A0A087YCS7_POEFO Loading...

Transient receptor potential cation channel, subfamily C, member 4 associated protein a

AlphaFold DB , UniProt , Accession A0A087YCS7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 774 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	31.1	Very low	27.6	Very low	254 Å²	254	144.8 Å²	144.8	100%	1.251	85%	0.854	S	S	*	*				0	118.3	0	-66.7	-173.6	-168.7	0	0	106.4
2	A	29.8	Very low	27.7	Very low	103 Å²	103	141.6 Å²	141.6	85%	0.851	85%	0.845	S	S	*	*			cis	-137.6	152.6	11.3	0	0	0	0	0	110
3	T	28.6	Very low	28.2	Very low	132 Å²	132	136.7 Å²	136.7	81%	0.81	84%	0.842	S	S	*	*			trans	-91.9	172.2	-176.4	-6.6	0	0	0	0	111.9
4	L	29.8	Very low	28.1	Very low	151 Å²	151	143.9 Å²	143.9	79%	0.791	85%	0.845	S	S	*	*			trans	105.7	127.8	161.8	-62.4	160.4	0	0	0	113.2
5	L	28.3	Very low	28.5	Very low	155 Å²	155	148.7 Å²	148.7	81%	0.812	85%	0.852	S	S	*	*			cis	-158.6	146.3	10.4	-99.3	147.5	0	0	0	108.3
6	G	26.6	Very low	28.6	Very low	76 Å²	76	154.1 Å²	154.1	78%	0.784	85%	0.854	S	S	*	*			trans	-75.8	156.8	170.6	0	0	0	0	0	113
7	S	24.5	Very low	28.8	Very low	102 Å²	102	159.1 Å²	159.1	71%	0.713	86%	0.857	S	S	*	*			trans	-131.8	109.5	145.8	77.1	0	0	0	0	108.2	F9	S7-F9 PolarHBondContact O-N 3.06Å
8	E	27.6	Very low	29.2	Very low	196 Å²	196	159.1 Å²	159.1	92%	0.916	86%	0.856	S	S	*	*			trans	-62.9	124.2	160.4	-68.7	178.5	148.6	0	0	108.4
9	F	25.9	Very low	29.7	Very low	190 Å²	190	157 Å²	157	83%	0.833	85%	0.854	S	S	*	*			trans	-129.1	120.6	158.4	-101.9	-83.2	0	0	0	109	S7 S11	S7-F9 PolarHBondContact O-N 3.06Å; F9-S11 PolarHBondContact O-N 2.69Å
10	S	25.6	Very low	30.5	Very low	108 Å²	108	157.7 Å²	157.7	76%	0.755	86%	0.857	S	S	*	*			trans	-47	120.6	179.2	52.4	0	0	0	0	114.1	S12	S10-S12 PolarHBondContact O-N 2.87Å; S10-S12 VanDerWaalsContact O-N 3.15Å
11	S	26.2	Very low	31.5	Very low	126 Å²	126	152.4 Å²	152.4	88%	0.881	83%	0.832	S	S	*	*			trans	-82.2	83.4	168.6	62.5	0	0	0	0	110.8	F9	F9-S11 PolarHBondContact O-N 2.69Å
12	S	27.9	Very low	33.2	Very low	106 Å²	106	144.9 Å²	144.9	74%	0.741	80%	0.796	S	S	*	*			trans	-77.5	122.4	159.7	61.7	0	0	0	0	108.9	S10 R14	S10-S12 PolarHBondContact O-N 2.87Å; S10-S12 VanDerWaalsContact O-N 3.15Å; S12-R14 PolarHBondContact O-N 3.28Å
13	G	35.1	Very low	35.1	Very low	78 Å²	78	142.3 Å²	142.3	80%	0.804	77%	0.768	S	S	*	*			trans	-56.2	134	-178.9	0	0	0	0	0	113.7
14	R	25.7	Very low	37	Very low	237 Å²	237	140.4 Å²	140.4	89%	0.894	76%	0.756	S	S	*	*			trans	-152.1	114.3	150.4	-113.4	175.5	177.6	179.1	-0.6	108	S12 R16	S12-R14 PolarHBondContact O-N 3.28Å; R14-R16 PolarHBondContact O-N 3.07Å
15	K	35.4	Very low	39	Very low	216 Å²	216	136.8 Å²	136.8	94%	0.939	74%	0.74	S	S	*	*			trans	-49.7	101.2	161.9	-76.2	178.2	175.1	178.3	0	107.7	R17	K15-R17 VanDerWaalsContact C-N 3.35Å; K15-R17 PolarHBondContact O-N 3.28Å
16	R	29.7	Very low	41	Very low	236 Å²	236	133.9 Å²	133.9	89%	0.891	72%	0.721	S	S	*	*			trans	-69.9	98.7	164.3	-91.2	-176.2	172.9	174.9	-1.9	106.5	R14 N18	R14-R16 PolarHBondContact O-N 3.07Å; R16-N18 PolarHBondContact O-N 3.22Å
17	R	32.4	Very low	43.2	Very low	239 Å²	239	134.2 Å²	134.2	90%	0.902	70%	0.704	S	S	*	*			trans	-49.9	119.3	153.9	-98.7	175.7	162.4	166.1	-5.6	106.5	K15 C19	K15-R17 VanDerWaalsContact C-N 3.35Å; K15-R17 PolarHBondContact O-N 3.28Å; R17-C19 PolarHBondContact O-N 3.08Å
18	N	35.3	Very low	45.5	Very low	158 Å²	158	132.8 Å²	132.8	85%	0.845	69%	0.692	S	S	*	*			trans	-56.1	113	172.6	-93.6	-18.2	0	0	0	108.7	R16	R16-N18 PolarHBondContact O-N 3.22Å
19	C	39.4	Very low	47.6	Very low	120 Å²	120	126.3 Å²	126.3	81%	0.811	67%	0.668	S	S	*	*			trans	-61.9	133.7	167.6	-92	0	0	0	0	109	R17 S21	R17-C19 PolarHBondContact O-N 3.08Å; C19-S21 VanDerWaalsContact C-N 3.32Å; C19-S21 PolarHBondContact O-N 3.46Å
20	N	44.4	Very low	49.8	Very low	170 Å²	170	118.2 Å²	118.2	91%	0.909	64%	0.635	S	S	*	*			trans	-58.9	90.5	168.7	-74	-22.8	0	0	0	110.1
21	S	53	Low	52	Low	48 Å²	48	121.9 Å²	121.9	34%	0.336	64%	0.637	S	S	.	*			trans	-66.1	129.1	164.5	56.3	0	0	0	0	108.5	C19 K26	C19-S21 VanDerWaalsContact C-N 3.32Å; C19-S21 PolarHBondContact O-N 3.46Å; S21-K26 VanDerWaalsContact OG-CE 3.25Å; S21-K26 WeakPolarHBondContact OG-CE 3.45Å; S21-K26 WeakPolarHBondContact OG-CG 3.24Å
22	N	65.3	Low	54.4	Low	95 Å²	95	122.6 Å²	122.6	51%	0.508	63%	0.63	S	S	.	*			trans	-60.6	151.8	177.5	86.2	21.1	0	0	0	110.4	V24 T25 K26	N22-V24 PolarHBondContact O-N 2.74Å; N22-V24 WeakPolarHBondContact OD1-CA 3.45Å; N22-V24 WeakPolarHBondContact OD1-CB 3.37Å; N22-V24 PolarHBondContact OD1-N 3.49Å; N22-V24 VanDerWaalsContact OD1-N 3.09Å; N22-T25 VanDerWaalsContact CG-OG1 3.23Å; N22-T25 WeakPolarHBondContact O-CB 3.38Å; N22-T25 PolarHBondContact O-N 3.42Å; N22-T25 PolarHBondContact OD1-N 3.03Å; N22-T25 PolarHBondContact OD1-OG1 3.2Å; N22-K26 PolarHBondContact O-N 3.04Å
23	I	69.6	Low	56.8	Low	50 Å²	50	121.4 Å²	121.4	26%	0.256	62%	0.618	S	S	.	*	H	α-helix	trans	-57.5	-34	-175.1	-168.6	166.4	0	0	0	112.8	T25 K26 L27 F37 L43 P44 L47	I23-T25 VanDerWaalsContact C-N 3.32Å; I23-T25 PolarHBondContact O-N 3.48Å; I23-K26 PolarHBondContact O-N 3.19Å; I23-L27 HydrophobicContact CG1-CD1 4.02Å; I23-L27 HydrophobicContact CG1-CG 4.34Å; I23-L27 WeakPolarHBondContact O-CB 3.18Å; I23-L27 WeakPolarHBondContact O-CG 3.43Å; I23-L27 PolarHBondContact O-N 3.43Å; I23-F37 HydrophobicContact CD1-CE2 4.49Å; I23-F37 HydrophobicContact CG1-CE2 3.97Å; I23-F37 HydrophobicContact CG1-CZ 4.28Å; I23-L43 HydrophobicContact CD1-CD2 4.14Å; I23-P44 HydrophobicContact CB-CG 4.39Å; I23-L47 HydrophobicContact CD1-CD2 3.45Å; I23-L47 VanDerWaalsContact CD1-CD2 3.45Å
24	V	70.1	Confident	58.3	Low	91 Å²	91	121 Å²	121	55%	0.552	61%	0.614	S	S	*	*	H	α-helix	trans	-64.2	-37.8	177.5	-178.3	0	0	0	0	111	N22 L27 T28	N22-V24 PolarHBondContact O-N 2.74Å; N22-V24 WeakPolarHBondContact OD1-CA 3.45Å; N22-V24 WeakPolarHBondContact OD1-CB 3.37Å; N22-V24 PolarHBondContact OD1-N 3.49Å; N22-V24 VanDerWaalsContact OD1-N 3.09Å; V24-L27 PolarHBondContact O-N 2.93Å; V24-T28 VanDerWaalsContact O-CB 3.26Å; V24-T28 WeakPolarHBondContact O-CB 3.44Å; V24-T28 PolarHBondContact O-N 3.33Å; V24-T28 PolarHBondContact O-OG1 3.19Å
25	T	70.4	Confident	59.9	Low	76 Å²	76	117.4 Å²	117.4	47%	0.466	61%	0.607	S	S	.	*	H	α-helix	trans	-69.6	-40.8	179.7	-43	0	0	0	0	110.5	N22 I23 T28 S29	N22-T25 VanDerWaalsContact CG-OG1 3.23Å; N22-T25 WeakPolarHBondContact O-CB 3.38Å; N22-T25 PolarHBondContact O-N 3.42Å; N22-T25 PolarHBondContact OD1-N 3.03Å; N22-T25 PolarHBondContact OD1-OG1 3.2Å; I23-T25 VanDerWaalsContact C-N 3.32Å; I23-T25 PolarHBondContact O-N 3.48Å; T25-T28 PolarHBondContact O-N 2.62Å; T25-S29 VanDerWaalsContact O-CB 3.32Å; T25-S29 WeakPolarHBondContact O-CB 3.26Å; T25-S29 PolarHBondContact O-N 2.93Å
26	K	70.4	Confident	61.5	Low	94 Å²	94	109 Å²	109	41%	0.409	58%	0.583	S	S	.	*	H	α-helix	trans	-67.1	-43.9	174	-86.2	-175.5	172.3	-176.6	0	112.6	S21 N22 I23 T28 S29 S30 F37	S21-K26 VanDerWaalsContact OG-CE 3.25Å; S21-K26 WeakPolarHBondContact OG-CE 3.45Å; S21-K26 WeakPolarHBondContact OG-CG 3.24Å; N22-K26 PolarHBondContact O-N 3.04Å; I23-K26 PolarHBondContact O-N 3.19Å; K26-T28 VanDerWaalsContact C-N 3.28Å; K26-T28 PolarHBondContact O-N 3.08Å; K26-S29 PolarHBondContact O-N 2.73Å; K26-S30 WeakPolarHBondContact O-CB 3.48Å; K26-S30 PolarHBondContact O-N 3.34Å; K26-S30 PolarHBondContact O-OG 3.2Å; K26-F37 HydrophobicContact CB-CE2 4.12Å; K26-F37 HydrophobicContact CB-CZ 3.81Å; K26-F37 HydrophobicContact CD-CE1 3.64Å; K26-F37 HydrophobicContact CD-CZ 3.51Å; K26-F37 HydrophobicContact CG-CZ 4.32Å
27	L	73	Confident	63.4	Low	82 Å²	82	100.5 Å²	100.5	43%	0.429	55%	0.552	S	S	.	*	H	α-helix	trans	-65.2	-31.7	175.8	-72.9	170.6	0	0	0	112.8	I23 V24 S30 K31 F37	I23-L27 HydrophobicContact CG1-CD1 4.02Å; I23-L27 HydrophobicContact CG1-CG 4.34Å; I23-L27 WeakPolarHBondContact O-CB 3.18Å; I23-L27 WeakPolarHBondContact O-CG 3.43Å; I23-L27 PolarHBondContact O-N 3.43Å; V24-L27 PolarHBondContact O-N 2.93Å; L27-S30 WeakPolarHBondContact CA-OG 3.47Å; L27-S30 PolarHBondContact O-OG 3.48Å; L27-K31 WeakPolarHBondContact O-CG 3.41Å; L27-K31 PolarHBondContact O-N 2.5Å; L27-F37 HydrophobicContact CD2-CD2 4.23Å; L27-F37 HydrophobicContact CD2-CE2 4.3Å; L27-F37 HydrophobicContact CG-CE2 4.34Å
28	T	72.1	Confident	65.1	Low	73 Å²	73	93.5 Å²	93.5	45%	0.448	54%	0.54	S	S	.	.	H	α-helix	trans	-76	-42.3	176.1	-54.7	0	0	0	0	110.6	V24 T25 K26 S30 K31 I32	V24-T28 VanDerWaalsContact O-CB 3.26Å; V24-T28 WeakPolarHBondContact O-CB 3.44Å; V24-T28 PolarHBondContact O-N 3.33Å; V24-T28 PolarHBondContact O-OG1 3.19Å; T25-T28 PolarHBondContact O-N 2.62Å; K26-T28 VanDerWaalsContact C-N 3.28Å; K26-T28 PolarHBondContact O-N 3.08Å; T28-S30 VanDerWaalsContact C-N 3.32Å; T28-S30 PolarHBondContact O-N 3.2Å; T28-K31 PolarHBondContact O-N 2.72Å; T28-I32 WeakPolarHBondContact O-CG1 3.44Å
29	S	72.5	Confident	66.8	Low	59 Å²	59	88.6 Å²	88.6	41%	0.413	51%	0.509	S	S	.	.	H	α-helix	trans	-59.6	-43	172.9	-173.2	0	0	0	0	111.5	T25 K26 K31 I32 T33	T25-S29 VanDerWaalsContact O-CB 3.32Å; T25-S29 WeakPolarHBondContact O-CB 3.26Å; T25-S29 PolarHBondContact O-N 2.93Å; K26-S29 PolarHBondContact O-N 2.73Å; S29-K31 VanDerWaalsContact C-N 3.29Å; S29-K31 PolarHBondContact O-N 2.89Å; S29-I32 WeakPolarHBondContact O-CB 3.48Å; S29-I32 PolarHBondContact O-N 3.5Å; S29-T33 PolarHBondContact O-N 2.96Å; S29-T33 PolarHBondContact O-OG1 3.26Å; S29-T33 VanDerWaalsContact O-OG1 3.07Å
30	S	71.9	Confident	68.5	Low	20 Å²	20	83.5 Å²	83.5	14%	0.14	48%	0.477	C	S	.	.	H	α-helix	trans	-65.6	-31.1	-179.3	67	0	0	0	0	113.5	K26 L27 T28 I32 G34 E35	K26-S30 WeakPolarHBondContact O-CB 3.48Å; K26-S30 PolarHBondContact O-N 3.34Å; K26-S30 PolarHBondContact O-OG 3.2Å; L27-S30 WeakPolarHBondContact CA-OG 3.47Å; L27-S30 PolarHBondContact O-OG 3.48Å; T28-S30 VanDerWaalsContact C-N 3.32Å; T28-S30 PolarHBondContact O-N 3.2Å; S30-I32 PolarHBondContact O-N 3.31Å; S30-G34 VanDerWaalsContact O-CA 3.24Å; S30-G34 WeakPolarHBondContact O-CA 3.5Å; S30-G34 PolarHBondContact O-N 3.17Å; S30-E35 WeakPolarHBondContact CA-O 3.2Å; S30-E35 WeakPolarHBondContact CB-O 3.47Å
31	K	72.3	Confident	69.9	Low	186 Å²	186	75.7 Å²	75.7	81%	0.809	44%	0.435	S	S	*	.	H	α-helix	trans	-65.8	-23.2	172.2	-76.2	178.9	179	-174.2	0	112.7	L27 T28 S29	L27-K31 WeakPolarHBondContact O-CG 3.41Å; L27-K31 PolarHBondContact O-N 2.5Å; T28-K31 PolarHBondContact O-N 2.72Å; S29-K31 VanDerWaalsContact C-N 3.29Å; S29-K31 PolarHBondContact O-N 2.89Å
32	I	75.8	Confident	71	Confident	141 Å²	141	76.7 Å²	76.7	72%	0.723	44%	0.435	S	S	*	.	H	α-helix	trans	-96.7	-43.3	-177.6	-59.9	166.6	0	0	0	110.7	T28 S29 S30	T28-I32 WeakPolarHBondContact O-CG1 3.44Å; S29-I32 WeakPolarHBondContact O-CB 3.48Å; S29-I32 PolarHBondContact O-N 3.5Å; S30-I32 PolarHBondContact O-N 3.31Å
33	T	78.3	Confident	71.8	Confident	80 Å²	80	74 Å²	74	49%	0.491	42%	0.42	S	S	.	.	H	α-helix	trans	-89.5	-17.3	-176.5	61.3	0	0	0	0	113.4	S29 E35	S29-T33 PolarHBondContact O-N 2.96Å; S29-T33 PolarHBondContact O-OG1 3.26Å; S29-T33 VanDerWaalsContact O-OG1 3.07Å; T33-E35 PolarHBondContact O-N 3.18Å; T33-E35 PolarHBondContact OG1-N 3.42Å; T33-E35 VanDerWaalsContact OG1-N 3.17Å
34	G	67.4	Low	72.3	Confident	70 Å²	70	73.8 Å²	73.8	72%	0.722	42%	0.422	S	S	*	.	S	Bend	trans	75.5	-7	-167.5	0	0	0	0	0	113.9	S30 G36	S30-G34 VanDerWaalsContact O-CA 3.24Å; S30-G34 WeakPolarHBondContact O-CA 3.5Å; S30-G34 PolarHBondContact O-N 3.17Å; G34-G36 PolarHBondContact O-N 3.26Å
35	E	60.3	Low	72.7	Confident	161 Å²	161	70.4 Å²	70.4	75%	0.752	41%	0.405	S	S	*	.			trans	-96.5	91.5	-179.2	-64.5	-171.4	161.8	0	0	110.4	S30 T33	S30-E35 WeakPolarHBondContact CA-O 3.2Å; S30-E35 WeakPolarHBondContact CB-O 3.47Å; T33-E35 PolarHBondContact O-N 3.18Å; T33-E35 PolarHBondContact OG1-N 3.42Å; T33-E35 VanDerWaalsContact OG1-N 3.17Å
36	G	67.7	Low	73.1	Confident	41 Å²	41	69.3 Å²	69.3	42%	0.423	41%	0.409	S	S	.	.			trans	-97.6	-174	174.9	0	0	0	0	0	114.3	G34 S38	G34-G36 PolarHBondContact O-N 3.26Å; G36-S38 PolarHBondContact O-N 3.46Å
37	F	70.6	Confident	73.6	Confident	56 Å²	56	67.6 Å²	67.6	25%	0.246	40%	0.404	C	S	.	.			trans	-62.2	119.4	167.8	-61.1	-69.9	0	0	0	108.6	I23 K26 L27 Q42 L43	I23-F37 HydrophobicContact CD1-CE2 4.49Å; I23-F37 HydrophobicContact CG1-CE2 3.97Å; I23-F37 HydrophobicContact CG1-CZ 4.28Å; K26-F37 HydrophobicContact CB-CE2 4.12Å; K26-F37 HydrophobicContact CB-CZ 3.81Å; K26-F37 HydrophobicContact CD-CE1 3.64Å; K26-F37 HydrophobicContact CD-CZ 3.51Å; K26-F37 HydrophobicContact CG-CZ 4.32Å; L27-F37 HydrophobicContact CD2-CD2 4.23Å; L27-F37 HydrophobicContact CD2-CE2 4.3Å; L27-F37 HydrophobicContact CG-CE2 4.34Å; F37-Q42 HydrophobicContact CD1-CB 3.69Å; F37-Q42 HydrophobicContact CE1-CB 4.38Å; F37-Q42 WeakPolarHBondContact CE1-O 3.43Å; F37-L43 HydrophobicContact CD2-CD2 4.24Å; F37-L43 HydrophobicContact CE2-CD2 4.33Å; F37-L43 HydrophobicContact CG-CD2 4.41Å
38	S	67.6	Low	74.1	Confident	93 Å²	93	63.8 Å²	63.8	65%	0.65	39%	0.385	S	S	*	.			trans	-91.7	-14.6	176	64	0	0	0	0	112.4	G36 Q42	G36-S38 PolarHBondContact O-N 3.46Å; S38-Q42 PolarHBondContact OG-NE2 3.15Å; S38-Q42 PolarHBondContact OG-OE1 3.49Å
39	R	71.3	Confident	74.6	Confident	55 Å²	55	66.3 Å²	66.3	21%	0.208	39%	0.391	C	S	.	.	S	Bend	trans	-146.8	154.2	179.5	-63.9	-170.5	178.8	162.5	8.6	113.2	T41 Q42 E128	R39-T41 VanDerWaalsContact C-N 3.25Å; R39-T41 PolarHBondContact O-N 3Å; R39-Q42 HydrophobicContact CB-CG 4.39Å; R39-Q42 WeakPolarHBondContact O-CB 3.37Å; R39-Q42 PolarHBondContact O-N 3.35Å; R39-Q42 VanDerWaalsContact O-N 3.13Å; R39-E128 IonicContact CZ-OE1 3.78Å; R39-E128 IonicContact CZ-OE2 2.72Å; R39-E128 VanDerWaalsContact NH1-CD 3.27Å; R39-E128 IonicContact NH1-OE1 2.69Å; R39-E128 PolarHBondContact NH1-OE1 2.87Å; R39-E128 IonicContact NH1-OE2 3.31Å; R39-E128 PolarHBondContact NH1-OE2 3.41Å; R39-E128 VanDerWaalsContact NH2-CD 3.28Å; R39-E128 IonicContact NH2-OE1 3.45Å; R39-E128 PolarHBondContact NH2-OE1 3.15Å; R39-E128 IonicContact NH2-OE2 3.1Å
40	G	73.8	Confident	75.1	Confident	13 Å²	13	69 Å²	69	13%	0.134	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-60.1	-32.4	174.2	0	0	0	0	0	113.6	Q42 L43 F120	G40-Q42 PolarHBondContact O-N 2.8Å; G40-Q42 VanDerWaalsContact O-N 3.14Å; G40-L43 WeakPolarHBondContact O-CB 3.48Å; G40-L43 WeakPolarHBondContact O-CG 3.37Å; G40-L43 PolarHBondContact O-N 3.37Å; G40-L43 VanDerWaalsContact O-N 3.13Å; G40-F120 PolarHBondContact N-O 2.97Å
41	T	74.4	Confident	75.8	Confident	5 Å²	5	73.9 Å²	73.9	3%	0.031	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-64	-14.8	176.2	54.9	0	0	0	0	114.7	R39 L64 Q65 H68	R39-T41 VanDerWaalsContact C-N 3.25Å; R39-T41 PolarHBondContact O-N 3Å; T41-L64 HydrophobicContact CG2-CB 3.91Å; T41-Q65 PolarHBondContact O-NE2 3.48Å; T41-H68 HydrophobicContact CG2-CB 4.25Å
42	Q	77	Confident	76.3	Confident	69 Å²	69	66.5 Å²	66.5	32%	0.322	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-88.5	-6.1	178.5	-60.7	173.8	-19.5	0	0	112.9	F37 S38 R39 G40	F37-Q42 HydrophobicContact CD1-CB 3.69Å; F37-Q42 HydrophobicContact CE1-CB 4.38Å; F37-Q42 WeakPolarHBondContact CE1-O 3.43Å; S38-Q42 PolarHBondContact OG-NE2 3.15Å; S38-Q42 PolarHBondContact OG-OE1 3.49Å; R39-Q42 HydrophobicContact CB-CG 4.39Å; R39-Q42 WeakPolarHBondContact O-CB 3.37Å; R39-Q42 PolarHBondContact O-N 3.35Å; R39-Q42 VanDerWaalsContact O-N 3.13Å; G40-Q42 PolarHBondContact O-N 2.8Å; G40-Q42 VanDerWaalsContact O-N 3.14Å
43	L	81	Confident	76.6	Confident	39 Å²	39	68.5 Å²	68.5	20%	0.204	39%	0.385	C	S	.	.	S	Bend	trans	-67.2	148.5	176.2	-67.8	171.9	0	0	0	111.1	I23 F37 G40 G45 L48 Q65 F120	I23-L43 HydrophobicContact CD1-CD2 4.14Å; F37-L43 HydrophobicContact CD2-CD2 4.24Å; F37-L43 HydrophobicContact CE2-CD2 4.33Å; F37-L43 HydrophobicContact CG-CD2 4.41Å; G40-L43 WeakPolarHBondContact O-CB 3.48Å; G40-L43 WeakPolarHBondContact O-CG 3.37Å; G40-L43 PolarHBondContact O-N 3.37Å; G40-L43 VanDerWaalsContact O-N 3.13Å; L43-G45 PolarHBondContact O-N 3.36Å; L43-L48 HydrophobicContact CB-CD1 4.44Å; L43-L48 HydrophobicContact CB-CD2 4.02Å; L43-L48 HydrophobicContact CB-CG 4.27Å; L43-L48 HydrophobicContact CD1-CD2 4.02Å; L43-Q65 PolarHBondContact O-NE2 3.42Å; L43-F120 HydrophobicContact CD1-CD1 4.49Å; L43-F120 HydrophobicContact CD1-CE1 4.01Å
44	P	81.2	Confident	76.9	Confident	46 Å²	46	69.4 Å²	69.4	30%	0.299	39%	0.393	S	S	.	.			trans	-62.3	126.9	178.2	-20.7	32.7	0	0	0	111.5	I23 G46 L47 L48	I23-P44 HydrophobicContact CB-CG 4.39Å; P44-G46 PolarHBondContact O-N 3.11Å; P44-G46 VanDerWaalsContact O-N 3.13Å; P44-L47 WeakPolarHBondContact O-CB 3.45Å; P44-L47 PolarHBondContact O-N 3.22Å; P44-L48 PolarHBondContact O-N 2.94Å
45	G	77.4	Confident	77.6	Confident	19 Å²	19	68.3 Å²	68.3	20%	0.196	38%	0.376	C	S	.	.	H	α-helix	trans	-56.1	-32.4	-178.3	0	0	0	0	0	114.4	L43 L47 L48 Q49	L43-G45 PolarHBondContact O-N 3.36Å; G45-L47 VanDerWaalsContact C-N 3.28Å; G45-L47 PolarHBondContact O-N 3.08Å; G45-L48 PolarHBondContact O-N 3.08Å; G45-Q49 WeakPolarHBondContact O-CG 3.5Å; G45-Q49 PolarHBondContact O-N 3.01Å
46	G	78.7	Confident	78.7	Confident	53 Å²	53	68 Å²	68	55%	0.546	37%	0.372	S	S	.	.	H	α-helix	trans	-61.9	-33.4	174.5	0	0	0	0	0	113.8	P44 E50	P44-G46 PolarHBondContact O-N 3.11Å; P44-G46 VanDerWaalsContact O-N 3.13Å; G46-E50 PolarHBondContact O-N 3.25Å
47	L	81.4	Confident	79.5	Confident	58 Å²	58	68.3 Å²	68.3	30%	0.304	36%	0.361	S	S	.	.	H	α-helix	trans	-73.8	-40.2	175.1	178.6	66.8	0	0	0	111.3	I23 P44 G45 Q49 E50 R51	I23-L47 HydrophobicContact CD1-CD2 3.45Å; I23-L47 VanDerWaalsContact CD1-CD2 3.45Å; P44-L47 WeakPolarHBondContact O-CB 3.45Å; P44-L47 PolarHBondContact O-N 3.22Å; G45-L47 VanDerWaalsContact C-N 3.28Å; G45-L47 PolarHBondContact O-N 3.08Å; L47-Q49 VanDerWaalsContact C-N 3.34Å; L47-E50 PolarHBondContact O-N 3.32Å; L47-R51 HydrophobicContact CD1-CG 4.29Å; L47-R51 WeakPolarHBondContact O-CG 3.41Å; L47-R51 PolarHBondContact O-N 2.93Å; L47-R51 VanDerWaalsContact O-N 3.13Å
48	L	83.9	Confident	80.2	Confident	3 Å²	3	70.7 Å²	70.7	2%	0.016	37%	0.373	C	S	.	.	H	α-helix	trans	-60.7	-46.7	177.4	-62.5	177.8	0	0	0	110.2	L43 P44 G45 E50 R51 D52 W57 P61 F120	L43-L48 HydrophobicContact CB-CD1 4.44Å; L43-L48 HydrophobicContact CB-CD2 4.02Å; L43-L48 HydrophobicContact CB-CG 4.27Å; L43-L48 HydrophobicContact CD1-CD2 4.02Å; P44-L48 PolarHBondContact O-N 2.94Å; G45-L48 PolarHBondContact O-N 3.08Å; L48-E50 PolarHBondContact O-N 3.16Å; L48-R51 PolarHBondContact O-N 3.49Å; L48-D52 VanDerWaalsContact O-CB 3.31Å; L48-D52 WeakPolarHBondContact O-CB 3.37Å; L48-D52 PolarHBondContact O-N 3.24Å; L48-W57 HydrophobicContact CD2-CZ3 4.23Å; L48-P61 HydrophobicContact CB-CB 4.4Å; L48-P61 HydrophobicContact CD1-CB 3.94Å; L48-P61 HydrophobicContact CD2-CB 3.95Å; L48-P61 HydrophobicContact CG-CB 4.31Å; L48-F120 HydrophobicContact CD2-CD1 4.37Å; L48-F120 HydrophobicContact CD2-CE1 3.68Å; L48-F120 HydrophobicContact CD2-CZ 4.42Å
49	Q	82.4	Confident	81.2	Confident	126 Å²	126	67.2 Å²	67.2	59%	0.589	35%	0.351	S	S	*	.	H	α-helix	trans	-63.3	-38.7	177.8	-72.3	174.7	2.8	0	0	113.8	G45 L47 R51 D62	G45-Q49 WeakPolarHBondContact O-CG 3.5Å; G45-Q49 PolarHBondContact O-N 3.01Å; L47-Q49 VanDerWaalsContact C-N 3.34Å; Q49-R51 VanDerWaalsContact C-N 3.31Å; Q49-R51 PolarHBondContact O-N 3.49Å; Q49-D62 WeakPolarHBondContact CG-OD2 3.4Å; Q49-D62 PolarHBondContact NE2-OD2 2.99Å; Q49-D62 VanDerWaalsContact NE2-OD2 3.13Å
50	E	83.7	Confident	82	Confident	114 Å²	114	64.6 Å²	64.6	53%	0.533	34%	0.341	S	S	.	.	H	α-helix	trans	-64.7	-38	176.6	-167.6	-161.3	127	0	0	111.5	G46 L47 L48 P54	G46-E50 PolarHBondContact O-N 3.25Å; L47-E50 PolarHBondContact O-N 3.32Å; L48-E50 PolarHBondContact O-N 3.16Å; E50-P54 WeakPolarHBondContact O-CD 3.42Å
51	R	84.8	Confident	82.8	Confident	124 Å²	124	64.1 Å²	64.1	47%	0.468	34%	0.336	S	S	.	.	H	α-helix	trans	-91.6	-18.5	-174.8	-68.1	-71.1	138	153.7	-1	114.3	L47 L48 Q49 K53 P54 A55 W57	L47-R51 HydrophobicContact CD1-CG 4.29Å; L47-R51 WeakPolarHBondContact O-CG 3.41Å; L47-R51 PolarHBondContact O-N 2.93Å; L47-R51 VanDerWaalsContact O-N 3.13Å; L48-R51 PolarHBondContact O-N 3.49Å; Q49-R51 VanDerWaalsContact C-N 3.31Å; Q49-R51 PolarHBondContact O-N 3.49Å; R51-K53 PolarHBondContact O-N 3.46Å; R51-P54 VanDerWaalsContact O-CD 3.3Å; R51-P54 WeakPolarHBondContact O-CD 3.37Å; R51-A55 WeakPolarHBondContact O-CB 3.4Å; R51-A55 PolarHBondContact O-N 3.32Å; R51-W57 HydrophobicContact CB-CE3 4.29Å; R51-W57 HydrophobicContact CB-CH2 3.61Å; R51-W57 HydrophobicContact CB-CZ3 3.46Å; R51-W57 VanDerWaalsContact CB-CZ3 3.46Å; R51-W57 HydrophobicContact CG-CH2 4.48Å
52	D	83.9	Confident	83.4	Confident	31 Å²	31	65.2 Å²	65.2	17%	0.166	34%	0.342	C	S	.	.	H	α-helix	trans	-54.6	-49.5	-175.2	-174.3	72.1	0	0	0	113.1	L48 K56 W57 H58 G59	L48-D52 VanDerWaalsContact O-CB 3.31Å; L48-D52 WeakPolarHBondContact O-CB 3.37Å; L48-D52 PolarHBondContact O-N 3.24Å; D52-K56 WeakPolarHBondContact O-CA 3.38Å; D52-K56 PolarHBondContact O-N 3.44Å; D52-W57 PolarHBondContact O-N 3.43Å; D52-W57 VanDerWaalsContact OD1-CB 3.28Å; D52-W57 WeakPolarHBondContact OD1-CB 3.48Å; D52-H58 PolarHBondContact OD1-N 3.1Å; D52-G59 VanDerWaalsContact OD1-CA 3.29Å; D52-G59 WeakPolarHBondContact OD1-CA 3.46Å; D52-G59 PolarHBondContact OD1-N 3.25Å; D52-G59 PolarHBondContact OD2-N 3.09Å
53	K	82.1	Confident	84	Confident	183 Å²	183	63.3 Å²	63.3	80%	0.796	33%	0.333	S	S	*	.	H	α-helix	trans	-69	-51	178.9	-72.2	-179.6	-179.1	-179.6	0	113	R51 A55 K56	R51-K53 PolarHBondContact O-N 3.46Å; K53-A55 VanDerWaalsContact C-N 3.3Å; K53-A55 PolarHBondContact O-N 2.89Å; K53-K56 PolarHBondContact O-N 3.25Å
54	P	84.3	Confident	84.4	Confident	99 Å²	99	61.4 Å²	61.4	64%	0.643	32%	0.324	S	S	*	.	H	α-helix	trans	-58.6	-38.6	176.8	-25.8	32	0	0	0	114.1	E50 R51	E50-P54 WeakPolarHBondContact O-CD 3.42Å; R51-P54 VanDerWaalsContact O-CD 3.3Å; R51-P54 WeakPolarHBondContact O-CD 3.37Å
55	A	81.4	Confident	84.7	Confident	46 Å²	46	61 Å²	61	38%	0.38	32%	0.317	S	S	.	.	H	α-helix	trans	-91.4	-2.2	-176.8	0	0	0	0	0	113.6	R51 K53 W57	R51-A55 WeakPolarHBondContact O-CB 3.4Å; R51-A55 PolarHBondContact O-N 3.32Å; K53-A55 VanDerWaalsContact C-N 3.3Å; K53-A55 PolarHBondContact O-N 2.89Å; A55-W57 HydrophobicContact CB-CD2 3.8Å; A55-W57 HydrophobicContact CB-CG 4.06Å; A55-W57 HydrophobicContact CB-CH2 4.46Å; A55-W57 HydrophobicContact CB-CZ2 3.72Å; A55-W57 PolarHBondContact O-N 3.4Å
56	K	83.8	Confident	85.3	Confident	154 Å²	154	64.4 Å²	64.4	67%	0.67	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	47.6	-178.8	-55.6	178.9	179.9	178.8	0	112.5	D52 K53 H58	D52-K56 WeakPolarHBondContact O-CA 3.38Å; D52-K56 PolarHBondContact O-N 3.44Å; K53-K56 PolarHBondContact O-N 3.25Å; K56-H58 VanDerWaalsContact C-N 3.3Å; K56-H58 PolarHBondContact O-CE1 2.74Å; K56-H58 PolarHBondContact O-ND1 2.74Å
57	W	85.5	Confident	85.8	Confident	49 Å²	49	62 Å²	62	19%	0.186	30%	0.301	C	S	.	.			trans	-83.8	-4.7	178.7	-64.2	-25.7	0	0	0	113.9	L48 R51 D52 A55 G59 I60 P61 T116 F120	L48-W57 HydrophobicContact CD2-CZ3 4.23Å; R51-W57 HydrophobicContact CB-CE3 4.29Å; R51-W57 HydrophobicContact CB-CH2 3.61Å; R51-W57 HydrophobicContact CB-CZ3 3.46Å; R51-W57 VanDerWaalsContact CB-CZ3 3.46Å; R51-W57 HydrophobicContact CG-CH2 4.48Å; D52-W57 PolarHBondContact O-N 3.43Å; D52-W57 VanDerWaalsContact OD1-CB 3.28Å; D52-W57 WeakPolarHBondContact OD1-CB 3.48Å; A55-W57 HydrophobicContact CB-CD2 3.8Å; A55-W57 HydrophobicContact CB-CG 4.06Å; A55-W57 HydrophobicContact CB-CH2 4.46Å; A55-W57 HydrophobicContact CB-CZ2 3.72Å; A55-W57 PolarHBondContact O-N 3.4Å; W57-G59 PolarHBondContact O-N 2.96Å; W57-G59 VanDerWaalsContact O-N 3.09Å; W57-I60 WeakPolarHBondContact O-CB 3.23Å; W57-I60 VanDerWaalsContact O-CG1 3.3Å; W57-I60 WeakPolarHBondContact O-CG1 3.44Å; W57-I60 PolarHBondContact O-N 2.9Å; W57-P61 HydrophobicContact CB-CG 4Å; W57-P61 HydrophobicContact CD2-CG 4.12Å; W57-P61 HydrophobicContact CE3-CG 3.82Å; W57-P61 HydrophobicContact CG-CG 4.24Å; W57-T116 HydrophobicContact CB-CG2 3.87Å; W57-T116 HydrophobicContact CG-CG2 3.87Å; W57-F120 AromaticContact CD2-CE2 3.99Å; W57-F120 HydrophobicContact CD2-CE2 3.99Å; W57-F120 AromaticContact CD2-CZ 3.96Å; W57-F120 HydrophobicContact CD2-CZ 3.96Å; W57-F120 AromaticContact CE2-CE2 3.83Å; W57-F120 AromaticContact CE2-CZ 3.77Å; W57-F120 HydrophobicContact CE3-CE2 4.38Å; W57-F120 AromaticContact CE3-CZ 3.95Å; W57-F120 HydrophobicContact CE3-CZ 3.95Å; W57-F120 HydrophobicContact CG-CE2 4.4Å; W57-F120 HydrophobicContact CH2-CE1 4.48Å; W57-F120 AromaticContact CH2-CZ 3.64Å; W57-F120 HydrophobicContact CH2-CZ 3.64Å; W57-F120 HydrophobicContact CZ2-CE2 4.13Å; W57-F120 AromaticContact CZ2-CZ 3.64Å; W57-F120 HydrophobicContact CZ2-CZ 3.64Å; W57-F120 HydrophobicContact CZ3-CE1 4.48Å; W57-F120 AromaticContact CZ3-CZ 3.78Å; W57-F120 HydrophobicContact CZ3-CZ 3.78Å
58	H	85.4	Confident	86.1	Confident	106 Å²	106	62.1 Å²	62.1	49%	0.491	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	27.9	173.4	-52.4	106.5	0	0	0	114.9	D52 K56 I60 N113	D52-H58 PolarHBondContact OD1-N 3.1Å; K56-H58 VanDerWaalsContact C-N 3.3Å; K56-H58 PolarHBondContact O-CE1 2.74Å; K56-H58 PolarHBondContact O-ND1 2.74Å; H58-I60 VanDerWaalsContact C-N 3.26Å; H58-I60 PolarHBondContact O-N 3.24Å; H58-N113 PolarHBondContact ND1-OD1 2.84Å
59	G	86.9	Confident	86.1	Confident	19 Å²	19	68.2 Å²	68.2	20%	0.196	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.8	6	-179.9	0	0	0	0	0	114.8	D52 W57 D62 L63	D52-G59 VanDerWaalsContact OD1-CA 3.29Å; D52-G59 WeakPolarHBondContact OD1-CA 3.46Å; D52-G59 PolarHBondContact OD1-N 3.25Å; D52-G59 PolarHBondContact OD2-N 3.09Å; W57-G59 PolarHBondContact O-N 2.96Å; W57-G59 VanDerWaalsContact O-N 3.09Å; G59-D62 PolarHBondContact O-N 3.43Å; G59-L63 WeakPolarHBondContact O-CG 3.48Å; G59-L63 PolarHBondContact O-N 2.82Å; G59-L63 VanDerWaalsContact O-N 3.14Å
60	I	89.8	Confident	86.2	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.1	-45.4	-178.7	-65.6	167.7	0	0	0	112.2	W57 H58 D62 L63 L64 L87 N113 T116 F117	W57-I60 WeakPolarHBondContact O-CB 3.23Å; W57-I60 VanDerWaalsContact O-CG1 3.3Å; W57-I60 WeakPolarHBondContact O-CG1 3.44Å; W57-I60 PolarHBondContact O-N 2.9Å; H58-I60 VanDerWaalsContact C-N 3.26Å; H58-I60 PolarHBondContact O-N 3.24Å; I60-D62 VanDerWaalsContact C-N 3.35Å; I60-D62 PolarHBondContact O-N 3.39Å; I60-L63 PolarHBondContact O-N 3.14Å; I60-L64 HydrophobicContact CG2-CD1 3.9Å; I60-L64 HydrophobicContact CG2-CG 4.28Å; I60-L64 WeakPolarHBondContact O-CB 3.39Å; I60-L64 WeakPolarHBondContact O-CG 3.3Å; I60-L64 PolarHBondContact O-N 3.15Å; I60-L87 HydrophobicContact CG1-CD2 4.45Å; I60-L87 HydrophobicContact CG2-CD2 4.13Å; I60-N113 HydrophobicContact CD1-CB 3.6Å; I60-N113 WeakPolarHBondContact CD1-O 3.4Å; I60-T116 HydrophobicContact CB-CG2 4.22Å; I60-T116 HydrophobicContact CD1-CG2 4.33Å; I60-T116 HydrophobicContact CG2-CG2 4.34Å; I60-F117 HydrophobicContact CG2-CB 4.07Å; I60-F117 HydrophobicContact CG2-CD2 4.18Å
61	P	89.2	Confident	86.1	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.019	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-38.9	-179.1	-25.2	36.7	0	0	0	113.4	L48 W57 L64 Q65 F120	L48-P61 HydrophobicContact CB-CB 4.4Å; L48-P61 HydrophobicContact CD1-CB 3.94Å; L48-P61 HydrophobicContact CD2-CB 3.95Å; L48-P61 HydrophobicContact CG-CB 4.31Å; W57-P61 HydrophobicContact CB-CG 4Å; W57-P61 HydrophobicContact CD2-CG 4.12Å; W57-P61 HydrophobicContact CE3-CG 3.82Å; W57-P61 HydrophobicContact CG-CG 4.24Å; P61-L64 PolarHBondContact O-N 3.4Å; P61-Q65 PolarHBondContact O-N 2.92Å; P61-F120 HydrophobicContact CB-CD1 4.02Å; P61-F120 HydrophobicContact CB-CD2 4.45Å; P61-F120 HydrophobicContact CB-CE1 4.12Å; P61-F120 HydrophobicContact CB-CG 4.2Å; P61-F120 HydrophobicContact CB-CZ 4.38Å; P61-F120 HydrophobicContact CG-CD1 4.21Å; P61-F120 HydrophobicContact CG-CD2 3.83Å; P61-F120 HydrophobicContact CG-CE1 4.12Å; P61-F120 HydrophobicContact CG-CE2 3.72Å; P61-F120 HydrophobicContact CG-CG 4.09Å; P61-F120 HydrophobicContact CG-CZ 3.87Å
62	D	87.8	Confident	85.6	Confident	29 Å²	29	57.8 Å²	57.8	16%	0.155	29%	0.289	C	S	.	.	H	α-helix	trans	-67.7	-40.3	178	-85.7	5.3	0	0	0	111.5	Q49 G59 I60 Q65 K66	Q49-D62 WeakPolarHBondContact CG-OD2 3.4Å; Q49-D62 PolarHBondContact NE2-OD2 2.99Å; Q49-D62 VanDerWaalsContact NE2-OD2 3.13Å; G59-D62 PolarHBondContact O-N 3.43Å; I60-D62 VanDerWaalsContact C-N 3.35Å; I60-D62 PolarHBondContact O-N 3.39Å; D62-Q65 PolarHBondContact O-N 3.42Å; D62-K66 WeakPolarHBondContact O-CG 3.3Å; D62-K66 PolarHBondContact O-N 2.75Å; D62-K66 VanDerWaalsContact O-N 3.16Å
63	L	89.2	Confident	84.7	Confident	28 Å²	28	59.7 Å²	59.7	15%	0.147	30%	0.303	C	S	.	.	H	α-helix	trans	-66.3	-40.2	174.5	-73.2	173.6	0	0	0	111.6	G59 I60 K66 L67 Y83 L87	G59-L63 WeakPolarHBondContact O-CG 3.48Å; G59-L63 PolarHBondContact O-N 2.82Å; G59-L63 VanDerWaalsContact O-N 3.14Å; I60-L63 PolarHBondContact O-N 3.14Å; L63-K66 PolarHBondContact O-N 3.17Å; L63-L67 WeakPolarHBondContact O-CB 3.35Å; L63-L67 PolarHBondContact O-N 2.99Å; L63-Y83 HydrophobicContact CD2-CD1 4.2Å; L63-L87 HydrophobicContact CB-CD1 4.11Å; L63-L87 HydrophobicContact CB-CD2 3.74Å; L63-L87 HydrophobicContact CB-CG 3.89Å; L63-L87 HydrophobicContact CD1-CD2 3.92Å; L63-L87 HydrophobicContact CD1-CG 4.14Å
64	L	89.7	Confident	84	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.8	-39.5	175	-84.5	176.8	0	0	0	112.5	T41 I60 P61 L67 H68 L87 F117 F120 L125	T41-L64 HydrophobicContact CG2-CB 3.91Å; I60-L64 HydrophobicContact CG2-CD1 3.9Å; I60-L64 HydrophobicContact CG2-CG 4.28Å; I60-L64 WeakPolarHBondContact O-CB 3.39Å; I60-L64 WeakPolarHBondContact O-CG 3.3Å; I60-L64 PolarHBondContact O-N 3.15Å; P61-L64 PolarHBondContact O-N 3.4Å; L64-L67 HydrophobicContact CD2-CD2 4.37Å; L64-L67 PolarHBondContact O-N 2.94Å; L64-H68 WeakPolarHBondContact O-CB 3.46Å; L64-H68 PolarHBondContact O-N 3.45Å; L64-L87 HydrophobicContact CD2-CD1 4.28Å; L64-F117 HydrophobicContact CD1-CD2 3.93Å; L64-F117 HydrophobicContact CD1-CE2 4.35Å; L64-F117 HydrophobicContact CD2-CD2 3.79Å; L64-F117 HydrophobicContact CD2-CE2 3.34Å; L64-F117 HydrophobicContact CD2-CZ 4.05Å; L64-F117 HydrophobicContact CG-CD2 4.02Å; L64-F117 HydrophobicContact CG-CE2 4.08Å; L64-F120 HydrophobicContact CD1-CB 3.87Å; L64-L125 HydrophobicContact CD2-CD2 4.33Å
65	Q	88.4	Confident	83.3	Confident	36 Å²	36	54.3 Å²	54.3	17%	0.168	28%	0.281	C	S	.	.	H	α-helix	trans	-62.9	-44.9	175.1	-175.9	164.3	58.8	0	0	111.1	T41 L43 P61 D62 H68 E69	T41-Q65 PolarHBondContact O-NE2 3.48Å; L43-Q65 PolarHBondContact O-NE2 3.42Å; P61-Q65 PolarHBondContact O-N 2.92Å; D62-Q65 PolarHBondContact O-N 3.42Å; Q65-H68 WeakPolarHBondContact O-CB 3.36Å; Q65-H68 PolarHBondContact O-N 2.99Å; Q65-E69 WeakPolarHBondContact O-CG 3.33Å; Q65-E69 PolarHBondContact O-N 3Å
66	K	88.1	Confident	82.8	Confident	92 Å²	92	57 Å²	57	40%	0.4	29%	0.289	S	S	.	.	H	α-helix	trans	-64.3	-39.9	175.2	-69.1	170.8	-174.2	168.8	0	112.6	D62 L63 S70 Y83	D62-K66 WeakPolarHBondContact O-CG 3.3Å; D62-K66 PolarHBondContact O-N 2.75Å; D62-K66 VanDerWaalsContact O-N 3.16Å; L63-K66 PolarHBondContact O-N 3.17Å; K66-S70 WeakPolarHBondContact O-CB 3.34Å; K66-S70 PolarHBondContact O-N 2.94Å; K66-S70 PolarHBondContact O-OG 3.45Å; K66-Y83 HydrophobicContact CB-CD1 4.13Å; K66-Y83 HydrophobicContact CB-CD2 4.01Å; K66-Y83 HydrophobicContact CB-CE1 4.05Å; K66-Y83 HydrophobicContact CB-CE2 3.91Å; K66-Y83 HydrophobicContact CB-CG 4.13Å; K66-Y83 HydrophobicContact CD-CD1 4.26Å; K66-Y83 HydrophobicContact CD-CE1 3.74Å; K66-Y83 HydrophobicContact CG-CE1 4.45Å
67	L	89.3	Confident	82.4	Confident	1 Å²	1	51 Å²	51	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-60.9	-46.6	174	-179.3	63	0	0	0	110.4	L63 L64 S70 S71 A80 L84 L87 L125 L126 I129	L63-L67 WeakPolarHBondContact O-CB 3.35Å; L63-L67 PolarHBondContact O-N 2.99Å; L64-L67 HydrophobicContact CD2-CD2 4.37Å; L64-L67 PolarHBondContact O-N 2.94Å; L67-S70 WeakPolarHBondContact CA-OG 3.48Å; L67-S70 PolarHBondContact O-N 3.27Å; L67-S70 PolarHBondContact O-OG 3.48Å; L67-S70 VanDerWaalsContact O-OG 3.1Å; L67-S71 WeakPolarHBondContact O-CB 3.49Å; L67-S71 PolarHBondContact O-N 3.41Å; L67-S71 PolarHBondContact O-OG 3.06Å; L67-A80 HydrophobicContact CD1-CB 3.86Å; L67-A80 VanDerWaalsContact CD1-O 3.27Å; L67-A80 WeakPolarHBondContact CD1-O 3.47Å; L67-L84 HydrophobicContact CD1-CB 4.29Å; L67-L84 HydrophobicContact CD2-CD1 4.3Å; L67-L87 HydrophobicContact CD2-CD1 4.04Å; L67-L125 HydrophobicContact CB-CD2 4.39Å; L67-L125 HydrophobicContact CD2-CD2 4.08Å; L67-L125 HydrophobicContact CG-CD2 4.08Å; L67-L126 HydrophobicContact CD2-CD2 4.26Å; L67-I129 HydrophobicContact CD1-CD1 4.21Å; L67-I129 HydrophobicContact CD2-CD1 4.32Å; L67-I129 HydrophobicContact CG-CD1 4.14Å
