Very low	30.4	Very low	129 Å²	129	142.8 Å²	142.8	69%	0.69	76%	0.755	S	S	*	*			cis	-166.8	-177.9	-30.1	-109.3	7	0	0	0	107.7
481	I	31.2	Very low	31.1	Very low	164 Å²	164	144 Å²	144	84%	0.841	75%	0.754	S	S	*	*			trans	120.5	127.5	153.8	-60.8	166.5	0	0	0	115.2
482	E	26.6	Very low	32.1	Very low	171 Å²	171	142.6 Å²	142.6	80%	0.799	75%	0.749	S	S	*	*			trans	-76.7	159.6	-175.6	-57.3	149.3	125.3	0	0	113.3
483	N	28.6	Very low	33.3	Very low	171 Å²	171	139.6 Å²	139.6	91%	0.914	74%	0.741	S	S	*	*				-162.4	159.1	123.6	-110.9	-46.1	0	0	0	113.8
484	E	26.7	Very low	34.7	Very low	166 Å²	166	139.5 Å²	139.5	78%	0.776	74%	0.738	S	S	*	*			trans	-110.8	166.9	-158.7	-145.9	-178.2	-156.5	0	0	113.2
485	T	27.3	Very low	36.3	Very low	111 Å²	111	136.9 Å²	136.9	68%	0.681	72%	0.724	S	S	*	*			trans	87.3	143.1	160.2	73.3	0	0	0	0	122.7
486	N	27.5	Very low	37.5	Very low	150 Å²	150	134.9 Å²	134.9	80%	0.802	71%	0.714	S	S	*	*			trans	89.4	89.7	157	-59.4	-46	0	0	0	121.2
487	E	31	Very low	38.9	Very low	189 Å²	189	139.2 Å²	139.2	88%	0.883	72%	0.72	S	S	*	*			trans	-147.2	96.7	142.1	-114.4	175.9	170.4	0	0	110.3
488	K	35.3	Very low	40.7	Very low	192 Å²	192	134.9 Å²	134.9	84%	0.835	70%	0.704	S	S	*	*				60.6	105.7	102.6	-86.6	-179.6	175.6	171.8	0	115.7	T490	K488-T490 PolarHBondContact O-N 2.87Å
489	C	30.1	Very low	42.8	Very low	138 Å²	138	134 Å²	134	93%	0.932	70%	0.695	S	S	*	*			trans	-57.8	113	163.3	-178.4	0	0	0	0	110.3
490	T	46.6	Very low	44.8	Very low	106 Å²	106	130.7 Å²	130.7	65%	0.65	68%	0.684	S	S	*	*			trans	-89.7	123.6	174.7	40.2	0	0	0	0	110.2	K488 D492 M494	K488-T490 PolarHBondContact O-N 2.87Å; T490-D492 PolarHBondContact O-N 3.5Å; T490-M494 HydrophobicContact CG2-CE 4.44Å
491	D	46.9	Very low	47	Very low	112 Å²	112	131 Å²	131	60%	0.599	68%	0.682	S	S	*	*			trans	-64.4	127.3	-177.7	-170.2	-14.5	0	0	0	111.6	A493 M494 L495	D491-A493 PolarHBondContact O-N 3.2Å; D491-A493 VanDerWaalsContact O-N 3.09Å; D491-A493 PolarHBondContact OD1-N 2.92Å; D491-M494 WeakPolarHBondContact O-CB 3.33Å; D491-M494 PolarHBondContact O-N 3.17Å; D491-L495 PolarHBondContact O-N 3.44Å
492	D	51.8	Low	48.8	Very low	130 Å²	130	128.8 Å²	128.8	70%	0.695	66%	0.663	S	S	*	*	H	α-helix	trans	-53.2	-32.1	-179.3	-96.6	-24.6	0	0	0	112	T490 M494 L495 H496	T490-D492 PolarHBondContact O-N 3.5Å; D492-M494 VanDerWaalsContact C-N 3.32Å; D492-M494 PolarHBondContact O-N 2.9Å; D492-L495 PolarHBondContact O-N 3.26Å; D492-H496 WeakPolarHBondContact O-CB 3.42Å; D492-H496 PolarHBondContact O-N 3.48Å