68	H	87.6	Confident	81.9	Confident	62 Å²	62	52.5 Å²	52.5	29%	0.287	28%	0.282	S	S	.	.	H	α-helix	trans	-59.8	-50.2	177.6	-177.3	58.9	0	0	0	111.9	T41 L64 Q65 S70 S71 L125	T41-H68 HydrophobicContact CG2-CB 4.25Å; L64-H68 WeakPolarHBondContact O-CB 3.46Å; L64-H68 PolarHBondContact O-N 3.45Å; Q65-H68 WeakPolarHBondContact O-CB 3.36Å; Q65-H68 PolarHBondContact O-N 2.99Å; H68-S70 VanDerWaalsContact C-N 3.29Å; H68-S70 PolarHBondContact O-N 3.05Å; H68-S71 WeakPolarHBondContact CA-OG 3.5Å; H68-S71 PolarHBondContact O-N 3.41Å; H68-S71 VanDerWaalsContact O-N 3.11Å; H68-S71 PolarHBondContact O-OG 2.78Å; H68-L125 HydrophobicContact CB-CD1 4.31Å; H68-L125 HydrophobicContact CB-CD2 3.87Å; H68-L125 WeakPolarHBondContact ND1-CD1 3.32Å
69	E	84.9	Confident	81.5	Confident	130 Å²	130	53.4 Å²	53.4	61%	0.607	29%	0.286	S	S	*	.	H	α-helix	trans	-59.9	-38.2	178.9	-71.9	174.7	179.5	0	0	112.7	Q65	Q65-E69 WeakPolarHBondContact O-CG 3.33Å; Q65-E69 PolarHBondContact O-N 3Å
70	S	84.1	Confident	81.4	Confident	19 Å²	19	52.5 Å²	52.5	13%	0.133	28%	0.277	C	S	.	.	H	α-helix	trans	-81.9	-12.8	178.5	57.5	0	0	0	0	114.1	K66 L67 H68 S75 A80	K66-S70 WeakPolarHBondContact O-CB 3.34Å; K66-S70 PolarHBondContact O-N 2.94Å; K66-S70 PolarHBondContact O-OG 3.45Å; L67-S70 WeakPolarHBondContact CA-OG 3.48Å; L67-S70 PolarHBondContact O-N 3.27Å; L67-S70 PolarHBondContact O-OG 3.48Å; L67-S70 VanDerWaalsContact O-OG 3.1Å; H68-S70 VanDerWaalsContact C-N 3.29Å; H68-S70 PolarHBondContact O-N 3.05Å; S70-S75 WeakPolarHBondContact O-CB 3.38Å; S70-A80 VanDerWaalsContact OG-CA 3.32Å; S70-A80 WeakPolarHBondContact OG-CA 3.26Å; S70-A80 WeakPolarHBondContact OG-CB 3.2Å
71	S	81.4	Confident	81.1	Confident	15 Å²	15	54.2 Å²	54.2	11%	0.105	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-0.5	-177.6	69.5	0	0	0	0	115.6	L67 H68 R132	L67-S71 WeakPolarHBondContact O-CB 3.49Å; L67-S71 PolarHBondContact O-N 3.41Å; L67-S71 PolarHBondContact O-OG 3.06Å; H68-S71 WeakPolarHBondContact CA-OG 3.5Å; H68-S71 PolarHBondContact O-N 3.41Å; H68-S71 VanDerWaalsContact O-N 3.11Å; H68-S71 PolarHBondContact O-OG 2.78Å; S71-R132 PolarHBondContact O-NH1 2.9Å; S71-R132 VanDerWaalsContact O-NH1 3.13Å
72	H	74.8	Confident	80.9	Confident	111 Å²	111	56 Å²	56	51%	0.514	30%	0.304	S	S	.	.			trans	-51.1	144.6	-174.4	-163.6	-79.3	0	0	0	112.8	N74 S75 R132	H72-N74 PolarHBondContact O-N 3.3Å; H72-S75 WeakPolarHBondContact CB-OG 3.43Å; H72-S75 WeakPolarHBondContact O-CB 3.33Å; H72-S75 PolarHBondContact O-N 3.31Å; H72-R132 VanDerWaalsContact O-CZ 3.23Å; H72-R132 PolarHBondContact O-NH1 3.21Å; H72-R132 PolarHBondContact O-NH2 3.44Å
73	P	66	Low	80.9	Confident	72 Å²	72	58.4 Å²	58.4	47%	0.468	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-16.3	-175.4	-33.6	34.8	0	0	0	118.4	R132	P73-R132 VanDerWaalsContact C-CZ 3.43Å; P73-R132 VanDerWaalsContact O-CZ 3.28Å; P73-R132 PolarHBondContact O-NE 3.49Å; P73-R132 PolarHBondContact O-NH2 2.93Å
74	N	66.4	Low	80.9	Confident	123 Å²	123	57 Å²	57	66%	0.658	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.1	4	179.1	-64	-40	0	0	0	113.8	H72 Q138	H72-N74 PolarHBondContact O-N 3.3Å; N74-Q138 PolarHBondContact OD1-NE2 3.41Å
75	S	69.8	Low	80.8	Confident	46 Å²	46	63.7 Å²	63.7	32%	0.322	33%	0.333	S	S	.	.	S	Bend	trans	-87.2	151.3	180	-64.2	0	0	0	0	112	S70 H72 L77 R132	S70-S75 WeakPolarHBondContact O-CB 3.38Å; H72-S75 WeakPolarHBondContact CB-OG 3.43Å; H72-S75 WeakPolarHBondContact O-CB 3.33Å; H72-S75 PolarHBondContact O-N 3.31Å; S75-L77 PolarHBondContact O-N 2.78Å; S75-R132 PolarHBondContact O-NH2 3.31Å; S75-R132 VanDerWaalsContact O-NH2 3.09Å
76	D	69.9	Low	80.7	Confident	102 Å²	102	64.8 Å²	64.8	55%	0.545	34%	0.344	S	S	.	.			trans	-69.6	120.1	167.2	175.7	11.3	0	0	0	109.9	S78	D76-S78 PolarHBondContact O-N 3.3Å; D76-S78 WeakPolarHBondContact OD1-CB 3.36Å; D76-S78 PolarHBondContact OD1-N 3.41Å; D76-S78 PolarHBondContact OD1-OG 3.46Å; D76-S78 PolarHBondContact OD2-OG 3.27Å
77	L	76.3	Confident	80.6	Confident	29 Å²	29	60.4 Å²	60.4	15%	0.152	33%	0.325	C	S	.	.	H	α-helix	trans	-74.9	-3.9	-175.8	-71.6	173.1	0	0	0	113.5	S75 H79 A80 H81 R132 M144 L148	S75-L77 PolarHBondContact O-N 2.78Å; L77-H79 VanDerWaalsContact C-N 3.29Å; L77-H79 PolarHBondContact O-N 3.03Å; L77-A80 HydrophobicContact CD2-CB 4.05Å; L77-A80 WeakPolarHBondContact O-CB 3.22Å; L77-A80 PolarHBondContact O-N 3.41Å; L77-H81 PolarHBondContact O-N 3.11Å; L77-R132 VanDerWaalsContact CD2-NH1 3.29Å; L77-M144 HydrophobicContact CD1-CG 4.19Å; L77-L148 HydrophobicContact CB-CD2 3.83Å; L77-L148 HydrophobicContact CD1-CD2 3.85Å; L77-L148 HydrophobicContact CD2-CD2 4.48Å; L77-L148 HydrophobicContact CG-CD2 4.27Å
78	S	75.9	Confident	80.4	Confident	79 Å²	79	61 Å²	61	55%	0.552	33%	0.33	S	S	*	.	H	α-helix	trans	-59.8	-38.6	178.5	-55	0	0	0	0	112.6	D76 H81 G82	D76-S78 PolarHBondContact O-N 3.3Å; D76-S78 WeakPolarHBondContact OD1-CB 3.36Å; D76-S78 PolarHBondContact OD1-N 3.41Å; D76-S78 PolarHBondContact OD1-OG 3.46Å; D76-S78 PolarHBondContact OD2-OG 3.27Å; S78-H81 PolarHBondContact O-N 3.31Å; S78-G82 PolarHBondContact O-N 2.96Å
79	H	77.1	Confident	80.2	Confident	125 Å²	125	61.8 Å²	61.8	58%	0.579	34%	0.342	S	S	*	.	H	α-helix	trans	-72.2	-39.3	176.1	-65.2	85.9	0	0	0	111.8	L77 H81 G82 Y83	L77-H79 VanDerWaalsContact C-N 3.29Å; L77-H79 PolarHBondContact O-N 3.03Å; H79-H81 VanDerWaalsContact C-N 3.28Å; H79-H81 PolarHBondContact O-N 2.95Å; H79-G82 PolarHBondContact O-N 3.26Å; H79-Y83 WeakPolarHBondContact O-CD2 3.41Å; H79-Y83 PolarHBondContact O-N 3.41Å
80	A	82.8	Confident	80	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-60.5	-39.2	174.5	0	0	0	0	0	111.3	L67 S70 L77 G82 Y83 L84	L67-A80 HydrophobicContact CD1-CB 3.86Å; L67-A80 VanDerWaalsContact CD1-O 3.27Å; L67-A80 WeakPolarHBondContact CD1-O 3.47Å; S70-A80 VanDerWaalsContact OG-CA 3.32Å; S70-A80 WeakPolarHBondContact OG-CA 3.26Å; S70-A80 WeakPolarHBondContact OG-CB 3.2Å; L77-A80 HydrophobicContact CD2-CB 4.05Å; L77-A80 WeakPolarHBondContact O-CB 3.22Å; L77-A80 PolarHBondContact O-N 3.41Å; A80-G82 PolarHBondContact O-N 2.72Å; A80-Y83 PolarHBondContact O-N 2.81Å; A80-L84 WeakPolarHBondContact O-CB 3.38Å; A80-L84 PolarHBondContact O-N 3.29Å
81	H	83.9	Confident	79.9	Confident	36 Å²	36	58 Å²	58	17%	0.167	32%	0.323	C	S	.	.	H	α-helix	trans	-61.5	-41.7	177	-169	-166.5	0	0	0	112.5	L77 S78 H79 Y83 L84 K85 E147 L148 D151	L77-H81 PolarHBondContact O-N 3.11Å; S78-H81 PolarHBondContact O-N 3.31Å; H79-H81 VanDerWaalsContact C-N 3.28Å; H79-H81 PolarHBondContact O-N 2.95Å; H81-Y83 PolarHBondContact O-N 3.22Å; H81-L84 PolarHBondContact O-N 3.26Å; H81-K85 WeakPolarHBondContact O-CB 3.27Å; H81-K85 PolarHBondContact O-N 3.38Å; H81-E147 VanDerWaalsContact CE1-CB 3.46Å; H81-E147 WeakPolarHBondContact CE1-CB 3.3Å; H81-L148 HydrophobicContact CB-CD1 3.88Å; H81-D151 IonicContact CD2-OD2 3.98Å; H81-D151 PolarHBondContact CD2-OD2 3.23Å; H81-D151 VanDerWaalsContact CD2-OD2 3.29Å; H81-D151 IonicContact CE1-OD2 2.67Å; H81-D151 IonicContact NE2-OD2 3.29Å; H81-D151 PolarHBondContact NE2-OD2 2.93Å
82	G	85.5	Confident	79.7	Confident	40 Å²	40	58.8 Å²	58.8	41%	0.412	33%	0.328	S	S	.	.	H	α-helix	trans	-61.3	-41.6	176.6	0	0	0	0	0	113.4	S78 H79 A80 S86	S78-G82 PolarHBondContact O-N 2.96Å; H79-G82 PolarHBondContact O-N 3.26Å; A80-G82 PolarHBondContact O-N 2.72Å; G82-S86 PolarHBondContact O-N 2.82Å; G82-S86 PolarHBondContact O-OG 3.37Å
83	Y	88.6	Confident	79.5	Confident	80 Å²	80	58 Å²	58	31%	0.314	33%	0.331	S	S	.	.	H	α-helix	trans	-69	-40.6	175.5	-63.1	-56.4	0	0	0	111.9	L63 K66 H79 A80 H81 K85 S86 L87	L63-Y83 HydrophobicContact CD2-CD1 4.2Å; K66-Y83 HydrophobicContact CB-CD1 4.13Å; K66-Y83 HydrophobicContact CB-CD2 4.01Å; K66-Y83 HydrophobicContact CB-CE1 4.05Å; K66-Y83 HydrophobicContact CB-CE2 3.91Å; K66-Y83 HydrophobicContact CB-CG 4.13Å; K66-Y83 HydrophobicContact CD-CD1 4.26Å; K66-Y83 HydrophobicContact CD-CE1 3.74Å; K66-Y83 HydrophobicContact CG-CE1 4.45Å; H79-Y83 WeakPolarHBondContact O-CD2 3.41Å; H79-Y83 PolarHBondContact O-N 3.41Å; A80-Y83 PolarHBondContact O-N 2.81Å; H81-Y83 PolarHBondContact O-N 3.22Å; Y83-K85 PolarHBondContact O-N 2.92Å; Y83-S86 WeakPolarHBondContact O-CB 3.35Å; Y83-S86 PolarHBondContact O-N 3.46Å; Y83-L87 PolarHBondContact O-N 3.22Å
84	L	88.6	Confident	79.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.2	-41.5	176.7	-175.8	63.4	0	0	0	112.2	L67 A80 H81 S86 L87 S88 L126 L148 D151 C152 V155	L67-L84 HydrophobicContact CD1-CB 4.29Å; L67-L84 HydrophobicContact CD2-CD1 4.3Å; A80-L84 WeakPolarHBondContact O-CB 3.38Å; A80-L84 PolarHBondContact O-N 3.29Å; H81-L84 PolarHBondContact O-N 3.26Å; L84-S86 VanDerWaalsContact C-N 3.27Å; L84-S86 PolarHBondContact O-N 3.41Å; L84-L87 PolarHBondContact O-N 3.04Å; L84-S88 WeakPolarHBondContact O-CB 3.09Å; L84-S88 PolarHBondContact O-N 3.01Å; L84-L126 HydrophobicContact CD1-CD2 3.66Å; L84-L148 HydrophobicContact CD2-CD1 3.64Å; L84-D151 HydrophobicContact CD2-CB 3.66Å; L84-D151 HydrophobicContact CG-CB 4.04Å; L84-C152 HydrophobicContact CD2-CB 4.38Å; L84-C152 WeakPolarHBondContact CD2-SG 3.38Å; L84-V155 HydrophobicContact CD1-CG2 4.25Å
85	K	86.9	Confident	79.5	Confident	140 Å²	140	50.5 Å²	50.5	61%	0.609	29%	0.287	S	S	*	.	H	α-helix	trans	-61.5	-37.8	176.7	-174.2	171.5	-178.7	172.3	0	112.1	H81 Y83 S89	H81-K85 WeakPolarHBondContact O-CB 3.27Å; H81-K85 PolarHBondContact O-N 3.38Å; Y83-K85 PolarHBondContact O-N 2.92Å; K85-S89 PolarHBondContact O-N 3.37Å
86	S	85.9	Confident	79.2	Confident	58 Å²	58	53.4 Å²	53.4	41%	0.406	30%	0.296	S	S	.	.	H	α-helix	trans	-65.3	-44.2	175.2	-55.7	0	0	0	0	111.4	G82 Y83 L84 Q90	G82-S86 PolarHBondContact O-N 2.82Å; G82-S86 PolarHBondContact O-OG 3.37Å; Y83-S86 WeakPolarHBondContact O-CB 3.35Å; Y83-S86 PolarHBondContact O-N 3.46Å; L84-S86 VanDerWaalsContact C-N 3.27Å; L84-S86 PolarHBondContact O-N 3.41Å; S86-Q90 WeakPolarHBondContact O-CG 3.04Å; S86-Q90 PolarHBondContact O-N 2.71Å
87	L	86.9	Confident	78.8	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.2	-46.5	174.7	-75.3	162.7	0	0	0	111.8	I60 L63 L64 L67 Y83 L84 S89 Q90 L91 F117	I60-L87 HydrophobicContact CG1-CD2 4.45Å; I60-L87 HydrophobicContact CG2-CD2 4.13Å; L63-L87 HydrophobicContact CB-CD1 4.11Å; L63-L87 HydrophobicContact CB-CD2 3.74Å; L63-L87 HydrophobicContact CB-CG 3.89Å; L63-L87 HydrophobicContact CD1-CD2 3.92Å; L63-L87 HydrophobicContact CD1-CG 4.14Å; L64-L87 HydrophobicContact CD2-CD1 4.28Å; L67-L87 HydrophobicContact CD2-CD1 4.04Å; Y83-L87 PolarHBondContact O-N 3.22Å; L84-L87 PolarHBondContact O-N 3.04Å; L87-S89 VanDerWaalsContact C-N 3.35Å; L87-S89 PolarHBondContact O-N 2.81Å; L87-Q90 PolarHBondContact O-N 3.33Å; L87-Q90 VanDerWaalsContact O-N 3.08Å; L87-L91 VanDerWaalsContact O-CG 3.27Å; L87-L91 WeakPolarHBondContact O-CG 3.25Å; L87-L91 PolarHBondContact O-N 3.21Å; L87-F117 HydrophobicContact CD1-CE2 4.24Å; L87-F117 HydrophobicContact CD2-CD2 4.36Å
88	S	85.1	Confident	78.2	Confident	13 Å²	13	55.2 Å²	55.2	9%	0.091	31%	0.305	C	S	.	.	H	α-helix	trans	-58.3	-45.4	178.7	175.2	0	0	0	0	111.6	L84 Q90 L91 S92	L84-S88 WeakPolarHBondContact O-CB 3.09Å; L84-S88 PolarHBondContact O-N 3.01Å; S88-Q90 VanDerWaalsContact C-N 3.25Å; S88-Q90 PolarHBondContact O-N 3.19Å; S88-L91 PolarHBondContact O-N 3.21Å; S88-S92 WeakPolarHBondContact O-CB 3.48Å; S88-S92 PolarHBondContact O-N 2.99Å; S88-S92 PolarHBondContact O-OG 2.96Å
89	S	83.4	Confident	77.2	Confident	80 Å²	80	56.5 Å²	56.5	56%	0.559	31%	0.309	S	S	*	.	H	α-helix	trans	-59.3	-35.1	176.2	-174.9	0	0	0	0	113.1	K85 L87 V93	K85-S89 PolarHBondContact O-N 3.37Å; L87-S89 VanDerWaalsContact C-N 3.35Å; L87-S89 PolarHBondContact O-N 2.81Å; S89-V93 WeakPolarHBondContact O-CG2 3.45Å
90	Q	81.3	Confident	76.1	Confident	69 Å²	69	54.9 Å²	54.9	32%	0.322	31%	0.308	S	S	.	.	H	α-helix	trans	-75.1	-37.3	178.5	-70	179.7	-6.4	0	0	112.3	S86 L87 S88	S86-Q90 WeakPolarHBondContact O-CG 3.04Å; S86-Q90 PolarHBondContact O-N 2.71Å; L87-Q90 PolarHBondContact O-N 3.33Å; L87-Q90 VanDerWaalsContact O-N 3.08Å; S88-Q90 VanDerWaalsContact C-N 3.25Å; S88-Q90 PolarHBondContact O-N 3.19Å
91	L	82	Confident	74.5	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-81.5	-32.2	-176.5	-61.8	173.4	0	0	0	112.7	L87 S88 E94 A95 N113 T114 F117 V155	L87-L91 VanDerWaalsContact O-CG 3.27Å; L87-L91 WeakPolarHBondContact O-CG 3.25Å; L87-L91 PolarHBondContact O-N 3.21Å; S88-L91 PolarHBondContact O-N 3.21Å; L91-E94 PolarHBondContact O-N 3.08Å; L91-A95 PolarHBondContact O-N 3.09Å; L91-A95 VanDerWaalsContact O-N 3.15Å; L91-N113 VanDerWaalsContact CD2-C 3.49Å; L91-N113 HydrophobicContact CD2-CB 3.69Å; L91-T114 HydrophobicContact CB-CG2 4.33Å; L91-T114 HydrophobicContact CD2-CG2 3.89Å; L91-F117 HydrophobicContact CD1-CB 4.28Å; L91-F117 HydrophobicContact CD1-CD1 4.44Å; L91-F117 HydrophobicContact CD1-CD2 3.91Å; L91-F117 HydrophobicContact CD1-CE2 4.33Å; L91-F117 HydrophobicContact CD1-CG 3.97Å; L91-F117 HydrophobicContact CD2-CB 4.27Å; L91-V155 HydrophobicContact CD1-CG1 3.58Å; L91-V155 HydrophobicContact CD1-CG2 4.44Å
92	S	76.4	Confident	72.5	Confident	31 Å²	31	65.2 Å²	65.2	22%	0.217	36%	0.361	C	S	.	.	H	α-helix	trans	-70.7	-33.2	-179.1	-65.2	0	0	0	0	113.5	S88 E94 A95 M96 N158	S88-S92 WeakPolarHBondContact O-CB 3.48Å; S88-S92 PolarHBondContact O-N 2.99Å; S88-S92 PolarHBondContact O-OG 2.96Å; S92-E94 VanDerWaalsContact C-N 3.3Å; S92-E94 PolarHBondContact O-N 3.01Å; S92-A95 PolarHBondContact O-N 3.45Å; S92-M96 WeakPolarHBondContact O-CE 3.41Å; S92-M96 WeakPolarHBondContact O-CG 3.39Å; S92-M96 PolarHBondContact O-N 3.01Å; S92-N158 WeakPolarHBondContact CA-ND2 3.33Å; S92-N158 PolarHBondContact OG-ND2 3.32Å; S92-N158 VanDerWaalsContact OG-ND2 3.07Å
93	V	71	Confident	70.7	Confident	95 Å²	95	74.3 Å²	74.3	58%	0.576	38%	0.383	S	S	*	.	H	α-helix	trans	-63.7	-39.9	177.2	174.2	0	0	0	0	111	S89 S97	S89-V93 WeakPolarHBondContact O-CG2 3.45Å; V93-S97 PolarHBondContact O-N 2.86Å
94	E	68.8	Low	68.2	Low	33 Å²	33	76 Å²	76	15%	0.154	40%	0.402	C	S	.	.	H	α-helix	trans	-67.8	-46.8	176.1	180	175.8	-121	0	0	111.7	L91 S92 M96 S97 F98 P112 N113 T114	L91-E94 PolarHBondContact O-N 3.08Å; S92-E94 VanDerWaalsContact C-N 3.3Å; S92-E94 PolarHBondContact O-N 3.01Å; E94-M96 VanDerWaalsContact C-N 3.3Å; E94-M96 PolarHBondContact O-N 3.23Å; E94-S97 PolarHBondContact O-N 3.19Å; E94-S97 PolarHBondContact O-OG 3.39Å; E94-F98 PolarHBondContact O-N 2.64Å; E94-F98 VanDerWaalsContact O-N 3.12Å; E94-P112 VanDerWaalsContact CD-CB 3.43Å; E94-P112 HydrophobicContact CG-CB 4.5Å; E94-P112 WeakPolarHBondContact OE1-CA 3.47Å; E94-P112 WeakPolarHBondContact OE1-CB 3.48Å; E94-N113 PolarHBondContact OE1-N 3.21Å; E94-N113 WeakPolarHBondContact OE2-CA 3.36Å; E94-N113 VanDerWaalsContact OE2-CB 3.3Å; E94-N113 WeakPolarHBondContact OE2-CB 3.06Å; E94-N113 PolarHBondContact OE2-N 3.22Å; E94-T114 PolarHBondContact OE2-N 2.89Å; E94-T114 PolarHBondContact OE2-OG1 3.36Å
95	A	64.2	Low	65.6	Low	5 Å²	5	85.3 Å²	85.3	4%	0.041	44%	0.443	C	S	.	.	H	α-helix	trans	-59.5	-39.6	177.5	0	0	0	0	0	112.6	L91 S92 F98 V99 N158	L91-A95 PolarHBondContact O-N 3.09Å; L91-A95 VanDerWaalsContact O-N 3.15Å; S92-A95 PolarHBondContact O-N 3.45Å; A95-F98 PolarHBondContact O-N 2.97Å; A95-V99 WeakPolarHBondContact O-CG2 3.1Å; A95-V99 PolarHBondContact O-N 3.12Å; A95-N158 HydrophobicContact CB-CB 3.96Å
96	M	62.5	Low	63.5	Low	107 Å²	107	83.6 Å²	83.6	53%	0.527	45%	0.454	S	S	.	.	H	α-helix	trans	-62.3	-44.8	175.3	-77.2	-173.8	-74.9	0	0	112.1	S92 E94 F98 V99 T100	S92-M96 WeakPolarHBondContact O-CE 3.41Å; S92-M96 WeakPolarHBondContact O-CG 3.39Å; S92-M96 PolarHBondContact O-N 3.01Å; E94-M96 VanDerWaalsContact C-N 3.3Å; E94-M96 PolarHBondContact O-N 3.23Å; M96-F98 VanDerWaalsContact C-N 3.28Å; M96-F98 PolarHBondContact O-N 3.44Å; M96-V99 PolarHBondContact O-N 3.21Å; M96-T100 WeakPolarHBondContact O-CG2 3.4Å; M96-T100 PolarHBondContact O-N 3.24Å; M96-T100 PolarHBondContact O-OG1 3.37Å; M96-T100 VanDerWaalsContact O-OG1 3.07Å
97	S	62.6	Low	61.5	Low	52 Å²	52	87.3 Å²	87.3	36%	0.364	47%	0.465	S	S	.	.	H	α-helix	trans	-61.3	-36.2	177.8	68.6	0	0	0	0	113.1	V93 E94 V99 T100 E101	V93-S97 PolarHBondContact O-N 2.86Å; E94-S97 PolarHBondContact O-N 3.19Å; E94-S97 PolarHBondContact O-OG 3.39Å; S97-V99 VanDerWaalsContact C-N 3.33Å; S97-V99 PolarHBondContact O-N 3.14Å; S97-T100 PolarHBondContact O-OG1 3.05Å; S97-E101 PolarHBondContact O-N 3.36Å
98	F	61.8	Low	59.2	Low	117 Å²	117	96.7 Å²	96.7	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-69.9	-28.1	-179.3	-164.3	-93.7	0	0	0	113.4	E94 A95 M96 I161	E94-F98 PolarHBondContact O-N 2.64Å; E94-F98 VanDerWaalsContact O-N 3.12Å; A95-F98 PolarHBondContact O-N 2.97Å; M96-F98 VanDerWaalsContact C-N 3.28Å; M96-F98 PolarHBondContact O-N 3.44Å; F98-I161 HydrophobicContact CD1-CG2 3.99Å; F98-I161 HydrophobicContact CE1-CG2 4.47Å
99	V	56.7	Low	57.5	Low	106 Å²	106	99.7 Å²	99.7	64%	0.642	53%	0.53	S	S	*	.	H	α-helix	trans	-87.2	-26.3	-179.5	176.5	0	0	0	0	112.1	A95 M96 S97 I161	A95-V99 WeakPolarHBondContact O-CG2 3.1Å; A95-V99 PolarHBondContact O-N 3.12Å; M96-V99 PolarHBondContact O-N 3.21Å; S97-V99 VanDerWaalsContact C-N 3.33Å; S97-V99 PolarHBondContact O-N 3.14Å; V99-I161 HydrophobicContact CG2-CG2 4.35Å
100	T	53.1	Low	56.2	Low	91 Å²	91	101.6 Å²	101.6	56%	0.558	54%	0.538	S	S	*	.	H	α-helix	trans	-95.1	-18.9	-173.7	54.3	0	0	0	0	115.6	M96 S97	M96-T100 WeakPolarHBondContact O-CG2 3.4Å; M96-T100 PolarHBondContact O-N 3.24Å; M96-T100 PolarHBondContact O-OG1 3.37Å; M96-T100 VanDerWaalsContact O-OG1 3.07Å; S97-T100 PolarHBondContact O-OG1 3.05Å
101	E	50	Low	55.3	Low	103 Å²	103	104.1 Å²	104.1	48%	0.481	55%	0.549	S	S	.	.	S	Bend	trans	-89.2	120.8	-179.6	-70.4	-171	173.5	0	0	111.7	S97 R103 Q107	S97-E101 PolarHBondContact O-N 3.36Å; E101-R103 PolarHBondContact O-N 2.63Å; E101-Q107 PolarHBondContact OE1-NE2 3.14Å; E101-Q107 PolarHBondContact OE2-NE2 3.44Å
102	D	41.4	Very low	54.9	Low	150 Å²	150	105.6 Å²	105.6	80%	0.802	56%	0.558	S	S	*	*			trans	-52	126.9	166.5	-105.1	-26	0	0	0	108.7	T104	D102-T104 PolarHBondContact O-N 3.49Å; D102-T104 PolarHBondContact O-OG1 2.72Å
103	R	46.6	Very low	55.4	Low	231 Å²	231	105.4 Å²	105.4	87%	0.872	56%	0.555	S	S	*	*	S	Bend	trans	-64.2	56.2	-176.7	-70.9	-174.8	173.6	-177.3	-0.7	113.7	E101	E101-R103 PolarHBondContact O-N 2.63Å
104	T	37.1	Very low	56.1	Low	115 Å²	115	100.9 Å²	100.9	71%	0.706	53%	0.528	S	S	*	.	S	Bend	trans	-117.9	95.8	175.2	50.2	0	0	0	0	108.1	D102	D102-T104 PolarHBondContact O-N 3.49Å; D102-T104 PolarHBondContact O-OG1 2.72Å
105	K	34.8	Very low	57	Low	196 Å²	196	103.3 Å²	103.3	85%	0.852	54%	0.536	S	S	*	.	S	Bend	trans	92.4	110.2	-178.6	-55.5	172.5	-177.8	177.3	0	113.3	Q107	K105-Q107 PolarHBondContact O-N 3.39Å
106	A	40.8	Very low	58.1	Low	104 Å²	104	103.3 Å²	103.3	86%	0.86	54%	0.535	S	S	*	.			trans	-50.1	105.3	165.2	0	0	0	0	0	109.4	E108	A106-E108 PolarHBondContact O-N 3.4Å
107	Q	44.1	Very low	59.5	Low	135 Å²	135	98.2 Å²	98.2	63%	0.631	51%	0.51	S	S	*	.			trans	-67.5	126.6	166.7	-86.6	-176.7	6.2	0	0	108.5	E101 K105 S109	E101-Q107 PolarHBondContact OE1-NE2 3.14Å; E101-Q107 PolarHBondContact OE2-NE2 3.44Å; K105-Q107 PolarHBondContact O-N 3.39Å; Q107-S109 VanDerWaalsContact C-N 3.26Å; Q107-S109 PolarHBondContact O-N 3.13Å
108	E	40.2	Very low	60.9	Low	197 Å²	197	98.3 Å²	98.3	92%	0.921	51%	0.507	S	S	*	.			trans	-68.5	76.9	173	-67.8	177.9	151	0	0	110.9	A106	A106-E108 PolarHBondContact O-N 3.4Å
109	S	48.9	Very low	62.2	Low	77 Å²	77	97.3 Å²	97.3	54%	0.538	51%	0.506	S	S	.	.			trans	-105.3	108.9	147.4	66.5	0	0	0	0	106.7	Q107 F111	Q107-S109 VanDerWaalsContact C-N 3.26Å; Q107-S109 PolarHBondContact O-N 3.13Å; S109-F111 PolarHBondContact O-N 3.35Å; S109-F111 VanDerWaalsContact O-N 3.14Å
110	T	56.3	Low	63.7	Low	119 Å²	119	92.9 Å²	92.9	73%	0.73	48%	0.478	S	S	*	.	S	Bend	trans	-64.9	-21.3	-170.4	-35.9	0	0	0	0	112
111	F	62.2	Low	65.4	Low	122 Å²	122	89 Å²	89	54%	0.535	46%	0.456	S	S	.	.	S	Bend	trans	-155	128.4	171.1	-62.8	-75.8	0	0	0	110.5	S109 Y115	S109-F111 PolarHBondContact O-N 3.35Å; S109-F111 VanDerWaalsContact O-N 3.14Å; F111-Y115 HydrophobicContact CB-CD1 3.65Å; F111-Y115 HydrophobicContact CB-CE1 4.13Å; F111-Y115 HydrophobicContact CB-CG 4.33Å; F111-Y115 AromaticContact CD1-CD1 3.53Å; F111-Y115 HydrophobicContact CD1-CD1 3.53Å; F111-Y115 HydrophobicContact CD1-CD2 4.4Å; F111-Y115 AromaticContact CD1-CE1 3.27Å; F111-Y115 HydrophobicContact CD1-CE1 3.27Å; F111-Y115 HydrophobicContact CD1-CE2 4.21Å; F111-Y115 HydrophobicContact CD1-CG 4.08Å; F111-Y115 AromaticContact CD1-CZ 3.65Å; F111-Y115 AromaticContact CE1-CE1 3.89Å; F111-Y115 HydrophobicContact CE1-CE1 3.89Å; F111-Y115 AromaticContact CE1-CZ 3.89Å; F111-Y115 AromaticContact CG-CD1 3.85Å; F111-Y115 HydrophobicContact CG-CD1 3.85Å; F111-Y115 AromaticContact CG-CE1 3.81Å; F111-Y115 HydrophobicContact CG-CE1 3.81Å
112	P	74.3	Confident	67.5	Low	31 Å²	31	84.1 Å²	84.1	20%	0.201	43%	0.433	C	S	.	.			trans	-69.5	158.9	177.6	24.4	-30.1	0	0	0	113	E94 T114 Y115 T116	E94-P112 VanDerWaalsContact CD-CB 3.43Å; E94-P112 HydrophobicContact CG-CB 4.5Å; E94-P112 WeakPolarHBondContact OE1-CA 3.47Å; E94-P112 WeakPolarHBondContact OE1-CB 3.48Å; P112-T114 PolarHBondContact O-N 3.04Å; P112-Y115 WeakPolarHBondContact O-CA 3.35Å; P112-Y115 WeakPolarHBondContact O-CB 3.14Å; P112-Y115 PolarHBondContact O-N 2.94Å; P112-T116 PolarHBondContact O-N 3.01Å
113	N	86.1	Confident	69.9	Low	28 Å²	28	77.1 Å²	77.1	15%	0.15	40%	0.396	C	S	.	.	H	α-helix	trans	-59	-36.9	174	-76.3	-23	0	0	0	111.4	H58 I60 L91 E94 Y115 T116 F117	H58-N113 PolarHBondContact ND1-OD1 2.84Å; I60-N113 HydrophobicContact CD1-CB 3.6Å; I60-N113 WeakPolarHBondContact CD1-O 3.4Å; L91-N113 VanDerWaalsContact CD2-C 3.49Å; L91-N113 HydrophobicContact CD2-CB 3.69Å; E94-N113 PolarHBondContact OE1-N 3.21Å; E94-N113 WeakPolarHBondContact OE2-CA 3.36Å; E94-N113 VanDerWaalsContact OE2-CB 3.3Å; E94-N113 WeakPolarHBondContact OE2-CB 3.06Å; E94-N113 PolarHBondContact OE2-N 3.22Å; N113-Y115 VanDerWaalsContact C-N 3.32Å; N113-Y115 PolarHBondContact O-N 3.5Å; N113-T116 PolarHBondContact O-N 3.26Å; N113-F117 WeakPolarHBondContact O-CB 3.28Å; N113-F117 PolarHBondContact O-N 2.77Å
114	T	86	Confident	72	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-59.6	-38.3	171.4	49.3	0	0	0	0	112.9	L91 E94 P112 F117 D118 C162 T163	L91-T114 HydrophobicContact CB-CG2 4.33Å; L91-T114 HydrophobicContact CD2-CG2 3.89Å; E94-T114 PolarHBondContact OE2-N 2.89Å; E94-T114 PolarHBondContact OE2-OG1 3.36Å; P112-T114 PolarHBondContact O-N 3.04Å; T114-F117 WeakPolarHBondContact O-CB 3.26Å; T114-F117 PolarHBondContact O-N 3.34Å; T114-D118 PolarHBondContact O-N 3.2Å; T114-C162 HydrophobicContact CG2-CB 3.94Å; T114-C162 WeakPolarHBondContact OG1-CB 3.33Å; T114-T163 VanDerWaalsContact C-OG1 3.24Å; T114-T163 WeakPolarHBondContact CB-OG1 3.13Å; T114-T163 PolarHBondContact OG1-OG1 2.95Å
115	Y	86.7	Confident	74.6	Confident	83 Å²	83	63.9 Å²	63.9	33%	0.325	34%	0.338	S	S	.	.	H	α-helix	trans	-66	-43.2	173.4	171.6	-88.8	0	0	0	111.3	F111 P112 N113 F117 D118 L119 T163	F111-Y115 HydrophobicContact CB-CD1 3.65Å; F111-Y115 HydrophobicContact CB-CE1 4.13Å; F111-Y115 HydrophobicContact CB-CG 4.33Å; F111-Y115 AromaticContact CD1-CD1 3.53Å; F111-Y115 HydrophobicContact CD1-CD1 3.53Å; F111-Y115 HydrophobicContact CD1-CD2 4.4Å; F111-Y115 AromaticContact CD1-CE1 3.27Å; F111-Y115 HydrophobicContact CD1-CE1 3.27Å; F111-Y115 HydrophobicContact CD1-CE2 4.21Å; F111-Y115 HydrophobicContact CD1-CG 4.08Å; F111-Y115 AromaticContact CD1-CZ 3.65Å; F111-Y115 AromaticContact CE1-CE1 3.89Å; F111-Y115 HydrophobicContact CE1-CE1 3.89Å; F111-Y115 AromaticContact CE1-CZ 3.89Å; F111-Y115 AromaticContact CG-CD1 3.85Å; F111-Y115 HydrophobicContact CG-CD1 3.85Å; F111-Y115 AromaticContact CG-CE1 3.81Å; F111-Y115 HydrophobicContact CG-CE1 3.81Å; P112-Y115 WeakPolarHBondContact O-CA 3.35Å; P112-Y115 WeakPolarHBondContact O-CB 3.14Å; P112-Y115 PolarHBondContact O-N 2.94Å; N113-Y115 VanDerWaalsContact C-N 3.32Å; N113-Y115 PolarHBondContact O-N 3.5Å; Y115-F117 VanDerWaalsContact C-N 3.3Å; Y115-F117 PolarHBondContact O-N 3.17Å; Y115-D118 PolarHBondContact O-N 3.38Å; Y115-L119 HydrophobicContact CE1-CB 4.47Å; Y115-L119 HydrophobicContact CE1-CD2 4.05Å; Y115-L119 VanDerWaalsContact O-CB 3.22Å; Y115-L119 WeakPolarHBondContact O-CB 3.25Å; Y115-L119 PolarHBondContact O-N 2.98Å; Y115-T163 HydrophobicContact CD2-CG2 4.2Å; Y115-T163 PolarHBondContact N-OG1 3.37Å
116	T	88.6	Confident	77.3	Confident	5 Å²	5	54.5 Å²	54.5	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-42.1	175.2	-59.8	0	0	0	0	110.6	W57 I60 P112 N113 D118 L119 F120	W57-T116 HydrophobicContact CB-CG2 3.87Å; W57-T116 HydrophobicContact CG-CG2 3.87Å; I60-T116 HydrophobicContact CB-CG2 4.22Å; I60-T116 HydrophobicContact CD1-CG2 4.33Å; I60-T116 HydrophobicContact CG2-CG2 4.34Å; P112-T116 PolarHBondContact O-N 3.01Å; N113-T116 PolarHBondContact O-N 3.26Å; T116-D118 PolarHBondContact O-N 3.13Å; T116-L119 PolarHBondContact O-N 3.4Å; T116-F120 HydrophobicContact CG2-CD2 4.02Å; T116-F120 HydrophobicContact CG2-CE2 4.05Å; T116-F120 VanDerWaalsContact O-CD2 3.29Å; T116-F120 WeakPolarHBondContact O-CD2 3.08Å; T116-F120 PolarHBondContact O-N 2.65Å
117	F	91.5	Very high	79.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59	-47.1	176.4	179.1	-94	0	0	0	112.2	I60 L64 L87 L91 N113 T114 Y115 G122 V123 L126 V155	I60-F117 HydrophobicContact CG2-CB 4.07Å; I60-F117 HydrophobicContact CG2-CD2 4.18Å; L64-F117 HydrophobicContact CD1-CD2 3.93Å; L64-F117 HydrophobicContact CD1-CE2 4.35Å; L64-F117 HydrophobicContact CD2-CD2 3.79Å; L64-F117 HydrophobicContact CD2-CE2 3.34Å; L64-F117 HydrophobicContact CD2-CZ 4.05Å; L64-F117 HydrophobicContact CG-CD2 4.02Å; L64-F117 HydrophobicContact CG-CE2 4.08Å; L87-F117 HydrophobicContact CD1-CE2 4.24Å; L87-F117 HydrophobicContact CD2-CD2 4.36Å; L91-F117 HydrophobicContact CD1-CB 4.28Å; L91-F117 HydrophobicContact CD1-CD1 4.44Å; L91-F117 HydrophobicContact CD1-CD2 3.91Å; L91-F117 HydrophobicContact CD1-CE2 4.33Å; L91-F117 HydrophobicContact CD1-CG 3.97Å; L91-F117 HydrophobicContact CD2-CB 4.27Å; N113-F117 WeakPolarHBondContact O-CB 3.28Å; N113-F117 PolarHBondContact O-N 2.77Å; T114-F117 WeakPolarHBondContact O-CB 3.26Å; T114-F117 PolarHBondContact O-N 3.34Å; Y115-F117 VanDerWaalsContact C-N 3.3Å; Y115-F117 PolarHBondContact O-N 3.17Å; F117-G122 WeakPolarHBondContact O-CA 3.43Å; F117-G122 PolarHBondContact O-N 3.34Å; F117-V123 HydrophobicContact CD1-CG2 4.38Å; F117-V123 HydrophobicContact CE1-CG2 4.31Å; F117-L126 HydrophobicContact CE1-CD1 3.91Å; F117-L126 HydrophobicContact CE1-CG 4.38Å; F117-L126 HydrophobicContact CZ-CD1 3.63Å; F117-L126 HydrophobicContact CZ-CD2 4.5Å; F117-L126 HydrophobicContact CZ-CG 3.88Å; F117-V155 HydrophobicContact CD1-CG1 4.43Å; F117-V155 HydrophobicContact CE1-CG1 3.82Å; F117-V155 HydrophobicContact CE2-CG1 4.36Å; F117-V155 HydrophobicContact CZ-CG1 3.8Å
118	D	91.4	Very high	81.9	Confident	54 Å²	54	46.7 Å²	46.7	29%	0.289	24%	0.243	S	C	.	.	H	α-helix	trans	-64.9	-46.7	176.7	-175.3	50.8	0	0	0	112.3	T114 Y115 T116 F120 G121 V123 T163 V166	T114-D118 PolarHBondContact O-N 3.2Å; Y115-D118 PolarHBondContact O-N 3.38Å; T116-D118 PolarHBondContact O-N 3.13Å; D118-F120 PolarHBondContact O-N 3.33Å; D118-F120 VanDerWaalsContact O-N 3.09Å; D118-G121 WeakPolarHBondContact O-CA 3.4Å; D118-G121 PolarHBondContact O-N 3.29Å; D118-V123 HydrophobicContact CB-CG2 4.12Å; D118-V123 VanDerWaalsContact OD1-CG2 3.25Å; D118-V123 WeakPolarHBondContact OD1-CG2 3.41Å; D118-T163 HydrophobicContact CB-CG2 4.37Å; D118-V166 HydrophobicContact CB-CG2 4.23Å
119	L	88.4	Confident	84.2	Confident	97 Å²	97	37.6 Å²	37.6	51%	0.508	20%	0.201	S	C	.	.	H	α-helix	trans	-53	-36.3	-179.7	179.4	65.6	0	0	0	113	Y115 T116 G121	Y115-L119 HydrophobicContact CE1-CB 4.47Å; Y115-L119 HydrophobicContact CE1-CD2 4.05Å; Y115-L119 VanDerWaalsContact O-CB 3.22Å; Y115-L119 WeakPolarHBondContact O-CB 3.25Å; Y115-L119 PolarHBondContact O-N 2.98Å; T116-L119 PolarHBondContact O-N 3.4Å; L119-G121 VanDerWaalsContact C-N 3.33Å
120	F	89.9	Confident	86.2	Confident	13 Å²	13	34 Å²	34	6%	0.057	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	8.2	179.3	-74.9	-89.6	0	0	0	114.1	G40 L43 L48 W57 P61 L64 T116 D118	G40-F120 PolarHBondContact N-O 2.97Å; L43-F120 HydrophobicContact CD1-CD1 4.49Å; L43-F120 HydrophobicContact CD1-CE1 4.01Å; L48-F120 HydrophobicContact CD2-CD1 4.37Å; L48-F120 HydrophobicContact CD2-CE1 3.68Å; L48-F120 HydrophobicContact CD2-CZ 4.42Å; W57-F120 AromaticContact CD2-CE2 3.99Å; W57-F120 HydrophobicContact CD2-CE2 3.99Å; W57-F120 AromaticContact CD2-CZ 3.96Å; W57-F120 HydrophobicContact CD2-CZ 3.96Å; W57-F120 AromaticContact CE2-CE2 3.83Å; W57-F120 AromaticContact CE2-CZ 3.77Å; W57-F120 HydrophobicContact CE3-CE2 4.38Å; W57-F120 AromaticContact CE3-CZ 3.95Å; W57-F120 HydrophobicContact CE3-CZ 3.95Å; W57-F120 HydrophobicContact CG-CE2 4.4Å; W57-F120 HydrophobicContact CH2-CE1 4.48Å; W57-F120 AromaticContact CH2-CZ 3.64Å; W57-F120 HydrophobicContact CH2-CZ 3.64Å; W57-F120 HydrophobicContact CZ2-CE2 4.13Å; W57-F120 AromaticContact CZ2-CZ 3.64Å; W57-F120 HydrophobicContact CZ2-CZ 3.64Å; W57-F120 HydrophobicContact CZ3-CE1 4.48Å; W57-F120 AromaticContact CZ3-CZ 3.78Å; W57-F120 HydrophobicContact CZ3-CZ 3.78Å; P61-F120 HydrophobicContact CB-CD1 4.02Å; P61-F120 HydrophobicContact CB-CD2 4.45Å; P61-F120 HydrophobicContact CB-CE1 4.12Å; P61-F120 HydrophobicContact CB-CG 4.2Å; P61-F120 HydrophobicContact CB-CZ 4.38Å; P61-F120 HydrophobicContact CG-CD1 4.21Å; P61-F120 HydrophobicContact CG-CD2 3.83Å; P61-F120 HydrophobicContact CG-CE1 4.12Å; P61-F120 HydrophobicContact CG-CE2 3.72Å; P61-F120 HydrophobicContact CG-CG 4.09Å; P61-F120 HydrophobicContact CG-CZ 3.87Å; L64-F120 HydrophobicContact CD1-CB 3.87Å; T116-F120 HydrophobicContact CG2-CD2 4.02Å; T116-F120 HydrophobicContact CG2-CE2 4.05Å; T116-F120 VanDerWaalsContact O-CD2 3.29Å; T116-F120 WeakPolarHBondContact O-CD2 3.08Å; T116-F120 PolarHBondContact O-N 2.65Å; D118-F120 PolarHBondContact O-N 3.33Å; D118-F120 VanDerWaalsContact O-N 3.09Å
121	G	88.9	Confident	87.7	Confident	9 Å²	9	29.1 Å²	29.1	9%	0.093	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	24.5	176.6	0	0	0	0	0	114	D118 L119 L125	D118-G121 WeakPolarHBondContact O-CA 3.4Å; D118-G121 PolarHBondContact O-N 3.29Å; L119-G121 VanDerWaalsContact C-N 3.33Å; G121-L125 WeakPolarHBondContact O-CB 3.49Å; G121-L125 PolarHBondContact O-N 3.42Å; G121-L125 VanDerWaalsContact O-N 3.15Å
122	G	92.3	Very high	88.6	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.8	-42.3	-179.7	0	0	0	0	0	113.1	F117 L125 L126	F117-G122 WeakPolarHBondContact O-CA 3.43Å; F117-G122 PolarHBondContact O-N 3.34Å; G122-L125 PolarHBondContact O-N 3.03Å; G122-L126 WeakPolarHBondContact O-CG 3.45Å; G122-L126 PolarHBondContact O-N 2.87Å
123	V	93.2	Very high	88.6	Confident	3 Å²	3	24.4 Å²	24.4	2%	0.018	12%	0.123	C	C	.	.	H	α-helix	trans	-61	-50.9	179.1	173.2	0	0	0	0	111	F117 D118 L125 L126 V127 L156 C159 V166 L170	F117-V123 HydrophobicContact CD1-CG2 4.38Å; F117-V123 HydrophobicContact CE1-CG2 4.31Å; D118-V123 HydrophobicContact CB-CG2 4.12Å; D118-V123 VanDerWaalsContact OD1-CG2 3.25Å; D118-V123 WeakPolarHBondContact OD1-CG2 3.41Å; V123-L125 VanDerWaalsContact C-N 3.29Å; V123-L125 PolarHBondContact O-N 2.99Å; V123-L126 PolarHBondContact O-N 2.9Å; V123-L126 VanDerWaalsContact O-N 3.17Å; V123-V127 WeakPolarHBondContact O-CG2 3.49Å; V123-V127 PolarHBondContact O-N 2.92Å; V123-L156 HydrophobicContact CB-CD2 4.49Å; V123-L156 HydrophobicContact CG1-CD2 3.92Å; V123-C159 HydrophobicContact CG2-CB 4.16Å; V123-V166 HydrophobicContact CG1-CG1 4.23Å; V123-V166 HydrophobicContact CG2-CG1 4.06Å; V123-V166 HydrophobicContact CG2-CG2 4.43Å; V123-L170 HydrophobicContact CG1-CD2 3.77Å; V123-L170 HydrophobicContact CG1-CG 4.33Å
124	D	90.8	Very high	87.9	Confident	66 Å²	66	26.8 Å²	26.8	35%	0.353	14%	0.139	S	C	.	.	H	α-helix	trans	-58.6	-41.1	177.1	-74.8	-35.7	0	0	0	112.3	V127 E128	D124-V127 PolarHBondContact O-N 2.88Å; D124-E128 WeakPolarHBondContact O-CG 3.41Å; D124-E128 PolarHBondContact O-N 3.35Å
125	L	90.5	Very high	86.8	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-63.5	-41.1	177.6	-178.9	62.3	0	0	0	112	L64 L67 H68 G121 G122 V123 E128 I129	L64-L125 HydrophobicContact CD2-CD2 4.33Å; L67-L125 HydrophobicContact CB-CD2 4.39Å; L67-L125 HydrophobicContact CD2-CD2 4.08Å; L67-L125 HydrophobicContact CG-CD2 4.08Å; H68-L125 HydrophobicContact CB-CD1 4.31Å; H68-L125 HydrophobicContact CB-CD2 3.87Å; H68-L125 WeakPolarHBondContact ND1-CD1 3.32Å; G121-L125 WeakPolarHBondContact O-CB 3.49Å; G121-L125 PolarHBondContact O-N 3.42Å; G121-L125 VanDerWaalsContact O-N 3.15Å; G122-L125 PolarHBondContact O-N 3.03Å; V123-L125 VanDerWaalsContact C-N 3.29Å; V123-L125 PolarHBondContact O-N 2.99Å; L125-E128 PolarHBondContact O-N 3.34Å; L125-I129 HydrophobicContact CD1-CD1 4.34Å; L125-I129 HydrophobicContact CG-CD1 4Å; L125-I129 VanDerWaalsContact O-CG1 3.25Å; L125-I129 WeakPolarHBondContact O-CG1 3.4Å; L125-I129 PolarHBondContact O-N 2.87Å
126	L	92.6	Very high	85.4	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.4	-40.1	176.3	-68.3	-173.9	0	0	0	112.2	L67 L84 F117 G122 V123 E128 I129 L130 V155 L156	L67-L126 HydrophobicContact CD2-CD2 4.26Å; L84-L126 HydrophobicContact CD1-CD2 3.66Å; F117-L126 HydrophobicContact CE1-CD1 3.91Å; F117-L126 HydrophobicContact CE1-CG 4.38Å; F117-L126 HydrophobicContact CZ-CD1 3.63Å; F117-L126 HydrophobicContact CZ-CD2 4.5Å; F117-L126 HydrophobicContact CZ-CG 3.88Å; G122-L126 WeakPolarHBondContact O-CG 3.45Å; G122-L126 PolarHBondContact O-N 2.87Å; V123-L126 PolarHBondContact O-N 2.9Å; V123-L126 VanDerWaalsContact O-N 3.17Å; L126-E128 VanDerWaalsContact C-N 3.31Å; L126-E128 PolarHBondContact O-N 3.36Å; L126-I129 HydrophobicContact CD2-CD1 4.37Å; L126-I129 PolarHBondContact O-N 3.42Å; L126-L130 WeakPolarHBondContact O-CB 3.47Å; L126-L130 WeakPolarHBondContact O-CG 3.4Å; L126-L130 PolarHBondContact O-N 3.45Å; L126-V155 HydrophobicContact CD1-CB 3.75Å; L126-V155 HydrophobicContact CD1-CG1 3.48Å; L126-V155 VanDerWaalsContact CD1-CG1 3.48Å; L126-L156 HydrophobicContact CB-CD1 4.41Å; L126-L156 HydrophobicContact CB-CD2 4.01Å; L126-L156 HydrophobicContact CB-CG 4.16Å; L126-L156 HydrophobicContact CD1-CD2 4.12Å; L126-L156 HydrophobicContact CD1-CG 4.01Å
127	V	92.5	Very high	83.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.2	-43.7	174.6	174.4	0	0	0	0	110.5	V123 D124 L130 M131 L170 R173 F176	V123-V127 WeakPolarHBondContact O-CG2 3.49Å; V123-V127 PolarHBondContact O-N 2.92Å; D124-V127 PolarHBondContact O-N 2.88Å; V127-L130 PolarHBondContact O-N 3.26Å; V127-M131 HydrophobicContact CG1-CG 4.25Å; V127-M131 HydrophobicContact CG1-SD 3.68Å; V127-M131 WeakPolarHBondContact O-CB 3.29Å; V127-M131 VanDerWaalsContact O-CG 3.32Å; V127-M131 WeakPolarHBondContact O-CG 3.48Å; V127-M131 PolarHBondContact O-N 3.31Å; V127-L170 HydrophobicContact CG2-CD2 3.75Å; V127-R173 VanDerWaalsContact CG1-CZ 3.46Å; V127-F176 HydrophobicContact CB-CD2 4.32Å; V127-F176 HydrophobicContact CB-CE2 4.3Å; V127-F176 HydrophobicContact CG1-CB 4.21Å; V127-F176 HydrophobicContact CG1-CD2 3.44Å; V127-F176 VanDerWaalsContact CG1-CD2 3.44Å; V127-F176 HydrophobicContact CG1-CE2 3.89Å; V127-F176 HydrophobicContact CG1-CG 3.84Å; V127-F176 HydrophobicContact CG2-CD1 4.36Å; V127-F176 HydrophobicContact CG2-CD2 4.16Å; V127-F176 HydrophobicContact CG2-CE1 4.15Å; V127-F176 HydrophobicContact CG2-CE2 3.93Å; V127-F176 HydrophobicContact CG2-CG 4.35Å; V127-F176 HydrophobicContact CG2-CZ 3.92Å
128	E	88.8	Confident	81.9	Confident	75 Å²	75	43.3 Å²	43.3	35%	0.35	23%	0.225	S	C	.	.	H	α-helix	trans	-63.6	-43	175.6	-74.6	-176.1	164.8	0	0	113.5	R39 D124 L125 L126 L130 M131 R132	R39-E128 IonicContact CZ-OE1 3.78Å; R39-E128 IonicContact CZ-OE2 2.72Å; R39-E128 VanDerWaalsContact NH1-CD 3.27Å; R39-E128 IonicContact NH1-OE1 2.69Å; R39-E128 PolarHBondContact NH1-OE1 2.87Å; R39-E128 IonicContact NH1-OE2 3.31Å; R39-E128 PolarHBondContact NH1-OE2 3.41Å; R39-E128 VanDerWaalsContact NH2-CD 3.28Å; R39-E128 IonicContact NH2-OE1 3.45Å; R39-E128 PolarHBondContact NH2-OE1 3.15Å; R39-E128 IonicContact NH2-OE2 3.1Å; D124-E128 WeakPolarHBondContact O-CG 3.41Å; D124-E128 PolarHBondContact O-N 3.35Å; L125-E128 PolarHBondContact O-N 3.34Å; L126-E128 VanDerWaalsContact C-N 3.31Å; L126-E128 PolarHBondContact O-N 3.36Å; E128-L130 VanDerWaalsContact C-N 3.33Å; E128-L130 PolarHBondContact O-N 3.14Å; E128-M131 PolarHBondContact O-N 2.88Å; E128-R132 PolarHBondContact O-N 3.29Å
129	I	88.7	Confident	79.9	Confident	6 Å²	6	51.4 Å²	51.4	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-59	-48	176.5	-73	166.7	0	0	0	109.8	L67 L125 L126 R132 M144	L67-I129 HydrophobicContact CD1-CD1 4.21Å; L67-I129 HydrophobicContact CD2-CD1 4.32Å; L67-I129 HydrophobicContact CG-CD1 4.14Å; L125-I129 HydrophobicContact CD1-CD1 4.34Å; L125-I129 HydrophobicContact CG-CD1 4Å; L125-I129 VanDerWaalsContact O-CG1 3.25Å; L125-I129 WeakPolarHBondContact O-CG1 3.4Å; L125-I129 PolarHBondContact O-N 2.87Å; L126-I129 HydrophobicContact CD2-CD1 4.37Å; L126-I129 PolarHBondContact O-N 3.42Å; I129-R132 VanDerWaalsContact O-CB 3.31Å; I129-R132 WeakPolarHBondContact O-CB 3.43Å; I129-R132 PolarHBondContact O-N 3.36Å; I129-M144 HydrophobicContact CG2-CE 3.82Å; I129-M144 VanDerWaalsContact O-SD 3.34Å
130	L	89.7	Confident	78	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-63.9	-45.4	179.1	-78.9	169.9	0	0	0	112	L126 V127 E128 R132 P133 V149 C152 L153 L156 F176 F179 L183	L126-L130 WeakPolarHBondContact O-CB 3.47Å; L126-L130 WeakPolarHBondContact O-CG 3.4Å; L126-L130 PolarHBondContact O-N 3.45Å; V127-L130 PolarHBondContact O-N 3.26Å; E128-L130 VanDerWaalsContact C-N 3.33Å; E128-L130 PolarHBondContact O-N 3.14Å; L130-R132 VanDerWaalsContact C-N 3.28Å; L130-R132 PolarHBondContact O-N 3.43Å; L130-P133 WeakPolarHBondContact O-CD 3.32Å; L130-V149 HydrophobicContact CD2-CB 4.37Å; L130-V149 HydrophobicContact CD2-CG1 3.89Å; L130-V149 HydrophobicContact CD2-CG2 4.39Å; L130-C152 HydrophobicContact CD1-CB 3.89Å; L130-C152 HydrophobicContact CD2-CB 3.81Å; L130-C152 HydrophobicContact CG-CB 3.79Å; L130-L153 HydrophobicContact CD1-CD2 4.33Å; L130-L156 HydrophobicContact CD1-CD1 3.57Å; L130-F176 HydrophobicContact CD1-CE2 4.39Å; L130-F179 HydrophobicContact CB-CE1 4.04Å; L130-F179 WeakPolarHBondContact O-CE1 3.22Å; L130-F179 WeakPolarHBondContact O-CZ 3.21Å; L130-L183 HydrophobicContact CD2-CD1 4.27Å
131	M	88.1	Confident	76.5	Confident	15 Å²	15	62.6 Å²	62.6	7%	0.074	30%	0.303	C	S	.	.	H	α-helix	trans	-78.6	-5.6	-177.3	-67.3	-175.9	76.9	0	0	113.8	V127 E128 P133 T134 L135 D175 F176 F179	V127-M131 HydrophobicContact CG1-CG 4.25Å; V127-M131 HydrophobicContact CG1-SD 3.68Å; V127-M131 WeakPolarHBondContact O-CB 3.29Å; V127-M131 VanDerWaalsContact O-CG 3.32Å; V127-M131 WeakPolarHBondContact O-CG 3.48Å; V127-M131 PolarHBondContact O-N 3.31Å; E128-M131 PolarHBondContact O-N 2.88Å; M131-P133 VanDerWaalsContact C-N 3.3Å; M131-P133 VanDerWaalsContact O-N 3.1Å; M131-T134 WeakPolarHBondContact O-CA 3.33Å; M131-T134 WeakPolarHBondContact O-CB 3.37Å; M131-T134 PolarHBondContact O-N 3.44Å; M131-T134 PolarHBondContact O-OG1 3.04Å; M131-L135 HydrophobicContact CB-CD1 4.47Å; M131-L135 PolarHBondContact O-N 2.75Å; M131-D175 HydrophobicContact CE-CB 4.19Å; M131-F176 HydrophobicContact CG-CD2 4.14Å; M131-F176 HydrophobicContact SD-CB 4.05Å; M131-F176 HydrophobicContact SD-CD2 3.86Å; M131-F176 HydrophobicContact SD-CG 4.45Å; M131-F179 HydrophobicContact CE-CB 4.06Å; M131-F179 HydrophobicContact CE-CG 4.44Å; M131-F179 HydrophobicContact CG-CB 4.34Å; M131-F179 HydrophobicContact CG-CD1 3.63Å; M131-F179 HydrophobicContact CG-CD2 4.42Å; M131-F179 HydrophobicContact CG-CE1 4.02Å; M131-F179 HydrophobicContact CG-CG 3.86Å
132	R	82	Confident	74.9	Confident	26 Å²	26	64.7 Å²	64.7	10%	0.098	32%	0.315	C	S	.	.	H	α-helix	trans	-47.5	-38.7	179.8	-176.8	172.3	168.5	-175.1	-11.3	115.3	S71 H72 P73 S75 L77 E128 I129 L130 T134 L135 T136	S71-R132 PolarHBondContact O-NH1 2.9Å; S71-R132 VanDerWaalsContact O-NH1 3.13Å; H72-R132 VanDerWaalsContact O-CZ 3.23Å; H72-R132 PolarHBondContact O-NH1 3.21Å; H72-R132 PolarHBondContact O-NH2 3.44Å; P73-R132 VanDerWaalsContact C-CZ 3.43Å; P73-R132 VanDerWaalsContact O-CZ 3.28Å; P73-R132 PolarHBondContact O-NE 3.49Å; P73-R132 PolarHBondContact O-NH2 2.93Å; S75-R132 PolarHBondContact O-NH2 3.31Å; S75-R132 VanDerWaalsContact O-NH2 3.09Å; L77-R132 VanDerWaalsContact CD2-NH1 3.29Å; E128-R132 PolarHBondContact O-N 3.29Å; I129-R132 VanDerWaalsContact O-CB 3.31Å; I129-R132 WeakPolarHBondContact O-CB 3.43Å; I129-R132 PolarHBondContact O-N 3.36Å; L130-R132 VanDerWaalsContact C-N 3.28Å; L130-R132 PolarHBondContact O-N 3.43Å; R132-T134 PolarHBondContact O-N 3.13Å; R132-T134 VanDerWaalsContact O-N 3.16Å; R132-L135 PolarHBondContact O-N 3.45Å; R132-L135 VanDerWaalsContact O-N 3.1Å; R132-T136 HydrophobicContact CG-CG2 4.09Å; R132-T136 WeakPolarHBondContact O-CG2 3.25Å; R132-T136 PolarHBondContact O-N 3.32Å; R132-T136 PolarHBondContact O-OG1 2.97Å
133	P	74.4	Confident	73.6	Confident	29 Å²	29	73.8 Å²	73.8	19%	0.188	35%	0.354	C	S	.	.	H	α-helix	trans	-62.3	-18.4	175.8	-23.7	36.1	0	0	0	114.6	L130 M131 M144	L130-P133 WeakPolarHBondContact O-CD 3.32Å; M131-P133 VanDerWaalsContact C-N 3.3Å; M131-P133 VanDerWaalsContact O-N 3.1Å; P133-M144 HydrophobicContact CG-CG 4.23Å; P133-M144 HydrophobicContact CG-SD 4.02Å
134	T	71.8	Confident	72.7	Confident	77 Å²	77	74.8 Å²	74.8	47%	0.472	36%	0.359	S	S	.	.	H	α-helix	trans	-92.2	-23.3	174.6	67.5	0	0	0	0	113.2	M131 R132 F179	M131-T134 WeakPolarHBondContact O-CA 3.33Å; M131-T134 WeakPolarHBondContact O-CB 3.37Å; M131-T134 PolarHBondContact O-N 3.44Å; M131-T134 PolarHBondContact O-OG1 3.04Å; R132-T134 PolarHBondContact O-N 3.13Å; R132-T134 VanDerWaalsContact O-N 3.16Å; T134-F179 HydrophobicContact CG2-CD2 3.61Å; T134-F179 HydrophobicContact CG2-CE2 3.73Å
135	L	61.9	Low	72.3	Confident	117 Å²	117	75.7 Å²	75.7	61%	0.613	36%	0.364	S	S	*	.	H	α-helix	trans	-91.5	-10.3	-176	-60.2	173.2	0	0	0	113.7	M131 R132	M131-L135 HydrophobicContact CB-CD1 4.47Å; M131-L135 PolarHBondContact O-N 2.75Å; R132-L135 PolarHBondContact O-N 3.45Å; R132-L135 VanDerWaalsContact O-N 3.1Å
136	T	57.9	Low	72	Confident	24 Å²	24	76.8 Å²	76.8	15%	0.147	37%	0.37	C	S	.	.			trans	-91.6	124.4	-174.7	43.7	0	0	0	0	112.4	R132 Q138	R132-T136 HydrophobicContact CG-CG2 4.09Å; R132-T136 WeakPolarHBondContact O-CG2 3.25Å; R132-T136 PolarHBondContact O-N 3.32Å; R132-T136 PolarHBondContact O-OG1 2.97Å; T136-Q138 PolarHBondContact O-N 2.87Å
137	M	51.3	Low	71.6	Confident	190 Å²	190	80.6 Å²	80.6	94%	0.936	39%	0.388	S	S	*	.			trans	-76.9	9.9	176.6	-66.8	-89.8	92	0	0	114
138	Q	54.6	Low	71.4	Confident	104 Å²	104	80.8 Å²	80.8	49%	0.486	39%	0.388	S	S	.	.			trans	-83	137.4	-174.1	-67.5	-176	-3.2	0	0	111.8	N74 T136 K140	N74-Q138 PolarHBondContact OD1-NE2 3.41Å; T136-Q138 PolarHBondContact O-N 2.87Å; Q138-K140 PolarHBondContact O-N 3.36Å; Q138-K140 VanDerWaalsContact O-N 3.12Å
139	K	50.3	Low	71.4	Confident	224 Å²	224	77.6 Å²	77.6	97%	0.974	37%	0.374	S	S	*	.	S	Bend	trans	-60.6	-20	-179.8	-72.9	-175.7	177.7	-179.2	0	114.5
140	K	49	Very low	71.3	Confident	185 Å²	185	80.2 Å²	80.2	80%	0.804	39%	0.385	S	S	*	.	S	Bend	trans	-113.5	110.7	170.6	-82.8	-175.7	175.2	-179.3	0	108.3	Q138 P142	Q138-K140 PolarHBondContact O-N 3.36Å; Q138-K140 VanDerWaalsContact O-N 3.12Å; K140-P142 WeakPolarHBondContact O-CD 3.44Å
141	K	56.5	Low	71.3	Confident	161 Å²	161	81.2 Å²	81.2	70%	0.7	39%	0.391	S	S	*	.			trans	-63.1	121.8	173.7	-69.7	-175.1	177.9	-176.9	0	108.9	K143	K141-K143 PolarHBondContact O-N 3.46Å
142	P	56.8	Low	71.5	Confident	53 Å²	53	80.5 Å²	80.5	34%	0.344	39%	0.387	S	S	.	.			trans	-65.2	119.8	174.6	24.6	-30.1	0	0	0	108.9	K140 M144	K140-P142 WeakPolarHBondContact O-CD 3.44Å; P142-M144 PolarHBondContact O-N 3.11Å
143	K	63.4	Low	71.9	Confident	190 Å²	190	79.3 Å²	79.3	83%	0.826	38%	0.383	S	S	*	.			trans	-72.3	114.1	173.1	-171.2	177.5	179	-176.9	0	107.6	K141	K141-K143 PolarHBondContact O-N 3.46Å
144	M	74.5	Confident	72.6	Confident	25 Å²	25	79.4 Å²	79.4	12%	0.123	38%	0.384	C	S	.	.			trans	-65.7	149.9	174.7	-78	-178.9	68.1	0	0	110.7	L77 I129 P133 P142 D146 L148 V149	L77-M144 HydrophobicContact CD1-CG 4.19Å; I129-M144 HydrophobicContact CG2-CE 3.82Å; I129-M144 VanDerWaalsContact O-SD 3.34Å; P133-M144 HydrophobicContact CG-CG 4.23Å; P133-M144 HydrophobicContact CG-SD 4.02Å; P142-M144 PolarHBondContact O-N 3.11Å; M144-D146 PolarHBondContact O-N 3.27Å; M144-L148 HydrophobicContact CE-CD2 3.7Å; M144-L148 HydrophobicContact CE-CG 4.09Å; M144-V149 HydrophobicContact CB-CG2 3.9Å; M144-V149 HydrophobicContact CE-CG2 3.99Å; M144-V149 HydrophobicContact SD-CG2 4.45Å
145	N	82.7	Confident	73.4	Confident	84 Å²	84	75.7 Å²	75.7	45%	0.449	36%	0.361	S	S	.	.			trans	-64.3	129.2	172.9	-177.5	-1.3	0	0	0	109.7	E147 L148 V149	N145-E147 PolarHBondContact O-N 3.22Å; N145-E147 PolarHBondContact OD1-N 3.34Å; N145-L148 HydrophobicContact CB-CB 4.04Å; N145-L148 WeakPolarHBondContact O-CB 3.41Å; N145-L148 PolarHBondContact O-N 3.04Å; N145-L148 VanDerWaalsContact O-N 3.08Å; N145-V149 PolarHBondContact O-N 3.28Å; N145-V149 VanDerWaalsContact O-N 3.09Å
146	D	84	Confident	74.9	Confident	26 Å²	26	70.1 Å²	70.1	14%	0.139	33%	0.332	C	S	.	.	H	α-helix	trans	-56.3	-39	179.6	-60.7	-31	0	0	0	111.6	M144 L148 V149 K150 N186 K188	M144-D146 PolarHBondContact O-N 3.27Å; D146-L148 PolarHBondContact O-N 3.07Å; D146-V149 PolarHBondContact O-N 3.2Å; D146-K150 WeakPolarHBondContact O-CB 3.24Å; D146-K150 PolarHBondContact O-N 2.65Å; D146-N186 PolarHBondContact OD1-ND2 3.03Å; D146-K188 HydrophobicContact CB-CD 3.95Å; D146-K188 WeakPolarHBondContact OD2-CD 3.49Å; D146-K188 IonicContact OD2-NZ 2.78Å; D146-K188 PolarHBondContact OD2-NZ 3.16Å
147	E	85	Confident	76.3	Confident	80 Å²	80	71.5 Å²	71.5	37%	0.374	34%	0.335	S	S	.	.	H	α-helix	trans	-67.6	-35.6	178.7	-66	-57.1	131.5	0	0	112	H81 N145 K150 D151	H81-E147 VanDerWaalsContact CE1-CB 3.46Å; H81-E147 WeakPolarHBondContact CE1-CB 3.3Å; N145-E147 PolarHBondContact O-N 3.22Å; N145-E147 PolarHBondContact OD1-N 3.34Å; E147-K150 PolarHBondContact O-N 3.05Å; E147-D151 WeakPolarHBondContact O-CB 3.41Å; E147-D151 VanDerWaalsContact O-CG 3.27Å; E147-D151 PolarHBondContact O-N 2.81Å
148	L	87.6	Confident	78	Confident	3 Å²	3	63.2 Å²	63.2	2%	0.016	30%	0.295	C	S	.	.	H	α-helix	trans	-66.8	-42.1	175.2	176.2	69.4	0	0	0	110.9	L77 H81 L84 M144 N145 D146 D151 C152	L77-L148 HydrophobicContact CB-CD2 3.83Å; L77-L148 HydrophobicContact CD1-CD2 3.85Å; L77-L148 HydrophobicContact CD2-CD2 4.48Å; L77-L148 HydrophobicContact CG-CD2 4.27Å; H81-L148 HydrophobicContact CB-CD1 3.88Å; L84-L148 HydrophobicContact CD2-CD1 3.64Å; M144-L148 HydrophobicContact CE-CD2 3.7Å; M144-L148 HydrophobicContact CE-CG 4.09Å; N145-L148 HydrophobicContact CB-CB 4.04Å; N145-L148 WeakPolarHBondContact O-CB 3.41Å; N145-L148 PolarHBondContact O-N 3.04Å; N145-L148 VanDerWaalsContact O-N 3.08Å; D146-L148 PolarHBondContact O-N 3.07Å; L148-D151 PolarHBondContact O-N 2.97Å; L148-C152 PolarHBondContact O-N 3.16Å; L148-C152 PolarHBondContact O-SG 3.08Å
149	V	89.3	Confident	79.7	Confident	8 Å²	8	58.3 Å²	58.3	5%	0.048	27%	0.271	C	S	.	.	H	α-helix	trans	-63.5	-45.3	176.7	175.2	0	0	0	0	110.2	L130 M144 N145 D146 C152 L153 L183 T189	L130-V149 HydrophobicContact CD2-CB 4.37Å; L130-V149 HydrophobicContact CD2-CG1 3.89Å; L130-V149 HydrophobicContact CD2-CG2 4.39Å; M144-V149 HydrophobicContact CB-CG2 3.9Å; M144-V149 HydrophobicContact CE-CG2 3.99Å; M144-V149 HydrophobicContact SD-CG2 4.45Å; N145-V149 PolarHBondContact O-N 3.28Å; N145-V149 VanDerWaalsContact O-N 3.09Å; D146-V149 PolarHBondContact O-N 3.2Å; V149-C152 WeakPolarHBondContact O-CB 3.27Å; V149-C152 PolarHBondContact O-N 2.92Å; V149-L153 HydrophobicContact CG1-CD1 3.93Å; V149-L153 HydrophobicContact CG1-CG 4.38Å; V149-L153 VanDerWaalsContact O-CG 3.32Å; V149-L153 WeakPolarHBondContact O-CG 3.49Å; V149-L153 PolarHBondContact O-N 3.37Å; V149-L183 HydrophobicContact CG1-CD1 4.26Å; V149-T189 HydrophobicContact CB-CG2 4.2Å; V149-T189 HydrophobicContact CG1-CG2 3.94Å
150	K	87.3	Confident	81.5	Confident	62 Å²	62	48.3 Å²	48.3	27%	0.27	23%	0.23	S	C	.	.	H	α-helix	trans	-55.9	-51.7	175.4	-178.4	-177.6	169.9	-172.7	0	111.5	D146 E147 C152 L153 S154 T189	D146-K150 WeakPolarHBondContact O-CB 3.24Å; D146-K150 PolarHBondContact O-N 2.65Å; E147-K150 PolarHBondContact O-N 3.05Å; K150-C152 VanDerWaalsContact C-N 3.31Å; K150-C152 PolarHBondContact O-N 3.38Å; K150-L153 PolarHBondContact O-N 3.08Å; K150-S154 PolarHBondContact O-N 3.34Å; K150-S154 PolarHBondContact O-OG 3.02Å; K150-T189 HydrophobicContact CB-CG2 4.16Å
151	D	88.5	Confident	83.1	Confident	23 Å²	23	41.9 Å²	41.9	12%	0.123	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-37.8	179.7	-71.1	-20.5	0	0	0	111.8	H81 L84 E147 L148 V155	H81-D151 IonicContact CD2-OD2 3.98Å; H81-D151 PolarHBondContact CD2-OD2 3.23Å; H81-D151 VanDerWaalsContact CD2-OD2 3.29Å; H81-D151 IonicContact CE1-OD2 2.67Å; H81-D151 IonicContact NE2-OD2 3.29Å; H81-D151 PolarHBondContact NE2-OD2 2.93Å; L84-D151 HydrophobicContact CD2-CB 3.66Å; L84-D151 HydrophobicContact CG-CB 4.04Å; E147-D151 WeakPolarHBondContact O-CB 3.41Å; E147-D151 VanDerWaalsContact O-CG 3.27Å; E147-D151 PolarHBondContact O-N 2.81Å; L148-D151 PolarHBondContact O-N 2.97Å; D151-V155 VanDerWaalsContact O-CG2 3.32Å; D151-V155 WeakPolarHBondContact O-CG2 3.21Å; D151-V155 PolarHBondContact O-N 3.36Å
152	C	92.5	Very high	84.3	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.8	-48.4	174.9	-69.2	0	0	0	0	111.5	L84 L130 L148 V149 K150 V155 L156	L84-C152 HydrophobicContact CD2-CB 4.38Å; L84-C152 WeakPolarHBondContact CD2-SG 3.38Å; L130-C152 HydrophobicContact CD1-CB 3.89Å; L130-C152 HydrophobicContact CD2-CB 3.81Å; L130-C152 HydrophobicContact CG-CB 3.79Å; L148-C152 PolarHBondContact O-N 3.16Å; L148-C152 PolarHBondContact O-SG 3.08Å; V149-C152 WeakPolarHBondContact O-CB 3.27Å; V149-C152 PolarHBondContact O-N 2.92Å; K150-C152 VanDerWaalsContact C-N 3.31Å; K150-C152 PolarHBondContact O-N 3.38Å; C152-V155 PolarHBondContact O-N 3.32Å; C152-L156 WeakPolarHBondContact O-CG 3.33Å; C152-L156 PolarHBondContact O-N 3.5Å
153	L	91.1	Very high	85.7	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-42.4	179.8	-69.5	170.3	0	0	0	111.4	L130 V149 K150 L156 Y157 L180 L183 Q192 T193 L196	L130-L153 HydrophobicContact CD1-CD2 4.33Å; V149-L153 HydrophobicContact CG1-CD1 3.93Å; V149-L153 HydrophobicContact CG1-CG 4.38Å; V149-L153 VanDerWaalsContact O-CG 3.32Å; V149-L153 WeakPolarHBondContact O-CG 3.49Å; V149-L153 PolarHBondContact O-N 3.37Å; K150-L153 PolarHBondContact O-N 3.08Å; L153-L156 PolarHBondContact O-N 2.9Å; L153-Y157 WeakPolarHBondContact O-CB 3.38Å; L153-Y157 PolarHBondContact O-N 2.9Å; L153-L180 HydrophobicContact CD2-CD2 4.01Å; L153-L183 HydrophobicContact CD2-CD1 4.32Å; L153-Q192 HydrophobicContact CB-CB 4.2Å; L153-Q192 HydrophobicContact CD1-CB 4.28Å; L153-T193 VanDerWaalsContact CD1-OG1 3.27Å; L153-T193 WeakPolarHBondContact CD1-OG1 3.46Å; L153-L196 HydrophobicContact CD2-CD2 3.8Å
154	S	87.7	Confident	86.7	Confident	30 Å²	30	32.4 Å²	32.4	21%	0.21	16%	0.162	C	C	.	.	H	α-helix	trans	-62.8	-43	176.7	-70.2	0	0	0	0	112.4	K150 Y157 N158	K150-S154 PolarHBondContact O-N 3.34Å; K150-S154 PolarHBondContact O-OG 3.02Å; S154-Y157 PolarHBondContact O-N 3.46Å; S154-N158 PolarHBondContact O-N 3.04Å; S154-N158 PolarHBondContact O-ND2 3.45Å; S154-N158 PolarHBondContact O-OD1 2.85Å
155	V	89.9	Confident	87.2	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65.9	-42.1	176.4	173.4	0	0	0	0	111.5	L84 L91 F117 L126 D151 C152 N158 C159	L84-V155 HydrophobicContact CD1-CG2 4.25Å; L91-V155 HydrophobicContact CD1-CG1 3.58Å; L91-V155 HydrophobicContact CD1-CG2 4.44Å; F117-V155 HydrophobicContact CD1-CG1 4.43Å; F117-V155 HydrophobicContact CE1-CG1 3.82Å; F117-V155 HydrophobicContact CE2-CG1 4.36Å; F117-V155 HydrophobicContact CZ-CG1 3.8Å; L126-V155 HydrophobicContact CD1-CB 3.75Å; L126-V155 HydrophobicContact CD1-CG1 3.48Å; L126-V155 VanDerWaalsContact CD1-CG1 3.48Å; D151-V155 VanDerWaalsContact O-CG2 3.32Å; D151-V155 WeakPolarHBondContact O-CG2 3.21Å; D151-V155 PolarHBondContact O-N 3.36Å; C152-V155 PolarHBondContact O-N 3.32Å; V155-N158 PolarHBondContact O-N 3.41Å; V155-C159 PolarHBondContact O-N 3.31Å; V155-C159 PolarHBondContact O-SG 2.94Å
156	L	92.6	Very high	87.7	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.7	-45.2	175.9	-74.8	174.7	0	0	0	111.7	V123 L126 L130 C152 L153 C159 C160 L170 F176 L196	V123-L156 HydrophobicContact CB-CD2 4.49Å; V123-L156 HydrophobicContact CG1-CD2 3.92Å; L126-L156 HydrophobicContact CB-CD1 4.41Å; L126-L156 HydrophobicContact CB-CD2 4.01Å; L126-L156 HydrophobicContact CB-CG 4.16Å; L126-L156 HydrophobicContact CD1-CD2 4.12Å; L126-L156 HydrophobicContact CD1-CG 4.01Å; L130-L156 HydrophobicContact CD1-CD1 3.57Å; C152-L156 WeakPolarHBondContact O-CG 3.33Å; C152-L156 PolarHBondContact O-N 3.5Å; L153-L156 PolarHBondContact O-N 2.9Å; L156-C159 WeakPolarHBondContact O-CB 3.43Å; L156-C159 PolarHBondContact O-N 3.22Å; L156-C160 PolarHBondContact O-N 3.48Å; L156-C160 PolarHBondContact O-SG 3.24Å; L156-C160 VanDerWaalsContact O-SG 3.36Å; L156-L170 HydrophobicContact CD2-CD1 4.49Å; L156-F176 HydrophobicContact CD1-CZ 3.95Å; L156-L196 HydrophobicContact CB-CD2 4.17Å; L156-L196 HydrophobicContact CD1-CD2 4.34Å
157	Y	88.2	Confident	88.1	Confident	53 Å²	53	28.7 Å²	28.7	21%	0.208	15%	0.152	C	C	.	.	H	α-helix	trans	-59.2	-46.5	175.7	176.7	-106	0	0	0	112.1	L153 S154 C159 C160 I161 T195 D199 L318	L153-Y157 WeakPolarHBondContact O-CB 3.38Å; L153-Y157 PolarHBondContact O-N 2.9Å; S154-Y157 PolarHBondContact O-N 3.46Å; Y157-C159 VanDerWaalsContact C-N 3.27Å; Y157-C159 PolarHBondContact O-N 3.28Å; Y157-C160 WeakPolarHBondContact O-CB 3.39Å; Y157-C160 PolarHBondContact O-N 3.08Å; Y157-C160 VanDerWaalsContact O-N 3.1Å; Y157-I161 HydrophobicContact CD1-CD1 3.83Å; Y157-I161 HydrophobicContact CE1-CD1 3.28Å; Y157-I161 HydrophobicContact CE1-CG1 4.41Å; Y157-I161 HydrophobicContact CE2-CD1 4.06Å; Y157-I161 HydrophobicContact CE2-CG1 4.49Å; Y157-I161 HydrophobicContact CG-CD1 4.44Å; Y157-I161 VanDerWaalsContact CZ-CD1 3.43Å; Y157-I161 PolarHBondContact O-N 3.33Å; Y157-I161 VanDerWaalsContact O-N 3.08Å; Y157-T195 HydrophobicContact CD2-CG2 4.13Å; Y157-T195 HydrophobicContact CE2-CG2 3.52Å; Y157-D199 WeakPolarHBondContact CE2-OD2 3.42Å; Y157-L318 HydrophobicContact CE1-CD2 4.11Å
158	N	87.1	Confident	88.4	Confident	16 Å²	16	31.2 Å²	31.2	9%	0.086	16%	0.162	C	C	.	.	H	α-helix	trans	-59.7	-38.4	175.6	-68.1	-12.8	0	0	0	112.1	S92 A95 S154 V155 I161 C162	S92-N158 WeakPolarHBondContact CA-ND2 3.33Å; S92-N158 PolarHBondContact OG-ND2 3.32Å; S92-N158 VanDerWaalsContact OG-ND2 3.07Å; A95-N158 HydrophobicContact CB-CB 3.96Å; S154-N158 PolarHBondContact O-N 3.04Å; S154-N158 PolarHBondContact O-ND2 3.45Å; S154-N158 PolarHBondContact O-OD1 2.85Å; V155-N158 PolarHBondContact O-N 3.41Å; N158-I161 PolarHBondContact O-N 2.98Å; N158-C162 WeakPolarHBondContact O-CB 3.42Å; N158-C162 PolarHBondContact O-N 3.41Å
159	C	89.5	Confident	88.7	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66.3	-39	175.5	-62.7	0	0	0	0	111.9	V123 V155 L156 Y157 I161 T163 V166	V123-C159 HydrophobicContact CG2-CB 4.16Å; V155-C159 PolarHBondContact O-N 3.31Å; V155-C159 PolarHBondContact O-SG 2.94Å; L156-C159 WeakPolarHBondContact O-CB 3.43Å; L156-C159 PolarHBondContact O-N 3.22Å; Y157-C159 VanDerWaalsContact C-N 3.27Å; Y157-C159 PolarHBondContact O-N 3.28Å; C159-I161 VanDerWaalsContact C-N 3.29Å; C159-I161 PolarHBondContact O-N 3.43Å; C159-T163 WeakPolarHBondContact O-CB 3.41Å; C159-T163 PolarHBondContact O-N 3.44Å; C159-V166 HydrophobicContact CB-CG1 4Å
160	C	88.3	Confident	88.9	Confident	15 Å²	15	33.8 Å²	33.8	10%	0.101	18%	0.181	C	C	.	.	H	α-helix	trans	-60.6	-36.3	174.1	-70.1	0	0	0	0	112.9	L156 Y157 T167	L156-C160 PolarHBondContact O-N 3.48Å; L156-C160 PolarHBondContact O-SG 3.24Å; L156-C160 VanDerWaalsContact O-SG 3.36Å; Y157-C160 WeakPolarHBondContact O-CB 3.39Å; Y157-C160 PolarHBondContact O-N 3.08Å; Y157-C160 VanDerWaalsContact O-N 3.1Å; C160-T167 WeakPolarHBondContact CA-OG1 3.3Å; C160-T167 HydrophobicContact CB-CG2 4.49Å; C160-T167 WeakPolarHBondContact CB-OG1 3.43Å; C160-T167 PolarHBondContact O-OG1 2.8Å
161	I	82.1	Confident	89.2	Confident	50 Å²	50	31.1 Å²	31.1	26%	0.256	17%	0.17	S	C	.	.	H	α-helix	trans	-74.9	-48.7	178.8	-66.8	170.7	0	0	0	111.4	F98 V99 Y157 N158 C159	F98-I161 HydrophobicContact CD1-CG2 3.99Å; F98-I161 HydrophobicContact CE1-CG2 4.47Å; V99-I161 HydrophobicContact CG2-CG2 4.35Å; Y157-I161 HydrophobicContact CD1-CD1 3.83Å; Y157-I161 HydrophobicContact CE1-CD1 3.28Å; Y157-I161 HydrophobicContact CE1-CG1 4.41Å; Y157-I161 HydrophobicContact CE2-CD1 4.06Å; Y157-I161 HydrophobicContact CE2-CG1 4.49Å; Y157-I161 HydrophobicContact CG-CD1 4.44Å; Y157-I161 VanDerWaalsContact CZ-CD1 3.43Å; Y157-I161 PolarHBondContact O-N 3.33Å; Y157-I161 VanDerWaalsContact O-N 3.08Å; N158-I161 PolarHBondContact O-N 2.98Å; C159-I161 VanDerWaalsContact C-N 3.29Å; C159-I161 PolarHBondContact O-N 3.43Å
162	C	82.9	Confident	89.3	Confident	16 Å²	16	33.7 Å²	33.7	11%	0.108	20%	0.195	C	C	.	.	H	α-helix	trans	-95.2	-17.6	-164.6	-62.9	0	0	0	0	114.3	T114 N158	T114-C162 HydrophobicContact CG2-CB 3.94Å; T114-C162 WeakPolarHBondContact OG1-CB 3.33Å; N158-C162 WeakPolarHBondContact O-CB 3.42Å; N158-C162 PolarHBondContact O-N 3.41Å
163	T	84.9	Confident	89.3	Confident	7 Å²	7	36.7 Å²	36.7	4%	0.043	21%	0.206	C	C	.	.	S	Bend	trans	-120	117.2	-175.5	-55.7	0	0	0	0	111.3	T114 Y115 D118 C159 G165 V166	T114-T163 VanDerWaalsContact C-OG1 3.24Å; T114-T163 WeakPolarHBondContact CB-OG1 3.13Å; T114-T163 PolarHBondContact OG1-OG1 2.95Å; Y115-T163 HydrophobicContact CD2-CG2 4.2Å; Y115-T163 PolarHBondContact N-OG1 3.37Å; D118-T163 HydrophobicContact CB-CG2 4.37Å; C159-T163 WeakPolarHBondContact O-CB 3.41Å; C159-T163 PolarHBondContact O-N 3.44Å; T163-G165 PolarHBondContact O-N 3.17Å; T163-V166 HydrophobicContact CG2-CG2 3.65Å; T163-V166 PolarHBondContact O-N 3.47Å
164	E	84.3	Confident	89.3	Confident	181 Å²	181	40.5 Å²	40.5	85%	0.846	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	133.9	178	-170	-179.4	176.1	0	0	111.2
165	G	86.9	Confident	89.4	Confident	37 Å²	37	42.9 Å²	42.9	38%	0.381	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.9	-21.3	175.3	0	0	0	0	0	114.9	T163 T167 K168 S169	T163-G165 PolarHBondContact O-N 3.17Å; G165-T167 PolarHBondContact O-N 2.76Å; G165-K168 PolarHBondContact O-N 3.24Å; G165-S169 PolarHBondContact O-N 3.41Å
166	V	91.8	Very high	89.5	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-59.2	-50.9	178.4	172	0	0	0	0	111.4	D118 V123 C159 T163 K168 S169 L170	D118-V166 HydrophobicContact CB-CG2 4.23Å; V123-V166 HydrophobicContact CG1-CG1 4.23Å; V123-V166 HydrophobicContact CG2-CG1 4.06Å; V123-V166 HydrophobicContact CG2-CG2 4.43Å; C159-V166 HydrophobicContact CB-CG1 4Å; T163-V166 HydrophobicContact CG2-CG2 3.65Å; T163-V166 PolarHBondContact O-N 3.47Å; V166-K168 VanDerWaalsContact C-N 3.25Å; V166-K168 PolarHBondContact O-N 2.96Å; V166-S169 WeakPolarHBondContact O-CB 3.38Å; V166-S169 PolarHBondContact O-N 3.14Å; V166-L170 HydrophobicContact CG1-CD1 4.15Å; V166-L170 HydrophobicContact CG1-CG 4.4Å; V166-L170 PolarHBondContact O-N 3.5Å
167	T	92.6	Very high	89.6	Confident	19 Å²	19	42.9 Å²	42.9	12%	0.117	24%	0.237	C	C	.	.	H	α-helix	trans	-58.9	-37.9	179.3	-38.5	0	0	0	0	111.8	C160 G165 A171 I200 V203	C160-T167 WeakPolarHBondContact CA-OG1 3.3Å; C160-T167 HydrophobicContact CB-CG2 4.49Å; C160-T167 WeakPolarHBondContact CB-OG1 3.43Å; C160-T167 PolarHBondContact O-OG1 2.8Å; G165-T167 PolarHBondContact O-N 2.76Å; T167-A171 VanDerWaalsContact O-CB 3.23Å; T167-A171 WeakPolarHBondContact O-CB 3.24Å; T167-A171 PolarHBondContact O-N 2.77Å; T167-I200 HydrophobicContact CG2-CG1 4.37Å; T167-V203 HydrophobicContact CG2-CG1 4.26Å; T167-V203 HydrophobicContact CG2-CG2 3.58Å
168	K	92.4	Very high	89.7	Confident	134 Å²	134	42.4 Å²	42.4	58%	0.583	24%	0.237	S	C	*	.	H	α-helix	trans	-68.4	-39	176.2	-68.7	175.9	-178.2	165	0	111.9	G165 V166 A171 A172 V203	G165-K168 PolarHBondContact O-N 3.24Å; V166-K168 VanDerWaalsContact C-N 3.25Å; V166-K168 PolarHBondContact O-N 2.96Å; K168-A171 PolarHBondContact O-N 3.04Å; K168-A172 PolarHBondContact O-N 3.23Å; K168-A172 VanDerWaalsContact O-N 3.1Å; K168-V203 HydrophobicContact CG-CG2 4.45Å
169	S	92.5	Very high	89.9	Confident	63 Å²	63	42.3 Å²	42.3	44%	0.441	24%	0.236	S	C	.	.	H	α-helix	trans	-63.5	-47.3	175.8	-174.1	0	0	0	0	111.1	G165 V166 A171 A172	G165-S169 PolarHBondContact O-N 3.41Å; V166-S169 WeakPolarHBondContact O-CB 3.38Å; V166-S169 PolarHBondContact O-N 3.14Å; S169-A171 PolarHBondContact O-N 3.45Å; S169-A172 WeakPolarHBondContact O-CB 3.11Å; S169-A172 PolarHBondContact O-N 3.38Å
170	L	94.3	Very high	90.1	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-40.7	174.9	-65.5	179.9	0	0	0	111.9	V123 V127 L156 V166 A172 R173 F176 I200	V123-L170 HydrophobicContact CG1-CD2 3.77Å; V123-L170 HydrophobicContact CG1-CG 4.33Å; V127-L170 HydrophobicContact CG2-CD2 3.75Å; L156-L170 HydrophobicContact CD2-CD1 4.49Å; V166-L170 HydrophobicContact CG1-CD1 4.15Å; V166-L170 HydrophobicContact CG1-CG 4.4Å; V166-L170 PolarHBondContact O-N 3.5Å; L170-A172 PolarHBondContact O-N 3.35Å; L170-R173 PolarHBondContact O-N 2.93Å; L170-R173 VanDerWaalsContact O-N 3.11Å; L170-F176 HydrophobicContact CB-CD1 4.49Å; L170-F176 HydrophobicContact CB-CE1 4.46Å; L170-F176 HydrophobicContact CD1-CE1 4.41Å; L170-F176 HydrophobicContact CD2-CD1 4.06Å; L170-F176 HydrophobicContact CD2-CE1 3.85Å; L170-F176 HydrophobicContact CG-CE1 4.47Å; L170-I200 HydrophobicContact CB-CD1 3.99Å; L170-I200 HydrophobicContact CB-CG1 4.22Å; L170-I200 HydrophobicContact CD1-CD1 4.29Å
171	A	92.4	Very high	90.3	Very high	5 Å²	5	41.6 Å²	41.6	4%	0.041	23%	0.231	C	C	.	.	H	α-helix	trans	-64.5	-24.9	176.8	0	0	0	0	0	113.9	T167 K168 S169 R173 I200 V203 K204	T167-A171 VanDerWaalsContact O-CB 3.23Å; T167-A171 WeakPolarHBondContact O-CB 3.24Å; T167-A171 PolarHBondContact O-N 2.77Å; K168-A171 PolarHBondContact O-N 3.04Å; S169-A171 PolarHBondContact O-N 3.45Å; A171-R173 PolarHBondContact O-N 2.93Å; A171-I200 HydrophobicContact CB-CG2 3.85Å; A171-V203 HydrophobicContact CB-CG2 3.93Å; A171-K204 HydrophobicContact CB-CB 4.07Å; A171-K204 HydrophobicContact CB-CG 4.28Å; A171-K204 PolarHBondContact O-NZ 3.27Å
172	A	92.4	Very high	90.6	Very high	78 Å²	78	41.6 Å²	41.6	65%	0.645	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-14.4	175.6	0	0	0	0	0	113.1	K168 S169 L170 D174	K168-A172 PolarHBondContact O-N 3.23Å; K168-A172 VanDerWaalsContact O-N 3.1Å; S169-A172 WeakPolarHBondContact O-CB 3.11Å; S169-A172 PolarHBondContact O-N 3.38Å; L170-A172 PolarHBondContact O-N 3.35Å; A172-D174 PolarHBondContact O-N 3.07Å
173	R	91.6	Very high	91	Very high	63 Å²	63	42.1 Å²	42.1	24%	0.238	24%	0.235	C	C	.	.			trans	-96.8	84.4	-177.6	-70.3	-167.8	61.4	175.5	-5	112.3	V127 L170 A171 D175 F176 V177	V127-R173 VanDerWaalsContact CG1-CZ 3.46Å; L170-R173 PolarHBondContact O-N 2.93Å; L170-R173 VanDerWaalsContact O-N 3.11Å; A171-R173 PolarHBondContact O-N 2.93Å; R173-D175 WeakPolarHBondContact CB-OD1 3.47Å; R173-D175 IonicContact CZ-OD2 2.63Å; R173-D175 IonicContact NE-OD1 2.94Å; R173-D175 IonicContact NE-OD2 3.15Å; R173-D175 IonicContact NH2-OD2 3.37Å; R173-D175 PolarHBondContact NH2-OD2 2.97Å; R173-D175 PolarHBondContact O-N 3.13Å; R173-F176 HydrophobicContact CB-CB 3.83Å; R173-F176 PolarHBondContact O-N 3.08Å; R173-V177 WeakPolarHBondContact O-CG2 3.47Å; R173-V177 PolarHBondContact O-N 3.26Å
174	D	90.3	Very high	91.2	Very high	80 Å²	80	41.8 Å²	41.8	43%	0.428	23%	0.233	S	C	.	.	H	α-helix	trans	-57.3	-36.6	179.7	-73.2	-18.5	0	0	0	113	A172 F176 V177 L178 K204	A172-D174 PolarHBondContact O-N 3.07Å; D174-F176 VanDerWaalsContact C-N 3.32Å; D174-F176 PolarHBondContact O-N 3.08Å; D174-V177 PolarHBondContact O-N 3.24Å; D174-L178 WeakPolarHBondContact O-CB 3.47Å; D174-L178 VanDerWaalsContact O-CG 3.24Å; D174-L178 WeakPolarHBondContact O-CG 3.41Å; D174-L178 PolarHBondContact O-N 3.43Å; D174-K204 VanDerWaalsContact OD1-CE 3.28Å; D174-K204 WeakPolarHBondContact OD1-CE 3.48Å; D174-K204 IonicContact OD1-NZ 3.41Å; D174-K204 PolarHBondContact OD1-NZ 3.07Å