493	A	55.4	Low	50.9	Low	63 Å²	63	123.5 Å²	123.5	52%	0.521	65%	0.645	S	S	.	*	H	α-helix	trans	-62.2	-38.6	176.9	0	0	0	0	0	112.5	D491 H496 Y497	D491-A493 PolarHBondContact O-N 3.2Å; D491-A493 VanDerWaalsContact O-N 3.09Å; D491-A493 PolarHBondContact OD1-N 2.92Å; A493-H496 PolarHBondContact O-N 3.46Å; A493-Y497 PolarHBondContact O-N 3.36Å
494	M	60.8	Low	52.7	Low	126 Å²	126	118.1 Å²	118.1	62%	0.621	62%	0.624	S	S	*	*	H	α-helix	trans	-71.6	-38.5	179.9	-165	174.1	71.5	0	0	111.2	T490 D491 D492 Y497 A498	T490-M494 HydrophobicContact CG2-CE 4.44Å; D491-M494 WeakPolarHBondContact O-CB 3.33Å; D491-M494 PolarHBondContact O-N 3.17Å; D492-M494 VanDerWaalsContact C-N 3.32Å; D492-M494 PolarHBondContact O-N 2.9Å; M494-Y497 PolarHBondContact O-N 3.03Å; M494-A498 WeakPolarHBondContact O-CB 3.3Å; M494-A498 PolarHBondContact O-N 3.41Å
495	L	62.6	Low	54.9	Low	82 Å²	82	113 Å²	113	43%	0.429	61%	0.606	S	S	.	*	H	α-helix	trans	-61.8	-44.8	171.9	-177.9	65.9	0	0	0	111.2	D491 D492 Y497 A498 I499	D491-L495 PolarHBondContact O-N 3.44Å; D492-L495 PolarHBondContact O-N 3.26Å; L495-Y497 VanDerWaalsContact C-N 3.32Å; L495-Y497 PolarHBondContact O-N 2.83Å; L495-A498 PolarHBondContact O-N 3.4Å; L495-I499 HydrophobicContact CD1-CD1 4.31Å; L495-I499 HydrophobicContact CG-CD1 4Å; L495-I499 VanDerWaalsContact O-CG1 3.31Å; L495-I499 WeakPolarHBondContact O-CG1 3.42Å; L495-I499 PolarHBondContact O-N 2.94Å
496	H	55.5	Low	56.8	Low	129 Å²	129	112.6 Å²	112.6	60%	0.597	60%	0.599	S	S	*	*	H	α-helix	trans	-62.7	-38.8	178.6	-133.2	-92.6	0	0	0	112.2	D492 A493 L500	D492-H496 WeakPolarHBondContact O-CB 3.42Å; D492-H496 PolarHBondContact O-N 3.48Å; A493-H496 PolarHBondContact O-N 3.46Å; H496-L500 WeakPolarHBondContact O-CG 3.5Å; H496-L500 PolarHBondContact O-N 3.34Å; H496-L500 VanDerWaalsContact O-N 3.1Å
497	Y	59.4	Low	58.8	Low	171 Å²	171	112.2 Å²	112.2	67%	0.671	59%	0.591	S	S	*	*	H	α-helix	trans	-68	-41.7	176.2	-144.1	-87.2	0	0	0	112.1	A493 M494 L495 I499 L500 Q501	A493-Y497 PolarHBondContact O-N 3.36Å; M494-Y497 PolarHBondContact O-N 3.03Å; L495-Y497 VanDerWaalsContact C-N 3.32Å; L495-Y497 PolarHBondContact O-N 2.83Å; Y497-I499 PolarHBondContact O-N 3.24Å; Y497-L500 PolarHBondContact O-N 2.99Å; Y497-Q501 WeakPolarHBondContact O-CB 3.48Å; Y497-Q501 PolarHBondContact O-N 3.08Å