175	D	90.6	Very high	91.3	Very high	81 Å²	81	37.1 Å²	37.1	43%	0.433	22%	0.217	S	C	.	.	H	α-helix	trans	-57.5	-44.3	174.7	64.6	-44.3	0	0	0	112	M131 R173 F179	M131-D175 HydrophobicContact CE-CB 4.19Å; R173-D175 WeakPolarHBondContact CB-OD1 3.47Å; R173-D175 IonicContact CZ-OD2 2.63Å; R173-D175 IonicContact NE-OD1 2.94Å; R173-D175 IonicContact NE-OD2 3.15Å; R173-D175 IonicContact NH2-OD2 3.37Å; R173-D175 PolarHBondContact NH2-OD2 2.97Å; R173-D175 PolarHBondContact O-N 3.13Å; D175-F179 WeakPolarHBondContact O-CB 3.43Å; D175-F179 PolarHBondContact O-N 3.25Å
176	F	92.9	Very high	91.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-71.8	-44.5	179.3	177.5	-119.2	0	0	0	111.4	V127 L130 M131 L156 L170 R173 D174 L178 F179 L180 I200	V127-F176 HydrophobicContact CB-CD2 4.32Å; V127-F176 HydrophobicContact CB-CE2 4.3Å; V127-F176 HydrophobicContact CG1-CB 4.21Å; V127-F176 HydrophobicContact CG1-CD2 3.44Å; V127-F176 VanDerWaalsContact CG1-CD2 3.44Å; V127-F176 HydrophobicContact CG1-CE2 3.89Å; V127-F176 HydrophobicContact CG1-CG 3.84Å; V127-F176 HydrophobicContact CG2-CD1 4.36Å; V127-F176 HydrophobicContact CG2-CD2 4.16Å; V127-F176 HydrophobicContact CG2-CE1 4.15Å; V127-F176 HydrophobicContact CG2-CE2 3.93Å; V127-F176 HydrophobicContact CG2-CG 4.35Å; V127-F176 HydrophobicContact CG2-CZ 3.92Å; L130-F176 HydrophobicContact CD1-CE2 4.39Å; M131-F176 HydrophobicContact CG-CD2 4.14Å; M131-F176 HydrophobicContact SD-CB 4.05Å; M131-F176 HydrophobicContact SD-CD2 3.86Å; M131-F176 HydrophobicContact SD-CG 4.45Å; L156-F176 HydrophobicContact CD1-CZ 3.95Å; L170-F176 HydrophobicContact CB-CD1 4.49Å; L170-F176 HydrophobicContact CB-CE1 4.46Å; L170-F176 HydrophobicContact CD1-CE1 4.41Å; L170-F176 HydrophobicContact CD2-CD1 4.06Å; L170-F176 HydrophobicContact CD2-CE1 3.85Å; L170-F176 HydrophobicContact CG-CE1 4.47Å; R173-F176 HydrophobicContact CB-CB 3.83Å; R173-F176 PolarHBondContact O-N 3.08Å; D174-F176 VanDerWaalsContact C-N 3.32Å; D174-F176 PolarHBondContact O-N 3.08Å; F176-L178 PolarHBondContact O-N 3.49Å; F176-F179 HydrophobicContact CD2-CD1 4.41Å; F176-F179 WeakPolarHBondContact O-CA 3.36Å; F176-F179 WeakPolarHBondContact O-CB 3.41Å; F176-F179 PolarHBondContact O-N 3.13Å; F176-F179 VanDerWaalsContact O-N 3.11Å; F176-L180 HydrophobicContact CD1-CD1 4.3Å; F176-L180 HydrophobicContact CE1-CD1 3.79Å; F176-L180 HydrophobicContact CE1-CD2 4.35Å; F176-L180 HydrophobicContact CE1-CG 4.16Å; F176-L180 HydrophobicContact CE2-CD2 3.87Å; F176-L180 HydrophobicContact CE2-CG 4.14Å; F176-L180 HydrophobicContact CZ-CD1 3.99Å; F176-L180 HydrophobicContact CZ-CD2 3.68Å; F176-L180 HydrophobicContact CZ-CG 3.94Å; F176-L180 WeakPolarHBondContact O-CG 3.25Å; F176-L180 PolarHBondContact O-N 3.26Å; F176-I200 HydrophobicContact CE1-CD1 4.21Å
177	V	92.7	Very high	91	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.7	-43.9	179.9	-170.3	0	0	0	0	111	R173 D174 F179 L180 F181 I200 I208	R173-V177 WeakPolarHBondContact O-CG2 3.47Å; R173-V177 PolarHBondContact O-N 3.26Å; D174-V177 PolarHBondContact O-N 3.24Å; V177-F179 VanDerWaalsContact C-N 3.27Å; V177-F179 PolarHBondContact O-N 3.04Å; V177-L180 WeakPolarHBondContact O-CB 3.31Å; V177-L180 PolarHBondContact O-N 3.45Å; V177-L180 VanDerWaalsContact O-N 3.16Å; V177-F181 HydrophobicContact CG1-CE2 4.25Å; V177-F181 VanDerWaalsContact O-CD2 3.3Å; V177-F181 WeakPolarHBondContact O-CD2 3.46Å; V177-I200 HydrophobicContact CG1-CG2 4.48Å; V177-I200 HydrophobicContact CG2-CG2 3.71Å; V177-I208 HydrophobicContact CB-CD1 3.61Å; V177-I208 HydrophobicContact CG1-CD1 3.16Å; V177-I208 HydrophobicContact CG2-CD1 4.29Å
178	L	91.4	Very high	90.6	Very high	42 Å²	42	47.9 Å²	47.9	22%	0.22	25%	0.254	C	S	.	.	H	α-helix	trans	-61.2	-36.4	174	-69.6	175.9	0	0	0	112.1	D174 F176 F181 I208 I213	D174-L178 WeakPolarHBondContact O-CB 3.47Å; D174-L178 VanDerWaalsContact O-CG 3.24Å; D174-L178 WeakPolarHBondContact O-CG 3.41Å; D174-L178 PolarHBondContact O-N 3.43Å; F176-L178 PolarHBondContact O-N 3.49Å; L178-F181 PolarHBondContact O-N 2.85Å; L178-I208 HydrophobicContact CD2-CG2 3.85Å; L178-I213 HydrophobicContact CD2-CG1 3.67Å
179	F	91.5	Very high	90.4	Very high	14 Å²	14	41.6 Å²	41.6	6%	0.061	23%	0.227	C	C	.	.	H	α-helix	trans	-64.2	-39.4	174.5	172.7	-99.1	0	0	0	112.6	L130 M131 T134 D175 F176 V177 F181 T182 L183	L130-F179 HydrophobicContact CB-CE1 4.04Å; L130-F179 WeakPolarHBondContact O-CE1 3.22Å; L130-F179 WeakPolarHBondContact O-CZ 3.21Å; M131-F179 HydrophobicContact CE-CB 4.06Å; M131-F179 HydrophobicContact CE-CG 4.44Å; M131-F179 HydrophobicContact CG-CB 4.34Å; M131-F179 HydrophobicContact CG-CD1 3.63Å; M131-F179 HydrophobicContact CG-CD2 4.42Å; M131-F179 HydrophobicContact CG-CE1 4.02Å; M131-F179 HydrophobicContact CG-CG 3.86Å; T134-F179 HydrophobicContact CG2-CD2 3.61Å; T134-F179 HydrophobicContact CG2-CE2 3.73Å; D175-F179 WeakPolarHBondContact O-CB 3.43Å; D175-F179 PolarHBondContact O-N 3.25Å; F176-F179 HydrophobicContact CD2-CD1 4.41Å; F176-F179 WeakPolarHBondContact O-CA 3.36Å; F176-F179 WeakPolarHBondContact O-CB 3.41Å; F176-F179 PolarHBondContact O-N 3.13Å; F176-F179 VanDerWaalsContact O-N 3.11Å; V177-F179 VanDerWaalsContact C-N 3.27Å; V177-F179 PolarHBondContact O-N 3.04Å; F179-F181 VanDerWaalsContact C-N 3.26Å; F179-F181 PolarHBondContact O-N 3.22Å; F179-T182 WeakPolarHBondContact O-CB 3.45Å; F179-T182 PolarHBondContact O-N 3.1Å; F179-T182 PolarHBondContact O-OG1 3.5Å; F179-L183 HydrophobicContact CD1-CD1 4.47Å; F179-L183 HydrophobicContact CE1-CD1 3.78Å; F179-L183 HydrophobicContact CE1-CD2 4.04Å; F179-L183 HydrophobicContact CE1-CG 3.86Å; F179-L183 HydrophobicContact CZ-CD1 4.36Å; F179-L183 HydrophobicContact CZ-CD2 3.76Å; F179-L183 HydrophobicContact CZ-CG 4.05Å; F179-L183 PolarHBondContact O-N 2.78Å
180	L	93.6	Very high	90.2	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-57.4	-38.2	177.9	-69.5	176.3	0	0	0	112.1	L153 F176 V177 T182 L183 M184 T193 L196 I197 I200	L153-L180 HydrophobicContact CD2-CD2 4.01Å; F176-L180 HydrophobicContact CD1-CD1 4.3Å; F176-L180 HydrophobicContact CE1-CD1 3.79Å; F176-L180 HydrophobicContact CE1-CD2 4.35Å; F176-L180 HydrophobicContact CE1-CG 4.16Å; F176-L180 HydrophobicContact CE2-CD2 3.87Å; F176-L180 HydrophobicContact CE2-CG 4.14Å; F176-L180 HydrophobicContact CZ-CD1 3.99Å; F176-L180 HydrophobicContact CZ-CD2 3.68Å; F176-L180 HydrophobicContact CZ-CG 3.94Å; F176-L180 WeakPolarHBondContact O-CG 3.25Å; F176-L180 PolarHBondContact O-N 3.26Å; V177-L180 WeakPolarHBondContact O-CB 3.31Å; V177-L180 PolarHBondContact O-N 3.45Å; V177-L180 VanDerWaalsContact O-N 3.16Å; L180-T182 PolarHBondContact O-N 3Å; L180-L183 HydrophobicContact CD2-CD1 4.14Å; L180-L183 WeakPolarHBondContact O-CB 3.46Å; L180-L183 PolarHBondContact O-N 3.32Å; L180-M184 PolarHBondContact O-N 3.06Å; L180-T193 HydrophobicContact CB-CG2 4.28Å; L180-T193 WeakPolarHBondContact O-CG2 3.47Å; L180-L196 HydrophobicContact CD1-CD2 4.2Å; L180-L196 HydrophobicContact CD1-CG 4.32Å; L180-L196 HydrophobicContact CD2-CD2 4.25Å; L180-I197 HydrophobicContact CB-CD1 3.77Å; L180-I197 HydrophobicContact CB-CG1 3.64Å; L180-I197 HydrophobicContact CD1-CG1 3.92Å; L180-I197 HydrophobicContact CG-CG1 4.43Å; L180-I200 HydrophobicContact CD1-CD1 3.77Å
181	F	92.6	Very high	89.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-57.1	-34.6	174.4	-77.6	-95	0	0	0	112.3	V177 L178 F179 L183 M184 I197 L210 I213 L219 F231 I234	V177-F181 HydrophobicContact CG1-CE2 4.25Å; V177-F181 VanDerWaalsContact O-CD2 3.3Å; V177-F181 WeakPolarHBondContact O-CD2 3.46Å; L178-F181 PolarHBondContact O-N 2.85Å; F179-F181 VanDerWaalsContact C-N 3.26Å; F179-F181 PolarHBondContact O-N 3.22Å; F181-L183 VanDerWaalsContact C-N 3.31Å; F181-L183 PolarHBondContact O-N 2.72Å; F181-M184 HydrophobicContact CD1-SD 4.21Å; F181-M184 WeakPolarHBondContact O-CB 3.37Å; F181-M184 PolarHBondContact O-N 3.4Å; F181-I197 HydrophobicContact CD2-CD1 4.28Å; F181-I197 HydrophobicContact CE2-CD1 4.44Å; F181-I197 HydrophobicContact CE2-CG2 4.19Å; F181-I197 HydrophobicContact CG-CD1 4.37Å; F181-I197 HydrophobicContact CZ-CG2 4.13Å; F181-L210 HydrophobicContact CE1-CD2 4.35Å; F181-L210 HydrophobicContact CZ-CD2 4.39Å; F181-I213 HydrophobicContact CB-CD1 4.09Å; F181-I213 HydrophobicContact CB-CG1 4.25Å; F181-I213 HydrophobicContact CB-CG2 3.88Å; F181-I213 HydrophobicContact CD1-CD1 3.45Å; F181-I213 VanDerWaalsContact CD1-CD1 3.45Å; F181-I213 HydrophobicContact CD1-CG1 4.46Å; F181-I213 HydrophobicContact CD2-CD1 3.89Å; F181-I213 HydrophobicContact CD2-CG1 4.27Å; F181-I213 HydrophobicContact CE1-CD1 3.72Å; F181-I213 HydrophobicContact CE2-CD1 4.17Å; F181-I213 HydrophobicContact CG-CD1 3.54Å; F181-I213 HydrophobicContact CG-CG1 4.09Å; F181-I213 HydrophobicContact CZ-CD1 4.08Å; F181-L219 HydrophobicContact CB-CD2 4.22Å; F181-L219 WeakPolarHBondContact O-CD2 3.5Å; F181-F231 AromaticContact CD1-CE2 3.97Å; F181-F231 HydrophobicContact CD1-CE2 3.97Å; F181-F231 AromaticContact CE1-CE2 3.75Å; F181-F231 HydrophobicContact CE1-CE2 3.75Å; F181-F231 HydrophobicContact CE1-CZ 4.33Å; F181-I234 HydrophobicContact CE1-CG2 3.85Å; F181-I234 HydrophobicContact CZ-CG2 3.76Å
182	T	88.5	Confident	89.4	Confident	50 Å²	50	41.2 Å²	41.2	31%	0.307	22%	0.218	S	C	.	.	H	α-helix	trans	-68.2	-31.5	178.6	76	0	0	0	0	112.7	F179 L180 M184 T185	F179-T182 WeakPolarHBondContact O-CB 3.45Å; F179-T182 PolarHBondContact O-N 3.1Å; F179-T182 PolarHBondContact O-OG1 3.5Å; L180-T182 PolarHBondContact O-N 3Å; T182-M184 PolarHBondContact O-N 3.33Å; T182-T185 PolarHBondContact O-N 3.32Å; T182-T185 PolarHBondContact O-OG1 2.94Å
183	L	90	Very high	89.4	Confident	27 Å²	27	37.5 Å²	37.5	14%	0.141	19%	0.187	C	C	.	.	H	α-helix	trans	-68.2	-21.5	176.3	-64.5	-175.7	0	0	0	112.6	L130 V149 L153 F179 L180 F181 T185 N186 T193	L130-L183 HydrophobicContact CD2-CD1 4.27Å; V149-L183 HydrophobicContact CG1-CD1 4.26Å; L153-L183 HydrophobicContact CD2-CD1 4.32Å; F179-L183 HydrophobicContact CD1-CD1 4.47Å; F179-L183 HydrophobicContact CE1-CD1 3.78Å; F179-L183 HydrophobicContact CE1-CD2 4.04Å; F179-L183 HydrophobicContact CE1-CG 3.86Å; F179-L183 HydrophobicContact CZ-CD1 4.36Å; F179-L183 HydrophobicContact CZ-CD2 3.76Å; F179-L183 HydrophobicContact CZ-CG 4.05Å; F179-L183 PolarHBondContact O-N 2.78Å; L180-L183 HydrophobicContact CD2-CD1 4.14Å; L180-L183 WeakPolarHBondContact O-CB 3.46Å; L180-L183 PolarHBondContact O-N 3.32Å; F181-L183 VanDerWaalsContact C-N 3.31Å; F181-L183 PolarHBondContact O-N 2.72Å; L183-T185 PolarHBondContact O-N 2.93Å; L183-T185 VanDerWaalsContact O-N 3.11Å; L183-N186 PolarHBondContact O-N 3.42Å; L183-T193 HydrophobicContact CB-CG2 3.91Å
184	M	89.8	Confident	89.3	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-11.4	175.9	-57.3	-175.6	68	0	0	113	L180 F181 T182 N186 F190 T193 A194 I197 L219 F223 F231 I234	L180-M184 PolarHBondContact O-N 3.06Å; F181-M184 HydrophobicContact CD1-SD 4.21Å; F181-M184 WeakPolarHBondContact O-CB 3.37Å; F181-M184 PolarHBondContact O-N 3.4Å; T182-M184 PolarHBondContact O-N 3.33Å; M184-N186 PolarHBondContact O-N 3.41Å; M184-F190 HydrophobicContact CB-CD2 3.97Å; M184-F190 HydrophobicContact CB-CE2 4.02Å; M184-F190 HydrophobicContact CE-CD2 4.11Å; M184-F190 HydrophobicContact CE-CE1 4.42Å; M184-F190 HydrophobicContact CE-CE2 3.3Å; M184-F190 HydrophobicContact CE-CZ 3.46Å; M184-F190 VanDerWaalsContact CE-CZ 3.46Å; M184-F190 VanDerWaalsContact O-CD2 3.28Å; M184-F190 WeakPolarHBondContact O-CD2 3.38Å; M184-T193 HydrophobicContact CG-CG2 3.65Å; M184-A194 HydrophobicContact CE-CB 4.06Å; M184-I197 HydrophobicContact CG-CD1 4.17Å; M184-I197 HydrophobicContact SD-CD1 3.64Å; M184-L219 HydrophobicContact CB-CD1 4.26Å; M184-F223 HydrophobicContact CB-CE1 3.96Å; M184-F223 HydrophobicContact CB-CZ 3.95Å; M184-F223 HydrophobicContact CE-CZ 4.11Å; M184-F223 WeakPolarHBondContact O-CE1 3.3Å; M184-F231 HydrophobicContact CE-CD2 3.78Å; M184-F231 HydrophobicContact CE-CE2 4.5Å; M184-F231 HydrophobicContact SD-CD2 4.27Å; M184-F231 HydrophobicContact SD-CE2 4.44Å; M184-I234 HydrophobicContact CE-CD1 3.74Å; M184-I234 HydrophobicContact SD-CD1 3.92Å
185	T	87	Confident	89.2	Confident	83 Å²	83	32.2 Å²	32.2	51%	0.509	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.3	170.5	-47.2	0	0	0	0	111.6	T182 L183 L219	T182-T185 PolarHBondContact O-N 3.32Å; T182-T185 PolarHBondContact O-OG1 2.94Å; L183-T185 PolarHBondContact O-N 2.93Å; L183-T185 VanDerWaalsContact O-N 3.11Å; T185-L219 VanDerWaalsContact OG1-CD1 3.27Å; T185-L219 WeakPolarHBondContact OG1-CD1 3.43Å
186	N	86.1	Confident	89.2	Confident	44 Å²	44	28.3 Å²	28.3	24%	0.235	14%	0.144	C	C	.	.			trans	-87.8	113.4	-176.9	-171.3	-9.5	0	0	0	111.4	D146 L183 M184 K188 T189 F190	D146-N186 PolarHBondContact OD1-ND2 3.03Å; L183-N186 PolarHBondContact O-N 3.42Å; M184-N186 PolarHBondContact O-N 3.41Å; N186-K188 VanDerWaalsContact C-N 3.27Å; N186-K188 PolarHBondContact O-N 3.33Å; N186-K188 PolarHBondContact OD1-N 3.42Å; N186-T189 WeakPolarHBondContact CB-OG1 3.31Å; N186-T189 PolarHBondContact O-N 3.16Å; N186-F190 WeakPolarHBondContact O-CB 3.22Å; N186-F190 PolarHBondContact O-N 2.84Å
187	K	84.8	Confident	89.2	Confident	124 Å²	124	28.3 Å²	28.3	54%	0.539	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-57.3	-36.4	-179.1	-65.2	-166.6	172.1	-149.6	0	113.6	T189 D224	K187-T189 VanDerWaalsContact C-N 3.32Å; K187-T189 PolarHBondContact O-N 3.03Å; K187-D224 IonicContact NZ-OD2 2.72Å; K187-D224 PolarHBondContact NZ-OD2 3.21Å
188	K	85.5	Confident	89	Confident	116 Å²	116	30.7 Å²	30.7	50%	0.504	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-71.1	-26.4	-175.9	-67	-174.1	-172.4	165.7	0	114.1	D146 N186	D146-K188 HydrophobicContact CB-CD 3.95Å; D146-K188 WeakPolarHBondContact OD2-CD 3.49Å; D146-K188 IonicContact OD2-NZ 2.78Å; D146-K188 PolarHBondContact OD2-NZ 3.16Å; N186-K188 VanDerWaalsContact C-N 3.27Å; N186-K188 PolarHBondContact O-N 3.33Å; N186-K188 PolarHBondContact OD1-N 3.42Å
189	T	87.4	Confident	88.8	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.006	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-113	3.4	-177.3	60	0	0	0	0	112.2	V149 K150 N186 K187 L191 Q192 T193	V149-T189 HydrophobicContact CB-CG2 4.2Å; V149-T189 HydrophobicContact CG1-CG2 3.94Å; K150-T189 HydrophobicContact CB-CG2 4.16Å; N186-T189 WeakPolarHBondContact CB-OG1 3.31Å; N186-T189 PolarHBondContact O-N 3.16Å; K187-T189 VanDerWaalsContact C-N 3.32Å; K187-T189 PolarHBondContact O-N 3.03Å; T189-L191 PolarHBondContact O-N 3.2Å; T189-Q192 VanDerWaalsContact C-OE1 3.3Å; T189-Q192 PolarHBondContact O-OE1 2.9Å; T189-T193 WeakPolarHBondContact O-CB 3.22Å; T189-T193 PolarHBondContact O-N 3.37Å; T189-T193 PolarHBondContact O-OG1 3.27Å
190	F	88.5	Confident	88.8	Confident	8 Å²	8	30.7 Å²	30.7	4%	0.035	16%	0.156	C	C	.	.	H	α-helix	trans	-57.8	-52.3	-171.6	175.4	-87	0	0	0	111.8	M184 N186 T193 A194 F223 Q227 N230	M184-F190 HydrophobicContact CB-CD2 3.97Å; M184-F190 HydrophobicContact CB-CE2 4.02Å; M184-F190 HydrophobicContact CE-CD2 4.11Å; M184-F190 HydrophobicContact CE-CE1 4.42Å; M184-F190 HydrophobicContact CE-CE2 3.3Å; M184-F190 HydrophobicContact CE-CZ 3.46Å; M184-F190 VanDerWaalsContact CE-CZ 3.46Å; M184-F190 VanDerWaalsContact O-CD2 3.28Å; M184-F190 WeakPolarHBondContact O-CD2 3.38Å; N186-F190 WeakPolarHBondContact O-CB 3.22Å; N186-F190 PolarHBondContact O-N 2.84Å; F190-T193 WeakPolarHBondContact O-CB 3.23Å; F190-T193 PolarHBondContact O-N 2.95Å; F190-A194 HydrophobicContact CE1-CB 4.23Å; F190-A194 WeakPolarHBondContact O-CB 3.24Å; F190-A194 PolarHBondContact O-N 2.72Å; F190-F223 HydrophobicContact CD2-CE1 4.32Å; F190-F223 HydrophobicContact CE2-CD1 4.05Å; F190-F223 AromaticContact CE2-CE1 3.74Å; F190-F223 HydrophobicContact CE2-CE1 3.74Å; F190-F223 AromaticContact CE2-CZ 3.99Å; F190-F223 HydrophobicContact CE2-CZ 3.99Å; F190-Q227 HydrophobicContact CD1-CB 4.44Å; F190-Q227 HydrophobicContact CD1-CG 3.93Å; F190-Q227 HydrophobicContact CD2-CB 4.13Å; F190-Q227 HydrophobicContact CD2-CG 3.79Å; F190-Q227 HydrophobicContact CE1-CB 4.05Å; F190-Q227 HydrophobicContact CE1-CG 4.04Å; F190-Q227 HydrophobicContact CE2-CB 3.64Å; F190-Q227 HydrophobicContact CE2-CG 3.85Å; F190-Q227 HydrophobicContact CG-CG 3.84Å; F190-Q227 VanDerWaalsContact CZ-CA 3.48Å; F190-Q227 HydrophobicContact CZ-CB 3.64Å; F190-Q227 HydrophobicContact CZ-CG 4.01Å; F190-Q227 WeakPolarHBondContact CZ-O 3.46Å; F190-N230 HydrophobicContact CE1-CB 3.66Å; F190-N230 HydrophobicContact CZ-CB 4.15Å
191	L	84.7	Confident	88.7	Confident	31 Å²	31	31.1 Å²	31.1	16%	0.162	16%	0.158	C	C	.	.	H	α-helix	trans	-66.6	-45	-172.8	-173.7	61.3	0	0	0	111.1	T189 T193 A194 T195 M322	T189-L191 PolarHBondContact O-N 3.2Å; L191-T193 VanDerWaalsContact C-N 3.28Å; L191-T193 PolarHBondContact O-N 2.73Å; L191-A194 PolarHBondContact O-N 3.02Å; L191-A194 VanDerWaalsContact O-N 3.17Å; L191-T195 PolarHBondContact O-N 2.78Å; L191-T195 PolarHBondContact O-OG1 3.1Å; L191-T195 VanDerWaalsContact O-OG1 3.04Å; L191-M322 HydrophobicContact CD2-CG 3.95Å
192	Q	85.8	Confident	88.4	Confident	24 Å²	24	34 Å²	34	11%	0.112	19%	0.189	C	C	.	.	H	α-helix	trans	-61.1	-39.5	176.3	-59	87.8	-18	0	0	111.5	L153 T189 L196 M322	L153-Q192 HydrophobicContact CB-CB 4.2Å; L153-Q192 HydrophobicContact CD1-CB 4.28Å; T189-Q192 VanDerWaalsContact C-OE1 3.3Å; T189-Q192 PolarHBondContact O-OE1 2.9Å; Q192-L196 WeakPolarHBondContact O-CB 3.39Å; Q192-L196 PolarHBondContact O-N 3.34Å; Q192-L196 VanDerWaalsContact O-N 3.08Å; Q192-M322 HydrophobicContact CG-CE 4.31Å; Q192-M322 HydrophobicContact CG-SD 4.18Å
193	T	91.7	Very high	88.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-46.9	175.3	-54.9	0	0	0	0	110.6	L153 L180 L183 M184 T189 F190 L191 L196 I197	L153-T193 VanDerWaalsContact CD1-OG1 3.27Å; L153-T193 WeakPolarHBondContact CD1-OG1 3.46Å; L180-T193 HydrophobicContact CB-CG2 4.28Å; L180-T193 WeakPolarHBondContact O-CG2 3.47Å; L183-T193 HydrophobicContact CB-CG2 3.91Å; M184-T193 HydrophobicContact CG-CG2 3.65Å; T189-T193 WeakPolarHBondContact O-CB 3.22Å; T189-T193 PolarHBondContact O-N 3.37Å; T189-T193 PolarHBondContact O-OG1 3.27Å; F190-T193 WeakPolarHBondContact O-CB 3.23Å; F190-T193 PolarHBondContact O-N 2.95Å; L191-T193 VanDerWaalsContact C-N 3.28Å; L191-T193 PolarHBondContact O-N 2.73Å; T193-L196 PolarHBondContact O-N 3.14Å; T193-I197 HydrophobicContact CG2-CD1 3.97Å; T193-I197 VanDerWaalsContact O-CG1 3.3Å; T193-I197 WeakPolarHBondContact O-CG1 3.21Å; T193-I197 PolarHBondContact O-N 3.46Å
194	A	89.9	Confident	88.2	Confident	5 Å²	5	35.2 Å²	35.2	4%	0.041	19%	0.194	C	C	.	.	H	α-helix	trans	-63	-45.4	-178.7	0	0	0	0	0	112	M184 F190 L191 I197 E198 I234	M184-A194 HydrophobicContact CE-CB 4.06Å; F190-A194 HydrophobicContact CE1-CB 4.23Å; F190-A194 WeakPolarHBondContact O-CB 3.24Å; F190-A194 PolarHBondContact O-N 2.72Å; L191-A194 PolarHBondContact O-N 3.02Å; L191-A194 VanDerWaalsContact O-N 3.17Å; A194-I197 PolarHBondContact O-N 3.27Å; A194-E198 WeakPolarHBondContact O-CB 3.35Å; A194-E198 PolarHBondContact O-N 2.94Å; A194-I234 HydrophobicContact CB-CD1 4.09Å
195	T	87.1	Confident	87.9	Confident	26 Å²	26	45.3 Å²	45.3	16%	0.16	24%	0.238	C	C	.	.	H	α-helix	trans	-60.2	-45.5	175.7	-57.1	0	0	0	0	111.4	Y157 L191 I197 E198 D199	Y157-T195 HydrophobicContact CD2-CG2 4.13Å; Y157-T195 HydrophobicContact CE2-CG2 3.52Å; L191-T195 PolarHBondContact O-N 2.78Å; L191-T195 PolarHBondContact O-OG1 3.1Å; L191-T195 VanDerWaalsContact O-OG1 3.04Å; T195-I197 VanDerWaalsContact C-N 3.34Å; T195-I197 PolarHBondContact O-N 3.04Å; T195-E198 WeakPolarHBondContact O-CB 3.47Å; T195-E198 PolarHBondContact O-N 3.34Å; T195-D199 PolarHBondContact O-N 2.88Å
196	L	91	Very high	87.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-40.1	177.9	-177.9	61.9	0	0	0	112	L153 L156 L180 Q192 T193 I200	L153-L196 HydrophobicContact CD2-CD2 3.8Å; L156-L196 HydrophobicContact CB-CD2 4.17Å; L156-L196 HydrophobicContact CD1-CD2 4.34Å; L180-L196 HydrophobicContact CD1-CD2 4.2Å; L180-L196 HydrophobicContact CD1-CG 4.32Å; L180-L196 HydrophobicContact CD2-CD2 4.25Å; Q192-L196 WeakPolarHBondContact O-CB 3.39Å; Q192-L196 PolarHBondContact O-N 3.34Å; Q192-L196 VanDerWaalsContact O-N 3.08Å; T193-L196 PolarHBondContact O-N 3.14Å; L196-I200 HydrophobicContact CD1-CD1 4.01Å; L196-I200 HydrophobicContact CD1-CG1 4.34Å; L196-I200 HydrophobicContact CG-CD1 3.85Å; L196-I200 WeakPolarHBondContact O-CB 3.32Å; L196-I200 WeakPolarHBondContact O-CD1 3.02Å; L196-I200 WeakPolarHBondContact O-CG1 3.49Å; L196-I200 PolarHBondContact O-N 2.93Å; L196-I200 VanDerWaalsContact O-N 3.07Å
197	I	93.3	Very high	88	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.4	-45	174.8	-69.3	167.8	0	0	0	110.4	L180 F181 M184 T193 A194 T195 D199 I200 L201 I234	L180-I197 HydrophobicContact CB-CD1 3.77Å; L180-I197 HydrophobicContact CB-CG1 3.64Å; L180-I197 HydrophobicContact CD1-CG1 3.92Å; L180-I197 HydrophobicContact CG-CG1 4.43Å; F181-I197 HydrophobicContact CD2-CD1 4.28Å; F181-I197 HydrophobicContact CE2-CD1 4.44Å; F181-I197 HydrophobicContact CE2-CG2 4.19Å; F181-I197 HydrophobicContact CG-CD1 4.37Å; F181-I197 HydrophobicContact CZ-CG2 4.13Å; M184-I197 HydrophobicContact CG-CD1 4.17Å; M184-I197 HydrophobicContact SD-CD1 3.64Å; T193-I197 HydrophobicContact CG2-CD1 3.97Å; T193-I197 VanDerWaalsContact O-CG1 3.3Å; T193-I197 WeakPolarHBondContact O-CG1 3.21Å; T193-I197 PolarHBondContact O-N 3.46Å; A194-I197 PolarHBondContact O-N 3.27Å; T195-I197 VanDerWaalsContact C-N 3.34Å; T195-I197 PolarHBondContact O-N 3.04Å; I197-D199 PolarHBondContact O-N 3.49Å; I197-I200 PolarHBondContact O-N 3.35Å; I197-L201 HydrophobicContact CG2-CD1 3.63Å; I197-L201 HydrophobicContact CG2-CG 3.99Å; I197-L201 WeakPolarHBondContact O-CB 3.21Å; I197-L201 VanDerWaalsContact O-CG 3.26Å; I197-L201 WeakPolarHBondContact O-CG 3.28Å; I197-L201 PolarHBondContact O-N 2.89Å; I197-I234 HydrophobicContact CB-CD1 4.07Å; I197-I234 HydrophobicContact CD1-CD1 4.22Å; I197-I234 HydrophobicContact CG2-CD1 3.89Å; I197-I234 HydrophobicContact CG2-CG1 4.07Å; I197-I234 HydrophobicContact CG2-CG2 3.83Å
198	E	88.6	Confident	88.2	Confident	50 Å²	50	40.3 Å²	40.3	23%	0.234	21%	0.21	C	C	.	.	H	α-helix	trans	-57.3	-49.2	179.5	-173.9	176.2	-176.2	0	0	111.7	A194 T195 I200 L201 G202 R233	A194-E198 WeakPolarHBondContact O-CB 3.35Å; A194-E198 PolarHBondContact O-N 2.94Å; T195-E198 WeakPolarHBondContact O-CB 3.47Å; T195-E198 PolarHBondContact O-N 3.34Å; E198-I200 PolarHBondContact O-N 3.39Å; E198-L201 PolarHBondContact O-N 3.38Å; E198-G202 PolarHBondContact O-N 3.19Å; E198-R233 IonicContact OE1-CZ 2.96Å; E198-R233 VanDerWaalsContact OE1-CZ 3.31Å; E198-R233 IonicContact OE1-NE 2.84Å; E198-R233 PolarHBondContact OE1-NE 2.87Å; E198-R233 VanDerWaalsContact OE1-NE 3.1Å; E198-R233 IonicContact OE1-NH2 2.76Å; E198-R233 PolarHBondContact OE1-NH2 3.45Å; E198-R233 IonicContact OE2-CZ 2.69Å; E198-R233 IonicContact OE2-NE 2.99Å; E198-R233 PolarHBondContact OE2-NE 2.86Å; E198-R233 IonicContact OE2-NH2 2.94Å; E198-R233 PolarHBondContact OE2-NH2 2.89Å
199	D	87.3	Confident	88.5	Confident	55 Å²	55	39.5 Å²	39.5	29%	0.294	21%	0.208	S	C	.	.	H	α-helix	trans	-63.2	-42.3	178	-72	-14	0	0	0	112.5	Y157 T195 I197 G202	Y157-D199 WeakPolarHBondContact CE2-OD2 3.42Å; T195-D199 PolarHBondContact O-N 2.88Å; I197-D199 PolarHBondContact O-N 3.49Å; D199-G202 PolarHBondContact O-N 2.95Å
200	I	91.9	Very high	88.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-46	177.8	-73.6	171.6	0	0	0	110.7	T167 L170 A171 F176 V177 L180 L196 I197 E198 G202 V203 K204	T167-I200 HydrophobicContact CG2-CG1 4.37Å; L170-I200 HydrophobicContact CB-CD1 3.99Å; L170-I200 HydrophobicContact CB-CG1 4.22Å; L170-I200 HydrophobicContact CD1-CD1 4.29Å; A171-I200 HydrophobicContact CB-CG2 3.85Å; F176-I200 HydrophobicContact CE1-CD1 4.21Å; V177-I200 HydrophobicContact CG1-CG2 4.48Å; V177-I200 HydrophobicContact CG2-CG2 3.71Å; L180-I200 HydrophobicContact CD1-CD1 3.77Å; L196-I200 HydrophobicContact CD1-CD1 4.01Å; L196-I200 HydrophobicContact CD1-CG1 4.34Å; L196-I200 HydrophobicContact CG-CD1 3.85Å; L196-I200 WeakPolarHBondContact O-CB 3.32Å; L196-I200 WeakPolarHBondContact O-CD1 3.02Å; L196-I200 WeakPolarHBondContact O-CG1 3.49Å; L196-I200 PolarHBondContact O-N 2.93Å; L196-I200 VanDerWaalsContact O-N 3.07Å; I197-I200 PolarHBondContact O-N 3.35Å; E198-I200 PolarHBondContact O-N 3.39Å; I200-G202 VanDerWaalsContact C-N 3.3Å; I200-G202 PolarHBondContact O-N 3.42Å; I200-V203 WeakPolarHBondContact O-CG2 3.38Å; I200-V203 PolarHBondContact O-N 3.03Å; I200-K204 PolarHBondContact O-N 3.42Å
201	L	90.3	Very high	88.9	Confident	9 Å²	9	46 Å²	46	5%	0.047	24%	0.238	C	C	.	.	H	α-helix	trans	-67	-33.3	178.6	-71.1	-178.7	0	0	0	111.9	I197 E198 V203 K204 I208 I234 V237 T238	I197-L201 HydrophobicContact CG2-CD1 3.63Å; I197-L201 HydrophobicContact CG2-CG 3.99Å; I197-L201 WeakPolarHBondContact O-CB 3.21Å; I197-L201 VanDerWaalsContact O-CG 3.26Å; I197-L201 WeakPolarHBondContact O-CG 3.28Å; I197-L201 PolarHBondContact O-N 2.89Å; E198-L201 PolarHBondContact O-N 3.38Å; L201-V203 PolarHBondContact O-N 2.99Å; L201-K204 HydrophobicContact CD2-CD 4.23Å; L201-K204 PolarHBondContact O-N 3.37Å; L201-K204 VanDerWaalsContact O-N 3.14Å; L201-I208 HydrophobicContact CD2-CD1 3.62Å; L201-I208 HydrophobicContact CD2-CG1 3.86Å; L201-I234 HydrophobicContact CD1-CG2 3.78Å; L201-V237 HydrophobicContact CB-CG1 4.16Å; L201-T238 HydrophobicContact CD1-CG2 3.73Å
202	G	86.9	Confident	89.1	Confident	62 Å²	62	46.5 Å²	46.5	64%	0.639	25%	0.25	S	S	*	.	H	α-helix	trans	-59.6	-26.7	177.2	0	0	0	0	0	114.3	E198 D199 I200	E198-G202 PolarHBondContact O-N 3.19Å; D199-G202 PolarHBondContact O-N 2.95Å; I200-G202 VanDerWaalsContact C-N 3.3Å; I200-G202 PolarHBondContact O-N 3.42Å
203	V	88.3	Confident	89.3	Confident	65 Å²	65	45.6 Å²	45.6	39%	0.394	25%	0.247	S	C	.	.	H	α-helix	trans	-104.3	-7.6	176.4	-56.4	0	0	0	0	113.8	T167 K168 A171 I200 L201 K205	T167-V203 HydrophobicContact CG2-CG1 4.26Å; T167-V203 HydrophobicContact CG2-CG2 3.58Å; K168-V203 HydrophobicContact CG-CG2 4.45Å; A171-V203 HydrophobicContact CB-CG2 3.93Å; I200-V203 WeakPolarHBondContact O-CG2 3.38Å; I200-V203 PolarHBondContact O-N 3.03Å; L201-V203 PolarHBondContact O-N 2.99Å; V203-K205 PolarHBondContact O-N 2.94Å
204	K	87.3	Confident	89	Confident	37 Å²	37	49.9 Å²	49.9	16%	0.161	27%	0.274	C	S	.	.			trans	-77.8	119.6	-175.5	-166.2	176.7	174.1	56.4	0	110.3	A171 D174 I200 L201 E206 I208	A171-K204 HydrophobicContact CB-CB 4.07Å; A171-K204 HydrophobicContact CB-CG 4.28Å; A171-K204 PolarHBondContact O-NZ 3.27Å; D174-K204 VanDerWaalsContact OD1-CE 3.28Å; D174-K204 WeakPolarHBondContact OD1-CE 3.48Å; D174-K204 IonicContact OD1-NZ 3.41Å; D174-K204 PolarHBondContact OD1-NZ 3.07Å; I200-K204 PolarHBondContact O-N 3.42Å; L201-K204 HydrophobicContact CD2-CD 4.23Å; L201-K204 PolarHBondContact O-N 3.37Å; L201-K204 VanDerWaalsContact O-N 3.14Å; K204-E206 VanDerWaalsContact CD-O 3.29Å; K204-E206 WeakPolarHBondContact CD-O 3.45Å; K204-E206 WeakPolarHBondContact CE-O 3.33Å; K204-E206 VanDerWaalsContact CG-O 3.3Å; K204-E206 WeakPolarHBondContact CG-O 3.47Å; K204-I208 HydrophobicContact CD-CD1 4.01Å; K204-I208 HydrophobicContact CD-CG1 3.78Å; K204-I208 VanDerWaalsContact CE-CG1 3.42Å
205	K	82.4	Confident	89	Confident	211 Å²	211	55.5 Å²	55.5	92%	0.917	30%	0.304	S	S	*	.	S	Bend	trans	-69.3	-35	179.6	-66.3	-175	177.9	-178.1	0	113.4	V203	V203-K205 PolarHBondContact O-N 2.94Å
206	E	85.4	Confident	89.3	Confident	110 Å²	110	54.9 Å²	54.9	51%	0.514	30%	0.299	S	S	.	.	S	Bend	trans	-102.4	121.4	-177.2	-81.4	-162.1	-150.3	0	0	110.7	K204 R267	K204-E206 VanDerWaalsContact CD-O 3.29Å; K204-E206 WeakPolarHBondContact CD-O 3.45Å; K204-E206 WeakPolarHBondContact CE-O 3.33Å; K204-E206 VanDerWaalsContact CG-O 3.3Å; K204-E206 WeakPolarHBondContact CG-O 3.47Å; E206-R267 IonicContact OE2-CZ 2.81Å; E206-R267 IonicContact OE2-NH1 2.94Å; E206-R267 PolarHBondContact OE2-NH1 3.43Å; E206-R267 IonicContact OE2-NH2 3.17Å; E206-R267 PolarHBondContact OE2-NH2 3.39Å
207	M	89.1	Confident	89.4	Confident	29 Å²	29	56.7 Å²	56.7	14%	0.143	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-61.8	137.3	178.4	-175.6	-178.2	-75.9	0	0	111.7	S240 R267 A268	M207-S240 WeakPolarHBondContact CE-O 3.45Å; M207-R267 HydrophobicContact CB-CB 4.15Å; M207-R267 HydrophobicContact CG-CB 4.22Å; M207-R267 WeakPolarHBondContact O-CD 3.34Å; M207-R267 PolarHBondContact O-NH1 3.27Å; M207-R267 HydrophobicContact SD-CB 3.84Å; M207-A268 HydrophobicContact CE-CB 3.65Å; M207-A268 WeakPolarHBondContact SD-CA 3.48Å; M207-A268 HydrophobicContact SD-CB 3.59Å; M207-A268 VanDerWaalsContact SD-CB 3.59Å; M207-A268 PolarHBondContact SD-N 3.44Å
208	I	90.5	Very high	89.4	Confident	8 Å²	8	57.8 Å²	57.8	4%	0.041	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-74.4	143.7	176.4	-62.8	-165.4	0	0	0	110.7	V177 L178 L201 K204 N271	V177-I208 HydrophobicContact CB-CD1 3.61Å; V177-I208 HydrophobicContact CG1-CD1 3.16Å; V177-I208 HydrophobicContact CG2-CD1 4.29Å; L178-I208 HydrophobicContact CD2-CG2 3.85Å; L201-I208 HydrophobicContact CD2-CD1 3.62Å; L201-I208 HydrophobicContact CD2-CG1 3.86Å; K204-I208 HydrophobicContact CD-CD1 4.01Å; K204-I208 HydrophobicContact CD-CG1 3.78Å; K204-I208 VanDerWaalsContact CE-CG1 3.42Å; I208-N271 PolarHBondContact O-ND2 3.39Å
209	Q	91.1	Very high	89.6	Confident	99 Å²	99	55.8 Å²	55.8	46%	0.463	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-88.3	116.2	170.8	-67.1	-179	-37	0	0	110.2	E211 G212 R267	Q209-E211 PolarHBondContact O-N 3.13Å; Q209-G212 PolarHBondContact O-N 2.93Å; Q209-G212 VanDerWaalsContact O-N 3.13Å; Q209-R267 HydrophobicContact CG-CG 4.32Å
210	L	93.1	Very high	89.9	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-65.3	-27.6	-179.1	-65.4	-177.9	0	0	0	112.4	F181 G212 I213 L216 L235 T238 N271 T274 L275	F181-L210 HydrophobicContact CE1-CD2 4.35Å; F181-L210 HydrophobicContact CZ-CD2 4.39Å; L210-G212 PolarHBondContact O-N 3.45Å; L210-I213 HydrophobicContact CB-CD1 4.42Å; L210-I213 HydrophobicContact CD2-CD1 3.68Å; L210-I213 WeakPolarHBondContact O-CB 3.29Å; L210-I213 WeakPolarHBondContact O-CG1 3.34Å; L210-I213 PolarHBondContact O-N 2.97Å; L210-L216 HydrophobicContact CB-CD2 3.87Å; L210-L235 HydrophobicContact CD1-CD2 4.06Å; L210-T238 HydrophobicContact CD2-CG2 4.41Å; L210-N271 HydrophobicContact CD1-CB 3.87Å; L210-N271 HydrophobicContact CG-CB 4.06Å; L210-N271 PolarHBondContact N-OD1 3.46Å; L210-T274 HydrophobicContact CB-CG2 4.34Å; L210-L275 HydrophobicContact CD1-CD1 4.09Å; L210-L275 HydrophobicContact CD1-CD2 4.01Å; L210-L275 HydrophobicContact CD1-CG 3.94Å
211	E	90.7	Very high	90	Very high	145 Å²	145	58 Å²	58	68%	0.678	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-59.7	-26.3	174.8	-171.5	176.2	-171.7	0	0	112.7	Q209 I213	Q209-E211 PolarHBondContact O-N 3.13Å; E211-I213 PolarHBondContact O-N 2.97Å
212	G	89.2	Confident	90.1	Very high	41 Å²	41	60 Å²	60	42%	0.423	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-70.5	-11.2	175.4	0	0	0	0	0	114.4	Q209 L210 P214	Q209-G212 PolarHBondContact O-N 2.93Å; Q209-G212 VanDerWaalsContact O-N 3.13Å; L210-G212 PolarHBondContact O-N 3.45Å; G212-P214 WeakPolarHBondContact O-CD 3.34Å
213	I	90.6	Very high	90.4	Very high	6 Å²	6	57.4 Å²	57.4	3%	0.031	31%	0.308	C	S	.	.	S	Bend	trans	-79.8	119.6	-179.2	-60.1	165.6	0	0	0	109.7	L178 F181 L210 E211 N215 L216 L219	L178-I213 HydrophobicContact CD2-CG1 3.67Å; F181-I213 HydrophobicContact CB-CD1 4.09Å; F181-I213 HydrophobicContact CB-CG1 4.25Å; F181-I213 HydrophobicContact CB-CG2 3.88Å; F181-I213 HydrophobicContact CD1-CD1 3.45Å; F181-I213 VanDerWaalsContact CD1-CD1 3.45Å; F181-I213 HydrophobicContact CD1-CG1 4.46Å; F181-I213 HydrophobicContact CD2-CD1 3.89Å; F181-I213 HydrophobicContact CD2-CG1 4.27Å; F181-I213 HydrophobicContact CE1-CD1 3.72Å; F181-I213 HydrophobicContact CE2-CD1 4.17Å; F181-I213 HydrophobicContact CG-CD1 3.54Å; F181-I213 HydrophobicContact CG-CG1 4.09Å; F181-I213 HydrophobicContact CZ-CD1 4.08Å; L210-I213 HydrophobicContact CB-CD1 4.42Å; L210-I213 HydrophobicContact CD2-CD1 3.68Å; L210-I213 WeakPolarHBondContact O-CB 3.29Å; L210-I213 WeakPolarHBondContact O-CG1 3.34Å; L210-I213 PolarHBondContact O-N 2.97Å; E211-I213 PolarHBondContact O-N 2.97Å; I213-N215 PolarHBondContact O-N 3.11Å; I213-L216 HydrophobicContact CB-CB 4.2Å; I213-L216 HydrophobicContact CB-CD1 4.25Å; I213-L216 HydrophobicContact CD1-CD1 3.92Å; I213-L216 HydrophobicContact CG2-CB 4.27Å; I213-L216 HydrophobicContact CG2-CD1 4.08Å; I213-L216 PolarHBondContact O-N 3.13Å; I213-L219 HydrophobicContact CG2-CD2 4.3Å