498	A	69.2	Low	60.6	Low	55 Å²	55	111.8 Å²	111.8	46%	0.455	58%	0.581	S	S	.	*	H	α-helix	trans	-62.1	-41.5	175.3	0	0	0	0	0	112.3	M494 L495 Q501 R502	M494-A498 WeakPolarHBondContact O-CB 3.3Å; M494-A498 PolarHBondContact O-N 3.41Å; L495-A498 PolarHBondContact O-N 3.4Å; A498-Q501 PolarHBondContact O-N 3.15Å; A498-R502 WeakPolarHBondContact O-CB 3.42Å; A498-R502 PolarHBondContact O-N 3.26Å
499	I	72.5	Confident	62.3	Low	85 Å²	85	109.1 Å²	109.1	44%	0.436	57%	0.569	S	S	.	*	H	α-helix	trans	-63.1	-42.3	175.4	-68.6	166.3	0	0	0	111.2	L495 Y497 R502 S503	L495-I499 HydrophobicContact CD1-CD1 4.31Å; L495-I499 HydrophobicContact CG-CD1 4Å; L495-I499 VanDerWaalsContact O-CG1 3.31Å; L495-I499 WeakPolarHBondContact O-CG1 3.42Å; L495-I499 PolarHBondContact O-N 2.94Å; Y497-I499 PolarHBondContact O-N 3.24Å; I499-R502 PolarHBondContact O-N 3.42Å; I499-S503 WeakPolarHBondContact O-CB 3.45Å; I499-S503 PolarHBondContact O-N 2.84Å; I499-S503 PolarHBondContact O-OG 2.95Å
500	L	70.1	Confident	63.8	Low	104 Å²	104	107.5 Å²	107.5	55%	0.545	55%	0.548	S	S	.	.	H	α-helix	trans	-64.2	-41.2	175.7	-74.5	169.1	0	0	0	112.1	H496 Y497 S503 A504	H496-L500 WeakPolarHBondContact O-CG 3.5Å; H496-L500 PolarHBondContact O-N 3.34Å; H496-L500 VanDerWaalsContact O-N 3.1Å; Y497-L500 PolarHBondContact O-N 2.99Å; L500-S503 WeakPolarHBondContact CA-OG 3.43Å; L500-S503 PolarHBondContact O-OG 3.46Å; L500-S503 VanDerWaalsContact O-OG 3.09Å; L500-A504 WeakPolarHBondContact O-CB 3.4Å; L500-A504 PolarHBondContact O-N 3.12Å
501	Q	72.6	Confident	64.6	Low	137 Å²	137	108 Å²	108	64%	0.64	54%	0.543	S	S	*	.	H	α-helix	trans	-68.1	-39.5	177.3	-168	174	2.2	0	0	112.4	Y497 A498 S505	Y497-Q501 WeakPolarHBondContact O-CB 3.48Å; Y497-Q501 PolarHBondContact O-N 3.08Å; A498-Q501 PolarHBondContact O-N 3.15Å; Q501-S505 PolarHBondContact O-N 2.91Å; Q501-S505 VanDerWaalsContact O-N 3.1Å; Q501-S505 PolarHBondContact O-OG 3.31Å
502	R	68.4	Low	65.4	Low	117 Å²	117	109 Å²	109	44%	0.442	54%	0.544	S	S	.	.	H	α-helix	trans	-69.2	-41.3	177.7	-159.3	173.6	-169.2	-172.5	-1.9	111.9	E385 A498 I499 S505 L506	E385-R502 VanDerWaalsContact CD-NH2 3.3Å; E385-R502 IonicContact OE1-CZ 3.28Å; E385-R502 IonicContact OE1-NH1 3.32Å; E385-R502 PolarHBondContact OE1-NH1 2.85Å; E385-R502 IonicContact OE1-NH2 3.99Å; E385-R502 PolarHBondContact OE1-NH2 2.75Å; E385-R502 IonicContact OE2-CZ 3.2Å; E385-R502 IonicContact OE2-NH1 3.27Å; E385-R502 PolarHBondContact OE2-NH1 3.29Å; E385-R502 IonicContact OE2-NH2 2.84Å; A498-R502 WeakPolarHBondContact O-CB 3.42Å; A498-R502 PolarHBondContact O-N 3.26Å; I499-R502 PolarHBondContact O-N 3.42Å; R502-S505 PolarHBondContact O-N 3.09Å; R502-S505 PolarHBondContact O-OG 3.4Å; R502-L506 WeakPolarHBondContact O-CG 3.47Å; R502-L506 PolarHBondContact O-N 3.02Å; R502-L506 VanDerWaalsContact O-N 3.07Å
503	S	71.1	Confident	65.7	Low	59 Å²	59	110.4 Å²	110.4	41%	0.413	55%	0.547	S	S	.	.	H	α-helix	trans	-68.3	-35	175	52.6	0	0	0	0	113.1	I499 L500 K507	I499-S503 WeakPolarHBondContact O-CB 3.45Å; I499-S503 PolarHBondContact O-N 2.84Å; I499-S503 PolarHBondContact O-OG 2.95Å; L500-S503 WeakPolarHBondContact CA-OG 3.43Å; L500-S503 PolarHBondContact O-OG 3.46Å; L500-S503 VanDerWaalsContact O-OG 3.09Å; S503-K507 WeakPolarHBondContact O-CB 3.44Å; S503-K507 PolarHBondContact O-N 3.38Å; S503-K507 VanDerWaalsContact O-N 3.12Å
504	A	66.4	Low	65.5	Low	58 Å²	58	117.3 Å²	117.3	48%	0.479	56%	0.559	S	S	.	*	H	α-helix	trans	-64.6	-38.4	171.9	0	0	0	0	0	113	L500 R508	L500-A504 WeakPolarHBondContact O-CB 3.4Å; L500-A504 PolarHBondContact O-N 3.12Å; A504-R508 PolarHBondContact O-N 2.86Å
505	S	71.9	Confident	65	Low	58 Å²	58	117.5 Å²	117.5	41%	0.406	56%	0.562	S	S	.	*	H	α-helix	trans	-73.6	-36.2	178.8	68.2	0	0	0	0	113.3	Q501 R502 R508 K509	Q501-S505 PolarHBondContact O-N 2.91Å; Q501-S505 VanDerWaalsContact O-N 3.1Å; Q501-S505 PolarHBondContact O-OG 3.31Å; R502-S505 PolarHBondContact O-N 3.09Å; R502-S505 PolarHBondContact O-OG 3.4Å; S505-R508 PolarHBondContact O-N 3.43Å; S505-K509 PolarHBondContact O-N 3.34Å
506	L	68.5	Low	63.8	Low	103 Å²	103	122.4 Å²	122.4	54%	0.539	58%	0.579	S	S	.	*	H	α-helix	trans	-61.4	-44.3	171.2	-75.3	167.3	0	0	0	111.8	R502 R508 K509 E510	R502-L506 WeakPolarHBondContact O-CG 3.47Å; R502-L506 PolarHBondContact O-N 3.02Å; R502-L506 VanDerWaalsContact O-N 3.07Å; L506-R508 VanDerWaalsContact C-N 3.29Å; L506-R508 PolarHBondContact O-N 2.93Å; L506-K509 PolarHBondContact O-N 3.23Å; L506-E510 PolarHBondContact O-N 3.17Å