214	P	85.8	Confident	90.4	Very high	89 Å²	89	57.1 Å²	57.1	58%	0.578	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	125	-179.9	-23.1	33.8	0	0	0	112.2	G212 L216	G212-P214 WeakPolarHBondContact O-CD 3.34Å; P214-L216 VanDerWaalsContact C-N 3.3Å; P214-L216 PolarHBondContact O-N 2.98Å
215	N	88.9	Confident	90.3	Very high	124 Å²	124	59.9 Å²	59.9	66%	0.663	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	44.1	-179.9	-169.3	27.5	0	0	0	113.7	I213 S217 G218 L219	I213-N215 PolarHBondContact O-N 3.11Å; N215-S217 PolarHBondContact O-N 3.29Å; N215-S217 VanDerWaalsContact O-N 3.16Å; N215-G218 PolarHBondContact O-N 3.19Å; N215-G218 PolarHBondContact OD1-N 2.78Å; N215-L219 PolarHBondContact O-N 3.02Å
216	L	93.6	Very high	90.3	Very high	12 Å²	12	52.2 Å²	52.2	6%	0.063	29%	0.286	C	S	.	.	H	α-helix	trans	-49.4	-41.6	177.6	-179.8	63.6	0	0	0	112.9	L210 I213 P214 G218 L219 V220 T274 I278	L210-L216 HydrophobicContact CB-CD2 3.87Å; I213-L216 HydrophobicContact CB-CB 4.2Å; I213-L216 HydrophobicContact CB-CD1 4.25Å; I213-L216 HydrophobicContact CD1-CD1 3.92Å; I213-L216 HydrophobicContact CG2-CB 4.27Å; I213-L216 HydrophobicContact CG2-CD1 4.08Å; I213-L216 PolarHBondContact O-N 3.13Å; P214-L216 VanDerWaalsContact C-N 3.3Å; P214-L216 PolarHBondContact O-N 2.98Å; L216-G218 PolarHBondContact O-N 3.11Å; L216-L219 HydrophobicContact CD1-CD2 4.39Å; L216-L219 WeakPolarHBondContact O-CB 3.48Å; L216-L219 PolarHBondContact O-N 2.85Å; L216-V220 HydrophobicContact CD1-CG2 3.96Å; L216-V220 HydrophobicContact CG-CG2 4.31Å; L216-V220 WeakPolarHBondContact O-CG2 3.04Å; L216-V220 PolarHBondContact O-N 3.47Å; L216-T274 HydrophobicContact CD2-CG2 3.85Å; L216-I278 HydrophobicContact CD2-CD1 4.15Å; L216-I278 HydrophobicContact CG-CD1 4.01Å
217	S	93.6	Very high	90.5	Very high	39 Å²	39	47.5 Å²	47.5	27%	0.273	26%	0.263	S	S	.	.	H	α-helix	trans	-58.6	-48.3	177.4	-177.4	0	0	0	0	111.8	N215 L219 V220 Q221	N215-S217 PolarHBondContact O-N 3.29Å; N215-S217 VanDerWaalsContact O-N 3.16Å; S217-L219 VanDerWaalsContact C-N 3.34Å; S217-L219 PolarHBondContact O-N 3.47Å; S217-V220 PolarHBondContact O-N 3.34Å; S217-Q221 VanDerWaalsContact O-CB 3.31Å; S217-Q221 WeakPolarHBondContact O-CB 3.48Å; S217-Q221 WeakPolarHBondContact O-CG 3.39Å; S217-Q221 PolarHBondContact O-N 2.7Å
218	G	93.4	Very high	90.6	Very high	22 Å²	22	46.1 Å²	46.1	23%	0.227	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-36.7	177.7	0	0	0	0	0	112.7	N215 L216 Q221 S222	N215-G218 PolarHBondContact O-N 3.19Å; N215-G218 PolarHBondContact OD1-N 2.78Å; L216-G218 PolarHBondContact O-N 3.11Å; G218-Q221 PolarHBondContact O-N 3.26Å; G218-S222 PolarHBondContact O-N 2.98Å
219	L	92.8	Very high	90.4	Very high	9 Å²	9	45.8 Å²	45.8	5%	0.047	26%	0.255	C	S	.	.	H	α-helix	trans	-60.4	-55.4	174.3	175.3	65.9	0	0	0	111	F181 M184 T185 I213 N215 L216 S217 Q221 S222 F223	F181-L219 HydrophobicContact CB-CD2 4.22Å; F181-L219 WeakPolarHBondContact O-CD2 3.5Å; M184-L219 HydrophobicContact CB-CD1 4.26Å; T185-L219 VanDerWaalsContact OG1-CD1 3.27Å; T185-L219 WeakPolarHBondContact OG1-CD1 3.43Å; I213-L219 HydrophobicContact CG2-CD2 4.3Å; N215-L219 PolarHBondContact O-N 3.02Å; L216-L219 HydrophobicContact CD1-CD2 4.39Å; L216-L219 WeakPolarHBondContact O-CB 3.48Å; L216-L219 PolarHBondContact O-N 2.85Å; S217-L219 VanDerWaalsContact C-N 3.34Å; S217-L219 PolarHBondContact O-N 3.47Å; L219-Q221 VanDerWaalsContact C-N 3.27Å; L219-Q221 PolarHBondContact O-N 3.27Å; L219-S222 WeakPolarHBondContact O-CB 3.43Å; L219-S222 PolarHBondContact O-N 3.33Å; L219-S222 PolarHBondContact O-OG 3.31Å; L219-F223 HydrophobicContact CD1-CE1 3.65Å; L219-F223 HydrophobicContact CD1-CZ 3.85Å; L219-F223 HydrophobicContact CD2-CZ 4.27Å; L219-F223 HydrophobicContact CG-CE1 3.98Å; L219-F223 HydrophobicContact CG-CZ 3.71Å; L219-F223 PolarHBondContact O-N 2.87Å
220	V	94.1	Very high	90.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-38	-179.2	173.6	0	0	0	0	111	L216 S217 S222 F223 L228 F231 I278 F281 R284	L216-V220 HydrophobicContact CD1-CG2 3.96Å; L216-V220 HydrophobicContact CG-CG2 4.31Å; L216-V220 WeakPolarHBondContact O-CG2 3.04Å; L216-V220 PolarHBondContact O-N 3.47Å; S217-V220 PolarHBondContact O-N 3.34Å; V220-S222 VanDerWaalsContact C-N 3.28Å; V220-S222 PolarHBondContact O-N 3.3Å; V220-F223 HydrophobicContact CG2-CE2 4.47Å; V220-F223 WeakPolarHBondContact O-CB 3.45Å; V220-F223 PolarHBondContact O-N 3.08Å; V220-L228 HydrophobicContact CG1-CD1 4.36Å; V220-F231 HydrophobicContact CG2-CE1 3.86Å; V220-F231 HydrophobicContact CG2-CZ 4.28Å; V220-I278 HydrophobicContact CB-CD1 4.2Å; V220-I278 HydrophobicContact CB-CG2 4.33Å; V220-I278 HydrophobicContact CG1-CD1 4.47Å; V220-I278 HydrophobicContact CG1-CG2 4.2Å; V220-I278 HydrophobicContact CG2-CD1 3.92Å; V220-F281 HydrophobicContact CG1-CD2 3.82Å; V220-F281 HydrophobicContact CG1-CE2 4.28Å; V220-R284 PolarHBondContact O-NH1 2.91Å
221	Q	92.3	Very high	90.2	Very high	102 Å²	102	41.5 Å²	41.5	48%	0.477	24%	0.236	S	C	.	.	H	α-helix	trans	-65	-29.1	175.2	-75.7	173.4	-6.4	0	0	113.3	S217 G218 L219 F223	S217-Q221 VanDerWaalsContact O-CB 3.31Å; S217-Q221 WeakPolarHBondContact O-CB 3.48Å; S217-Q221 WeakPolarHBondContact O-CG 3.39Å; S217-Q221 PolarHBondContact O-N 2.7Å; G218-Q221 PolarHBondContact O-N 3.26Å; L219-Q221 VanDerWaalsContact C-N 3.27Å; L219-Q221 PolarHBondContact O-N 3.27Å; Q221-F223 VanDerWaalsContact C-N 3.31Å; Q221-F223 PolarHBondContact O-N 3.1Å
222	S	92.3	Very high	90.3	Very high	51 Å²	51	34.6 Å²	34.6	36%	0.357	20%	0.203	S	C	.	.	H	α-helix	trans	-73.7	-20.6	178.3	77.8	0	0	0	0	114.1	G218 L219 V220	G218-S222 PolarHBondContact O-N 2.98Å; L219-S222 WeakPolarHBondContact O-CB 3.43Å; L219-S222 PolarHBondContact O-N 3.33Å; L219-S222 PolarHBondContact O-OG 3.31Å; V220-S222 VanDerWaalsContact C-N 3.28Å; V220-S222 PolarHBondContact O-N 3.3Å
223	F	93.3	Very high	90.3	Very high	7 Å²	7	36.5 Å²	36.5	3%	0.031	20%	0.198	C	C	.	.			trans	-65	138.1	-179.4	-65.4	-16.6	0	0	0	111.2	M184 F190 L219 V220 Q221 Q227 L228 F231 R284	M184-F223 HydrophobicContact CB-CE1 3.96Å; M184-F223 HydrophobicContact CB-CZ 3.95Å; M184-F223 HydrophobicContact CE-CZ 4.11Å; M184-F223 WeakPolarHBondContact O-CE1 3.3Å; F190-F223 HydrophobicContact CD2-CE1 4.32Å; F190-F223 HydrophobicContact CE2-CD1 4.05Å; F190-F223 AromaticContact CE2-CE1 3.74Å; F190-F223 HydrophobicContact CE2-CE1 3.74Å; F190-F223 AromaticContact CE2-CZ 3.99Å; F190-F223 HydrophobicContact CE2-CZ 3.99Å; L219-F223 HydrophobicContact CD1-CE1 3.65Å; L219-F223 HydrophobicContact CD1-CZ 3.85Å; L219-F223 HydrophobicContact CD2-CZ 4.27Å; L219-F223 HydrophobicContact CG-CE1 3.98Å; L219-F223 HydrophobicContact CG-CZ 3.71Å; L219-F223 PolarHBondContact O-N 2.87Å; V220-F223 HydrophobicContact CG2-CE2 4.47Å; V220-F223 WeakPolarHBondContact O-CB 3.45Å; V220-F223 PolarHBondContact O-N 3.08Å; Q221-F223 VanDerWaalsContact C-N 3.31Å; Q221-F223 PolarHBondContact O-N 3.1Å; F223-Q227 HydrophobicContact CB-CB 3.7Å; F223-Q227 HydrophobicContact CD1-CB 4.08Å; F223-Q227 HydrophobicContact CG-CB 3.92Å; F223-L228 HydrophobicContact CB-CB 4.32Å; F223-F231 HydrophobicContact CD2-CB 4.17Å; F223-F231 HydrophobicContact CD2-CD1 4.43Å; F223-F231 HydrophobicContact CD2-CG 4.25Å; F223-F231 HydrophobicContact CE2-CB 3.88Å; F223-F231 AromaticContact CE2-CD1 3.95Å; F223-F231 HydrophobicContact CE2-CD1 3.95Å; F223-F231 AromaticContact CE2-CD2 3.77Å; F223-F231 HydrophobicContact CE2-CD2 3.77Å; F223-F231 HydrophobicContact CE2-CE1 4.41Å; F223-F231 HydrophobicContact CE2-CE2 4.25Å; F223-F231 AromaticContact CE2-CG 3.6Å; F223-F231 HydrophobicContact CE2-CG 3.6Å; F223-F231 HydrophobicContact CZ-CD2 4.32Å; F223-R284 PolarHBondContact O-NH2 2.85Å
224	D	89.6	Confident	90.3	Very high	58 Å²	58	36.2 Å²	36.2	31%	0.31	20%	0.196	S	C	.	.			trans	-76.6	-171.8	161	59.5	43.4	0	0	0	111.3	K187 Q226 Q227 L228	K187-D224 IonicContact NZ-OD2 2.72Å; K187-D224 PolarHBondContact NZ-OD2 3.21Å; D224-Q226 PolarHBondContact OD1-N 3.03Å; D224-Q226 VanDerWaalsContact OD1-N 3.11Å; D224-Q227 WeakPolarHBondContact OD1-CG 3.27Å; D224-Q227 PolarHBondContact OD1-N 3.28Å; D224-Q227 PolarHBondContact OD2-OE1 3.49Å; D224-L228 WeakPolarHBondContact O-CB 2.97Å; D224-L228 PolarHBondContact O-N 3.21Å
225	Q	85.4	Confident	90.7	Very high	95 Å²	95	32 Å²	32	44%	0.444	17%	0.169	S	C	.	.	H	α-helix	trans	-64.8	-39.8	-177.2	-75.1	-172.9	19.6	0	0	112.6	A229 L288	Q225-A229 WeakPolarHBondContact O-CB 3.32Å; Q225-A229 PolarHBondContact O-N 2.81Å; Q225-A229 VanDerWaalsContact O-N 3.09Å; Q225-L288 HydrophobicContact CB-CD2 3.67Å; Q225-L288 HydrophobicContact CG-CD2 3.93Å
226	Q	82.4	Confident	90.6	Very high	51 Å²	51	27.3 Å²	27.3	24%	0.238	15%	0.146	C	C	.	.	H	α-helix	trans	-74.5	-42.4	-178.1	-172.7	177.4	-1.3	0	0	110.7	D224 L228 A229 N230 Y363	D224-Q226 PolarHBondContact OD1-N 3.03Å; D224-Q226 VanDerWaalsContact OD1-N 3.11Å; Q226-L228 VanDerWaalsContact C-N 3.34Å; Q226-L228 PolarHBondContact O-N 2.74Å; Q226-A229 PolarHBondContact O-N 2.84Å; Q226-N230 PolarHBondContact O-N 3.32Å; Q226-N230 PolarHBondContact O-ND2 2.86Å; Q226-Y363 HydrophobicContact CG-CE2 3.89Å; Q226-Y363 WeakPolarHBondContact CG-OH 3.34Å; Q226-Y363 PolarHBondContact NE2-OH 2.92Å
227	Q	89.3	Confident	90.4	Very high	10 Å²	10	29.8 Å²	29.8	5%	0.047	16%	0.161	C	C	.	.	H	α-helix	trans	-60.4	-44.5	174.4	-68.9	-179.1	-62.1	0	0	111.3	F190 F223 D224 A229 N230 F231	F190-Q227 HydrophobicContact CD1-CB 4.44Å; F190-Q227 HydrophobicContact CD1-CG 3.93Å; F190-Q227 HydrophobicContact CD2-CB 4.13Å; F190-Q227 HydrophobicContact CD2-CG 3.79Å; F190-Q227 HydrophobicContact CE1-CB 4.05Å; F190-Q227 HydrophobicContact CE1-CG 4.04Å; F190-Q227 HydrophobicContact CE2-CB 3.64Å; F190-Q227 HydrophobicContact CE2-CG 3.85Å; F190-Q227 HydrophobicContact CG-CG 3.84Å; F190-Q227 VanDerWaalsContact CZ-CA 3.48Å; F190-Q227 HydrophobicContact CZ-CB 3.64Å; F190-Q227 HydrophobicContact CZ-CG 4.01Å; F190-Q227 WeakPolarHBondContact CZ-O 3.46Å; F223-Q227 HydrophobicContact CB-CB 3.7Å; F223-Q227 HydrophobicContact CD1-CB 4.08Å; F223-Q227 HydrophobicContact CG-CB 3.92Å; D224-Q227 WeakPolarHBondContact OD1-CG 3.27Å; D224-Q227 PolarHBondContact OD1-N 3.28Å; D224-Q227 PolarHBondContact OD2-OE1 3.49Å; Q227-A229 VanDerWaalsContact C-N 3.34Å; Q227-A229 PolarHBondContact O-N 3.41Å; Q227-N230 PolarHBondContact O-N 2.94Å; Q227-F231 WeakPolarHBondContact O-CB 3.47Å; Q227-F231 PolarHBondContact O-N 3.11Å
228	L	91.8	Very high	90.3	Very high	1 Å²	1	28 Å²	28	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-63.9	-38.7	177.6	-178.8	62	0	0	0	112.4	V220 F223 D224 Q226 F231 C232 F281 R284 L285 L288	V220-L228 HydrophobicContact CG1-CD1 4.36Å; F223-L228 HydrophobicContact CB-CB 4.32Å; D224-L228 WeakPolarHBondContact O-CB 2.97Å; D224-L228 PolarHBondContact O-N 3.21Å; Q226-L228 VanDerWaalsContact C-N 3.34Å; Q226-L228 PolarHBondContact O-N 2.74Å; L228-F231 HydrophobicContact CD1-CD1 4.44Å; L228-F231 WeakPolarHBondContact O-CB 3.46Å; L228-F231 PolarHBondContact O-N 3.17Å; L228-C232 PolarHBondContact O-N 3.27Å; L228-C232 VanDerWaalsContact O-N 3.15Å; L228-C232 PolarHBondContact O-SG 3.22Å; L228-F281 HydrophobicContact CD1-CD2 4.38Å; L228-F281 HydrophobicContact CD1-CE2 3.98Å; L228-R284 HydrophobicContact CD2-CB 3.6Å; L228-L285 HydrophobicContact CD1-CD2 4.44Å; L228-L285 HydrophobicContact CD2-CD2 4.12Å; L228-L285 HydrophobicContact CG-CD2 4.16Å; L228-L288 HydrophobicContact CB-CD1 4.18Å; L228-L288 HydrophobicContact CD2-CD1 3.79Å; L228-L288 HydrophobicContact CG-CD1 3.95Å
229	A	86.4	Confident	90.2	Very high	1 Å²	1	27 Å²	27	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-65.8	-43.5	177.3	0	0	0	0	0	112.4	Q225 Q226 Q227 F231 C232 L288 Y363	Q225-A229 WeakPolarHBondContact O-CB 3.32Å; Q225-A229 PolarHBondContact O-N 2.81Å; Q225-A229 VanDerWaalsContact O-N 3.09Å; Q226-A229 PolarHBondContact O-N 2.84Å; Q227-A229 VanDerWaalsContact C-N 3.34Å; Q227-A229 PolarHBondContact O-N 3.41Å; A229-F231 VanDerWaalsContact C-N 3.32Å; A229-F231 PolarHBondContact O-N 3.06Å; A229-C232 VanDerWaalsContact O-CB 3.28Å; A229-C232 WeakPolarHBondContact O-CB 3.31Å; A229-C232 PolarHBondContact O-N 2.85Å; A229-C232 VanDerWaalsContact O-N 3.16Å; A229-L288 HydrophobicContact CB-CD1 4.46Å; A229-Y363 HydrophobicContact CB-CD1 3.5Å; A229-Y363 VanDerWaalsContact CB-CD1 3.5Å; A229-Y363 HydrophobicContact CB-CD2 4.1Å; A229-Y363 HydrophobicContact CB-CE1 4.08Å; A229-Y363 HydrophobicContact CB-CG 3.49Å; A229-Y363 VanDerWaalsContact CB-CG 3.49Å
230	N	86.6	Confident	90	Very high	9 Å²	9	27.4 Å²	27.4	5%	0.048	14%	0.142	C	C	.	.	H	α-helix	trans	-64.9	-36.7	172.9	-77.4	-72.3	0	0	0	112.2	F190 Q226 Q227 C232 R233 Y363	F190-N230 HydrophobicContact CE1-CB 3.66Å; F190-N230 HydrophobicContact CZ-CB 4.15Å; Q226-N230 PolarHBondContact O-N 3.32Å; Q226-N230 PolarHBondContact O-ND2 2.86Å; Q227-N230 PolarHBondContact O-N 2.94Å; N230-C232 PolarHBondContact O-N 2.95Å; N230-R233 VanDerWaalsContact O-CB 3.32Å; N230-R233 WeakPolarHBondContact O-CB 3.33Å; N230-R233 PolarHBondContact O-N 2.71Å; N230-Y363 WeakPolarHBondContact ND2-CE1 3.26Å; N230-Y363 PolarHBondContact ND2-OH 3.42Å; N230-Y363 WeakPolarHBondContact OD1-CE1 3.35Å
231	F	92.7	Very high	89.1	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.2	-30.1	174.9	-173.4	-117.4	0	0	0	111.9	F181 M184 V220 F223 Q227 L228 A229 R233 I234 L235	F181-F231 AromaticContact CD1-CE2 3.97Å; F181-F231 HydrophobicContact CD1-CE2 3.97Å; F181-F231 AromaticContact CE1-CE2 3.75Å; F181-F231 HydrophobicContact CE1-CE2 3.75Å; F181-F231 HydrophobicContact CE1-CZ 4.33Å; M184-F231 HydrophobicContact CE-CD2 3.78Å; M184-F231 HydrophobicContact CE-CE2 4.5Å; M184-F231 HydrophobicContact SD-CD2 4.27Å; M184-F231 HydrophobicContact SD-CE2 4.44Å; V220-F231 HydrophobicContact CG2-CE1 3.86Å; V220-F231 HydrophobicContact CG2-CZ 4.28Å; F223-F231 HydrophobicContact CD2-CB 4.17Å; F223-F231 HydrophobicContact CD2-CD1 4.43Å; F223-F231 HydrophobicContact CD2-CG 4.25Å; F223-F231 HydrophobicContact CE2-CB 3.88Å; F223-F231 AromaticContact CE2-CD1 3.95Å; F223-F231 HydrophobicContact CE2-CD1 3.95Å; F223-F231 AromaticContact CE2-CD2 3.77Å; F223-F231 HydrophobicContact CE2-CD2 3.77Å; F223-F231 HydrophobicContact CE2-CE1 4.41Å; F223-F231 HydrophobicContact CE2-CE2 4.25Å; F223-F231 AromaticContact CE2-CG 3.6Å; F223-F231 HydrophobicContact CE2-CG 3.6Å; F223-F231 HydrophobicContact CZ-CD2 4.32Å; Q227-F231 WeakPolarHBondContact O-CB 3.47Å; Q227-F231 PolarHBondContact O-N 3.11Å; L228-F231 HydrophobicContact CD1-CD1 4.44Å; L228-F231 WeakPolarHBondContact O-CB 3.46Å; L228-F231 PolarHBondContact O-N 3.17Å; A229-F231 VanDerWaalsContact C-N 3.32Å; A229-F231 PolarHBondContact O-N 3.06Å; F231-R233 PolarHBondContact O-N 2.9Å; F231-I234 HydrophobicContact CD2-CB 4.46Å; F231-I234 HydrophobicContact CD2-CD1 4.24Å; F231-I234 WeakPolarHBondContact O-CB 3.15Å; F231-I234 PolarHBondContact O-N 3.03Å; F231-I234 VanDerWaalsContact O-N 3.09Å; F231-L235 HydrophobicContact CD1-CD1 3.76Å; F231-L235 HydrophobicContact CD1-CD2 4.2Å; F231-L235 HydrophobicContact CD1-CG 3.83Å; F231-L235 HydrophobicContact CE1-CD1 3.75Å; F231-L235 HydrophobicContact CE1-CD2 3.54Å; F231-L235 HydrophobicContact CE1-CG 3.7Å; F231-L235 HydrophobicContact CG-CG 4.47Å; F231-L235 HydrophobicContact CZ-CD2 3.74Å; F231-L235 HydrophobicContact CZ-CG 4.25Å; F231-L235 WeakPolarHBondContact O-CG 3.16Å; F231-L235 PolarHBondContact O-N 2.57Å
232	C	92.6	Very high	87.6	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.4	-28.4	174.9	-64.5	0	0	0	0	113.2	L228 A229 N230 L235 S236 E366 V370	L228-C232 PolarHBondContact O-N 3.27Å; L228-C232 VanDerWaalsContact O-N 3.15Å; L228-C232 PolarHBondContact O-SG 3.22Å; A229-C232 VanDerWaalsContact O-CB 3.28Å; A229-C232 WeakPolarHBondContact O-CB 3.31Å; A229-C232 PolarHBondContact O-N 2.85Å; A229-C232 VanDerWaalsContact O-N 3.16Å; N230-C232 PolarHBondContact O-N 2.95Å; C232-L235 PolarHBondContact O-N 2.7Å; C232-S236 PolarHBondContact O-N 3.06Å; C232-E366 HydrophobicContact CB-CB 3.85Å; C232-V370 HydrophobicContact CB-CG2 3.87Å
233	R	88.4	Confident	85.5	Confident	80 Å²	80	34.7 Å²	34.7	30%	0.302	18%	0.181	S	C	.	.	H	α-helix	trans	-63.2	-44.4	173.2	-64.4	175.8	63.9	160.4	1.9	111.5	E198 N230 F231 L235 S236 E366	E198-R233 IonicContact OE1-CZ 2.96Å; E198-R233 VanDerWaalsContact OE1-CZ 3.31Å; E198-R233 IonicContact OE1-NE 2.84Å; E198-R233 PolarHBondContact OE1-NE 2.87Å; E198-R233 VanDerWaalsContact OE1-NE 3.1Å; E198-R233 IonicContact OE1-NH2 2.76Å; E198-R233 PolarHBondContact OE1-NH2 3.45Å; E198-R233 IonicContact OE2-CZ 2.69Å; E198-R233 IonicContact OE2-NE 2.99Å; E198-R233 PolarHBondContact OE2-NE 2.86Å; E198-R233 IonicContact OE2-NH2 2.94Å; E198-R233 PolarHBondContact OE2-NH2 2.89Å; N230-R233 VanDerWaalsContact O-CB 3.32Å; N230-R233 WeakPolarHBondContact O-CB 3.33Å; N230-R233 PolarHBondContact O-N 2.71Å; F231-R233 PolarHBondContact O-N 2.9Å; R233-L235 VanDerWaalsContact C-N 3.33Å; R233-S236 WeakPolarHBondContact O-CB 3.47Å; R233-S236 PolarHBondContact O-N 3.44Å; R233-S236 PolarHBondContact O-OG 3.16Å; R233-E366 HydrophobicContact CG-CG 3.67Å
234	I	91.7	Very high	83.2	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-65.9	-40.1	174.5	-61.3	171.8	0	0	0	110.2	F181 M184 A194 I197 L201 F231 S236 V237 T238	F181-I234 HydrophobicContact CE1-CG2 3.85Å; F181-I234 HydrophobicContact CZ-CG2 3.76Å; M184-I234 HydrophobicContact CE-CD1 3.74Å; M184-I234 HydrophobicContact SD-CD1 3.92Å; A194-I234 HydrophobicContact CB-CD1 4.09Å; I197-I234 HydrophobicContact CB-CD1 4.07Å; I197-I234 HydrophobicContact CD1-CD1 4.22Å; I197-I234 HydrophobicContact CG2-CD1 3.89Å; I197-I234 HydrophobicContact CG2-CG1 4.07Å; I197-I234 HydrophobicContact CG2-CG2 3.83Å; L201-I234 HydrophobicContact CD1-CG2 3.78Å; F231-I234 HydrophobicContact CD2-CB 4.46Å; F231-I234 HydrophobicContact CD2-CD1 4.24Å; F231-I234 WeakPolarHBondContact O-CB 3.15Å; F231-I234 PolarHBondContact O-N 3.03Å; F231-I234 VanDerWaalsContact O-N 3.09Å; I234-S236 VanDerWaalsContact C-N 3.29Å; I234-S236 PolarHBondContact O-N 3.1Å; I234-V237 PolarHBondContact O-N 2.95Å; I234-T238 HydrophobicContact CG2-CG2 4.46Å; I234-T238 WeakPolarHBondContact O-CG2 3.33Å; I234-T238 PolarHBondContact O-N 3.4Å; I234-T238 PolarHBondContact O-OG1 3.44Å
235	L	93.1	Very high	80.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.6	-39.1	176.8	-66.1	-175.1	0	0	0	111.9	L210 F231 C232 R233 V237 T238 I239 L275 F281 V370	L210-L235 HydrophobicContact CD1-CD2 4.06Å; F231-L235 HydrophobicContact CD1-CD1 3.76Å; F231-L235 HydrophobicContact CD1-CD2 4.2Å; F231-L235 HydrophobicContact CD1-CG 3.83Å; F231-L235 HydrophobicContact CE1-CD1 3.75Å; F231-L235 HydrophobicContact CE1-CD2 3.54Å; F231-L235 HydrophobicContact CE1-CG 3.7Å; F231-L235 HydrophobicContact CG-CG 4.47Å; F231-L235 HydrophobicContact CZ-CD2 3.74Å; F231-L235 HydrophobicContact CZ-CG 4.25Å; F231-L235 WeakPolarHBondContact O-CG 3.16Å; F231-L235 PolarHBondContact O-N 2.57Å; C232-L235 PolarHBondContact O-N 2.7Å; R233-L235 VanDerWaalsContact C-N 3.33Å; L235-V237 PolarHBondContact O-N 2.81Å; L235-T238 WeakPolarHBondContact CA-OG1 3.48Å; L235-T238 PolarHBondContact O-N 2.95Å; L235-T238 PolarHBondContact O-OG1 3.01Å; L235-I239 VanDerWaalsContact O-CG1 3.29Å; L235-I239 WeakPolarHBondContact O-CG1 3.33Å; L235-I239 PolarHBondContact O-N 3.4Å; L235-L275 HydrophobicContact CD1-CD1 4.02Å; L235-L275 HydrophobicContact CD1-CD2 4.37Å; L235-L275 HydrophobicContact CD2-CD1 3.82Å; L235-L275 HydrophobicContact CD2-CD2 4.05Å; L235-L275 HydrophobicContact CG-CD1 4.46Å; L235-F281 HydrophobicContact CD1-CE2 4.1Å; L235-F281 HydrophobicContact CD1-CZ 3.59Å; L235-V370 HydrophobicContact CB-CG2 3.95Å
236	S	88.5	Confident	78.7	Confident	26 Å²	26	38.9 Å²	38.9	18%	0.182	22%	0.223	C	C	.	.	H	α-helix	trans	-51.4	-34.8	-179.6	81.1	0	0	0	0	113	C232 R233 I234 S240	C232-S236 PolarHBondContact O-N 3.06Å; R233-S236 WeakPolarHBondContact O-CB 3.47Å; R233-S236 PolarHBondContact O-N 3.44Å; R233-S236 PolarHBondContact O-OG 3.16Å; I234-S236 VanDerWaalsContact C-N 3.29Å; I234-S236 PolarHBondContact O-N 3.1Å; S236-S240 WeakPolarHBondContact O-CB 3.41Å; S236-S240 PolarHBondContact O-OG 3.08Å
237	V	88.6	Confident	77.1	Confident	64 Å²	64	40.4 Å²	40.4	39%	0.388	23%	0.233	S	C	.	.	H	α-helix	trans	-89.7	-28.1	178.8	-175.6	0	0	0	0	112.5	L201 I234 L235	L201-V237 HydrophobicContact CB-CG1 4.16Å; I234-V237 PolarHBondContact O-N 2.95Å; L235-V237 PolarHBondContact O-N 2.81Å
238	T	91.1	Very high	75.2	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-90.2	-15.1	-175.6	56.1	0	0	0	0	114	L201 L210 I234 L235 N271	L201-T238 HydrophobicContact CD1-CG2 3.73Å; L210-T238 HydrophobicContact CD2-CG2 4.41Å; I234-T238 HydrophobicContact CG2-CG2 4.46Å; I234-T238 WeakPolarHBondContact O-CG2 3.33Å; I234-T238 PolarHBondContact O-N 3.4Å; I234-T238 PolarHBondContact O-OG1 3.44Å; L235-T238 WeakPolarHBondContact CA-OG1 3.48Å; L235-T238 PolarHBondContact O-N 2.95Å; L235-T238 PolarHBondContact O-OG1 3.01Å; T238-N271 WeakPolarHBondContact O-CB 3.49Å; T238-N271 PolarHBondContact O-ND2 2.84Å
239	I	91.6	Very high	73.2	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-116	-11	-179.7	77.2	178.4	0	0	0	113.9	L235 A268 N271 Q272 L275 V370 V373 L374	L235-I239 VanDerWaalsContact O-CG1 3.29Å; L235-I239 WeakPolarHBondContact O-CG1 3.33Å; L235-I239 PolarHBondContact O-N 3.4Å; I239-A268 WeakPolarHBondContact O-CB 3.31Å; I239-N271 HydrophobicContact CG2-CB 4.27Å; I239-Q272 HydrophobicContact CB-CG 3.94Å; I239-Q272 PolarHBondContact O-NE2 2.9Å; I239-L275 HydrophobicContact CG2-CD1 3.52Å; I239-V370 HydrophobicContact CD1-CB 4.32Å; I239-V370 HydrophobicContact CD1-CG1 3.83Å; I239-V370 HydrophobicContact CD1-CG2 4.24Å; I239-V373 HydrophobicContact CD1-CB 4.24Å; I239-V373 HydrophobicContact CD1-CG1 4.16Å; I239-V373 HydrophobicContact CG1-CB 4.36Å; I239-V373 HydrophobicContact CG1-CG1 3.87Å; I239-L374 HydrophobicContact CD1-CG 4.41Å
240	S	88.3	Confident	72.2	Confident	18 Å²	18	58.1 Å²	58.1	13%	0.126	32%	0.317	C	S	.	.	S	Bend	trans	-91.8	129.6	176.1	-53.2	0	0	0	0	108.5	M207 S236 Y369	M207-S240 WeakPolarHBondContact CE-O 3.45Å; S236-S240 WeakPolarHBondContact O-CB 3.41Å; S236-S240 PolarHBondContact O-OG 3.08Å; S240-Y369 WeakPolarHBondContact OG-CE1 3.36Å; S240-Y369 PolarHBondContact OG-OH 3.15Å
241	E	75.3	Confident	72.1	Confident	99 Å²	99	59.3 Å²	59.3	46%	0.463	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-53.7	129.8	168.7	-70.9	-59.1	142.6	0	0	108.4	D243 S266 A268	E241-D243 PolarHBondContact O-N 3.23Å; E241-S266 WeakPolarHBondContact OE1-CB 3.45Å; E241-S266 PolarHBondContact OE1-OG 3.39Å; E241-A268 HydrophobicContact CG-CB 4.34Å; E241-A268 WeakPolarHBondContact OE1-CB 3.37Å
242	P	59.9	Low	71.8	Confident	76 Å²	76	59.4 Å²	59.4	49%	0.494	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-58.1	120.3	174.5	23.7	-30	0	0	0	106.4	I244	P242-I244 PolarHBondContact O-N 3.31Å
243	D	49.3	Very low	71.3	Confident	132 Å²	132	61.8 Å²	61.8	71%	0.706	34%	0.338	S	S	*	.			trans	-65.5	88.5	167	-140.2	-15.3	0	0	0	104.4	E241 G245	E241-D243 PolarHBondContact O-N 3.23Å; D243-G245 PolarHBondContact O-N 2.96Å
244	I	44.6	Very low	71	Confident	114 Å²	114	59.7 Å²	59.7	59%	0.585	34%	0.338	S	S	*	.			trans	-64.9	88.8	171.9	-54.9	169.2	0	0	0	101.7	P242 N246	P242-I244 PolarHBondContact O-N 3.31Å; I244-N246 HydrophobicContact CG2-CB 4.43Å; I244-N246 VanDerWaalsContact O-CA 3.27Å; I244-N246 WeakPolarHBondContact O-CA 3.48Å; I244-N246 WeakPolarHBondContact O-CB 3.31Å; I244-N246 PolarHBondContact O-N 2.95Å
245	G	38.8	Very low	70.4	Confident	76 Å²	76	61.3 Å²	61.3	78%	0.784	35%	0.345	S	S	*	.	S	Bend	trans	-53.3	68.8	-161.1	0	0	0	0	0	115	D243	D243-G245 PolarHBondContact O-N 2.96Å
246	N	42.7	Very low	69.6	Low	57 Å²	57	62.6 Å²	62.6	31%	0.305	35%	0.352	S	S	.	.			trans	-156.7	6.5	-156.4	-128.6	4.4	0	0	0	109.2	I244 D248 K249 H250	I244-N246 HydrophobicContact CG2-CB 4.43Å; I244-N246 VanDerWaalsContact O-CA 3.27Å; I244-N246 WeakPolarHBondContact O-CA 3.48Å; I244-N246 WeakPolarHBondContact O-CB 3.31Å; I244-N246 PolarHBondContact O-N 2.95Å; N246-D248 VanDerWaalsContact C-N 3.26Å; N246-D248 PolarHBondContact O-N 3.45Å; N246-K249 CarbonylContact O-C 3.51Å; N246-K249 PolarHBondContact O-N 3.28Å; N246-H250 PolarHBondContact ND2-NE2 2.97Å; N246-H250 PolarHBondContact O-CD2 2.94Å; N246-H250 VanDerWaalsContact O-CD2 3.3Å; N246-H250 PolarHBondContact O-N 3.46Å
247	D	48.7	Very low	69.1	Low	83 Å²	83	63.5 Å²	63.5	44%	0.444	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-26.5	177.7	-103.7	19.7	0	0	0	112.8	K249 K255	D247-K249 VanDerWaalsContact C-N 3.33Å; D247-K255 WeakPolarHBondContact OD1-CE 3.47Å; D247-K255 IonicContact OD1-NZ 2.72Å; D247-K255 PolarHBondContact OD1-NZ 3.06Å; D247-K255 IonicContact OD2-NZ 3.75Å; D247-K255 PolarHBondContact OD2-NZ 3.15Å
248	D	47.9	Very low	68.3	Low	139 Å²	139	65.4 Å²	65.4	74%	0.743	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-11.8	170.6	-66.1	-17.4	0	0	0	113.3	N246	N246-D248 VanDerWaalsContact C-N 3.26Å; N246-D248 PolarHBondContact O-N 3.45Å
249	K	51.4	Low	67.3	Low	173 Å²	173	70.9 Å²	70.9	75%	0.752	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	-15.2	-175.8	-69.3	-176.1	-178.8	175.5	0	114.4	N246 D247	N246-K249 CarbonylContact O-C 3.51Å; N246-K249 PolarHBondContact O-N 3.28Å; D247-K249 VanDerWaalsContact C-N 3.33Å
250	H	65.3	Low	66.1	Low	72 Å²	72	78.9 Å²	78.9	33%	0.333	43%	0.426	S	S	.	.	S	Bend	trans	-101.8	112	174.2	-70.6	-56.9	0	0	0	111.7	N246 A254 K255	N246-H250 PolarHBondContact ND2-NE2 2.97Å; N246-H250 PolarHBondContact O-CD2 2.94Å; N246-H250 VanDerWaalsContact O-CD2 3.3Å; N246-H250 PolarHBondContact O-N 3.46Å; H250-A254 HydrophobicContact CB-CB 4.28Å; H250-K255 HydrophobicContact CB-CG 4.34Å
251	T	83.8	Confident	64.8	Low	34 Å²	34	88 Å²	88	21%	0.209	46%	0.458	C	S	.	.			trans	-56.1	153.8	172.2	65.5	0	0	0	0	110.7	L253 A254 K255 Q656 L658	T251-L253 PolarHBondContact O-N 3.41Å; T251-L253 VanDerWaalsContact O-N 3.11Å; T251-A254 WeakPolarHBondContact O-CB 3.36Å; T251-A254 PolarHBondContact O-N 2.85Å; T251-A254 PolarHBondContact OG1-N 2.72Å; T251-A254 VanDerWaalsContact OG1-N 3.13Å; T251-K255 PolarHBondContact O-N 3.29Å; T251-Q656 WeakPolarHBondContact CG2-O 3.38Å; T251-L658 CarbonylContact C-O 3.43Å; T251-L658 VanDerWaalsContact CA-O 3.26Å; T251-L658 WeakPolarHBondContact CA-O 3.49Å
252	L	85.9	Confident	64	Low	2 Å²	2	88.4 Å²	88.4	1%	0.01	46%	0.463	C	S	.	.	H	α-helix	trans	-57.8	-25.7	172.3	-66.6	-179.5	0	0	0	112.1	K255 N256 L658 T659 Q660 V663 F712	L252-K255 HydrophobicContact CD2-CD 4.4Å; L252-N256 VanDerWaalsContact O-CB 3.31Å; L252-N256 WeakPolarHBondContact O-CB 3.5Å; L252-N256 VanDerWaalsContact O-CG 3.3Å; L252-N256 PolarHBondContact O-N 3.05Å; L252-L658 HydrophobicContact CD1-CB 4.44Å; L252-L658 PolarHBondContact N-O 3.36Å; L252-T659 WeakPolarHBondContact CD1-O 3.25Å; L252-Q660 HydrophobicContact CD2-CG 3.79Å; L252-V663 HydrophobicContact CD1-CB 3.65Å; L252-V663 HydrophobicContact CD1-CG1 4.04Å; L252-V663 HydrophobicContact CD1-CG2 3.78Å; L252-F712 HydrophobicContact CB-CE2 4.21Å; L252-F712 HydrophobicContact CB-CZ 3.56Å; L252-F712 HydrophobicContact CD1-CE1 4.5Å; L252-F712 HydrophobicContact CD1-CZ 4.26Å
253	L	83.2	Confident	64.2	Low	50 Å²	50	89.8 Å²	89.8	26%	0.262	48%	0.481	S	S	.	.	H	α-helix	trans	-62.1	-51.6	171	-179.1	67.8	0	0	0	111.1	T251 K255 N256 A257 V655 F712 L772	T251-L253 PolarHBondContact O-N 3.41Å; T251-L253 VanDerWaalsContact O-N 3.11Å; L253-K255 PolarHBondContact O-N 2.91Å; L253-N256 PolarHBondContact O-N 3.39Å; L253-A257 PolarHBondContact O-N 3.01Å; L253-A257 VanDerWaalsContact O-N 3.08Å; L253-V655 HydrophobicContact CD1-CG1 4.47Å; L253-V655 HydrophobicContact CD2-CG1 4.16Å; L253-F712 HydrophobicContact CB-CE2 4.33Å; L253-F712 HydrophobicContact CD1-CD2 4.36Å; L253-L772 HydrophobicContact CD1-CD2 3.54Å
254	A	80.9	Confident	65.4	Low	36 Å²	36	87.8 Å²	87.8	30%	0.298	48%	0.477	S	S	.	.	H	α-helix	trans	-61.2	-43.2	176.6	0	0	0	0	0	111.8	H250 T251 N256 A257 Q258	H250-A254 HydrophobicContact CB-CB 4.28Å; T251-A254 WeakPolarHBondContact O-CB 3.36Å; T251-A254 PolarHBondContact O-N 2.85Å; T251-A254 PolarHBondContact OG1-N 2.72Å; T251-A254 VanDerWaalsContact OG1-N 3.13Å; A254-N256 PolarHBondContact O-N 2.89Å; A254-A257 PolarHBondContact O-N 3.41Å; A254-Q258 PolarHBondContact O-N 3.48Å
255	K	78.8	Confident	67.1	Low	35 Å²	35	85.6 Å²	85.6	15%	0.152	47%	0.47	C	S	.	.	H	α-helix	trans	-60.7	-45.4	176.7	-70.5	-173.3	173.5	-172.1	0	112.3	D247 H250 T251 L252 L253 A257 Q258 Q259	D247-K255 WeakPolarHBondContact OD1-CE 3.47Å; D247-K255 IonicContact OD1-NZ 2.72Å; D247-K255 PolarHBondContact OD1-NZ 3.06Å; D247-K255 IonicContact OD2-NZ 3.75Å; D247-K255 PolarHBondContact OD2-NZ 3.15Å; H250-K255 HydrophobicContact CB-CG 4.34Å; T251-K255 PolarHBondContact O-N 3.29Å; L252-K255 HydrophobicContact CD2-CD 4.4Å; L253-K255 PolarHBondContact O-N 2.91Å; K255-A257 VanDerWaalsContact C-N 3.33Å; K255-A257 PolarHBondContact O-N 2.79Å; K255-Q258 PolarHBondContact O-N 3.42Å; K255-Q259 WeakPolarHBondContact O-CG 3.14Å; K255-Q259 PolarHBondContact O-N 3.22Å
256	N	77.9	Confident	69.3	Low	27 Å²	27	83.4 Å²	83.4	14%	0.144	44%	0.443	C	S	.	.	H	α-helix	trans	-64.4	-36.9	178.1	-81	-0.8	0	0	0	112.2	L252 L253 A254 K260 H716 K720	L252-N256 VanDerWaalsContact O-CB 3.31Å; L252-N256 WeakPolarHBondContact O-CB 3.5Å; L252-N256 VanDerWaalsContact O-CG 3.3Å; L252-N256 PolarHBondContact O-N 3.05Å; L253-N256 PolarHBondContact O-N 3.39Å; A254-N256 PolarHBondContact O-N 2.89Å; N256-K260 PolarHBondContact O-N 3.3Å; N256-H716 PolarHBondContact ND2-ND1 2.87Å; N256-H716 PolarHBondContact OD1-ND1 3.5Å; N256-K720 PolarHBondContact OD1-NZ 2.88Å
257	A	76.6	Confident	71.5	Confident	46 Å²	46	85.3 Å²	85.3	38%	0.38	45%	0.446	S	S	.	.	H	α-helix	trans	-65.9	-38.2	175.3	0	0	0	0	0	112.1	L253 A254 K255	L253-A257 PolarHBondContact O-N 3.01Å; L253-A257 VanDerWaalsContact O-N 3.08Å; A254-A257 PolarHBondContact O-N 3.41Å; K255-A257 VanDerWaalsContact C-N 3.33Å; K255-A257 PolarHBondContact O-N 2.79Å
258	Q	72.6	Confident	73.5	Confident	104 Å²	104	81.3 Å²	81.3	49%	0.486	43%	0.425	S	S	.	.	H	α-helix	trans	-70.9	-42.5	176.5	-171.1	178.3	-2.1	0	0	112.6	A254 K255 K260 R261	A254-Q258 PolarHBondContact O-N 3.48Å; K255-Q258 PolarHBondContact O-N 3.42Å; Q258-K260 VanDerWaalsContact C-N 3.29Å; Q258-K260 PolarHBondContact O-N 2.89Å; Q258-R261 WeakPolarHBondContact O-CB 3.42Å; Q258-R261 PolarHBondContact O-N 2.98Å
259	Q	70.1	Confident	75.5	Confident	116 Å²	116	76.8 Å²	76.8	54%	0.542	40%	0.399	S	S	.	.	H	α-helix	trans	-60.6	-36.3	179.3	-78.9	-177.9	-13.7	0	0	112.7	K255 R261 N262	K255-Q259 WeakPolarHBondContact O-CG 3.14Å; K255-Q259 PolarHBondContact O-N 3.22Å; Q259-R261 PolarHBondContact O-N 3.41Å; Q259-R261 VanDerWaalsContact O-N 3.16Å; Q259-N262 PolarHBondContact O-N 3Å
260	K	66.1	Low	77.4	Confident	167 Å²	167	70.4 Å²	70.4	73%	0.726	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.6	174.3	-78.2	-176.5	177.2	-178.1	0	113.6	N256 Q258	N256-K260 PolarHBondContact O-N 3.3Å; Q258-K260 VanDerWaalsContact C-N 3.29Å; Q258-K260 PolarHBondContact O-N 2.89Å
261	R	61.7	Low	78.9	Confident	211 Å²	211	67 Å²	67	80%	0.796	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-19.8	-178.6	-63.2	-178.2	179.6	-176.1	-0.1	113.1	Q258 Q259	Q258-R261 WeakPolarHBondContact O-CB 3.42Å; Q258-R261 PolarHBondContact O-N 2.98Å; Q259-R261 PolarHBondContact O-N 3.41Å; Q259-R261 VanDerWaalsContact O-N 3.16Å
262	N	58.8	Low	79.4	Confident	106 Å²	106	66.1 Å²	66.1	57%	0.567	35%	0.352	S	S	*	.			trans	-128.2	86.5	-171.5	-67.5	-13.1	0	0	0	111.6	Q259	Q259-N262 PolarHBondContact O-N 3Å
263	A	63.1	Low	79.8	Confident	106 Å²	106	68.6 Å²	68.6	88%	0.876	37%	0.367	S	S	*	.			trans	-84.7	-12.3	177.8	0	0	0	0	0	114.3
264	S	74.1	Confident	80.4	Confident	89 Å²	89	67.5 Å²	67.5	62%	0.622	36%	0.363	S	S	*	.	S	Bend	trans	-78	149.1	-179.6	55.9	0	0	0	0	112.1
265	P	80	Confident	81.1	Confident	68 Å²	68	65.8 Å²	65.8	44%	0.442	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-58.1	145.5	171.3	26.8	-33.8	0	0	0	110.6	E269 V270	P265-E269 WeakPolarHBondContact CA-OE2 3.46Å; P265-E269 HydrophobicContact CB-CB 4.36Å; P265-E269 WeakPolarHBondContact CB-OE2 3.49Å; P265-V270 HydrophobicContact CB-CG2 4.36Å; P265-V270 HydrophobicContact CG-CG2 4.24Å
266	S	85.6	Confident	81.9	Confident	30 Å²	30	64.7 Å²	64.7	21%	0.21	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-70.1	164	177.4	67.9	0	0	0	0	111.1	E241 A268 E269 V270	E241-S266 WeakPolarHBondContact OE1-CB 3.45Å; E241-S266 PolarHBondContact OE1-OG 3.39Å; S266-A268 PolarHBondContact O-N 3.43Å; S266-E269 PolarHBondContact N-OE2 3.46Å; S266-E269 PolarHBondContact O-N 3.18Å; S266-E269 WeakPolarHBondContact OG-CB 3.42Å; S266-E269 WeakPolarHBondContact OG-CG 3.33Å; S266-E269 PolarHBondContact OG-N 3.3Å; S266-E269 VanDerWaalsContact OG-N 3.13Å; S266-V270 WeakPolarHBondContact O-CG2 3.39Å; S266-V270 PolarHBondContact O-N 3.49Å; S266-V270 VanDerWaalsContact O-N 3.11Å
267	R	88.8	Confident	82.7	Confident	97 Å²	97	68.9 Å²	68.9	37%	0.366	37%	0.366	S	S	.	.	H	α-helix	trans	-62.5	-34.5	174.8	-67	-170.7	-177.5	167.9	7.2	111.7	E206 M207 Q209 V270 N271	E206-R267 IonicContact OE2-CZ 2.81Å; E206-R267 IonicContact OE2-NH1 2.94Å; E206-R267 PolarHBondContact OE2-NH1 3.43Å; E206-R267 IonicContact OE2-NH2 3.17Å; E206-R267 PolarHBondContact OE2-NH2 3.39Å; M207-R267 HydrophobicContact CB-CB 4.15Å; M207-R267 HydrophobicContact CG-CB 4.22Å; M207-R267 WeakPolarHBondContact O-CD 3.34Å; M207-R267 PolarHBondContact O-NH1 3.27Å; M207-R267 HydrophobicContact SD-CB 3.84Å; Q209-R267 HydrophobicContact CG-CG 4.32Å; R267-V270 PolarHBondContact O-N 3.11Å; R267-N271 WeakPolarHBondContact O-CB 3.33Å; R267-N271 PolarHBondContact O-N 3.43Å; R267-N271 PolarHBondContact O-ND2 2.96Å
268	A	90.6	Very high	83.6	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-67.1	-42.5	179	0	0	0	0	0	110.8	M207 I239 E241 S266 V270 N271 Q272	M207-A268 HydrophobicContact CE-CB 3.65Å; M207-A268 WeakPolarHBondContact SD-CA 3.48Å; M207-A268 HydrophobicContact SD-CB 3.59Å; M207-A268 VanDerWaalsContact SD-CB 3.59Å; M207-A268 PolarHBondContact SD-N 3.44Å; I239-A268 WeakPolarHBondContact O-CB 3.31Å; E241-A268 HydrophobicContact CG-CB 4.34Å; E241-A268 WeakPolarHBondContact OE1-CB 3.37Å; S266-A268 PolarHBondContact O-N 3.43Å; A268-V270 PolarHBondContact O-N 3.28Å; A268-N271 WeakPolarHBondContact O-CB 3.49Å; A268-N271 PolarHBondContact O-N 2.89Å; A268-Q272 VanDerWaalsContact O-CG 3.27Å; A268-Q272 WeakPolarHBondContact O-CG 3.27Å; A268-Q272 PolarHBondContact O-N 3.38Å
269	E	89.8	Confident	84.7	Confident	43 Å²	43	66.2 Å²	66.2	20%	0.201	35%	0.354	C	S	.	.	H	α-helix	trans	-60.9	-43.5	174.9	-72.7	170.7	160.8	0	0	112.1	P265 S266 N271 Q272 V273 R378	P265-E269 WeakPolarHBondContact CA-OE2 3.46Å; P265-E269 HydrophobicContact CB-CB 4.36Å; P265-E269 WeakPolarHBondContact CB-OE2 3.49Å; S266-E269 PolarHBondContact N-OE2 3.46Å; S266-E269 PolarHBondContact O-N 3.18Å; S266-E269 WeakPolarHBondContact OG-CB 3.42Å; S266-E269 WeakPolarHBondContact OG-CG 3.33Å; S266-E269 PolarHBondContact OG-N 3.3Å; S266-E269 VanDerWaalsContact OG-N 3.13Å; E269-N271 VanDerWaalsContact C-N 3.32Å; E269-N271 PolarHBondContact O-N 3.38Å; E269-Q272 PolarHBondContact O-N 3.26Å; E269-V273 WeakPolarHBondContact O-CG2 3.44Å; E269-V273 PolarHBondContact O-N 3.08Å; E269-V273 VanDerWaalsContact O-N 3.1Å; E269-R378 VanDerWaalsContact CD-CZ 3.42Å; E269-R378 VanDerWaalsContact CD-NH2 3.31Å; E269-R378 IonicContact OE1-CZ 3.68Å; E269-R378 IonicContact OE1-NE 3.42Å; E269-R378 PolarHBondContact OE1-NE 3.48Å; E269-R378 IonicContact OE1-NH2 2.72Å; E269-R378 PolarHBondContact OE1-NH2 3Å; E269-R378 IonicContact OE2-CZ 3.98Å; E269-R378 IonicContact OE2-NE 3.62Å; E269-R378 PolarHBondContact OE2-NE 2.81Å; E269-R378 IonicContact OE2-NH1 2.92Å; E269-R378 IonicContact OE2-NH2 3.64Å; E269-R378 PolarHBondContact OE2-NH2 3.26Å
270	V	92.8	Very high	85.8	Confident	39 Å²	39	62 Å²	62	24%	0.236	34%	0.341	C	S	.	.	H	α-helix	trans	-61.9	-41.9	175.3	174.4	0	0	0	0	111	P265 S266 R267 A268 V273 T274	P265-V270 HydrophobicContact CB-CG2 4.36Å; P265-V270 HydrophobicContact CG-CG2 4.24Å; S266-V270 WeakPolarHBondContact O-CG2 3.39Å; S266-V270 PolarHBondContact O-N 3.49Å; S266-V270 VanDerWaalsContact O-N 3.11Å; R267-V270 PolarHBondContact O-N 3.11Å; A268-V270 PolarHBondContact O-N 3.28Å; V270-V273 PolarHBondContact O-N 3.33Å; V270-T274 WeakPolarHBondContact O-CB 3.26Å; V270-T274 PolarHBondContact O-N 2.87Å; V270-T274 PolarHBondContact O-OG1 3.5Å
271	N	95.1	Very high	87.3	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.1	-41.6	177.5	-72.7	-15.9	0	0	0	112.4	I208 L210 T238 I239 R267 A268 E269 V273 T274 L275	I208-N271 PolarHBondContact O-ND2 3.39Å; L210-N271 HydrophobicContact CD1-CB 3.87Å; L210-N271 HydrophobicContact CG-CB 4.06Å; L210-N271 PolarHBondContact N-OD1 3.46Å; T238-N271 WeakPolarHBondContact O-CB 3.49Å; T238-N271 PolarHBondContact O-ND2 2.84Å; I239-N271 HydrophobicContact CG2-CB 4.27Å; R267-N271 WeakPolarHBondContact O-CB 3.33Å; R267-N271 PolarHBondContact O-N 3.43Å; R267-N271 PolarHBondContact O-ND2 2.96Å; A268-N271 WeakPolarHBondContact O-CB 3.49Å; A268-N271 PolarHBondContact O-N 2.89Å; E269-N271 VanDerWaalsContact C-N 3.32Å; E269-N271 PolarHBondContact O-N 3.38Å; N271-V273 PolarHBondContact O-N 2.75Å; N271-T274 WeakPolarHBondContact O-CB 3.3Å; N271-T274 PolarHBondContact O-N 3.32Å; N271-L275 WeakPolarHBondContact O-CG 3.46Å; N271-L275 PolarHBondContact O-N 2.89Å
272	Q	94.9	Very high	89	Confident	17 Å²	17	44.1 Å²	44.1	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-58.7	-47.8	174.8	-70.1	173	21.6	0	0	111.1	I239 A268 E269 T274 L275 L276 L374	I239-Q272 HydrophobicContact CB-CG 3.94Å; I239-Q272 PolarHBondContact O-NE2 2.9Å; A268-Q272 VanDerWaalsContact O-CG 3.27Å; A268-Q272 WeakPolarHBondContact O-CG 3.27Å; A268-Q272 PolarHBondContact O-N 3.38Å; E269-Q272 PolarHBondContact O-N 3.26Å; Q272-T274 VanDerWaalsContact C-N 3.33Å; Q272-T274 PolarHBondContact O-N 3.5Å; Q272-L275 PolarHBondContact O-N 3.11Å; Q272-L276 VanDerWaalsContact O-CG 3.31Å; Q272-L276 WeakPolarHBondContact O-CG 3.41Å; Q272-L276 PolarHBondContact O-N 3.27Å; Q272-L374 HydrophobicContact CB-CD2 3.87Å; Q272-L374 HydrophobicContact CG-CD2 3.85Å
273	V	94.8	Very high	90.8	Very high	53 Å²	53	42 Å²	42	32%	0.321	26%	0.256	S	S	.	.	H	α-helix	trans	-61.4	-42.6	176.9	173.4	0	0	0	0	111.3	E269 V270 N271 L275 L276 N277 Q379	E269-V273 WeakPolarHBondContact O-CG2 3.44Å; E269-V273 PolarHBondContact O-N 3.08Å; E269-V273 VanDerWaalsContact O-N 3.1Å; V270-V273 PolarHBondContact O-N 3.33Å; N271-V273 PolarHBondContact O-N 2.75Å; V273-L275 VanDerWaalsContact C-N 3.31Å; V273-L275 PolarHBondContact O-N 2.84Å; V273-L276 PolarHBondContact O-N 3.23Å; V273-N277 PolarHBondContact O-N 2.66Å; V273-N277 VanDerWaalsContact O-N 3.15Å; V273-N277 PolarHBondContact O-ND2 3.27Å; V273-Q379 HydrophobicContact CG2-CG 3.95Å
274	T	95.6	Very high	92.4	Very high	28 Å²	28	39.6 Å²	39.6	17%	0.172	22%	0.224	C	C	.	.	H	α-helix	trans	-57.1	-44.7	177.7	-58.6	0	0	0	0	111.4	L210 L216 V270 N271 Q272 N277	L210-T274 HydrophobicContact CB-CG2 4.34Å; L216-T274 HydrophobicContact CD2-CG2 3.85Å; V270-T274 WeakPolarHBondContact O-CB 3.26Å; V270-T274 PolarHBondContact O-N 2.87Å; V270-T274 PolarHBondContact O-OG1 3.5Å; N271-T274 WeakPolarHBondContact O-CB 3.3Å; N271-T274 PolarHBondContact O-N 3.32Å; Q272-T274 VanDerWaalsContact C-N 3.33Å; Q272-T274 PolarHBondContact O-N 3.5Å; T274-N277 PolarHBondContact O-N 3.47Å
275	L	95.9	Very high	93.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.6	-39.2	178.2	-68.1	171.2	0	0	0	113.1	L210 L235 I239 N271 Q272 V273 N277 I278 F281	L210-L275 HydrophobicContact CD1-CD1 4.09Å; L210-L275 HydrophobicContact CD1-CD2 4.01Å; L210-L275 HydrophobicContact CD1-CG 3.94Å; L235-L275 HydrophobicContact CD1-CD1 4.02Å; L235-L275 HydrophobicContact CD1-CD2 4.37Å; L235-L275 HydrophobicContact CD2-CD1 3.82Å; L235-L275 HydrophobicContact CD2-CD2 4.05Å; L235-L275 HydrophobicContact CG-CD1 4.46Å; I239-L275 HydrophobicContact CG2-CD1 3.52Å; N271-L275 WeakPolarHBondContact O-CG 3.46Å; N271-L275 PolarHBondContact O-N 2.89Å; Q272-L275 PolarHBondContact O-N 3.11Å; V273-L275 VanDerWaalsContact C-N 3.31Å; V273-L275 PolarHBondContact O-N 2.84Å; L275-N277 PolarHBondContact O-N 2.93Å; L275-I278 HydrophobicContact CD2-CD1 4.03Å; L275-I278 WeakPolarHBondContact O-CB 3.37Å; L275-I278 PolarHBondContact O-N 3.08Å; L275-F281 HydrophobicContact CB-CD1 4.19Å; L275-F281 HydrophobicContact CB-CE1 3.91Å; L275-F281 HydrophobicContact CB-CZ 4.47Å; L275-F281 HydrophobicContact CD1-CE1 4.4Å; L275-F281 HydrophobicContact CD1-CZ 4.41Å; L275-F281 HydrophobicContact CD2-CZ 4.27Å
276	L	95.3	Very high	94.2	Very high	12 Å²	12	32.1 Å²	32.1	6%	0.063	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-26.3	177.9	-69.2	173.4	0	0	0	112.7	Q272 V273 I278 I282 L374 Q379 V383	Q272-L276 VanDerWaalsContact O-CG 3.31Å; Q272-L276 WeakPolarHBondContact O-CG 3.41Å; Q272-L276 PolarHBondContact O-N 3.27Å; V273-L276 PolarHBondContact O-N 3.23Å; L276-I278 VanDerWaalsContact C-N 3.27Å; L276-I278 PolarHBondContact O-N 3.22Å; L276-I282 HydrophobicContact CD2-CD1 3.81Å; L276-I282 HydrophobicContact CD2-CG1 3.92Å; L276-L374 HydrophobicContact CG-CD2 4.48Å; L276-Q379 HydrophobicContact CD1-CB 3.47Å; L276-Q379 VanDerWaalsContact CD1-CB 3.47Å; L276-Q379 HydrophobicContact CD1-CG 3.89Å; L276-V383 HydrophobicContact CD1-CG2 4.02Å; L276-V383 HydrophobicContact CD2-CG2 3.81Å
277	N	94.9	Very high	94.6	Very high	114 Å²	114	36.2 Å²	36.2	61%	0.61	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.1	175.1	-69.1	-28.6	0	0	0	113.5	V273 T274 L275 P279	V273-N277 PolarHBondContact O-N 2.66Å; V273-N277 VanDerWaalsContact O-N 3.15Å; V273-N277 PolarHBondContact O-ND2 3.27Å; T274-N277 PolarHBondContact O-N 3.47Å; L275-N277 PolarHBondContact O-N 2.93Å; N277-P279 WeakPolarHBondContact O-CD 3.43Å
278	I	96.1	Very high	94.8	Very high	10 Å²	10	32.5 Å²	32.5	5%	0.051	18%	0.175	C	C	.	.	S	Bend	trans	-79.6	119.1	176.6	-59	176.8	0	0	0	109.4	L216 V220 L275 L276 G280 F281	L216-I278 HydrophobicContact CD2-CD1 4.15Å; L216-I278 HydrophobicContact CG-CD1 4.01Å; V220-I278 HydrophobicContact CB-CD1 4.2Å; V220-I278 HydrophobicContact CB-CG2 4.33Å; V220-I278 HydrophobicContact CG1-CD1 4.47Å; V220-I278 HydrophobicContact CG1-CG2 4.2Å; V220-I278 HydrophobicContact CG2-CD1 3.92Å; L275-I278 HydrophobicContact CD2-CD1 4.03Å; L275-I278 WeakPolarHBondContact O-CB 3.37Å; L275-I278 PolarHBondContact O-N 3.08Å; L276-I278 VanDerWaalsContact C-N 3.27Å; L276-I278 PolarHBondContact O-N 3.22Å; I278-G280 PolarHBondContact O-N 3.03Å; I278-F281 HydrophobicContact CB-CB 4.06Å; I278-F281 HydrophobicContact CG2-CB 4.22Å; I278-F281 WeakPolarHBondContact O-CB 3.41Å; I278-F281 PolarHBondContact O-N 3.41Å
279	P	94.1	Very high	94.9	Very high	85 Å²	85	32.5 Å²	32.5	55%	0.552	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	132.1	-177.7	-24.9	34.5	0	0	0	112.9	N277 F281	N277-P279 WeakPolarHBondContact O-CD 3.43Å; P279-F281 PolarHBondContact O-N 3.21Å
280	G	94.3	Very high	95.1	Very high	27 Å²	27	32.1 Å²	32.1	28%	0.278	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	72	4.3	176.9	0	0	0	0	0	115.2	I278 E283 R284	I278-G280 PolarHBondContact O-N 3.03Å; G280-E283 PolarHBondContact O-N 2.95Å; G280-R284 VanDerWaalsContact O-CG 3.26Å; G280-R284 WeakPolarHBondContact O-CG 3.44Å; G280-R284 PolarHBondContact O-N 2.91Å
281	F	96.8	Very high	94.8	Very high	1 Å²	1	35.8 Å²	35.8	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-59.6	-55.4	-177.9	177.3	-111.1	0	0	0	112.2	V220 L228 L235 L275 I278 P279 E283 R284 L285 L374	V220-F281 HydrophobicContact CG1-CD2 3.82Å; V220-F281 HydrophobicContact CG1-CE2 4.28Å; L228-F281 HydrophobicContact CD1-CD2 4.38Å; L228-F281 HydrophobicContact CD1-CE2 3.98Å; L235-F281 HydrophobicContact CD1-CE2 4.1Å; L235-F281 HydrophobicContact CD1-CZ 3.59Å; L275-F281 HydrophobicContact CB-CD1 4.19Å; L275-F281 HydrophobicContact CB-CE1 3.91Å; L275-F281 HydrophobicContact CB-CZ 4.47Å; L275-F281 HydrophobicContact CD1-CE1 4.4Å; L275-F281 HydrophobicContact CD1-CZ 4.41Å; L275-F281 HydrophobicContact CD2-CZ 4.27Å; I278-F281 HydrophobicContact CB-CB 4.06Å; I278-F281 HydrophobicContact CG2-CB 4.22Å; I278-F281 WeakPolarHBondContact O-CB 3.41Å; I278-F281 PolarHBondContact O-N 3.41Å; P279-F281 PolarHBondContact O-N 3.21Å; F281-E283 VanDerWaalsContact C-N 3.35Å; F281-E283 PolarHBondContact O-N 3.28Å; F281-R284 PolarHBondContact O-N 3.2Å; F281-L285 HydrophobicContact CD1-CD1 4.33Å; F281-L285 HydrophobicContact CE1-CD1 3.69Å; F281-L285 HydrophobicContact CE1-CG 4.49Å; F281-L285 HydrophobicContact CE2-CD1 4.32Å; F281-L285 HydrophobicContact CE2-CD2 4.5Å; F281-L285 HydrophobicContact CE2-CG 4.43Å; F281-L285 HydrophobicContact CZ-CD1 3.69Å; F281-L285 HydrophobicContact CZ-CG 4.28Å; F281-L285 PolarHBondContact O-N 2.97Å; F281-L285 VanDerWaalsContact O-N 3.1Å; F281-L374 HydrophobicContact CE1-CD1 4.44Å
282	I	97.2	Very high	94	Very high	1 Å²	1	43 Å²	43	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-39.5	179.3	-57.9	-59.8	0	0	0	111.8	L276 R284 L285 C286 L374 M386 L387 F390	L276-I282 HydrophobicContact CD2-CD1 3.81Å; L276-I282 HydrophobicContact CD2-CG1 3.92Å; I282-R284 VanDerWaalsContact C-N 3.29Å; I282-R284 PolarHBondContact O-N 3.34Å; I282-L285 HydrophobicContact CD1-CD1 4.48Å; I282-L285 PolarHBondContact O-N 3.43Å; I282-C286 PolarHBondContact O-N 3.28Å; I282-C286 PolarHBondContact O-SG 3.01Å; I282-C286 VanDerWaalsContact O-SG 3.35Å; I282-L374 HydrophobicContact CD1-CD1 3.69Å; I282-M386 HydrophobicContact CB-CB 4.44Å; I282-M386 HydrophobicContact CB-CE 3.79Å; I282-M386 HydrophobicContact CB-SD 4.43Å; I282-M386 HydrophobicContact CG1-CE 3.69Å; I282-M386 HydrophobicContact CG1-SD 4.01Å; I282-M386 HydrophobicContact CG2-CB 3.93Å; I282-L387 HydrophobicContact CG2-CD2 3.53Å; I282-F390 HydrophobicContact CB-CD2 4.47Å; I282-F390 HydrophobicContact CB-CE2 4.28Å; I282-F390 HydrophobicContact CG2-CD2 4.06Å; I282-F390 HydrophobicContact CG2-CE2 4.3Å
283	E	97	Very high	92.6	Very high	63 Å²	63	43.6 Å²	43.6	29%	0.294	22%	0.222	S	C	.	.	H	α-helix	trans	-55.8	-46	175.9	-175	-175.9	171.1	0	0	111.6	G280 F281 C286 K287 F390	G280-E283 PolarHBondContact O-N 2.95Å; F281-E283 VanDerWaalsContact C-N 3.35Å; F281-E283 PolarHBondContact O-N 3.28Å; E283-C286 PolarHBondContact O-N 3.4Å; E283-K287 HydrophobicContact CG-CD 4.42Å; E283-K287 WeakPolarHBondContact O-CG 3.32Å; E283-K287 PolarHBondContact O-N 3.47Å; E283-K287 VanDerWaalsContact OE1-CE 3.23Å; E283-K287 WeakPolarHBondContact OE1-CE 3.19Å; E283-K287 IonicContact OE1-NZ 3.06Å; E283-K287 PolarHBondContact OE1-NZ 3.21Å; E283-F390 HydrophobicContact CB-CD1 3.8Å; E283-F390 HydrophobicContact CB-CD2 3.95Å; E283-F390 HydrophobicContact CB-CE1 3.59Å; E283-F390 HydrophobicContact CB-CE2 3.76Å; E283-F390 HydrophobicContact CB-CG 3.99Å; E283-F390 HydrophobicContact CB-CZ 3.58Å; E283-F390 HydrophobicContact CG-CD1 3.56Å; E283-F390 HydrophobicContact CG-CE1 3.59Å; E283-F390 HydrophobicContact CG-CG 4.08Å; E283-F390 HydrophobicContact CG-CZ 4.14Å
284	R	96.4	Very high	90.8	Very high	54 Å²	54	44.8 Å²	44.8	20%	0.204	23%	0.232	C	C	.	.	H	α-helix	trans	-67	-38.6	179.6	-70.3	173.7	62.2	-166.2	-2.5	111.9	V220 F223 L228 G280 F281 I282 K287 L288	V220-R284 PolarHBondContact O-NH1 2.91Å; F223-R284 PolarHBondContact O-NH2 2.85Å; L228-R284 HydrophobicContact CD2-CB 3.6Å; G280-R284 VanDerWaalsContact O-CG 3.26Å; G280-R284 WeakPolarHBondContact O-CG 3.44Å; G280-R284 PolarHBondContact O-N 2.91Å; F281-R284 PolarHBondContact O-N 3.2Å; I282-R284 VanDerWaalsContact C-N 3.29Å; I282-R284 PolarHBondContact O-N 3.34Å; R284-K287 PolarHBondContact O-N 3.06Å; R284-L288 WeakPolarHBondContact O-CG 3.42Å; R284-L288 PolarHBondContact O-N 2.76Å
285	L	96.8	Very high	88.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-44.1	173.1	-65.7	-173.1	0	0	0	111.7	L228 F281 I282 K287 L288 A289 V367 V370 L371	L228-L285 HydrophobicContact CD1-CD2 4.44Å; L228-L285 HydrophobicContact CD2-CD2 4.12Å; L228-L285 HydrophobicContact CG-CD2 4.16Å; F281-L285 HydrophobicContact CD1-CD1 4.33Å; F281-L285 HydrophobicContact CE1-CD1 3.69Å; F281-L285 HydrophobicContact CE1-CG 4.49Å; F281-L285 HydrophobicContact CE2-CD1 4.32Å; F281-L285 HydrophobicContact CE2-CD2 4.5Å; F281-L285 HydrophobicContact CE2-CG 4.43Å; F281-L285 HydrophobicContact CZ-CD1 3.69Å; F281-L285 HydrophobicContact CZ-CG 4.28Å; F281-L285 PolarHBondContact O-N 2.97Å; F281-L285 VanDerWaalsContact O-N 3.1Å; I282-L285 HydrophobicContact CD1-CD1 4.48Å; I282-L285 PolarHBondContact O-N 3.43Å; L285-K287 PolarHBondContact O-N 3.37Å; L285-L288 PolarHBondContact O-N 2.96Å; L285-A289 WeakPolarHBondContact O-CB 3.48Å; L285-A289 PolarHBondContact O-N 3.13Å; L285-V367 HydrophobicContact CB-CG1 4.09Å; L285-V367 HydrophobicContact CD2-CG1 4.29Å; L285-V367 HydrophobicContact CD2-CG2 4.37Å; L285-V367 VanDerWaalsContact O-CG1 3.32Å; L285-V367 WeakPolarHBondContact O-CG1 3.46Å; L285-V370 HydrophobicContact CD1-CG1 3.83Å; L285-L371 HydrophobicContact CB-CD2 3.92Å; L285-L371 HydrophobicContact CB-CG 4.35Å; L285-L371 HydrophobicContact CD1-CD2 3.87Å; L285-L371 HydrophobicContact CD1-CG 4.45Å
286	C	96.5	Very high	85.7	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.007	28%	0.275	C	S	.	.	H	α-helix	trans	-59	-46.8	175	-68.3	0	0	0	0	111.3	I282 E283 L288 A289 T290 L387 F390 L392	I282-C286 PolarHBondContact O-N 3.28Å; I282-C286 PolarHBondContact O-SG 3.01Å; I282-C286 VanDerWaalsContact O-SG 3.35Å; E283-C286 PolarHBondContact O-N 3.4Å; C286-L288 VanDerWaalsContact C-N 3.31Å; C286-L288 PolarHBondContact O-N 3.35Å; C286-A289 PolarHBondContact O-N 3.46Å; C286-T290 WeakPolarHBondContact O-CG2 3.38Å; C286-T290 PolarHBondContact O-N 3.39Å; C286-T290 PolarHBondContact O-OG1 3.11Å; C286-L387 VanDerWaalsContact SG-CD2 3.55Å; C286-F390 HydrophobicContact CB-CB 3.85Å; C286-L392 HydrophobicContact CB-CD1 4.45Å
287	K	94.3	Very high	83	Confident	115 Å²	115	59.1 Å²	59.1	50%	0.5	32%	0.315	S	S	.	.	H	α-helix	trans	-58.6	-40.8	176.6	-73	174.3	-175.9	171.2	0	112.5	E283 R284 L285 R291	E283-K287 HydrophobicContact CG-CD 4.42Å; E283-K287 WeakPolarHBondContact O-CG 3.32Å; E283-K287 PolarHBondContact O-N 3.47Å; E283-K287 VanDerWaalsContact OE1-CE 3.23Å; E283-K287 WeakPolarHBondContact OE1-CE 3.19Å; E283-K287 IonicContact OE1-NZ 3.06Å; E283-K287 PolarHBondContact OE1-NZ 3.21Å; R284-K287 PolarHBondContact O-N 3.06Å; L285-K287 PolarHBondContact O-N 3.37Å; K287-R291 WeakPolarHBondContact O-CB 3.27Å; K287-R291 PolarHBondContact O-N 3.33Å
288	L	92.6	Very high	80.6	Confident	19 Å²	19	57.7 Å²	57.7	10%	0.099	33%	0.327	C	S	.	.	H	α-helix	trans	-65.8	-46.9	176.1	-74.2	174.1	0	0	0	112	Q225 L228 A229 R284 L285 C286 T290 R291 K364 V367	Q225-L288 HydrophobicContact CB-CD2 3.67Å; Q225-L288 HydrophobicContact CG-CD2 3.93Å; L228-L288 HydrophobicContact CB-CD1 4.18Å; L228-L288 HydrophobicContact CD2-CD1 3.79Å; L228-L288 HydrophobicContact CG-CD1 3.95Å; A229-L288 HydrophobicContact CB-CD1 4.46Å; R284-L288 WeakPolarHBondContact O-CG 3.42Å; R284-L288 PolarHBondContact O-N 2.76Å; L285-L288 PolarHBondContact O-N 2.96Å; C286-L288 VanDerWaalsContact C-N 3.31Å; C286-L288 PolarHBondContact O-N 3.35Å; L288-T290 VanDerWaalsContact C-N 3.3Å; L288-T290 PolarHBondContact O-N 3.42Å; L288-R291 PolarHBondContact O-N 3.1Å; L288-K364 PolarHBondContact O-NZ 3.37Å; L288-V367 HydrophobicContact CB-CG1 4.37Å; L288-V367 HydrophobicContact CB-CG2 4.15Å; L288-V367 HydrophobicContact CD1-CG2 4.15Å
289	A	92.9	Very high	78.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-58.3	-44.1	178.4	0	0	0	0	0	111.3	L285 C286 K364 V367 L368 L371 L392 L399	L285-A289 WeakPolarHBondContact O-CB 3.48Å; L285-A289 PolarHBondContact O-N 3.13Å; C286-A289 PolarHBondContact O-N 3.46Å; A289-K364 PolarHBondContact O-NZ 3Å; A289-V367 HydrophobicContact CB-CG1 3.99Å; A289-L368 HydrophobicContact CB-CD2 4.01Å; A289-L371 HydrophobicContact CB-CD1 4.45Å; A289-L392 HydrophobicContact CB-CD1 3.87Å; A289-L399 WeakPolarHBondContact O-CD1 3.49Å
290	T	92.4	Very high	76.4	Confident	35 Å²	35	61.4 Å²	61.4	22%	0.215	35%	0.349	C	S	.	.	H	α-helix	trans	-93.7	1.8	-174.5	68.7	0	0	0	0	114.3	C286 L288 K292 L392	C286-T290 WeakPolarHBondContact O-CG2 3.38Å; C286-T290 PolarHBondContact O-N 3.39Å; C286-T290 PolarHBondContact O-OG1 3.11Å; L288-T290 VanDerWaalsContact C-N 3.3Å; L288-T290 PolarHBondContact O-N 3.42Å; T290-K292 PolarHBondContact O-N 3Å; T290-L392 HydrophobicContact CG2-CD1 3.96Å
291	R	87.4	Confident	74.3	Confident	117 Å²	117	61 Å²	61	44%	0.442	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-58.1	133.1	177.4	-177.2	173.2	174.4	-176.6	-9.2	110	K287 L288 K364	K287-R291 WeakPolarHBondContact O-CB 3.27Å; K287-R291 PolarHBondContact O-N 3.33Å; L288-R291 PolarHBondContact O-N 3.1Å; R291-K364 PolarHBondContact O-NZ 3.47Å
292	K	79.1	Confident	72.1	Confident	151 Å²	151	64 Å²	64	66%	0.657	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-70.9	132.1	171.8	-63.7	178.9	-177.9	175.5	0	108.8	T290	T290-K292 PolarHBondContact O-N 3Å
293	V	65.2	Low	70.2	Confident	30 Å²	30	68.9 Å²	68.9	18%	0.182	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-63.9	133.3	167	-176.5	0	0	0	0	107.3	E295 T357 E360 L403	V293-E295 PolarHBondContact O-N 2.86Å; V293-T357 HydrophobicContact CG1-CG2 4.13Å; V293-E360 WeakPolarHBondContact CA-OE2 3.43Å; V293-E360 HydrophobicContact CG2-CG 4.45Å; V293-L403 HydrophobicContact CG2-CD1 3.78Å; V293-L403 HydrophobicContact CG2-CD2 3.71Å; V293-L403 HydrophobicContact CG2-CG 4.34Å
294	S	55.3	Low	68.3	Low	77 Å²	77	66.7 Å²	66.7	54%	0.538	37%	0.368	S	S	.	.			trans	-54.1	113.2	175.6	-64.3	0	0	0	0	108.8	A296	S294-A296 PolarHBondContact O-N 3.49Å
295	E	44.1	Very low	66.3	Low	153 Å²	153	65.2 Å²	65.2	72%	0.715	36%	0.364	S	S	*	.			trans	-62.7	99.6	-180	-72	179.3	172.6	0	0	107.9	V293 T297 K402	V293-E295 PolarHBondContact O-N 2.86Å; E295-T297 PolarHBondContact O-N 3.11Å; E295-K402 IonicContact OE1-NZ 3.72Å; E295-K402 PolarHBondContact OE1-NZ 3.1Å
296	A	41.7	Very low	64.4	Low	44 Å²	44	67.5 Å²	67.5	36%	0.364	38%	0.375	S	S	.	.			trans	-60.6	120.8	169.1	0	0	0	0	0	107.4	S294 G298 Q353	S294-A296 PolarHBondContact O-N 3.49Å; A296-G298 PolarHBondContact O-N 2.91Å; A296-Q353 HydrophobicContact CB-CG 4.13Å
297	T	39.2	Very low	62.4	Low	145 Å²	145	70.9 Å²	70.9	89%	0.89	39%	0.393	S	S	*	.	S	Bend	trans	-52.9	101.9	169.8	26.9	0	0	0	0	109.8	E295 A299	E295-T297 PolarHBondContact O-N 3.11Å; T297-A299 PolarHBondContact O-N 2.84Å; T297-A299 VanDerWaalsContact O-N 3.14Å
298	G	43.3	Very low	60.6	Low	84 Å²	84	66.9 Å²	66.9	87%	0.866	37%	0.374	S	S	*	.	S	Bend	trans	70.8	6.9	157.4	0	0	0	0	0	118.8	A296	A296-G298 PolarHBondContact O-N 2.91Å
299	A	46	Very low	58.8	Low	52 Å²	52	70.4 Å²	70.4	43%	0.43	39%	0.387	S	S	.	.			trans	-84.7	137.4	175.8	0	0	0	0	0	112	T297 F301	T297-A299 PolarHBondContact O-N 2.84Å; T297-A299 VanDerWaalsContact O-N 3.14Å; A299-F301 PolarHBondContact O-N 3.34Å
300	N	55.4	Low	56.9	Low	120 Å²	120	73.8 Å²	73.8	64%	0.642	41%	0.408	S	S	*	.			trans	-72.3	110.8	176.1	-97.2	-12	0	0	0	109.6	L302 Q303 E304	N300-L302 PolarHBondContact O-N 2.44Å; N300-Q303 HydrophobicContact CB-CB 4.34Å; N300-Q303 WeakPolarHBondContact O-CA 3.31Å; N300-Q303 VanDerWaalsContact O-CB 3.23Å; N300-Q303 WeakPolarHBondContact O-CB 3.01Å; N300-Q303 PolarHBondContact O-N 2.98Å; N300-E304 PolarHBondContact O-N 2.72Å
301	F	50.5	Low	55	Low	18 Å²	18	74.9 Å²	74.9	8%	0.079	41%	0.408	C	S	.	.	H	α-helix	trans	-55.9	-22.7	177.9	177.9	-108.1	0	0	0	114.4	A299 E304 L305 T357 I361	A299-F301 PolarHBondContact O-N 3.34Å; F301-E304 HydrophobicContact CD2-CB 4.39Å; F301-E304 WeakPolarHBondContact O-CB 3.26Å; F301-E304 PolarHBondContact O-N 2.96Å; F301-L305 HydrophobicContact CD1-CD1 3.78Å; F301-L305 HydrophobicContact CE1-CD1 3.19Å; F301-L305 HydrophobicContact CE1-CG 3.99Å; F301-L305 HydrophobicContact CE2-CD1 4.45Å; F301-L305 HydrophobicContact CE2-CG 4.41Å; F301-L305 HydrophobicContact CZ-CD1 3.59Å; F301-L305 HydrophobicContact CZ-CG 3.91Å; F301-L305 PolarHBondContact O-N 2.67Å; F301-T357 HydrophobicContact CD2-CG2 4.09Å; F301-T357 HydrophobicContact CE2-CG2 3.46Å; F301-T357 VanDerWaalsContact CE2-CG2 3.46Å; F301-T357 HydrophobicContact CZ-CG2 4.35Å; F301-I361 HydrophobicContact CZ-CD1 4.23Å
302	L	51.1	Low	53.3	Low	64 Å²	64	72.3 Å²	72.3	34%	0.335	40%	0.403	S	S	.	.	H	α-helix	trans	-66.8	-43.3	171.2	-79.2	171.9	0	0	0	112	N300 E304 L305 E306 Y408	N300-L302 PolarHBondContact O-N 2.44Å; L302-E304 PolarHBondContact O-N 3Å; L302-L305 PolarHBondContact O-N 2.67Å; L302-E306 WeakPolarHBondContact O-CB 3.04Å; L302-E306 WeakPolarHBondContact O-CG 2.98Å; L302-E306 PolarHBondContact O-N 3.23Å; L302-Y408 HydrophobicContact CD1-CD1 4.07Å; L302-Y408 HydrophobicContact CD2-CD1 3.55Å; L302-Y408 HydrophobicContact CD2-CE1 3.54Å; L302-Y408 HydrophobicContact CG-CD1 3.88Å; L302-Y408 HydrophobicContact CG-CE1 4.08Å
303	Q	57.3	Low	51.8	Low	104 Å²	104	70.7 Å²	70.7	49%	0.486	40%	0.401	S	S	.	.	H	α-helix	trans	-60.6	-41.2	171.3	-167.7	69.2	54.5	0	0	109.5	N300 E306 D307	N300-Q303 HydrophobicContact CB-CB 4.34Å; N300-Q303 WeakPolarHBondContact O-CA 3.31Å; N300-Q303 VanDerWaalsContact O-CB 3.23Å; N300-Q303 WeakPolarHBondContact O-CB 3.01Å; N300-Q303 PolarHBondContact O-N 2.98Å; Q303-E306 PolarHBondContact O-N 3.47Å; Q303-D307 PolarHBondContact NE2-OD1 3.41Å; Q303-D307 VanDerWaalsContact NE2-OD1 3.15Å; Q303-D307 WeakPolarHBondContact O-CB 3.34Å; Q303-D307 PolarHBondContact O-N 2.95Å
304	E	57.7	Low	50.9	Low	18 Å²	18	74.4 Å²	74.4	8%	0.084	42%	0.42	C	S	.	.	H	α-helix	trans	-61.6	-45.2	175.8	-74.1	-179.8	-170.6	0	0	112.9	N300 F301 L302 W308 S354	N300-E304 PolarHBondContact O-N 2.72Å; F301-E304 HydrophobicContact CD2-CB 4.39Å; F301-E304 WeakPolarHBondContact O-CB 3.26Å; F301-E304 PolarHBondContact O-N 2.96Å; L302-E304 PolarHBondContact O-N 3Å; E304-W308 WeakPolarHBondContact O-CB 3.27Å; E304-W308 PolarHBondContact O-N 2.84Å; E304-S354 VanDerWaalsContact CA-CB 3.5Å; E304-S354 WeakPolarHBondContact O-CB 2.87Å; E304-S354 PolarHBondContact O-OG 3.39Å
305	L	54.4	Low	50.3	Low	22 Å²	22	73.7 Å²	73.7	12%	0.115	42%	0.419	C	S	.	.	H	α-helix	trans	-67	-42.6	176.5	-95.6	163.5	0	0	0	112.3	F301 L302 W308 Y309 V358	F301-L305 HydrophobicContact CD1-CD1 3.78Å; F301-L305 HydrophobicContact CE1-CD1 3.19Å; F301-L305 HydrophobicContact CE1-CG 3.99Å; F301-L305 HydrophobicContact CE2-CD1 4.45Å; F301-L305 HydrophobicContact CE2-CG 4.41Å; F301-L305 HydrophobicContact CZ-CD1 3.59Å; F301-L305 HydrophobicContact CZ-CG 3.91Å; F301-L305 PolarHBondContact O-N 2.67Å; L302-L305 PolarHBondContact O-N 2.67Å; L305-W308 HydrophobicContact CD2-CE3 4.31Å; L305-W308 WeakPolarHBondContact O-CB 3.44Å; L305-W308 PolarHBondContact O-N 2.85Å; L305-Y309 HydrophobicContact CD2-CE2 3.91Å; L305-Y309 WeakPolarHBondContact O-CD2 3.32Å; L305-Y309 PolarHBondContact O-N 3.02Å; L305-V358 HydrophobicContact CD2-CG2 4.44Å
306	E	55.6	Low	50.6	Low	49 Å²	49	71.8 Å²	71.8	23%	0.229	41%	0.413	C	S	.	.	H	α-helix	trans	-63	-44.2	174.3	-76.4	177.5	176.1	0	0	111.2	L302 Q303 W308 Y309 T310 V415	L302-E306 WeakPolarHBondContact O-CB 3.04Å; L302-E306 WeakPolarHBondContact O-CG 2.98Å; L302-E306 PolarHBondContact O-N 3.23Å; Q303-E306 PolarHBondContact O-N 3.47Å; E306-W308 PolarHBondContact O-N 3.02Å; E306-Y309 PolarHBondContact O-N 3.29Å; E306-T310 VanDerWaalsContact O-CB 3.24Å; E306-T310 WeakPolarHBondContact O-CB 3.4Å; E306-T310 PolarHBondContact O-N 3.28Å; E306-T310 PolarHBondContact O-OG1 3.31Å; E306-V415 HydrophobicContact CG-CB 4.47Å; E306-V415 HydrophobicContact CG-CG2 4.36Å; E306-V415 WeakPolarHBondContact OE1-CG2 3.15Å
307	D	55.9	Low	51	Low	71 Å²	71	72 Å²	72	38%	0.38	41%	0.41	S	S	.	.	H	α-helix	trans	-60	-34.8	173.9	-67.1	-13.7	0	0	0	110.6	Q303 W311	Q303-D307 PolarHBondContact NE2-OD1 3.41Å; Q303-D307 VanDerWaalsContact NE2-OD1 3.15Å; Q303-D307 WeakPolarHBondContact O-CB 3.34Å; Q303-D307 PolarHBondContact O-N 2.95Å; D307-W311 WeakPolarHBondContact O-CB 2.97Å; D307-W311 PolarHBondContact O-N 2.85Å
308	W	55.4	Low	51.3	Low	31 Å²	31	69 Å²	69	12%	0.117	39%	0.388	C	S	.	.	H	α-helix	trans	-71.4	-48	174.4	176.8	75.3	0	0	0	113.2	E304 L305 E306 W311 L312 V358 P426	E304-W308 WeakPolarHBondContact O-CB 3.27Å; E304-W308 PolarHBondContact O-N 2.84Å; L305-W308 HydrophobicContact CD2-CE3 4.31Å; L305-W308 WeakPolarHBondContact O-CB 3.44Å; L305-W308 PolarHBondContact O-N 2.85Å; E306-W308 PolarHBondContact O-N 3.02Å; W308-W311 CarbonylContact O-C 3.55Å; W308-W311 PolarHBondContact O-N 2.59Å; W308-W311 VanDerWaalsContact O-N 3.15Å; W308-L312 HydrophobicContact CD2-CD1 3.8Å; W308-L312 HydrophobicContact CE3-CD1 3.89Å; W308-L312 HydrophobicContact CH2-CD1 3.22Å; W308-L312 HydrophobicContact CZ2-CD1 3.09Å; W308-L312 HydrophobicContact CZ2-CG 4.19Å; W308-L312 HydrophobicContact CZ3-CD1 3.62Å; W308-L312 WeakPolarHBondContact O-CB 3.17Å; W308-L312 PolarHBondContact O-N 2.93Å; W308-V358 HydrophobicContact CD2-CG1 4.45Å; W308-V358 HydrophobicContact CD2-CG2 4.24Å; W308-V358 HydrophobicContact CG-CG2 4.21Å; W308-V358 HydrophobicContact CZ2-CG1 3.86Å; W308-P426 HydrophobicContact CH2-CG 4.16Å
309	Y	54.6	Low	51.4	Low	94 Å²	94	69.7 Å²	69.7	37%	0.369	37%	0.372	S	S	.	.	H	α-helix	trans	-61.7	-45.7	176.9	-78.2	-69.2	0	0	0	111.1	L305 E306 W311 L312 D313	L305-Y309 HydrophobicContact CD2-CE2 3.91Å; L305-Y309 WeakPolarHBondContact O-CD2 3.32Å; L305-Y309 PolarHBondContact O-N 3.02Å; E306-Y309 PolarHBondContact O-N 3.29Å; Y309-W311 PolarHBondContact O-N 3.07Å; Y309-L312 WeakPolarHBondContact O-CB 3.45Å; Y309-L312 PolarHBondContact O-N 3.47Å; Y309-D313 PolarHBondContact O-N 3.29Å; Y309-D313 VanDerWaalsContact O-N 3.12Å
310	T	53.9	Low	51.5	Low	70 Å²	70	67.8 Å²	67.8	43%	0.429	36%	0.356	S	S	.	.	H	α-helix	trans	-61.2	-31.9	175.3	-47.5	0	0	0	0	111.3	E306 N314	E306-T310 VanDerWaalsContact O-CB 3.24Å; E306-T310 WeakPolarHBondContact O-CB 3.4Å; E306-T310 PolarHBondContact O-N 3.28Å; E306-T310 PolarHBondContact O-OG1 3.31Å; T310-N314 PolarHBondContact O-ND2 3.03Å
311	W	52.3	Low	51.2	Low	59 Å²	59	64 Å²	64	22%	0.223	34%	0.336	C	S	.	.	H	α-helix	trans	-81.3	-33.7	176.3	-175.9	87.6	0	0	0	113.7	D307 W308 Y309 D313 N314 L316 V317 A320 M355	D307-W311 WeakPolarHBondContact O-CB 2.97Å; D307-W311 PolarHBondContact O-N 2.85Å; W308-W311 CarbonylContact O-C 3.55Å; W308-W311 PolarHBondContact O-N 2.59Å; W308-W311 VanDerWaalsContact O-N 3.15Å; Y309-W311 PolarHBondContact O-N 3.07Å; W311-D313 VanDerWaalsContact C-N 3.29Å; W311-D313 PolarHBondContact O-N 2.99Å; W311-N314 CarbonylContact O-C 3.33Å; W311-N314 VanDerWaalsContact O-CA 3.28Å; W311-N314 WeakPolarHBondContact O-CA 3.44Å; W311-N314 WeakPolarHBondContact O-CB 3.49Å; W311-N314 PolarHBondContact O-N 3.24Å; W311-L316 WeakPolarHBondContact CH2-O 3.28Å; W311-V317 HydrophobicContact CE3-CG2 4.42Å; W311-V317 VanDerWaalsContact CH2-CA 3.46Å; W311-V317 HydrophobicContact CH2-CB 4.31Å; W311-V317 HydrophobicContact CH2-CG2 4.27Å; W311-V317 HydrophobicContact CZ3-CB 4.08Å; W311-V317 HydrophobicContact CZ3-CG1 4.2Å; W311-V317 HydrophobicContact CZ3-CG2 3.69Å; W311-A320 HydrophobicContact CH2-CB 3.65Å; W311-A320 HydrophobicContact CZ2-CB 3.61Å; W311-M355 HydrophobicContact CD2-CE 4.49Å; W311-M355 HydrophobicContact CD2-SD 4.02Å; W311-M355 HydrophobicContact CE3-CE 3.88Å; W311-M355 HydrophobicContact CE3-SD 3.9Å; W311-M355 HydrophobicContact CH2-CE 3.24Å; W311-M355 HydrophobicContact CH2-SD 3.86Å; W311-M355 HydrophobicContact CZ2-CE 3.99Å; W311-M355 HydrophobicContact CZ2-SD 4.04Å; W311-M355 HydrophobicContact CZ3-CE 3.2Å; W311-M355 HydrophobicContact CZ3-SD 3.81Å
312	L	51.9	Low	51.1	Low	63 Å²	63	65.2 Å²	65.2	33%	0.33	34%	0.342	S	S	.	.	H	α-helix	trans	-60.2	-40.7	173.6	-116.8	166.5	0	0	0	111.6	W308 Y309 N314 A315 V317	W308-L312 HydrophobicContact CD2-CD1 3.8Å; W308-L312 HydrophobicContact CE3-CD1 3.89Å; W308-L312 HydrophobicContact CH2-CD1 3.22Å; W308-L312 HydrophobicContact CZ2-CD1 3.09Å; W308-L312 HydrophobicContact CZ2-CG 4.19Å; W308-L312 HydrophobicContact CZ3-CD1 3.62Å; W308-L312 WeakPolarHBondContact O-CB 3.17Å; W308-L312 PolarHBondContact O-N 2.93Å; Y309-L312 WeakPolarHBondContact O-CB 3.45Å; Y309-L312 PolarHBondContact O-N 3.47Å; L312-N314 PolarHBondContact O-N 3.2Å; L312-N314 VanDerWaalsContact O-N 3.15Å; L312-A315 PolarHBondContact O-N 2.86Å; L312-V317 HydrophobicContact CD2-CG2 3.75Å; L312-V317 HydrophobicContact CG-CG2 4.32Å
313	D	46.2	Very low	51	Low	116 Å²	116	66.2 Å²	66.2	62%	0.62	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-16	171.9	-74.4	-16	0	0	0	112.4	Y309 W311	Y309-D313 PolarHBondContact O-N 3.29Å; Y309-D313 VanDerWaalsContact O-N 3.12Å; W311-D313 VanDerWaalsContact C-N 3.29Å; W311-D313 PolarHBondContact O-N 2.99Å