507	K	69.6	Low	62.8	Low	142 Å²	142	121.9 Å²	121.9	62%	0.617	59%	0.587	S	S	*	*	H	α-helix	trans	-64.3	-32	179.6	-154.5	173.8	-170.2	177.6	0	113	S503 Q511	S503-K507 WeakPolarHBondContact O-CB 3.44Å; S503-K507 PolarHBondContact O-N 3.38Å; S503-K507 VanDerWaalsContact O-N 3.12Å; K507-Q511 WeakPolarHBondContact O-CG 3.21Å; K507-Q511 PolarHBondContact O-N 3.41Å; K507-Q511 VanDerWaalsContact O-N 3.15Å
508	R	67	Low	61.5	Low	180 Å²	180	123.1 Å²	123.1	68%	0.679	60%	0.599	S	S	*	*	H	α-helix	trans	-65.3	-45.5	169.3	-80.9	-173.2	172.8	177.3	-1.6	112.1	A504 S505 L506 E510 Q511 E512	A504-R508 PolarHBondContact O-N 2.86Å; S505-R508 PolarHBondContact O-N 3.43Å; L506-R508 VanDerWaalsContact C-N 3.29Å; L506-R508 PolarHBondContact O-N 2.93Å; R508-E510 PolarHBondContact O-N 3.38Å; R508-Q511 PolarHBondContact O-N 2.92Å; R508-E512 WeakPolarHBondContact O-CG 3.28Å; R508-E512 PolarHBondContact O-N 3.45Å
509	K	70.9	Confident	59.8	Low	136 Å²	136	127.6 Å²	127.6	59%	0.591	61%	0.614	S	S	*	*	H	α-helix	trans	-61.6	-40.2	177.9	-71.1	-177.8	177.7	-177.8	0	112.5	S505 L506 E512 Q513	S505-K509 PolarHBondContact O-N 3.34Å; L506-K509 PolarHBondContact O-N 3.23Å; K509-E512 PolarHBondContact O-N 2.92Å; K509-Q513 WeakPolarHBondContact O-CG 3.46Å; K509-Q513 PolarHBondContact O-N 2.96Å
510	E	63.6	Low	57.8	Low	104 Å²	104	129 Å²	129	49%	0.486	62%	0.622	S	S	.	*	H	α-helix	trans	-63.7	-41.2	172.9	-82.1	-164.2	101.8	0	0	112.8	L506 R508 Q513 R514	L506-E510 PolarHBondContact O-N 3.17Å; R508-E510 PolarHBondContact O-N 3.38Å; E510-Q513 PolarHBondContact O-N 3.05Å; E510-R514 WeakPolarHBondContact O-CG 3.18Å; E510-R514 PolarHBondContact O-N 2.92Å; E510-R514 IonicContact OE1-NH2 3.87Å
511	Q	62.4	Low	56.2	Low	116 Å²	116	130.4 Å²	130.4	54%	0.542	64%	0.635	S	S	.	*	H	α-helix	trans	-66.3	-40.7	176.4	-76	-175.3	-60.5	0	0	111.9	K507 R508 Q513 R514 I515	K507-Q511 WeakPolarHBondContact O-CG 3.21Å; K507-Q511 PolarHBondContact O-N 3.41Å; K507-Q511 VanDerWaalsContact O-N 3.15Å; R508-Q511 PolarHBondContact O-N 2.92Å; Q511-Q513 VanDerWaalsContact C-N 3.3Å; Q511-Q513 PolarHBondContact O-N 3.35Å; Q511-R514 PolarHBondContact O-N 3.08Å; Q511-I515 WeakPolarHBondContact O-CB 3.39Å; Q511-I515 WeakPolarHBondContact O-CD1 3.47Å; Q511-I515 WeakPolarHBondContact O-CG1 3.34Å; Q511-I515 PolarHBondContact O-N 3.17Å; Q511-I515 VanDerWaalsContact O-N 3.15Å
512	E	63.3	Low	54.4	Low	134 Å²	134	129.2 Å²	129.2	63%	0.626	64%	0.643	S	S	*	*	H	α-helix	trans	-62.6	-35.7	174.2	-74	172.7	-175.5	0	0	112.5	R508 K509	R508-E512 WeakPolarHBondContact O-CG 3.28Å; R508-E512 PolarHBondContact O-N 3.45Å; K509-E512 PolarHBondContact O-N 2.92Å
513	Q	58.3	Low	52.9	Low	160 Å²	160	129 Å²	129	75%	0.748	64%	0.643	S	S	*	*	H	α-helix	trans	-72.3	-34	174.7	-75.5	-178	-11.2	0	0	113.3	K509 E510 Q511	K509-Q513 WeakPolarHBondContact O-CG 3.46Å; K509-Q513 PolarHBondContact O-N 2.96Å; E510-Q513 PolarHBondContact O-N 3.05Å; Q511-Q513 VanDerWaalsContact C-N 3.3Å; Q511-Q513 PolarHBondContact O-N 3.35Å
514	R	51.5	Low	51.3	Low	207 Å²	207	133.2 Å²	133.2	78%	0.781	66%	0.66	S	S	*	*	H	α-helix	trans	-80	-12.9	177.8	-69.1	-171.1	-168.8	-159	6	114.8	E510 Q511	E510-R514 WeakPolarHBondContact O-CG 3.18Å; E510-R514 PolarHBondContact O-N 2.92Å; E510-R514 IonicContact OE1-NH2 3.87Å; Q511-R514 PolarHBondContact O-N 3.08Å
515	I	50.8	Low	50	Low	131 Å²	131	138.7 Å²	138.7	67%	0.672	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-4.8	-175.1	-69.9	168.7	0	0	0	113.4	Q511 P517	Q511-I515 WeakPolarHBondContact O-CB 3.39Å; Q511-I515 WeakPolarHBondContact O-CD1 3.47Å; Q511-I515 WeakPolarHBondContact O-CG1 3.34Å; Q511-I515 PolarHBondContact O-N 3.17Å; Q511-I515 VanDerWaalsContact O-N 3.15Å; I515-P517 WeakPolarHBondContact O-CD 3.44Å
516	K	36	Very low	48.3	Very low	184 Å²	184	143.9 Å²	143.9	80%	0.8	70%	0.7	S	S	*	*			trans	-90.2	112.1	171.3	-79.5	-175.9	175.4	176.8	0	111.9
517	P	35	Very low	46.8	Very low	118 Å²	118	147.2 Å²	147.2	77%	0.766	71%	0.705	S	S	*	*			trans	-73.6	158.5	174.3	-10.3	28.4	0	0	0	111.6	I515 I519	I515-P517 WeakPolarHBondContact O-CD 3.44Å; P517-I519 PolarHBondContact O-N 3.16Å; P517-I519 VanDerWaalsContact O-N 3.16Å
518	Q	31.6	Very low	45.3	Very low	197 Å²	197	147.7 Å²	147.7	92%	0.921	71%	0.714	S	S	*	*			trans	-56.5	111.4	179.2	-64.3	173.4	-46.6	0	0	113.3
519	I	34.3	Very low	43.8	Very low	150 Å²	150	145.3 Å²	145.3	77%	0.769	71%	0.714	S	S	*	*			trans	-142	126	154.8	-62.1	-174.3	0	0	0	109.7	P517	P517-I519 PolarHBondContact O-N 3.16Å; P517-I519 VanDerWaalsContact O-N 3.16Å
520	N	31.4	Very low	41.9	Very low	113 Å²	113	146.9 Å²	146.9	60%	0.604	73%	0.729	S	S	*	*			trans	63.1	91.7	162.4	-66.9	-23	0	0	0	121