314	N	47.3	Very low	50.6	Low	108 Å²	108	61.9 Å²	61.9	58%	0.578	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	45.1	175.8	-66.8	-54.8	0	0	0	112.4	T310 W311 L312 L316	T310-N314 PolarHBondContact O-ND2 3.03Å; W311-N314 CarbonylContact O-C 3.33Å; W311-N314 VanDerWaalsContact O-CA 3.28Å; W311-N314 WeakPolarHBondContact O-CA 3.44Å; W311-N314 WeakPolarHBondContact O-CB 3.49Å; W311-N314 PolarHBondContact O-N 3.24Å; L312-N314 PolarHBondContact O-N 3.2Å; L312-N314 VanDerWaalsContact O-N 3.15Å; N314-L316 PolarHBondContact O-N 3.04Å
315	A	41.6	Very low	50.1	Low	63 Å²	63	62.8 Å²	62.8	52%	0.521	34%	0.335	S	S	.	.	S	Bend	trans	36.4	36.9	148.4	0	0	0	0	0	122	L312	L312-A315 PolarHBondContact O-N 2.86Å
316	L	51.2	Low	49.7	Very low	112 Å²	112	65.1 Å²	65.1	59%	0.586	35%	0.351	S	S	*	.			trans	-138.5	41.5	169.6	-70.8	174.8	0	0	0	113.8	W311 N314 L318 A320	W311-L316 WeakPolarHBondContact CH2-O 3.28Å; N314-L316 PolarHBondContact O-N 3.04Å; L316-L318 PolarHBondContact O-N 3.23Å; L316-A320 PolarHBondContact O-N 3.41Å
317	V	49.7	Very low	49.2	Very low	49 Å²	49	66.7 Å²	66.7	30%	0.297	36%	0.358	S	S	.	.	H	α-helix	trans	-61	-44.4	-175.7	-173.4	0	0	0	0	113.3	W311 L312 L321	W311-V317 HydrophobicContact CE3-CG2 4.42Å; W311-V317 VanDerWaalsContact CH2-CA 3.46Å; W311-V317 HydrophobicContact CH2-CB 4.31Å; W311-V317 HydrophobicContact CH2-CG2 4.27Å; W311-V317 HydrophobicContact CZ3-CB 4.08Å; W311-V317 HydrophobicContact CZ3-CG1 4.2Å; W311-V317 HydrophobicContact CZ3-CG2 3.69Å; L312-V317 HydrophobicContact CD2-CG2 3.75Å; L312-V317 HydrophobicContact CG-CG2 4.32Å; V317-L321 HydrophobicContact CG1-CD1 3.86Å; V317-L321 HydrophobicContact CG1-CG 4.35Å; V317-L321 WeakPolarHBondContact O-CB 3.41Å; V317-L321 WeakPolarHBondContact O-CG 3.17Å; V317-L321 PolarHBondContact O-N 3.26Å; V317-L321 VanDerWaalsContact O-N 3.1Å
318	L	45	Very low	48.6	Very low	81 Å²	81	67.6 Å²	67.6	42%	0.424	36%	0.36	S	S	.	.	H	α-helix	trans	-75	-40.8	-170.5	-159.2	70	0	0	0	113.1	Y157 L316 L321 M322	Y157-L318 HydrophobicContact CE1-CD2 4.11Å; L316-L318 PolarHBondContact O-N 3.23Å; L318-L321 PolarHBondContact O-N 2.74Å; L318-M322 PolarHBondContact O-N 2.86Å
319	D	45.7	Very low	47.9	Very low	100 Å²	100	68.5 Å²	68.5	54%	0.535	37%	0.374	S	S	.	.	H	α-helix	trans	-68.6	-37.1	179.8	-115.5	12.9	0	0	0	111.5	M322 Q323	D319-M322 PolarHBondContact O-N 2.97Å; D319-Q323 WeakPolarHBondContact O-CG 3.49Å; D319-Q323 PolarHBondContact O-N 3.32Å
320	A	49.8	Very low	47.1	Very low	12 Å²	12	70.6 Å²	70.6	10%	0.099	39%	0.387	C	S	.	.	H	α-helix	trans	-72.9	-36.1	175.6	0	0	0	0	0	112.9	W311 L316 M322 Q323 M324 L351 M355	W311-A320 HydrophobicContact CH2-CB 3.65Å; W311-A320 HydrophobicContact CZ2-CB 3.61Å; L316-A320 PolarHBondContact O-N 3.41Å; A320-M322 VanDerWaalsContact C-N 3.33Å; A320-Q323 PolarHBondContact O-N 2.83Å; A320-M324 PolarHBondContact O-N 3.3Å; A320-M324 VanDerWaalsContact O-N 3.11Å; A320-L351 HydrophobicContact CB-CD2 4.36Å; A320-M355 HydrophobicContact CB-CE 4.44Å
321	L	48.2	Very low	46.3	Very low	41 Å²	41	74.4 Å²	74.4	22%	0.215	40%	0.4	C	S	.	.	H	α-helix	trans	-63.7	-38.8	171.8	-75.2	174.2	0	0	0	111.4	V317 L318 M324 A325	V317-L321 HydrophobicContact CG1-CD1 3.86Å; V317-L321 HydrophobicContact CG1-CG 4.35Å; V317-L321 WeakPolarHBondContact O-CB 3.41Å; V317-L321 WeakPolarHBondContact O-CG 3.17Å; V317-L321 PolarHBondContact O-N 3.26Å; V317-L321 VanDerWaalsContact O-N 3.1Å; L318-L321 PolarHBondContact O-N 2.74Å; L321-M324 HydrophobicContact CD2-CE 3.45Å; L321-M324 VanDerWaalsContact CD2-CE 3.45Å; L321-M324 PolarHBondContact O-N 3.37Å; L321-A325 PolarHBondContact O-N 3.28Å
322	M	47.9	Very low	45.4	Very low	42 Å²	42	76.6 Å²	76.6	21%	0.207	42%	0.424	C	S	.	.	H	α-helix	trans	-66.9	-38.6	174	-83	-177.9	45.4	0	0	112.4	L191 Q192 L318 D319 A320 A325 T326	L191-M322 HydrophobicContact CD2-CG 3.95Å; Q192-M322 HydrophobicContact CG-CE 4.31Å; Q192-M322 HydrophobicContact CG-SD 4.18Å; L318-M322 PolarHBondContact O-N 2.86Å; D319-M322 PolarHBondContact O-N 2.97Å; A320-M322 VanDerWaalsContact C-N 3.33Å; M322-A325 PolarHBondContact O-N 3.42Å; M322-T326 PolarHBondContact O-N 3.48Å; M322-T326 PolarHBondContact O-OG1 2.86Å; M322-T326 VanDerWaalsContact O-OG1 3.13Å
323	Q	49.9	Very low	44.5	Very low	86 Å²	86	77.8 Å²	77.8	40%	0.402	44%	0.438	S	S	.	.	H	α-helix	trans	-62.5	-38.9	174.7	-76.7	-179.2	4.3	0	0	112.6	D319 A320 A325 T326 E327	D319-Q323 WeakPolarHBondContact O-CG 3.49Å; D319-Q323 PolarHBondContact O-N 3.32Å; A320-Q323 PolarHBondContact O-N 2.83Å; Q323-A325 PolarHBondContact O-N 3.23Å; Q323-T326 WeakPolarHBondContact CA-OG1 3.43Å; Q323-T326 PolarHBondContact O-N 3.14Å; Q323-T326 PolarHBondContact O-OG1 3.27Å; Q323-E327 WeakPolarHBondContact O-CG 3.39Å; Q323-E327 PolarHBondContact O-N 3.29Å
324	M	47.3	Very low	43.9	Very low	13 Å²	13	77 Å²	77	6%	0.064	44%	0.437	C	S	.	.	H	α-helix	trans	-58.3	-44.3	174.8	-81.2	-157	-72	0	0	113.7	A320 L321 T326 E328 L351 K356	A320-M324 PolarHBondContact O-N 3.3Å; A320-M324 VanDerWaalsContact O-N 3.11Å; L321-M324 HydrophobicContact CD2-CE 3.45Å; L321-M324 VanDerWaalsContact CD2-CE 3.45Å; L321-M324 PolarHBondContact O-N 3.37Å; M324-T326 PolarHBondContact O-N 3.38Å; M324-E328 PolarHBondContact O-N 3.15Å; M324-L351 HydrophobicContact CE-CD2 3.98Å; M324-L351 HydrophobicContact CG-CD1 3.77Å; M324-L351 HydrophobicContact CG-CD2 3.42Å; M324-L351 VanDerWaalsContact CG-CD2 3.42Å; M324-L351 HydrophobicContact CG-CG 4.11Å; M324-L351 HydrophobicContact SD-CD2 3.66Å; M324-K356 HydrophobicContact SD-CG 4.24Å
325	A	47.3	Very low	43.1	Very low	36 Å²	36	81.9 Å²	81.9	30%	0.298	46%	0.457	S	S	.	.	H	α-helix	trans	-66.4	-27.7	-178.4	0	0	0	0	0	112.1	L321 M322 Q323	L321-A325 PolarHBondContact O-N 3.28Å; M322-A325 PolarHBondContact O-N 3.42Å; Q323-A325 PolarHBondContact O-N 3.23Å
326	T	46.2	Very low	42.5	Very low	72 Å²	72	83.2 Å²	83.2	44%	0.442	46%	0.462	S	S	.	.	H	α-helix	trans	-85.3	-38.8	176.8	40.5	0	0	0	0	113.8	M322 Q323 M324 A329	M322-T326 PolarHBondContact O-N 3.48Å; M322-T326 PolarHBondContact O-OG1 2.86Å; M322-T326 VanDerWaalsContact O-OG1 3.13Å; Q323-T326 WeakPolarHBondContact CA-OG1 3.43Å; Q323-T326 PolarHBondContact O-N 3.14Å; Q323-T326 PolarHBondContact O-OG1 3.27Å; M324-T326 PolarHBondContact O-N 3.38Å; T326-A329 PolarHBondContact O-N 3.44Å
327	E	44.8	Very low	41.7	Very low	81 Å²	81	83 Å²	83	38%	0.379	47%	0.47	S	S	.	.	H	α-helix	trans	-71.8	-34.9	-175.7	-74.5	-175.8	169.9	0	0	113.9	Q323 A329	Q323-E327 WeakPolarHBondContact O-CG 3.39Å; Q323-E327 PolarHBondContact O-N 3.29Å; E327-A329 VanDerWaalsContact C-N 3.32Å
328	E	43.8	Very low	40.8	Very low	91 Å²	91	88.3 Å²	88.3	43%	0.425	50%	0.497	S	S	.	.	H	α-helix	trans	-74.9	-23.2	176.6	-70.7	-168.1	172.8	0	0	112.6	M324 K356	M324-E328 PolarHBondContact O-N 3.15Å; E328-K356 IonicContact OE1-NZ 2.75Å; E328-K356 PolarHBondContact OE1-NZ 3.28Å
329	A	40.3	Very low	40.4	Very low	50 Å²	50	93.7 Å²	93.7	41%	0.413	52%	0.52	S	S	.	.	H	α-helix	trans	-69	-37.2	174.6	0	0	0	0	0	112.2	T326 E327 S332	T326-A329 PolarHBondContact O-N 3.44Å; E327-A329 VanDerWaalsContact C-N 3.32Å; A329-S332 PolarHBondContact O-N 3.19Å; A329-S332 PolarHBondContact O-OG 3.06Å
330	E	38.7	Very low	39.6	Very low	137 Å²	137	94.2 Å²	94.2	64%	0.64	53%	0.531	S	S	*	.	H	α-helix	trans	-73.8	-30.5	179.1	-67.4	-174.3	166.7	0	0	113	S332 S333 T334	E330-S332 PolarHBondContact O-N 3.09Å; E330-S333 PolarHBondContact O-N 3.48Å; E330-S333 PolarHBondContact O-OG 3.02Å; E330-T334 PolarHBondContact O-OG1 3.08Å
331	Q	36.3	Very low	38.6	Very low	151 Å²	151	98.7 Å²	98.7	71%	0.706	56%	0.562	S	S	*	*	H	α-helix	trans	-69.9	-20.3	176.5	-73.1	179.1	7.9	0	0	113.3	S333	Q331-S333 VanDerWaalsContact C-N 3.32Å
332	S	33.7	Very low	37.7	Very low	104 Å²	104	104.4 Å²	104.4	73%	0.727	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-7.6	176.4	73	0	0	0	0	114.5	A329 E330	A329-S332 PolarHBondContact O-N 3.19Å; A329-S332 PolarHBondContact O-OG 3.06Å; E330-S332 PolarHBondContact O-N 3.09Å
333	S	33.2	Very low	37.1	Very low	89 Å²	89	106.9 Å²	106.9	62%	0.622	62%	0.619	S	S	*	*	S	Bend	trans	-114.1	5.6	-172.7	51.2	0	0	0	0	116.1	E330 Q331	E330-S333 PolarHBondContact O-N 3.48Å; E330-S333 PolarHBondContact O-OG 3.02Å; Q331-S333 VanDerWaalsContact C-N 3.32Å
334	T	33.1	Very low	36.2	Very low	99 Å²	99	109.4 Å²	109.4	61%	0.607	64%	0.64	S	S	*	*			trans	-139.9	73.4	-175.7	1.1	0	0	0	0	112.7	E330 S336	E330-T334 PolarHBondContact O-OG1 3.08Å; T334-S336 VanDerWaalsContact C-N 3.32Å; T334-S336 PolarHBondContact O-N 3.27Å
335	E	30.7	Very low	35.1	Very low	211 Å²	211	113.2 Å²	113.2	99%	0.986	67%	0.669	S	S	*	*			trans	-82.1	84.9	147.7	-76.5	-172	172.2	0	0	107.8
336	S	29.1	Very low	34.6	Very low	91 Å²	91	117.9 Å²	117.9	64%	0.636	70%	0.696	S	S	*	*			trans	-132.6	113.7	159	69	0	0	0	0	108.8	T334 D338	T334-S336 VanDerWaalsContact C-N 3.32Å; T334-S336 PolarHBondContact O-N 3.27Å; S336-D338 PolarHBondContact O-N 2.89Å
337	S	35.9	Very low	33.8	Very low	107 Å²	107	121.1 Å²	121.1	75%	0.748	71%	0.71	S	S	*	*			trans	-48.9	122.2	167.5	49.3	0	0	0	0	111.2
338	D	29.7	Very low	33.2	Very low	160 Å²	160	128.5 Å²	128.5	86%	0.856	73%	0.734	S	S	*	*				-173.6	105.7	127.9	-89.9	-18.2	0	0	0	109	S336	S336-D338 PolarHBondContact O-N 2.89Å
339	E	36.1	Very low	33.1	Very low	194 Å²	194	131 Å²	131	91%	0.907	75%	0.746	S	S	*	*			trans	-72.7	120.5	158.1	-79.4	-154.9	158	0	0	108.6
340	S	29	Very low	33.2	Very low	111 Å²	111	139.5 Å²	139.5	78%	0.776	77%	0.767	S	S	*	*				172.2	148	116	58	0	0	0	0	113
341	S	29.2	Very low	33.8	Very low	107 Å²	107	134.2 Å²	134.2	75%	0.748	74%	0.743	S	S	*	*			trans	96.6	124.8	156.1	77.4	0	0	0	0	118.7
342	L	30.4	Very low	34.9	Very low	161 Å²	161	129.6 Å²	129.6	84%	0.843	73%	0.726	S	S	*	*			trans	90	77	166.5	-66.7	148.8	0	0	0	117.5	T344	L342-T344 PolarHBondContact O-N 3.4Å
343	A	34.9	Very low	36.1	Very low	94 Å²	94	128.2 Å²	128.2	78%	0.777	71%	0.708	S	S	*	*			trans	-57.2	121.7	147.6	0	0	0	0	0	110.6
344	T	31.4	Very low	37.3	Very low	138 Å²	138	124.1 Å²	124.1	85%	0.847	68%	0.679	S	S	*	*			trans	173.7	88.7	136.5	29.5	0	0	0	0	110.7	L342	L342-T344 PolarHBondContact O-N 3.4Å
345	S	24.3	Very low	38.8	Very low	94 Å²	94	119.8 Å²	119.8	66%	0.657	65%	0.652	S	S	*	*			trans	-162.8	108.2	146.3	-173.6	0	0	0	0	108.6	L347	S345-L347 VanDerWaalsContact C-N 3.27Å; S345-L347 PolarHBondContact O-N 2.74Å
346	P	35.1	Very low	40.5	Very low	133 Å²	133	113.4 Å²	113.4	86%	0.864	62%	0.621	S	S	*	*			trans	-85.3	22.4	-174.5	9.6	6.1	0	0	0	114.8
347	L	30.6	Very low	42.3	Very low	141 Å²	141	109.6 Å²	109.6	74%	0.738	59%	0.594	S	S	*	*			trans	-137.3	45.6	-173.6	-77	160.3	0	0	0	112.9	S345	S345-L347 VanDerWaalsContact C-N 3.27Å; S345-L347 PolarHBondContact O-N 2.74Å
348	R	31.8	Very low	43.9	Very low	236 Å²	236	104.8 Å²	104.8	89%	0.891	56%	0.56	S	S	*	*			trans	-89.2	109.3	156.2	-83.7	-172.5	177.8	162.7	-0.2	107.8	R350	R348-R350 PolarHBondContact O-N 3.34Å
349	H	40.9	Very low	45.9	Very low	144 Å²	144	98.5 Å²	98.5	67%	0.667	53%	0.525	S	S	*	.			trans	-51.8	87.3	-179.7	-68.4	-84.8	0	0	0	112.5
350	R	43.8	Very low	47.9	Very low	228 Å²	228	90.7 Å²	90.7	86%	0.86	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-75.1	122.4	156.6	-81.2	-169.2	-172.9	-161.7	2.4	107	R348	R348-R350 PolarHBondContact O-N 3.34Å
351	L	49.9	Very low	50.3	Low	25 Å²	25	85.8 Å²	85.8	13%	0.131	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-54	141.7	171.9	-93.9	91.8	0	0	0	110.6	A320 M324 Q353 M355	A320-L351 HydrophobicContact CB-CD2 4.36Å; M324-L351 HydrophobicContact CE-CD2 3.98Å; M324-L351 HydrophobicContact CG-CD1 3.77Å; M324-L351 HydrophobicContact CG-CD2 3.42Å; M324-L351 VanDerWaalsContact CG-CD2 3.42Å; M324-L351 HydrophobicContact CG-CG 4.11Å; M324-L351 HydrophobicContact SD-CD2 3.66Å; L351-Q353 PolarHBondContact O-N 3.08Å; L351-M355 HydrophobicContact CD2-CB 4.09Å; L351-M355 HydrophobicContact CD2-CE 3.69Å; L351-M355 HydrophobicContact CD2-CG 4.48Å; L351-M355 HydrophobicContact CD2-SD 3.61Å; L351-M355 HydrophobicContact CG-SD 4.29Å
352	P	60.1	Low	52.7	Low	55 Å²	55	84.4 Å²	84.4	36%	0.357	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-54	137.3	172.9	-26.3	35.6	0	0	0	111.5	S354 M355	P352-S354 VanDerWaalsContact CB-OG 3.29Å; P352-S354 WeakPolarHBondContact CB-OG 3.38Å; P352-S354 PolarHBondContact O-N 2.93Å; P352-S354 VanDerWaalsContact O-N 3.09Å; P352-M355 WeakPolarHBondContact O-CB 3.34Å; P352-M355 PolarHBondContact O-N 3.2Å
353	Q	59.5	Low	55.2	Low	75 Å²	75	78.1 Å²	78.1	35%	0.35	40%	0.402	S	S	.	.	H	α-helix	trans	-55	-29.1	177.3	-178.4	61.4	24.1	0	0	112.3	A296 L351 M355 K356 T357	A296-Q353 HydrophobicContact CB-CG 4.13Å; L351-Q353 PolarHBondContact O-N 3.08Å; Q353-M355 VanDerWaalsContact C-N 3.31Å; Q353-M355 PolarHBondContact O-N 3.13Å; Q353-K356 PolarHBondContact O-N 3.44Å; Q353-T357 PolarHBondContact O-N 2.89Å; Q353-T357 PolarHBondContact O-OG1 3.33Å
354	S	58.9	Low	57.8	Low	2 Å²	2	73.9 Å²	73.9	1%	0.014	37%	0.366	C	S	.	.	H	α-helix	trans	-53.9	-43.2	173.2	58.2	0	0	0	0	114	E304 P352 K356 T357 V358	E304-S354 VanDerWaalsContact CA-CB 3.5Å; E304-S354 WeakPolarHBondContact O-CB 2.87Å; E304-S354 PolarHBondContact O-OG 3.39Å; P352-S354 VanDerWaalsContact CB-OG 3.29Å; P352-S354 WeakPolarHBondContact CB-OG 3.38Å; P352-S354 PolarHBondContact O-N 2.93Å; P352-S354 VanDerWaalsContact O-N 3.09Å; S354-K356 VanDerWaalsContact C-N 3.33Å; S354-K356 PolarHBondContact O-N 3.08Å; S354-T357 PolarHBondContact O-N 2.81Å; S354-V358 WeakPolarHBondContact O-CG2 3.43Å; S354-V358 PolarHBondContact O-N 3.45Å
355	M	63.1	Low	60.6	Low	9 Å²	9	68 Å²	68	4%	0.044	33%	0.33	C	S	.	.	H	α-helix	trans	-65.7	-38.1	-179.4	-69.9	-170.6	68.8	0	0	111.4	W311 A320 L351 P352 Q353 T357 H359	W311-M355 HydrophobicContact CD2-CE 4.49Å; W311-M355 HydrophobicContact CD2-SD 4.02Å; W311-M355 HydrophobicContact CE3-CE 3.88Å; W311-M355 HydrophobicContact CE3-SD 3.9Å; W311-M355 HydrophobicContact CH2-CE 3.24Å; W311-M355 HydrophobicContact CH2-SD 3.86Å; W311-M355 HydrophobicContact CZ2-CE 3.99Å; W311-M355 HydrophobicContact CZ2-SD 4.04Å; W311-M355 HydrophobicContact CZ3-CE 3.2Å; W311-M355 HydrophobicContact CZ3-SD 3.81Å; A320-M355 HydrophobicContact CB-CE 4.44Å; L351-M355 HydrophobicContact CD2-CB 4.09Å; L351-M355 HydrophobicContact CD2-CE 3.69Å; L351-M355 HydrophobicContact CD2-CG 4.48Å; L351-M355 HydrophobicContact CD2-SD 3.61Å; L351-M355 HydrophobicContact CG-SD 4.29Å; P352-M355 WeakPolarHBondContact O-CB 3.34Å; P352-M355 PolarHBondContact O-N 3.2Å; Q353-M355 VanDerWaalsContact C-N 3.31Å; Q353-M355 PolarHBondContact O-N 3.13Å; M355-T357 VanDerWaalsContact C-N 3.34Å; M355-T357 PolarHBondContact O-N 2.95Å; M355-H359 WeakPolarHBondContact O-CB 3.49Å; M355-H359 PolarHBondContact O-N 3.37Å
356	K	65.9	Low	63.7	Low	77 Å²	77	65.7 Å²	65.7	34%	0.335	31%	0.308	S	S	.	.	H	α-helix	trans	-63.4	-42.2	176	-63.8	-165.5	176.4	-151.3	0	111.3	M324 E328 Q353 S354 E360	M324-K356 HydrophobicContact SD-CG 4.24Å; E328-K356 IonicContact OE1-NZ 2.75Å; E328-K356 PolarHBondContact OE1-NZ 3.28Å; Q353-K356 PolarHBondContact O-N 3.44Å; S354-K356 VanDerWaalsContact C-N 3.33Å; S354-K356 PolarHBondContact O-N 3.08Å; K356-E360 WeakPolarHBondContact O-CB 3.37Å; K356-E360 PolarHBondContact O-N 3.39Å
357	T	67.2	Low	66.5	Low	10 Å²	10	59.4 Å²	59.4	6%	0.061	27%	0.268	C	S	.	.	H	α-helix	trans	-66.7	-46.8	178.8	-53.5	0	0	0	0	112.1	V293 F301 Q353 S354 M355 H359 E360 I361	V293-T357 HydrophobicContact CG1-CG2 4.13Å; F301-T357 HydrophobicContact CD2-CG2 4.09Å; F301-T357 HydrophobicContact CE2-CG2 3.46Å; F301-T357 VanDerWaalsContact CE2-CG2 3.46Å; F301-T357 HydrophobicContact CZ-CG2 4.35Å; Q353-T357 PolarHBondContact O-N 2.89Å; Q353-T357 PolarHBondContact O-OG1 3.33Å; S354-T357 PolarHBondContact O-N 2.81Å; M355-T357 VanDerWaalsContact C-N 3.34Å; M355-T357 PolarHBondContact O-N 2.95Å; T357-H359 VanDerWaalsContact C-N 3.34Å; T357-H359 PolarHBondContact O-N 3.25Å; T357-E360 PolarHBondContact O-N 3.1Å; T357-I361 HydrophobicContact CG2-CD1 4.37Å; T357-I361 WeakPolarHBondContact O-CG1 3.46Å; T357-I361 PolarHBondContact O-N 3.25Å
358	V	69.8	Low	69.6	Low	6 Å²	6	52.7 Å²	52.7	4%	0.036	23%	0.233	C	C	.	.	H	α-helix	trans	-62.7	-42.9	178	172.9	0	0	0	0	111	L305 W308 S354 E360 I361 M362 P426	L305-V358 HydrophobicContact CD2-CG2 4.44Å; W308-V358 HydrophobicContact CD2-CG1 4.45Å; W308-V358 HydrophobicContact CD2-CG2 4.24Å; W308-V358 HydrophobicContact CG-CG2 4.21Å; W308-V358 HydrophobicContact CZ2-CG1 3.86Å; S354-V358 WeakPolarHBondContact O-CG2 3.43Å; S354-V358 PolarHBondContact O-N 3.45Å; V358-E360 VanDerWaalsContact C-N 3.33Å; V358-E360 PolarHBondContact O-N 3.48Å; V358-I361 WeakPolarHBondContact O-CB 3.42Å; V358-I361 PolarHBondContact O-N 3.07Å; V358-I361 VanDerWaalsContact O-N 3.14Å; V358-M362 HydrophobicContact CG1-SD 4.44Å; V358-M362 WeakPolarHBondContact O-CG 3.31Å; V358-M362 PolarHBondContact O-N 2.8Å; V358-P426 HydrophobicContact CG1-CB 4.39Å; V358-P426 HydrophobicContact CG1-CG 4.08Å
359	H	73.1	Confident	72.5	Confident	28 Å²	28	44.7 Å²	44.7	13%	0.13	20%	0.203	C	C	.	.	H	α-helix	trans	-61.6	-40.9	176.8	-168.6	57.2	0	0	0	112.3	M355 T357 M362 Y363	M355-H359 WeakPolarHBondContact O-CB 3.49Å; M355-H359 PolarHBondContact O-N 3.37Å; T357-H359 VanDerWaalsContact C-N 3.34Å; T357-H359 PolarHBondContact O-N 3.25Å; H359-M362 PolarHBondContact O-N 3.24Å; H359-Y363 AromaticContact CD2-CE2 3.32Å; H359-Y363 WeakPolarHBondContact CD2-CE2 3.43Å; H359-Y363 AromaticContact CD2-CZ 3.66Å; H359-Y363 AromaticContact CE1-CE1 3.86Å; H359-Y363 AromaticContact CE1-CE2 3.75Å; H359-Y363 AromaticContact CE1-CZ 3.23Å; H359-Y363 PolarHBondContact CE1-OH 3.36Å; H359-Y363 AromaticContact CG-CE2 3.79Å; H359-Y363 AromaticContact ND1-CZ 3.8Å; H359-Y363 AromaticContact NE2-CE2 3.32Å; H359-Y363 VanDerWaalsContact NE2-CE2 3.32Å; H359-Y363 WeakPolarHBondContact NE2-CE2 3.49Å; H359-Y363 AromaticContact NE2-CZ 3.12Å; H359-Y363 PolarHBondContact NE2-OH 2.94Å; H359-Y363 VanDerWaalsContact O-CD2 3.3Å; H359-Y363 WeakPolarHBondContact O-CD2 3.49Å; H359-Y363 PolarHBondContact O-N 3.12Å
360	E	76.5	Confident	75.1	Confident	31 Å²	31	37.9 Å²	37.9	15%	0.145	17%	0.171	C	C	.	.	H	α-helix	trans	-63.4	-39.2	172.9	-175.6	173.3	175.1	0	0	112.3	V293 K356 T357 V358 Y363 K364	V293-E360 WeakPolarHBondContact CA-OE2 3.43Å; V293-E360 HydrophobicContact CG2-CG 4.45Å; K356-E360 WeakPolarHBondContact O-CB 3.37Å; K356-E360 PolarHBondContact O-N 3.39Å; T357-E360 PolarHBondContact O-N 3.1Å; V358-E360 VanDerWaalsContact C-N 3.33Å; V358-E360 PolarHBondContact O-N 3.48Å; E360-Y363 PolarHBondContact O-N 3.38Å; E360-K364 HydrophobicContact CG-CD 4.46Å; E360-K364 WeakPolarHBondContact O-CG 3.43Å; E360-K364 PolarHBondContact O-N 3.48Å; E360-K364 VanDerWaalsContact O-N 3.07Å; E360-K364 WeakPolarHBondContact OE1-CE 3.49Å; E360-K364 IonicContact OE1-NZ 3.79Å
361	I	79.4	Confident	77.6	Confident	8 Å²	8	27 Å²	27	4%	0.041	13%	0.13	C	C	.	.	H	α-helix	trans	-61.4	-49	174.3	-69.7	169	0	0	0	110.4	F301 T357 V358 Y363 K364 V365 L403 P426 F430	F301-I361 HydrophobicContact CZ-CD1 4.23Å; T357-I361 HydrophobicContact CG2-CD1 4.37Å; T357-I361 WeakPolarHBondContact O-CG1 3.46Å; T357-I361 PolarHBondContact O-N 3.25Å; V358-I361 WeakPolarHBondContact O-CB 3.42Å; V358-I361 PolarHBondContact O-N 3.07Å; V358-I361 VanDerWaalsContact O-N 3.14Å; I361-Y363 VanDerWaalsContact C-N 3.31Å; I361-Y363 PolarHBondContact O-N 3.07Å; I361-K364 WeakPolarHBondContact O-CB 3.09Å; I361-K364 PolarHBondContact O-N 3.2Å; I361-V365 WeakPolarHBondContact O-CG2 3.4Å; I361-V365 PolarHBondContact O-N 3.39Å; I361-L403 HydrophobicContact CD1-CD1 4.46Å; I361-L403 HydrophobicContact CG1-CD1 4.36Å; I361-P426 HydrophobicContact CG2-CB 4.12Å; I361-P426 WeakPolarHBondContact CG2-O 3.22Å; I361-F430 HydrophobicContact CG2-CB 3.73Å; I361-F430 HydrophobicContact CG2-CD1 4.41Å; I361-F430 HydrophobicContact CG2-CG 4.09Å
362	M	80.3	Confident	79.8	Confident	77 Å²	77	26.1 Å²	26.1	38%	0.379	13%	0.126	S	C	.	.	H	α-helix	trans	-57.8	-43.9	178.1	-69.2	-178.9	71.2	0	0	111.7	V358 H359 K364 V365 E366 P426	V358-M362 HydrophobicContact CG1-SD 4.44Å; V358-M362 WeakPolarHBondContact O-CG 3.31Å; V358-M362 PolarHBondContact O-N 2.8Å; H359-M362 PolarHBondContact O-N 3.24Å; M362-K364 VanDerWaalsContact C-N 3.3Å; M362-K364 PolarHBondContact O-N 3.11Å; M362-V365 WeakPolarHBondContact O-CB 3.23Å; M362-V365 PolarHBondContact O-N 3.42Å; M362-V365 VanDerWaalsContact O-N 3.15Å; M362-E366 PolarHBondContact O-N 2.88Å; M362-P426 HydrophobicContact CG-CB 3.93Å; M362-P426 HydrophobicContact CG-CG 4.14Å; M362-P426 HydrophobicContact SD-CG 4.5Å
363	Y	83	Confident	81.4	Confident	30 Å²	30	24.1 Å²	24.1	12%	0.118	11%	0.113	C	C	.	.	H	α-helix	trans	-59.5	-40	174.7	-72.1	-29.8	0	0	0	113.6	Q226 A229 N230 H359 E360 I361 V365 E366 V367	Q226-Y363 HydrophobicContact CG-CE2 3.89Å; Q226-Y363 WeakPolarHBondContact CG-OH 3.34Å; Q226-Y363 PolarHBondContact NE2-OH 2.92Å; A229-Y363 HydrophobicContact CB-CD1 3.5Å; A229-Y363 VanDerWaalsContact CB-CD1 3.5Å; A229-Y363 HydrophobicContact CB-CD2 4.1Å; A229-Y363 HydrophobicContact CB-CE1 4.08Å; A229-Y363 HydrophobicContact CB-CG 3.49Å; A229-Y363 VanDerWaalsContact CB-CG 3.49Å; N230-Y363 WeakPolarHBondContact ND2-CE1 3.26Å; N230-Y363 PolarHBondContact ND2-OH 3.42Å; N230-Y363 WeakPolarHBondContact OD1-CE1 3.35Å; H359-Y363 AromaticContact CD2-CE2 3.32Å; H359-Y363 WeakPolarHBondContact CD2-CE2 3.43Å; H359-Y363 AromaticContact CD2-CZ 3.66Å; H359-Y363 AromaticContact CE1-CE1 3.86Å; H359-Y363 AromaticContact CE1-CE2 3.75Å; H359-Y363 AromaticContact CE1-CZ 3.23Å; H359-Y363 PolarHBondContact CE1-OH 3.36Å; H359-Y363 AromaticContact CG-CE2 3.79Å; H359-Y363 AromaticContact ND1-CZ 3.8Å; H359-Y363 AromaticContact NE2-CE2 3.32Å; H359-Y363 VanDerWaalsContact NE2-CE2 3.32Å; H359-Y363 WeakPolarHBondContact NE2-CE2 3.49Å; H359-Y363 AromaticContact NE2-CZ 3.12Å; H359-Y363 PolarHBondContact NE2-OH 2.94Å; H359-Y363 VanDerWaalsContact O-CD2 3.3Å; H359-Y363 WeakPolarHBondContact O-CD2 3.49Å; H359-Y363 PolarHBondContact O-N 3.12Å; E360-Y363 PolarHBondContact O-N 3.38Å; I361-Y363 VanDerWaalsContact C-N 3.31Å; I361-Y363 PolarHBondContact O-N 3.07Å; Y363-V365 VanDerWaalsContact C-N 3.35Å; Y363-E366 PolarHBondContact O-N 3.37Å; Y363-V367 VanDerWaalsContact O-CG2 3.27Å; Y363-V367 WeakPolarHBondContact O-CG2 3.29Å; Y363-V367 PolarHBondContact O-N 3.36Å
364	K	88.9	Confident	83	Confident	4 Å²	4	20.6 Å²	20.6	2%	0.017	10%	0.096	C	C	.	.	H	α-helix	trans	-67.8	-36.3	176.8	-68.8	172.7	-177.4	-63.7	0	111.5	L288 A289 R291 E360 I361 M362 E366 V367 L368 L403 F430	L288-K364 PolarHBondContact O-NZ 3.37Å; A289-K364 PolarHBondContact O-NZ 3Å; R291-K364 PolarHBondContact O-NZ 3.47Å; E360-K364 HydrophobicContact CG-CD 4.46Å; E360-K364 WeakPolarHBondContact O-CG 3.43Å; E360-K364 PolarHBondContact O-N 3.48Å; E360-K364 VanDerWaalsContact O-N 3.07Å; E360-K364 WeakPolarHBondContact OE1-CE 3.49Å; E360-K364 IonicContact OE1-NZ 3.79Å; I361-K364 WeakPolarHBondContact O-CB 3.09Å; I361-K364 PolarHBondContact O-N 3.2Å; M362-K364 VanDerWaalsContact C-N 3.3Å; M362-K364 PolarHBondContact O-N 3.11Å; K364-E366 VanDerWaalsContact C-N 3.33Å; K364-E366 PolarHBondContact O-N 2.87Å; K364-V367 PolarHBondContact O-N 3.15Å; K364-L368 WeakPolarHBondContact O-CB 3.1Å; K364-L368 WeakPolarHBondContact O-CG 3.33Å; K364-L368 PolarHBondContact O-N 3.11Å; K364-L403 HydrophobicContact CD-CD2 4.02Å; K364-F430 HydrophobicContact CB-CD2 3.96Å; K364-F430 HydrophobicContact CB-CE2 3.51Å; K364-F430 HydrophobicContact CB-CZ 4.25Å; K364-F430 HydrophobicContact CD-CE2 4.2Å; K364-F430 HydrophobicContact CD-CZ 4.1Å; K364-F430 HydrophobicContact CG-CE2 4.46Å
365	V	89.4	Confident	84.7	Confident	14 Å²	14	20.6 Å²	20.6	9%	0.085	10%	0.096	C	C	.	.	H	α-helix	trans	-53.8	-51.9	173.3	174.6	0	0	0	0	110.2	I361 M362 Y363 L368 Y369 F430 Q433	I361-V365 WeakPolarHBondContact O-CG2 3.4Å; I361-V365 PolarHBondContact O-N 3.39Å; M362-V365 WeakPolarHBondContact O-CB 3.23Å; M362-V365 PolarHBondContact O-N 3.42Å; M362-V365 VanDerWaalsContact O-N 3.15Å; Y363-V365 VanDerWaalsContact C-N 3.35Å; V365-L368 PolarHBondContact O-N 3.2Å; V365-Y369 WeakPolarHBondContact O-CB 3.39Å; V365-Y369 PolarHBondContact O-N 3.06Å; V365-F430 HydrophobicContact CG2-CB 3.74Å; V365-F430 HydrophobicContact CG2-CD2 4.24Å; V365-F430 HydrophobicContact CG2-CG 4.46Å; V365-Q433 HydrophobicContact CG1-CG 3.84Å
366	E	89.9	Confident	85.8	Confident	46 Å²	46	25.9 Å²	25.9	22%	0.215	12%	0.122	C	C	.	.	H	α-helix	trans	-65.4	-42.7	-178.2	-60.2	-57.4	152.3	0	0	112.7	C232 R233 M362 Y363 K364 Y369 V370	C232-E366 HydrophobicContact CB-CB 3.85Å; R233-E366 HydrophobicContact CG-CG 3.67Å; M362-E366 PolarHBondContact O-N 2.88Å; Y363-E366 PolarHBondContact O-N 3.37Å; K364-E366 VanDerWaalsContact C-N 3.33Å; K364-E366 PolarHBondContact O-N 2.87Å; E366-Y369 WeakPolarHBondContact O-CB 3.42Å; E366-Y369 PolarHBondContact O-N 3.13Å; E366-V370 WeakPolarHBondContact O-CG2 3.49Å; E366-V370 PolarHBondContact O-N 3.48Å
367	V	94.5	Very high	86.8	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.006	11%	0.113	C	C	.	.	H	α-helix	trans	-63.5	-45.9	177.3	171.1	0	0	0	0	110.9	L285 L288 A289 Y363 K364 Y369 V370 L371	L285-V367 HydrophobicContact CB-CG1 4.09Å; L285-V367 HydrophobicContact CD2-CG1 4.29Å; L285-V367 HydrophobicContact CD2-CG2 4.37Å; L285-V367 VanDerWaalsContact O-CG1 3.32Å; L285-V367 WeakPolarHBondContact O-CG1 3.46Å; L288-V367 HydrophobicContact CB-CG1 4.37Å; L288-V367 HydrophobicContact CB-CG2 4.15Å; L288-V367 HydrophobicContact CD1-CG2 4.15Å; A289-V367 HydrophobicContact CB-CG1 3.99Å; Y363-V367 VanDerWaalsContact O-CG2 3.27Å; Y363-V367 WeakPolarHBondContact O-CG2 3.29Å; Y363-V367 PolarHBondContact O-N 3.36Å; K364-V367 PolarHBondContact O-N 3.15Å; V367-Y369 VanDerWaalsContact C-N 3.29Å; V367-Y369 PolarHBondContact O-N 3.11Å; V367-V370 PolarHBondContact O-N 3.4Å; V367-L371 HydrophobicContact CG1-CD1 4.26Å; V367-L371 WeakPolarHBondContact O-CG 3.43Å; V367-L371 PolarHBondContact O-N 3.07Å
368	L	94.7	Very high	87.7	Confident	1 Å²	1	30 Å²	30	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-63.3	-37.7	177.3	-68.3	-176.9	0	0	0	111.4	A289 K364 V365 L371 C372 L396 F430 Q433 F434 L437	A289-L368 HydrophobicContact CB-CD2 4.01Å; K364-L368 WeakPolarHBondContact O-CB 3.1Å; K364-L368 WeakPolarHBondContact O-CG 3.33Å; K364-L368 PolarHBondContact O-N 3.11Å; V365-L368 PolarHBondContact O-N 3.2Å; L368-L371 PolarHBondContact O-N 3.24Å; L368-C372 VanDerWaalsContact O-CB 3.29Å; L368-C372 WeakPolarHBondContact O-CB 3.36Å; L368-C372 PolarHBondContact O-N 3.2Å; L368-L396 HydrophobicContact CD2-CD2 4.25Å; L368-F430 HydrophobicContact CD1-CD2 3.87Å; L368-F430 HydrophobicContact CD1-CE2 3.47Å; L368-F430 VanDerWaalsContact CD1-CE2 3.47Å; L368-F430 HydrophobicContact CD1-CZ 4.48Å; L368-F430 HydrophobicContact CG-CE2 4.44Å; L368-Q433 HydrophobicContact CB-CB 4.2Å; L368-Q433 HydrophobicContact CD1-CB 4.5Å; L368-F434 HydrophobicContact CD1-CB 4.22Å; L368-L437 HydrophobicContact CD2-CD2 3.57Å
369	Y	93.8	Very high	88.6	Confident	68 Å²	68	33.5 Å²	33.5	27%	0.267	16%	0.155	S	C	.	.	H	α-helix	trans	-61.2	-51.3	175.5	-179.8	-97.7	0	0	0	111.7	S240 V365 E366 V367 L371 C372 V373	S240-Y369 WeakPolarHBondContact OG-CE1 3.36Å; S240-Y369 PolarHBondContact OG-OH 3.15Å; V365-Y369 WeakPolarHBondContact O-CB 3.39Å; V365-Y369 PolarHBondContact O-N 3.06Å; E366-Y369 WeakPolarHBondContact O-CB 3.42Å; E366-Y369 PolarHBondContact O-N 3.13Å; V367-Y369 VanDerWaalsContact C-N 3.29Å; V367-Y369 PolarHBondContact O-N 3.11Å; Y369-L371 VanDerWaalsContact C-N 3.33Å; Y369-L371 PolarHBondContact O-N 2.83Å; Y369-C372 WeakPolarHBondContact O-CA 3.48Å; Y369-C372 WeakPolarHBondContact O-CB 3.27Å; Y369-C372 PolarHBondContact O-N 3.23Å; Y369-V373 HydrophobicContact CD1-CG2 4.2Å; Y369-V373 HydrophobicContact CE1-CG2 3.74Å; Y369-V373 HydrophobicContact CE2-CG2 4.23Å; Y369-V373 WeakPolarHBondContact O-CG2 3.39Å; Y369-V373 PolarHBondContact O-N 3.13Å
370	V	95.6	Very high	89.6	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-57.9	-44.8	177.5	167.9	0	0	0	0	111.4	C232 L235 I239 L285 E366 V367 C372 V373 L374	C232-V370 HydrophobicContact CB-CG2 3.87Å; L235-V370 HydrophobicContact CB-CG2 3.95Å; I239-V370 HydrophobicContact CD1-CB 4.32Å; I239-V370 HydrophobicContact CD1-CG1 3.83Å; I239-V370 HydrophobicContact CD1-CG2 4.24Å; L285-V370 HydrophobicContact CD1-CG1 3.83Å; E366-V370 WeakPolarHBondContact O-CG2 3.49Å; E366-V370 PolarHBondContact O-N 3.48Å; V367-V370 PolarHBondContact O-N 3.4Å; V370-C372 VanDerWaalsContact C-N 3.31Å; V370-C372 PolarHBondContact O-N 3.35Å; V370-V373 PolarHBondContact O-N 3.34Å; V370-L374 HydrophobicContact CG1-CD1 3.98Å; V370-L374 VanDerWaalsContact O-CG 3.29Å; V370-L374 WeakPolarHBondContact O-CG 3.38Å; V370-L374 PolarHBondContact O-N 3.45Å
371	L	96.6	Very high	90.4	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.7	-39.1	176.2	-68.8	179.5	0	0	0	112.2	L285 A289 V367 L368 Y369 L375 L387 L392 L437	L285-L371 HydrophobicContact CB-CD2 3.92Å; L285-L371 HydrophobicContact CB-CG 4.35Å; L285-L371 HydrophobicContact CD1-CD2 3.87Å; L285-L371 HydrophobicContact CD1-CG 4.45Å; A289-L371 HydrophobicContact CB-CD1 4.45Å; V367-L371 HydrophobicContact CG1-CD1 4.26Å; V367-L371 WeakPolarHBondContact O-CG 3.43Å; V367-L371 PolarHBondContact O-N 3.07Å; L368-L371 PolarHBondContact O-N 3.24Å; Y369-L371 VanDerWaalsContact C-N 3.33Å; Y369-L371 PolarHBondContact O-N 2.83Å; L371-L375 WeakPolarHBondContact O-CG 3.47Å; L371-L375 PolarHBondContact O-N 3.03Å; L371-L387 HydrophobicContact CD2-CD2 3.84Å; L371-L392 HydrophobicContact CD1-CD1 4.18Å; L371-L392 HydrophobicContact CD1-CD2 4.11Å; L371-L437 HydrophobicContact CB-CD1 4.03Å
372	C	95.3	Very high	91.2	Very high	6 Å²	6	41.5 Å²	41.5	4%	0.041	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-46.2	176.9	-169.8	0	0	0	0	111.6	L368 Y369 V370 L374 L375 M376 L437 S440	L368-C372 VanDerWaalsContact O-CB 3.29Å; L368-C372 WeakPolarHBondContact O-CB 3.36Å; L368-C372 PolarHBondContact O-N 3.2Å; Y369-C372 WeakPolarHBondContact O-CA 3.48Å; Y369-C372 WeakPolarHBondContact O-CB 3.27Å; Y369-C372 PolarHBondContact O-N 3.23Å; V370-C372 VanDerWaalsContact C-N 3.31Å; V370-C372 PolarHBondContact O-N 3.35Å; C372-L374 VanDerWaalsContact C-N 3.34Å; C372-L374 PolarHBondContact O-N 3.14Å; C372-L375 WeakPolarHBondContact O-CB 3.45Å; C372-L375 PolarHBondContact O-N 3.48Å; C372-M376 WeakPolarHBondContact O-CG 3.2Å; C372-M376 PolarHBondContact O-N 3.35Å; C372-M376 VanDerWaalsContact O-N 3.11Å; C372-L437 HydrophobicContact CB-CD1 4.35Å; C372-S440 PolarHBondContact SG-OG 3.34Å
373	V	93.2	Very high	92	Very high	13 Å²	13	37.9 Å²	37.9	8%	0.079	18%	0.175	C	C	.	.	H	α-helix	trans	-61.6	-43.3	177.9	176.3	0	0	0	0	111.2	I239 Y369 V370 L375 M376 G377	I239-V373 HydrophobicContact CD1-CB 4.24Å; I239-V373 HydrophobicContact CD1-CG1 4.16Å; I239-V373 HydrophobicContact CG1-CB 4.36Å; I239-V373 HydrophobicContact CG1-CG1 3.87Å; Y369-V373 HydrophobicContact CD1-CG2 4.2Å; Y369-V373 HydrophobicContact CE1-CG2 3.74Å; Y369-V373 HydrophobicContact CE2-CG2 4.23Å; Y369-V373 WeakPolarHBondContact O-CG2 3.39Å; Y369-V373 PolarHBondContact O-N 3.13Å; V370-V373 PolarHBondContact O-N 3.34Å; V373-L375 VanDerWaalsContact C-N 3.31Å; V373-L375 PolarHBondContact O-N 3.31Å; V373-M376 HydrophobicContact CG2-CE 4.5Å; V373-M376 PolarHBondContact O-N 3.38Å; V373-M376 VanDerWaalsContact O-N 3.11Å; V373-G377 PolarHBondContact O-N 3.39Å; V373-G377 VanDerWaalsContact O-N 3.15Å
374	L	94.6	Very high	92.6	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-63.3	-35.3	176.7	-68.6	171	0	0	0	112.8	I239 Q272 L276 F281 I282 V370 C372 M376 G377 V383	I239-L374 HydrophobicContact CD1-CG 4.41Å; Q272-L374 HydrophobicContact CB-CD2 3.87Å; Q272-L374 HydrophobicContact CG-CD2 3.85Å; L276-L374 HydrophobicContact CG-CD2 4.48Å; F281-L374 HydrophobicContact CE1-CD1 4.44Å; I282-L374 HydrophobicContact CD1-CD1 3.69Å; V370-L374 HydrophobicContact CG1-CD1 3.98Å; V370-L374 VanDerWaalsContact O-CG 3.29Å; V370-L374 WeakPolarHBondContact O-CG 3.38Å; V370-L374 PolarHBondContact O-N 3.45Å; C372-L374 VanDerWaalsContact C-N 3.34Å; C372-L374 PolarHBondContact O-N 3.14Å; L374-M376 VanDerWaalsContact C-N 3.3Å; L374-G377 PolarHBondContact O-N 2.88Å; L374-V383 HydrophobicContact CB-CG1 4.21Å; L374-V383 HydrophobicContact CB-CG2 4.16Å
375	L	93.1	Very high	92.9	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-69.3	-25.8	174.1	-80.8	172.9	0	0	0	113.5	L371 C372 V373 R380 V383 L387 L437 F441	L371-L375 WeakPolarHBondContact O-CG 3.47Å; L371-L375 PolarHBondContact O-N 3.03Å; C372-L375 WeakPolarHBondContact O-CB 3.45Å; C372-L375 PolarHBondContact O-N 3.48Å; V373-L375 VanDerWaalsContact C-N 3.31Å; V373-L375 PolarHBondContact O-N 3.31Å; L375-R380 WeakPolarHBondContact O-CB 3.27Å; L375-V383 HydrophobicContact CD2-CB 4.27Å; L375-V383 HydrophobicContact CD2-CG1 3.76Å; L375-V383 HydrophobicContact CG-CG1 3.97Å; L375-L387 HydrophobicContact CD1-CD1 3.66Å; L375-L387 HydrophobicContact CD2-CD1 3.8Å; L375-L387 HydrophobicContact CG-CD1 3.81Å; L375-L437 HydrophobicContact CD1-CD1 3.69Å; L375-F441 HydrophobicContact CD1-CB 4.24Å; L375-F441 HydrophobicContact CD1-CD2 4.3Å