521	T	34.8	Very low	40.5	Very low	134 Å²	134	147.1 Å²	147.1	82%	0.822	74%	0.738	S	S	*	*	S	Bend	trans	-138.2	30.1	133.9	-11.5	0	0	0	0	114.9	Y523	T521-Y523 VanDerWaalsContact C-N 3.31Å
522	S	35.6	Very low	39.2	Very low	113 Å²	113	150.7 Å²	150.7	79%	0.79	76%	0.755	S	S	*	*	S	Bend	trans	-88.6	9.6	166.2	-59.2	0	0	0	0	113.6
523	Y	37.1	Very low	37.8	Very low	113 Å²	113	152.3 Å²	152.3	44%	0.443	76%	0.762	S	S	.	*	S	Bend	trans	-105.1	-6.1	-164.5	-111.6	-75.7	0	0	0	116.9	T521 R527	T521-Y523 VanDerWaalsContact C-N 3.31Å; Y523-R527 VanDerWaalsContact CE1-CZ 3.47Å
524	N	37.1	Very low	36.5	Very low	147 Å²	147	152.5 Å²	152.5	79%	0.786	76%	0.763	S	S	*	*	S	Bend	trans	-101.1	3.7	-175.6	-76.2	2	0	0	0	115.5
525	I	39.9	Very low	35.6	Very low	173 Å²	173	151.5 Å²	151.5	89%	0.887	77%	0.767	S	S	*	*	S	Bend	trans	-109.9	-8.9	170.9	-65.2	178.6	0	0	0	111.9
526	M	35.4	Very low	34.6	Very low	167 Å²	167	150.4 Å²	150.4	82%	0.823	77%	0.768	S	S	*	*	S	Bend	trans	-120.6	23.5	-176.2	-150	175.5	-73.8	0	0	113.7
527	R	37.8	Very low	34.5	Very low	172 Å²	172	150.9 Å²	150.9	65%	0.649	77%	0.771	S	S	*	*			trans	-129.1	10	179.3	-120.1	-178.8	-160.9	154.1	7.4	116.8	Y523 L529	Y523-R527 VanDerWaalsContact CE1-CZ 3.47Å; R527-L529 WeakPolarHBondContact O-CA 3.12Å
528	N	38.2	Very low	34.5	Very low	152 Å²	152	153.7 Å²	153.7	81%	0.813	77%	0.773	S	S	*	*	S	Bend	trans	-69.7	125.9	142.7	-93.9	-4.6	0	0	0	107.7
529	L	35.7	Very low	34.5	Very low	130 Å²	130	152.2 Å²	152.2	68%	0.681	77%	0.766	S	S	*	*			cis	-156.1	104.2	-31.2	-138.8	151.2	0	0	0	104.3	R527 T531	R527-L529 WeakPolarHBondContact O-CA 3.12Å; L529-T531 WeakPolarHBondContact CD2-OG1 3.35Å; L529-T531 PolarHBondContact O-N 3.11Å; L529-T531 VanDerWaalsContact O-N 3.1Å
530	N	30.7	Very low	34.4	Very low	170 Å²	170	153.4 Å²	153.4	91%	0.909	77%	0.768	S	S	*	*			trans	-84.5	88.8	-166.3	-147.1	6.6	0	0	0	110.2
531	T	34.2	Very low	34.4	Very low	109 Å²	109	153.4 Å²	153.4	67%	0.669	77%	0.773	S	S	*	*			trans	-154.7	80.1	-179.6	5.1	0	0	0	0	113.5	L529	L529-T531 WeakPolarHBondContact CD2-OG1 3.35Å; L529-T531 PolarHBondContact O-N 3.11Å; L529-T531 VanDerWaalsContact O-N 3.1Å
532	Q	35.4	Very low	34.5	Very low	191 Å²	191	154.4 Å²	154.4	89%	0.893	77%	0.772	S	S	*	*			trans	176.3	96.2	159.6	-101.6	172.9	33.9	0	0	105.1
533	Q	32.8	Very low	34.3	Very low	167 Å²	167	154.6 Å²	154.6	78%	0.78	76%	0.763	S	S	*	*			cis	72.3	112.4	49.9	-143.7	178.5	8.6	0	0	114.4
534	H	30.8	Very low	34.1	Very low	165 Å²	165	159.4 Å²	159.4	76%	0.764	78%	0.782	S	S	*	*			trans	68	121.5	176.1	-59.9	-53.7	0	0	0	117.4
535	Q	32.5	Very low	34.2	Very low	185 Å²	185	157.8 Å²	157.8	86%	0.864	78%	0.782	S	S	*	*				-157.3	164.9	52.5	-73	179.6	-19.5	0	0	113.1
536	P	31.5	Very low	33.9	Very low	108 Å²	108	156.5 Å²	156.5	70%	0.701	78%	0.776	S	S	*	*			trans	-112.9	172.8	167	40	-31.1	0	0	0	114.4
537	K	33.4	Very low	34.4	Very low	195 Å²	195	156.1 Å²	156.1	85%	0.848	78%	0.777	S	S	*	*			trans	88.2	137.7	-174.9	-56.4	171.6	-179.1	179.3	0	112.3
538	Q	35	Very low	34.8	Very low	176 Å²	176	158.9 Å²	158.9	82%	0.822	80%	0.804	S	S	*	*			cis	-148	158.8	15.6	-128.8	156.8	-11.9	0	0	112.4
539	Q	30.3	Very low	34.6	Very low	166 Å²	166	159.2 Å²	159.2	78%	0.776	80%	0.804	S	S	*	*			trans	-53.9	148.5	167.3	-62.9	149.1	-55.7	0	0	113.4
540	H	33.1	Very low	34.5	Very low	175 Å²	175	160.7 Å²	160.7	81%	0.81	81%	0.81	S	S	*	*				-168.3	145.4	108.2	-111.8	-83.2	0	0	0	114.5
541	T	30.4	Very low	34.7	Very low	114 Å²	114	160.2 Å²	160.2	70%	0.699	81%	0.805	S	S	*	*			trans	-75.7	160.9	174.8	-46.8	0	0	0	0	112.4
542	I	37.6	Very low	34.8	Very low	155 Å²	155	163.2 Å²	163.2	80%	0.795	81%	0.813	S	S	*	*			trans	144.7	146.3	142.6	-76.5	154.6	0	0	0	109.2
543	L	32.3	Very low	34.7	Very low	116 Å²	116	161.5 Å²	161.5	61%	0.607	81%	0.808	S	S	*	*			cis	166.9	137.9	-26.3	-160.7	69.6	0	0	0	104.6
544	Y	33.2	Very low	34.9	Very low	214 Å²	214	161.1 Å²	161.1	84%	0.839	81%	0.81	S	S	*	*			trans	64.2	158.9	175.3	-56.2	-60.3	0	0	0	117.1
545	S	37.3	Very low	35.2	Very low	114 Å²	114	160.9 Å²	160.9	80%	0.797	81%	0.813	S	S	*	*			cis	-140	160.9	10.9	-174.8	0	0	0	0	113.2
546	I	34.8	Very low	35.4	Very low	146 Å²	146	159 Å²	159	75%	0.749	81%	0.809	S	S	*	*			trans	-67.8	151.3	170.7	-66.4	158.4	0	0	0	111.2
547	N	45.7	Very low	35.7	Very low	158 Å²	158	163.3 Å²	163.3	85%	0.845	82%	0.818	S	S	*	*			trans	-152.9	131.2	145.6	-119.8	-1.9	0	0	0	111.3
548	N	45.3	Very low	35.9	Very low	230 Å²	230	160.4 Å²	160.4	100%	1.23	82%	0.815	S	S	*	*			trans	68.1	0	-171.2	-71.5	7.1	0	0	0	117.3

Retrieved 548 of 548 residues in 198.7 ms (Link to these results)

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