376	M	87.8	Confident	93.3	Very high	120 Å²	120	43.4 Å²	43.4	59%	0.591	20%	0.2	S	C	*	.	H	α-helix	trans	-87.5	-11.3	176.4	-64.9	-173.8	-63.4	0	0	113	C372 V373 L374	C372-M376 WeakPolarHBondContact O-CG 3.2Å; C372-M376 PolarHBondContact O-N 3.35Å; C372-M376 VanDerWaalsContact O-N 3.11Å; V373-M376 HydrophobicContact CG2-CE 4.5Å; V373-M376 PolarHBondContact O-N 3.38Å; V373-M376 VanDerWaalsContact O-N 3.11Å; L374-M376 VanDerWaalsContact C-N 3.3Å
377	G	86.2	Confident	93.7	Very high	13 Å²	13	41.2 Å²	41.2	13%	0.134	19%	0.189	C	C	.	.	S	Bend	trans	-77.8	177.9	-178.5	0	0	0	0	0	115.4	V373 L374 Q379 R380	V373-G377 PolarHBondContact O-N 3.39Å; V373-G377 VanDerWaalsContact O-N 3.15Å; L374-G377 PolarHBondContact O-N 2.88Å; G377-Q379 VanDerWaalsContact C-N 3.26Å; G377-Q379 PolarHBondContact O-N 3.16Å; G377-R380 WeakPolarHBondContact O-CB 3.4Å; G377-R380 PolarHBondContact O-N 2.91Å
378	R	85.7	Confident	93.8	Very high	161 Å²	161	41.6 Å²	41.6	61%	0.608	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-30.2	-179.5	-67.5	-168.9	-174.2	-179.6	7.6	113.7	E269 R380	E269-R378 VanDerWaalsContact CD-CZ 3.42Å; E269-R378 VanDerWaalsContact CD-NH2 3.31Å; E269-R378 IonicContact OE1-CZ 3.68Å; E269-R378 IonicContact OE1-NE 3.42Å; E269-R378 PolarHBondContact OE1-NE 3.48Å; E269-R378 IonicContact OE1-NH2 2.72Å; E269-R378 PolarHBondContact OE1-NH2 3Å; E269-R378 IonicContact OE2-CZ 3.98Å; E269-R378 IonicContact OE2-NE 3.62Å; E269-R378 PolarHBondContact OE2-NE 2.81Å; E269-R378 IonicContact OE2-NH1 2.92Å; E269-R378 IonicContact OE2-NH2 3.64Å; E269-R378 PolarHBondContact OE2-NH2 3.26Å; R378-R380 VanDerWaalsContact C-N 3.28Å; R378-R380 PolarHBondContact O-N 2.85Å
379	Q	90.3	Very high	93.9	Very high	78 Å²	78	46.3 Å²	46.3	36%	0.364	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	17.9	-179	-60.7	-58.7	-22.4	0	0	113.5	V273 L276 G377 N381 Q382 V383	V273-Q379 HydrophobicContact CG2-CG 3.95Å; L276-Q379 HydrophobicContact CD1-CB 3.47Å; L276-Q379 VanDerWaalsContact CD1-CB 3.47Å; L276-Q379 HydrophobicContact CD1-CG 3.89Å; G377-Q379 VanDerWaalsContact C-N 3.26Å; G377-Q379 PolarHBondContact O-N 3.16Å; Q379-N381 VanDerWaalsContact C-N 3.26Å; Q379-N381 PolarHBondContact O-N 3.22Å; Q379-Q382 WeakPolarHBondContact O-CB 3.06Å; Q379-Q382 PolarHBondContact O-N 2.93Å; Q379-V383 PolarHBondContact O-N 2.82Å; Q379-V383 VanDerWaalsContact O-N 3.09Å
380	R	92.6	Very high	94.1	Very high	52 Å²	52	46 Å²	46	20%	0.196	22%	0.215	C	C	.	.	H	α-helix	trans	-48.7	-40.8	-173.8	65.3	174.2	-127.5	159.9	2.6	114.9	L375 G377 R378 Q382 V383 H384 D443 H444	L375-R380 WeakPolarHBondContact O-CB 3.27Å; G377-R380 WeakPolarHBondContact O-CB 3.4Å; G377-R380 PolarHBondContact O-N 2.91Å; R378-R380 VanDerWaalsContact C-N 3.28Å; R378-R380 PolarHBondContact O-N 2.85Å; R380-Q382 PolarHBondContact O-N 3.45Å; R380-V383 WeakPolarHBondContact O-CB 3.27Å; R380-V383 PolarHBondContact O-N 3.25Å; R380-H384 PolarHBondContact O-CD2 2.67Å; R380-H384 PolarHBondContact O-N 3.28Å; R380-D443 PolarHBondContact NH1-O 3.15Å; R380-H444 PolarHBondContact NH2-O 2.94Å
381	N	93.9	Very high	94.1	Very high	103 Å²	103	52.3 Å²	52.3	55%	0.551	24%	0.239	S	C	*	.	H	α-helix	trans	-67.6	-38.7	-177.2	-66.2	-13.6	0	0	0	111.6	Q379 K385	Q379-N381 VanDerWaalsContact C-N 3.26Å; Q379-N381 PolarHBondContact O-N 3.22Å; N381-K385 PolarHBondContact O-N 2.78Å; N381-K385 VanDerWaalsContact O-N 3.15Å
382	Q	95.6	Very high	94.1	Very high	81 Å²	81	52.3 Å²	52.3	38%	0.379	24%	0.239	S	C	.	.	H	α-helix	trans	-63.4	-44.7	172.3	-178	-175.5	4.8	0	0	110.3	Q379 R380 K385 M386	Q379-Q382 WeakPolarHBondContact O-CB 3.06Å; Q379-Q382 PolarHBondContact O-N 2.93Å; R380-Q382 PolarHBondContact O-N 3.45Å; Q382-K385 WeakPolarHBondContact O-CB 3.44Å; Q382-K385 PolarHBondContact O-N 3.19Å; Q382-M386 HydrophobicContact CG-SD 4.21Å; Q382-M386 WeakPolarHBondContact O-CG 3.44Å; Q382-M386 PolarHBondContact O-N 3.45Å
383	V	96.9	Very high	94.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-60.4	-49	177.7	179.9	0	0	0	0	110.5	L276 L374 L375 Q379 R380 K385 M386 L387	L276-V383 HydrophobicContact CD1-CG2 4.02Å; L276-V383 HydrophobicContact CD2-CG2 3.81Å; L374-V383 HydrophobicContact CB-CG1 4.21Å; L374-V383 HydrophobicContact CB-CG2 4.16Å; L375-V383 HydrophobicContact CD2-CB 4.27Å; L375-V383 HydrophobicContact CD2-CG1 3.76Å; L375-V383 HydrophobicContact CG-CG1 3.97Å; Q379-V383 PolarHBondContact O-N 2.82Å; Q379-V383 VanDerWaalsContact O-N 3.09Å; R380-V383 WeakPolarHBondContact O-CB 3.27Å; R380-V383 PolarHBondContact O-N 3.25Å; V383-K385 VanDerWaalsContact C-N 3.29Å; V383-K385 PolarHBondContact O-N 2.91Å; V383-M386 PolarHBondContact O-N 3.06Å; V383-M386 VanDerWaalsContact O-N 3.09Å; V383-L387 HydrophobicContact CG1-CD1 4.01Å; V383-L387 HydrophobicContact CG1-CD2 4.43Å; V383-L387 HydrophobicContact CG1-CG 4.01Å; V383-L387 VanDerWaalsContact O-CG 3.32Å; V383-L387 WeakPolarHBondContact O-CG 2.98Å; V383-L387 PolarHBondContact O-N 3.18Å
384	H	96.6	Very high	94.3	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-54.5	-43.4	176.5	-84	-74.5	0	0	0	113.1	R380 L387 A388 F441 H445 N447	R380-H384 PolarHBondContact O-CD2 2.67Å; R380-H384 PolarHBondContact O-N 3.28Å; H384-L387 PolarHBondContact O-N 3.5Å; H384-A388 WeakPolarHBondContact O-CB 3.36Å; H384-A388 PolarHBondContact O-N 2.98Å; H384-F441 PolarHBondContact CE1-O 3.24Å; H384-F441 AromaticContact ND1-CD2 3.83Å; H384-F441 AromaticContact ND1-CE2 3.9Å; H384-H445 WeakPolarHBondContact CB-NE2 3.4Å; H384-H445 AromaticContact CD2-CD2 3.21Å; H384-H445 PolarHBondContact CD2-CD2 2.92Å; H384-H445 AromaticContact CD2-CE1 3.95Å; H384-H445 AromaticContact CD2-CG 3.68Å; H384-H445 AromaticContact CD2-NE2 3.42Å; H384-H445 PolarHBondContact CD2-NE2 2.92Å; H384-H445 AromaticContact CE1-CD2 3.95Å; H384-H445 AromaticContact CE1-CG 3.62Å; H384-H445 AromaticContact CE1-ND1 3.92Å; H384-H445 AromaticContact CG-CD2 3.63Å; H384-H445 AromaticContact CG-CE1 3.55Å; H384-H445 AromaticContact CG-CG 3.85Å; H384-H445 AromaticContact CG-ND1 3.78Å; H384-H445 AromaticContact CG-NE2 3.44Å; H384-H445 AromaticContact ND1-CE1 3.89Å; H384-H445 AromaticContact ND1-CG 3.81Å; H384-H445 AromaticContact ND1-ND1 3.67Å; H384-H445 AromaticContact NE2-CD2 3.47Å; H384-H445 PolarHBondContact NE2-CD2 3.04Å; H384-H445 AromaticContact NE2-CG 3.55Å; H384-N447 PolarHBondContact O-ND2 3.27Å
385	K	95.9	Very high	94.3	Very high	132 Å²	132	52.5 Å²	52.5	57%	0.574	24%	0.242	S	C	*	.	H	α-helix	trans	-59.5	-49.5	175.9	179.3	176.3	173.3	177.9	0	110.8	N381 Q382 V383 L387 A388 E389	N381-K385 PolarHBondContact O-N 2.78Å; N381-K385 VanDerWaalsContact O-N 3.15Å; Q382-K385 WeakPolarHBondContact O-CB 3.44Å; Q382-K385 PolarHBondContact O-N 3.19Å; V383-K385 VanDerWaalsContact C-N 3.29Å; V383-K385 PolarHBondContact O-N 2.91Å; K385-L387 PolarHBondContact O-N 3.45Å; K385-A388 PolarHBondContact O-N 2.75Å; K385-E389 WeakPolarHBondContact CE-OE1 3.43Å; K385-E389 WeakPolarHBondContact CG-OE1 3.44Å; K385-E389 IonicContact NZ-OE1 2.71Å; K385-E389 WeakPolarHBondContact O-CB 3.38Å; K385-E389 VanDerWaalsContact O-CG 3.31Å; K385-E389 WeakPolarHBondContact O-CG 3.23Å; K385-E389 PolarHBondContact O-N 3Å
386	M	97.3	Very high	94.4	Very high	33 Å²	33	52.4 Å²	52.4	16%	0.163	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-43.9	178.4	-64.6	174.6	85.5	0	0	112.3	I282 Q382 V383 A388 E389 F390	I282-M386 HydrophobicContact CB-CB 4.44Å; I282-M386 HydrophobicContact CB-CE 3.79Å; I282-M386 HydrophobicContact CB-SD 4.43Å; I282-M386 HydrophobicContact CG1-CE 3.69Å; I282-M386 HydrophobicContact CG1-SD 4.01Å; I282-M386 HydrophobicContact CG2-CB 3.93Å; Q382-M386 HydrophobicContact CG-SD 4.21Å; Q382-M386 WeakPolarHBondContact O-CG 3.44Å; Q382-M386 PolarHBondContact O-N 3.45Å; V383-M386 PolarHBondContact O-N 3.06Å; V383-M386 VanDerWaalsContact O-N 3.09Å; M386-A388 VanDerWaalsContact C-N 3.3Å; M386-A388 PolarHBondContact O-N 3.2Å; M386-E389 PolarHBondContact O-N 3.32Å; M386-F390 HydrophobicContact CB-CD2 4.23Å; M386-F390 HydrophobicContact CB-CE2 3.98Å; M386-F390 HydrophobicContact CE-CE2 4.24Å; M386-F390 WeakPolarHBondContact O-CB 3.45Å; M386-F390 WeakPolarHBondContact O-CD2 3.47Å; M386-F390 WeakPolarHBondContact O-CG 3.5Å; M386-F390 PolarHBondContact O-N 2.71Å
387	L	97.9	Very high	94.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-34.1	179.4	-60.3	-172.9	0	0	0	112.7	I282 C286 L371 L375 V383 H384 K385 R391 L392 F441	I282-L387 HydrophobicContact CG2-CD2 3.53Å; C286-L387 VanDerWaalsContact SG-CD2 3.55Å; L371-L387 HydrophobicContact CD2-CD2 3.84Å; L375-L387 HydrophobicContact CD1-CD1 3.66Å; L375-L387 HydrophobicContact CD2-CD1 3.8Å; L375-L387 HydrophobicContact CG-CD1 3.81Å; V383-L387 HydrophobicContact CG1-CD1 4.01Å; V383-L387 HydrophobicContact CG1-CD2 4.43Å; V383-L387 HydrophobicContact CG1-CG 4.01Å; V383-L387 VanDerWaalsContact O-CG 3.32Å; V383-L387 WeakPolarHBondContact O-CG 2.98Å; V383-L387 PolarHBondContact O-N 3.18Å; H384-L387 PolarHBondContact O-N 3.5Å; K385-L387 PolarHBondContact O-N 3.45Å; L387-R391 PolarHBondContact O-N 3.38Å; L387-L392 HydrophobicContact CB-CB 4.33Å; L387-L392 HydrophobicContact CB-CD2 4.23Å; L387-L392 HydrophobicContact CD1-CD2 3.84Å; L387-L392 HydrophobicContact CD2-CD2 4.12Å; L387-L392 HydrophobicContact CG-CD2 4.26Å; L387-L392 PolarHBondContact O-N 3.07Å; L387-L392 VanDerWaalsContact O-N 3.08Å; L387-F441 HydrophobicContact CB-CE2 4.27Å; L387-F441 HydrophobicContact CD1-CD2 4.32Å
388	A	96.8	Very high	94.9	Very high	9 Å²	9	50.2 Å²	50.2	7%	0.074	23%	0.229	C	C	.	.	H	α-helix	trans	-68.4	-50.1	173.4	0	0	0	0	0	111.1	H384 K385 M386 F390 R391 L450 L482	H384-A388 WeakPolarHBondContact O-CB 3.36Å; H384-A388 PolarHBondContact O-N 2.98Å; K385-A388 PolarHBondContact O-N 2.75Å; M386-A388 VanDerWaalsContact C-N 3.3Å; M386-A388 PolarHBondContact O-N 3.2Å; A388-F390 VanDerWaalsContact C-N 3.26Å; A388-F390 PolarHBondContact O-N 3.49Å; A388-R391 PolarHBondContact O-N 3.03Å; A388-L450 HydrophobicContact CB-CD1 3.58Å; A388-L482 HydrophobicContact CB-CD1 4.35Å
389	E	96.4	Very high	94.9	Very high	99 Å²	99	42.9 Å²	42.9	46%	0.463	20%	0.202	S	C	.	.	H	α-helix	trans	-55.4	-41	177.1	-74.7	172	-179.9	0	0	111.9	K385 M386 R391	K385-E389 WeakPolarHBondContact CE-OE1 3.43Å; K385-E389 WeakPolarHBondContact CG-OE1 3.44Å; K385-E389 IonicContact NZ-OE1 2.71Å; K385-E389 WeakPolarHBondContact O-CB 3.38Å; K385-E389 VanDerWaalsContact O-CG 3.31Å; K385-E389 WeakPolarHBondContact O-CG 3.23Å; K385-E389 PolarHBondContact O-N 3Å; M386-E389 PolarHBondContact O-N 3.32Å; E389-R391 VanDerWaalsContact C-N 3.28Å; E389-R391 PolarHBondContact O-N 2.98Å
390	F	97.3	Very high	94.8	Very high	63 Å²	63	39.2 Å²	39.2	28%	0.276	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	12.4	178.1	-56.3	-48.7	0	0	0	114.5	I282 E283 C286 M386 A388 L392	I282-F390 HydrophobicContact CB-CD2 4.47Å; I282-F390 HydrophobicContact CB-CE2 4.28Å; I282-F390 HydrophobicContact CG2-CD2 4.06Å; I282-F390 HydrophobicContact CG2-CE2 4.3Å; E283-F390 HydrophobicContact CB-CD1 3.8Å; E283-F390 HydrophobicContact CB-CD2 3.95Å; E283-F390 HydrophobicContact CB-CE1 3.59Å; E283-F390 HydrophobicContact CB-CE2 3.76Å; E283-F390 HydrophobicContact CB-CG 3.99Å; E283-F390 HydrophobicContact CB-CZ 3.58Å; E283-F390 HydrophobicContact CG-CD1 3.56Å; E283-F390 HydrophobicContact CG-CE1 3.59Å; E283-F390 HydrophobicContact CG-CG 4.08Å; E283-F390 HydrophobicContact CG-CZ 4.14Å; C286-F390 HydrophobicContact CB-CB 3.85Å; M386-F390 HydrophobicContact CB-CD2 4.23Å; M386-F390 HydrophobicContact CB-CE2 3.98Å; M386-F390 HydrophobicContact CE-CE2 4.24Å; M386-F390 WeakPolarHBondContact O-CB 3.45Å; M386-F390 WeakPolarHBondContact O-CD2 3.47Å; M386-F390 WeakPolarHBondContact O-CG 3.5Å; M386-F390 PolarHBondContact O-N 2.71Å; A388-F390 VanDerWaalsContact C-N 3.26Å; A388-F390 PolarHBondContact O-N 3.49Å; F390-L392 VanDerWaalsContact C-N 3.29Å; F390-L392 PolarHBondContact O-N 3.04Å
391	R	96.7	Very high	94.1	Very high	132 Å²	132	41.2 Å²	41.2	50%	0.498	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	41.1	172.1	-60.3	-175.7	171.9	-168.8	-4.9	114.3	L387 A388 E389 I393 P394 G395 S481 L482	L387-R391 PolarHBondContact O-N 3.38Å; A388-R391 PolarHBondContact O-N 3.03Å; E389-R391 VanDerWaalsContact C-N 3.28Å; E389-R391 PolarHBondContact O-N 2.98Å; R391-I393 PolarHBondContact O-N 2.72Å; R391-P394 HydrophobicContact CB-CG 4.32Å; R391-P394 WeakPolarHBondContact O-CD 3.38Å; R391-G395 PolarHBondContact O-N 3.48Å; R391-G395 VanDerWaalsContact O-N 3.15Å; R391-S481 PolarHBondContact NH2-O 3.26Å; R391-L482 HydrophobicContact CG-CD2 3.95Å
392	L	97.3	Very high	93	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-56.7	-49.4	177.9	178.9	67.1	0	0	0	111.5	C286 A289 T290 L371 L387 F390 G395 L396 L437	C286-L392 HydrophobicContact CB-CD1 4.45Å; A289-L392 HydrophobicContact CB-CD1 3.87Å; T290-L392 HydrophobicContact CG2-CD1 3.96Å; L371-L392 HydrophobicContact CD1-CD1 4.18Å; L371-L392 HydrophobicContact CD1-CD2 4.11Å; L387-L392 HydrophobicContact CB-CB 4.33Å; L387-L392 HydrophobicContact CB-CD2 4.23Å; L387-L392 HydrophobicContact CD1-CD2 3.84Å; L387-L392 HydrophobicContact CD2-CD2 4.12Å; L387-L392 HydrophobicContact CG-CD2 4.26Å; L387-L392 PolarHBondContact O-N 3.07Å; L387-L392 VanDerWaalsContact O-N 3.08Å; F390-L392 VanDerWaalsContact C-N 3.29Å; F390-L392 PolarHBondContact O-N 3.04Å; L392-G395 PolarHBondContact O-N 3.37Å; L392-L396 HydrophobicContact CD1-CD1 4.07Å; L392-L396 HydrophobicContact CD1-CG 4.14Å; L392-L396 HydrophobicContact CD2-CD1 4.49Å; L392-L396 HydrophobicContact CG-CD1 3.93Å; L392-L396 HydrophobicContact CG-CG 4.33Å; L392-L396 WeakPolarHBondContact O-CG 3.47Å; L392-L396 PolarHBondContact O-N 3.47Å; L392-L437 HydrophobicContact CD2-CD2 3.95Å
393	I	97.1	Very high	91.7	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.015	19%	0.187	C	C	.	.	H	α-helix	trans	-64.7	-49.5	-174.2	-61.3	-58.6	0	0	0	112.9	R391 G395 L396 N397 L438 F441 L450 L451 L490	R391-I393 PolarHBondContact O-N 2.72Å; I393-G395 VanDerWaalsContact C-N 3.27Å; I393-G395 PolarHBondContact O-N 3.01Å; I393-L396 PolarHBondContact O-N 3.35Å; I393-N397 PolarHBondContact O-N 3.48Å; I393-L438 HydrophobicContact CD1-CD2 4.32Å; I393-F441 HydrophobicContact CD1-CD1 3.77Å; I393-F441 HydrophobicContact CD1-CD2 4.18Å; I393-F441 HydrophobicContact CD1-CE1 3.82Å; I393-F441 HydrophobicContact CD1-CE2 4.22Å; I393-F441 HydrophobicContact CD1-CG 3.95Å; I393-F441 HydrophobicContact CD1-CZ 4.05Å; I393-F441 HydrophobicContact CG1-CD1 4.02Å; I393-F441 HydrophobicContact CG1-CD2 4.43Å; I393-F441 HydrophobicContact CG1-CE1 3.52Å; I393-F441 HydrophobicContact CG1-CE2 3.97Å; I393-F441 HydrophobicContact CG1-CG 4.45Å; I393-F441 HydrophobicContact CG1-CZ 3.48Å; I393-F441 VanDerWaalsContact CG1-CZ 3.48Å; I393-L450 VanDerWaalsContact CG2-O 3.26Å; I393-L450 WeakPolarHBondContact CG2-O 3.31Å; I393-L451 HydrophobicContact CD1-CD2 4.11Å; I393-L451 HydrophobicContact CG2-CD2 3.84Å; I393-L451 HydrophobicContact CG2-CG 4.47Å; I393-L490 HydrophobicContact CG2-CD2 4.31Å
394	P	95.4	Very high	90.4	Very high	9 Å²	9	39.4 Å²	39.4	6%	0.058	19%	0.187	C	C	.	.	H	α-helix	trans	-57.4	-40	172.4	-25.7	33.7	0	0	0	113	R391 N397 N398 L482 V483	R391-P394 HydrophobicContact CB-CG 4.32Å; R391-P394 WeakPolarHBondContact O-CD 3.38Å; P394-N397 WeakPolarHBondContact O-CB 3.26Å; P394-N397 PolarHBondContact O-N 3.34Å; P394-N398 PolarHBondContact O-N 2.85Å; P394-N398 PolarHBondContact O-ND2 2.93Å; P394-L482 WeakPolarHBondContact CG-O 3.41Å; P394-V483 WeakPolarHBondContact CG-O 3.31Å
395	G	94.1	Very high	89.4	Confident	12 Å²	12	41.2 Å²	41.2	12%	0.124	19%	0.193	C	C	.	.	H	α-helix	trans	-62.9	-44.1	177.1	0	0	0	0	0	112.9	R391 L392 I393 N398 L399	R391-G395 PolarHBondContact O-N 3.48Å; R391-G395 VanDerWaalsContact O-N 3.15Å; L392-G395 PolarHBondContact O-N 3.37Å; I393-G395 VanDerWaalsContact C-N 3.27Å; I393-G395 PolarHBondContact O-N 3.01Å; G395-N398 WeakPolarHBondContact O-CB 3.36Å; G395-N398 PolarHBondContact O-N 2.89Å; G395-L399 PolarHBondContact O-N 2.52Å
396	L	94.4	Very high	87.9	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.2	-37.2	174.7	-70	177.1	0	0	0	112.3	L368 L392 I393 N398 L399 F400 F434 L437 L490	L368-L396 HydrophobicContact CD2-CD2 4.25Å; L392-L396 HydrophobicContact CD1-CD1 4.07Å; L392-L396 HydrophobicContact CD1-CG 4.14Å; L392-L396 HydrophobicContact CD2-CD1 4.49Å; L392-L396 HydrophobicContact CG-CD1 3.93Å; L392-L396 HydrophobicContact CG-CG 4.33Å; L392-L396 WeakPolarHBondContact O-CG 3.47Å; L392-L396 PolarHBondContact O-N 3.47Å; I393-L396 PolarHBondContact O-N 3.35Å; L396-N398 VanDerWaalsContact C-N 3.28Å; L396-N398 PolarHBondContact O-N 3.26Å; L396-L399 PolarHBondContact O-N 3.4Å; L396-L399 VanDerWaalsContact O-N 3.11Å; L396-F400 PolarHBondContact O-N 2.98Å; L396-F400 VanDerWaalsContact O-N 3.13Å; L396-F434 HydrophobicContact CB-CE2 4.11Å; L396-F434 HydrophobicContact CD1-CD2 4.4Å; L396-F434 HydrophobicContact CD1-CE2 4.24Å; L396-L437 HydrophobicContact CD1-CD2 3.61Å; L396-L490 HydrophobicContact CB-CD2 4.4Å
397	N	94.7	Very high	85.8	Confident	4 Å²	4	46 Å²	46	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-57.4	-44	172	-170.2	51.1	0	0	0	110.4	I393 P394 L399 F400 C484 D485 L490 R493	I393-N397 PolarHBondContact O-N 3.48Å; P394-N397 WeakPolarHBondContact O-CB 3.26Å; P394-N397 PolarHBondContact O-N 3.34Å; N397-L399 PolarHBondContact O-N 2.64Å; N397-F400 WeakPolarHBondContact O-CB 3.4Å; N397-F400 PolarHBondContact O-N 2.92Å; N397-F400 VanDerWaalsContact O-N 3.14Å; N397-C484 HydrophobicContact CB-CB 4.28Å; N397-D485 PolarHBondContact ND2-O 2.75Å; N397-L490 HydrophobicContact CB-CB 4.47Å; N397-L490 HydrophobicContact CB-CD1 4.3Å; N397-R493 PolarHBondContact O-NH1 3.39Å; N397-R493 WeakPolarHBondContact OD1-CD 3.37Å; N397-R493 PolarHBondContact OD1-NH1 3.44Å
398	N	90.1	Very high	83.5	Confident	83 Å²	83	50.5 Å²	50.5	44%	0.444	23%	0.228	S	C	.	.	H	α-helix	trans	-62.5	-26.4	178.1	-70	-32.6	0	0	0	114.2	P394 G395 L396	P394-N398 PolarHBondContact O-N 2.85Å; P394-N398 PolarHBondContact O-ND2 2.93Å; G395-N398 WeakPolarHBondContact O-CB 3.36Å; G395-N398 PolarHBondContact O-N 2.89Å; L396-N398 VanDerWaalsContact C-N 3.28Å; L396-N398 PolarHBondContact O-N 3.26Å
399	L	86.5	Confident	80.6	Confident	7 Å²	7	55.3 Å²	55.3	4%	0.037	26%	0.256	C	S	.	.	H	α-helix	trans	-87.7	-15.4	178	-62	-176.3	0	0	0	114	A289 G395 L396 N397 D401 K402 L403 I404	A289-L399 WeakPolarHBondContact O-CD1 3.49Å; G395-L399 PolarHBondContact O-N 2.52Å; L396-L399 PolarHBondContact O-N 3.4Å; L396-L399 VanDerWaalsContact O-N 3.11Å; N397-L399 PolarHBondContact O-N 2.64Å; L399-D401 PolarHBondContact O-N 3.25Å; L399-K402 PolarHBondContact O-N 3.2Å; L399-K402 VanDerWaalsContact O-N 3.16Å; L399-L403 PolarHBondContact O-N 2.72Å; L399-I404 HydrophobicContact CB-CD1 4.36Å; L399-I404 HydrophobicContact CB-CG1 4.41Å; L399-I404 PolarHBondContact O-N 2.83Å
400	F	88.1	Confident	77.8	Confident	1 Å²	1	55.9 Å²	55.9	0%	0.004	28%	0.278	C	S	.	.	I	π-helix	trans	-55.8	-59.1	-166.2	-176.1	-83	0	0	0	114.4	L396 N397 K402 I404 W405 F434 L490 R493 V497	L396-F400 PolarHBondContact O-N 2.98Å; L396-F400 VanDerWaalsContact O-N 3.13Å; N397-F400 WeakPolarHBondContact O-CB 3.4Å; N397-F400 PolarHBondContact O-N 2.92Å; N397-F400 VanDerWaalsContact O-N 3.14Å; F400-K402 VanDerWaalsContact C-N 3.31Å; F400-K402 PolarHBondContact O-N 3.04Å; F400-I404 HydrophobicContact CB-CD1 4.48Å; F400-I404 CarbonylContact O-C 3.57Å; F400-I404 WeakPolarHBondContact O-CB 3.45Å; F400-I404 PolarHBondContact O-N 3.07Å; F400-I404 VanDerWaalsContact O-N 3.12Å; F400-W405 HydrophobicContact CD1-CB 4.3Å; F400-W405 HydrophobicContact CE1-CB 3.92Å; F400-W405 HydrophobicContact CZ-CB 4.2Å; F400-W405 HydrophobicContact CZ-CG 4.5Å; F400-W405 PolarHBondContact O-N 3.26Å; F400-F434 AromaticContact CD2-CE1 3.9Å; F400-F434 HydrophobicContact CD2-CE1 3.9Å; F400-F434 AromaticContact CD2-CZ 3.74Å; F400-F434 HydrophobicContact CD2-CZ 3.74Å; F400-F434 AromaticContact CE2-CE1 3.82Å; F400-F434 HydrophobicContact CE2-CE1 3.82Å; F400-F434 HydrophobicContact CE2-CZ 4.06Å; F400-L490 HydrophobicContact CB-CD1 4.08Å; F400-L490 HydrophobicContact CD2-CD1 3.4Å; F400-L490 VanDerWaalsContact CD2-CD1 3.4Å; F400-L490 HydrophobicContact CE2-CD1 4.05Å; F400-L490 HydrophobicContact CG-CD1 3.95Å; F400-R493 HydrophobicContact CD1-CB 4Å; F400-R493 HydrophobicContact CE1-CB 3.7Å; F400-R493 HydrophobicContact CZ-CB 4Å; F400-V497 HydrophobicContact CE1-CG1 3.78Å; F400-V497 HydrophobicContact CZ-CG1 3.86Å; F400-V497 HydrophobicContact CZ-CG2 3.89Å
401	D	78.3	Confident	74.8	Confident	95 Å²	95	57 Å²	57	51%	0.508	29%	0.293	S	S	.	.	I	π-helix	trans	-75.7	-20.7	178.5	-68.4	-30	0	0	0	113.1	L399 R493	L399-D401 PolarHBondContact O-N 3.25Å; D401-R493 IonicContact OD1-NE 3.42Å; D401-R493 IonicContact OD1-NH2 2.98Å; D401-R493 PolarHBondContact OD1-NH2 3.39Å; D401-R493 IonicContact OD2-CZ 3.53Å; D401-R493 IonicContact OD2-NE 3.51Å; D401-R493 IonicContact OD2-NH2 3.77Å; D401-R493 PolarHBondContact OD2-NH2 2.87Å
402	K	70.9	Confident	71.7	Confident	121 Å²	121	57 Å²	57	53%	0.526	30%	0.304	S	S	.	.	I	π-helix	trans	-82.7	-33.8	-173.3	-68	-168.5	169.7	-154.5	0	112.6	E295 L399 F400	E295-K402 IonicContact OE1-NZ 3.72Å; E295-K402 PolarHBondContact OE1-NZ 3.1Å; L399-K402 PolarHBondContact O-N 3.2Å; L399-K402 VanDerWaalsContact O-N 3.16Å; F400-K402 VanDerWaalsContact C-N 3.31Å; F400-K402 PolarHBondContact O-N 3.04Å
403	L	67.9	Low	68.8	Low	25 Å²	25	64 Å²	64	13%	0.131	34%	0.336	C	S	.	.	I	π-helix	trans	-134.7	-43.8	-170.8	-170.4	65.7	0	0	0	112.4	V293 I361 K364 L399 F430	V293-L403 HydrophobicContact CG2-CD1 3.78Å; V293-L403 HydrophobicContact CG2-CD2 3.71Å; V293-L403 HydrophobicContact CG2-CG 4.34Å; I361-L403 HydrophobicContact CD1-CD1 4.46Å; I361-L403 HydrophobicContact CG1-CD1 4.36Å; K364-L403 HydrophobicContact CD-CD2 4.02Å; L399-L403 PolarHBondContact O-N 2.72Å; L403-F430 HydrophobicContact CD2-CE1 3.84Å; L403-F430 HydrophobicContact CD2-CZ 4.11Å; L403-F430 HydrophobicContact CG-CE1 3.88Å
404	I	69.6	Low	66.2	Low	0 Å²	0	70 Å²	70	0%	0	37%	0.372	C	S	.	.	I	π-helix	trans	-79.2	-45.6	-169.6	-48.4	-178.3	0	0	0	111.5	L399 F400 F430 K431 F434	L399-I404 HydrophobicContact CB-CD1 4.36Å; L399-I404 HydrophobicContact CB-CG1 4.41Å; L399-I404 PolarHBondContact O-N 2.83Å; F400-I404 HydrophobicContact CB-CD1 4.48Å; F400-I404 CarbonylContact O-C 3.57Å; F400-I404 WeakPolarHBondContact O-CB 3.45Å; F400-I404 PolarHBondContact O-N 3.07Å; F400-I404 VanDerWaalsContact O-N 3.12Å; I404-F430 HydrophobicContact CB-CE1 4.44Å; I404-F430 HydrophobicContact CG1-CE1 3.8Å; I404-F430 HydrophobicContact CG1-CZ 4.12Å; I404-K431 WeakPolarHBondContact O-CE 3.43Å; I404-K431 VanDerWaalsContact O-CG 3.31Å; I404-K431 WeakPolarHBondContact O-CG 3.4Å; I404-F434 HydrophobicContact CD1-CD1 4.44Å; I404-F434 HydrophobicContact CD1-CD2 3.53Å; I404-F434 HydrophobicContact CD1-CE1 4.45Å; I404-F434 HydrophobicContact CD1-CE2 3.54Å; I404-F434 HydrophobicContact CD1-CG 3.98Å; I404-F434 HydrophobicContact CD1-CZ 4.01Å; I404-F434 HydrophobicContact CG2-CB 4.18Å; I404-F434 HydrophobicContact CG2-CD1 3.62Å; I404-F434 HydrophobicContact CG2-CD2 4.41Å; I404-F434 HydrophobicContact CG2-CE1 4.08Å; I404-F434 HydrophobicContact CG2-CG 3.79Å
405	W	75.6	Confident	63.1	Low	37 Å²	37	72.7 Å²	72.7	14%	0.14	39%	0.389	C	S	.	.	S	Bend	trans	-128.3	41	-174.2	-132.3	-85	0	0	0	112.1	F400 K407 K431 L435 V497 E501 F507	F400-W405 HydrophobicContact CD1-CB 4.3Å; F400-W405 HydrophobicContact CE1-CB 3.92Å; F400-W405 HydrophobicContact CZ-CB 4.2Å; F400-W405 HydrophobicContact CZ-CG 4.5Å; F400-W405 PolarHBondContact O-N 3.26Å; W405-K407 PolarHBondContact O-N 2.78Å; W405-K431 HydrophobicContact CE3-CD 4.24Å; W405-K431 HydrophobicContact CE3-CG 4.12Å; W405-K431 HydrophobicContact CH2-CD 4.22Å; W405-K431 HydrophobicContact CZ3-CB 3.95Å; W405-K431 HydrophobicContact CZ3-CD 3.93Å; W405-K431 HydrophobicContact CZ3-CG 3.81Å; W405-L435 HydrophobicContact CH2-CD1 4.35Å; W405-L435 HydrophobicContact CZ3-CD1 4.33Å; W405-V497 HydrophobicContact CB-CG1 4.19Å; W405-V497 HydrophobicContact CD2-CB 4.18Å; W405-V497 HydrophobicContact CD2-CG1 4.25Å; W405-V497 HydrophobicContact CD2-CG2 4.07Å; W405-V497 HydrophobicContact CG-CB 4.02Å; W405-V497 HydrophobicContact CG-CG1 3.6Å; W405-V497 HydrophobicContact CG-CG2 4.28Å; W405-V497 HydrophobicContact CZ2-CG2 4.42Å; W405-E501 WeakPolarHBondContact CZ2-OE2 3.48Å; W405-F507 HydrophobicContact CH2-CB 4.2Å; W405-F507 HydrophobicContact CH2-CD1 4.2Å; W405-F507 HydrophobicContact CH2-CD2 4.48Å; W405-F507 HydrophobicContact CH2-CG 4.05Å
406	R	64.4	Low	60.4	Low	108 Å²	108	77.9 Å²	77.9	41%	0.408	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-59.5	135.9	178.8	-172.4	176.2	178	173.8	0.7	110.1
407	K	52.9	Low	57.5	Low	159 Å²	159	81.7 Å²	81.7	69%	0.691	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-80.3	124.4	174.3	-70.6	-173.7	174.9	-171.7	0	110.2	W405 T409	W405-K407 PolarHBondContact O-N 2.78Å; K407-T409 PolarHBondContact O-N 3.46Å
408	Y	49.2	Very low	54.7	Low	94 Å²	94	90 Å²	90	37%	0.369	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-74.2	119	164.1	-66.9	-72.1	0	0	0	108.9	L302 A410 E427	L302-Y408 HydrophobicContact CD1-CD1 4.07Å; L302-Y408 HydrophobicContact CD2-CD1 3.55Å; L302-Y408 HydrophobicContact CD2-CE1 3.54Å; L302-Y408 HydrophobicContact CG-CD1 3.88Å; L302-Y408 HydrophobicContact CG-CE1 4.08Å; Y408-A410 PolarHBondContact O-N 3.04Å; Y408-E427 PolarHBondContact OH-OE1 3.39Å; Y408-E427 VanDerWaalsContact OH-OE1 3.08Å; Y408-E427 PolarHBondContact OH-OE2 3.26Å
409	T	36.6	Very low	52	Low	109 Å²	109	92.8 Å²	92.8	67%	0.669	50%	0.502	S	S	*	.			trans	-70.8	115.8	168	40.4	0	0	0	0	107.7	K407 S411	K407-T409 PolarHBondContact O-N 3.46Å; T409-S411 PolarHBondContact O-N 3.29Å
410	A	36.5	Very low	49.6	Very low	112 Å²	112	101.8 Å²	101.8	93%	0.926	54%	0.544	S	S	*	.			trans	-66.5	72.2	-176.2	0	0	0	0	0	113	Y408	Y408-A410 PolarHBondContact O-N 3.04Å
411	S	34.2	Very low	47.3	Very low	85 Å²	85	108.6 Å²	108.6	59%	0.594	58%	0.581	S	S	*	*			trans	-132	98.9	160	63.8	0	0	0	0	109.3	T409	T409-S411 PolarHBondContact O-N 3.29Å
412	N	31.8	Very low	45.6	Very low	134 Å²	134	107.8 Å²	107.8	72%	0.717	58%	0.581	S	S	*	*	S	Bend	trans	79.2	125.1	154.4	-61.8	-12.1	0	0	0	119.3
413	H	37.7	Very low	44.5	Very low	147 Å²	147	106.1 Å²	106.1	68%	0.681	58%	0.578	S	S	*	*			trans	85.4	99.1	155.4	-60.6	-58	0	0	0	119.7	V415	H413-V415 HydrophobicContact CB-CG2 3.92Å; H413-V415 PolarHBondContact O-N 3.47Å
414	V	40.7	Very low	44	Very low	127 Å²	127	109.2 Å²	109.2	77%	0.77	60%	0.601	S	S	*	*			trans	-50.2	104.6	136.5	176.7	0	0	0	0	107.7
415	V	32.1	Very low	44	Very low	67 Å²	67	110.1 Å²	110.1	41%	0.406	61%	0.608	S	S	.	*			trans	-102.5	112.4	167.8	175.5	0	0	0	0	107.2	E306 H413	E306-V415 HydrophobicContact CG-CB 4.47Å; E306-V415 HydrophobicContact CG-CG2 4.36Å; E306-V415 WeakPolarHBondContact OE1-CG2 3.15Å; H413-V415 HydrophobicContact CB-CG2 3.92Å; H413-V415 PolarHBondContact O-N 3.47Å
416	H	36.9	Very low	43.9	Very low	121 Å²	121	109.5 Å²	109.5	56%	0.56	61%	0.608	S	S	*	*			trans	87.7	102.5	175.6	-56.7	-56.6	0	0	0	118.7	Q418	H416-Q418 PolarHBondContact O-N 3.29Å; H416-Q418 VanDerWaalsContact O-N 3.09Å
417	G	33.2	Very low	44.4	Very low	80 Å²	80	105.7 Å²	105.7	83%	0.825	60%	0.595	S	S	*	*			trans	-65.3	97.1	157.6	0	0	0	0	0	111.1
418	Q	35	Very low	45.7	Very low	178 Å²	178	99.8 Å²	99.8	83%	0.832	57%	0.571	S	S	*	*	S	Bend	trans	-145.5	109.9	144.4	-72.3	-168.3	-7.2	0	0	105.8	H416	H416-Q418 PolarHBondContact O-N 3.29Å; H416-Q418 VanDerWaalsContact O-N 3.09Å
419	N	33.9	Very low	47.4	Very low	142 Å²	142	97.4 Å²	97.4	76%	0.759	57%	0.567	S	S	*	*			trans	37.1	108.2	176.4	-73.1	-14.8	0	0	0	116.2	N421 C422	N419-N421 PolarHBondContact O-N 3.4Å; N419-C422 PolarHBondContact O-N 3.15Å; N419-C422 VanDerWaalsContact O-N 3.15Å
420	E	36.1	Very low	49.8	Very low	196 Å²	196	92.3 Å²	92.3	92%	0.916	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	4.2	167	-68.6	176.6	150.3	0	0	114.8
421	N	38.9	Very low	52.3	Low	144 Å²	144	88.1 Å²	88.1	77%	0.77	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117	12.6	-178.5	-66.9	-13.7	0	0	0	114.5	N419 D423	N419-N421 PolarHBondContact O-N 3.4Å; N421-D423 PolarHBondContact O-N 3.5Å
422	C	43	Very low	54.9	Low	77 Å²	77	85 Å²	85	52%	0.52	47%	0.474	S	S	.	.			trans	-79.5	99.9	173.2	-150.5	0	0	0	0	110.1	N419 C424	N419-C422 PolarHBondContact O-N 3.15Å; N419-C422 VanDerWaalsContact O-N 3.15Å; C422-C424 VanDerWaalsContact C-SG 3.55Å; C422-C424 VanDerWaalsContact CA-SG 3.55Å; C422-C424 HydrophobicContact CB-CB 4.16Å; C422-C424 WeakPolarHBondContact CB-SG 3.25Å; C422-C424 PolarHBondContact O-N 3.46Å; C422-C424 WeakPolarHBondContact SG-CB 3.41Å; C422-C424 CovalentContact SG-SG 2.06Å; C422-C424 PolarHBondContact SG-SG 3.09Å
423	D	48.9	Very low	57.8	Low	86 Å²	86	79.7 Å²	79.7	46%	0.46	45%	0.445	S	S	.	.			trans	-65.1	20.3	171.5	-76	-38.8	0	0	0	113.9	N421 I428 S506	N421-D423 PolarHBondContact O-N 3.5Å; D423-I428 HydrophobicContact CB-CG2 4.4Å; D423-S506 PolarHBondContact OD1-OG 2.85Å
424	C	56	Low	60.5	Low	91 Å²	91	72.7 Å²	72.7	62%	0.615	41%	0.412	S	S	*	.			trans	-94.1	-0.6	-157.4	-42.2	0	0	0	0	113.6	C422	C422-C424 VanDerWaalsContact C-SG 3.55Å; C422-C424 VanDerWaalsContact CA-SG 3.55Å; C422-C424 HydrophobicContact CB-CB 4.16Å; C422-C424 WeakPolarHBondContact CB-SG 3.25Å; C422-C424 PolarHBondContact O-N 3.46Å; C422-C424 WeakPolarHBondContact SG-CB 3.41Å; C422-C424 CovalentContact SG-SG 2.06Å; C422-C424 PolarHBondContact SG-SG 3.09Å
425	S	70.9	Confident	63.1	Low	19 Å²	19	66.7 Å²	66.7	13%	0.133	38%	0.375	C	S	.	.	S	Bend	trans	-83.8	145.8	-176.3	81	0	0	0	0	112.3	E427 I428 S429	S425-E427 PolarHBondContact O-N 3.04Å; S425-I428 PolarHBondContact O-N 2.96Å; S425-I428 WeakPolarHBondContact OG-CD1 3.45Å; S425-I428 WeakPolarHBondContact OG-CG1 3.27Å; S425-I428 PolarHBondContact OG-N 2.93Å; S425-S429 PolarHBondContact O-N 3.33Å; S425-S429 PolarHBondContact O-OG 3.07Å
426	P	72.2	Confident	66.1	Low	23 Å²	23	67.3 Å²	67.3	15%	0.149	37%	0.371	C	S	.	.	H	α-helix	trans	-56.4	-31.9	175.2	-28.3	36	0	0	0	113.7	W308 V358 I361 M362 F430	W308-P426 HydrophobicContact CH2-CG 4.16Å; V358-P426 HydrophobicContact CG1-CB 4.39Å; V358-P426 HydrophobicContact CG1-CG 4.08Å; I361-P426 HydrophobicContact CG2-CB 4.12Å; I361-P426 WeakPolarHBondContact CG2-O 3.22Å; M362-P426 HydrophobicContact CG-CB 3.93Å; M362-P426 HydrophobicContact CG-CG 4.14Å; M362-P426 HydrophobicContact SD-CG 4.5Å; P426-F430 WeakPolarHBondContact O-CB 3.47Å; P426-F430 PolarHBondContact O-N 3.22Å
427	E	74.8	Confident	69	Low	29 Å²	29	61.6 Å²	61.6	14%	0.136	34%	0.344	C	S	.	.	H	α-helix	trans	-69.7	-44.5	177.6	-170.4	-166.6	162.1	0	0	112.3	Y408 S425 S429 F430 K431	Y408-E427 PolarHBondContact OH-OE1 3.39Å; Y408-E427 VanDerWaalsContact OH-OE1 3.08Å; Y408-E427 PolarHBondContact OH-OE2 3.26Å; S425-E427 PolarHBondContact O-N 3.04Å; E427-S429 VanDerWaalsContact C-N 3.33Å; E427-F430 PolarHBondContact O-N 2.98Å; E427-K431 PolarHBondContact O-N 3.18Å; E427-K431 VanDerWaalsContact OE1-CE 3.29Å; E427-K431 WeakPolarHBondContact OE1-CE 3.28Å; E427-K431 IonicContact OE1-NZ 3.08Å; E427-K431 PolarHBondContact OE1-NZ 3.39Å
428	I	81.6	Confident	72	Confident	35 Å²	35	58 Å²	58	18%	0.179	31%	0.306	C	S	.	.	H	α-helix	trans	-61	-47.2	175.5	-68.2	167.9	0	0	0	109.2	D423 S425 F430 K431 I432 F507	D423-I428 HydrophobicContact CB-CG2 4.4Å; S425-I428 PolarHBondContact O-N 2.96Å; S425-I428 WeakPolarHBondContact OG-CD1 3.45Å; S425-I428 WeakPolarHBondContact OG-CG1 3.27Å; S425-I428 PolarHBondContact OG-N 2.93Å; I428-F430 VanDerWaalsContact C-N 3.28Å; I428-F430 PolarHBondContact O-N 3.15Å; I428-K431 PolarHBondContact O-N 3Å; I428-I432 HydrophobicContact CG2-CD1 3.78Å; I428-I432 HydrophobicContact CG2-CG1 4.4Å; I428-I432 WeakPolarHBondContact O-CG1 3.34Å; I428-I432 PolarHBondContact O-N 2.87Å; I428-F507 HydrophobicContact CB-CZ 4.21Å; I428-F507 HydrophobicContact CG1-CZ 4.03Å; I428-F507 HydrophobicContact CG2-CE1 4.13Å; I428-F507 HydrophobicContact CG2-CZ 3.89Å
429	S	84.2	Confident	74.9	Confident	43 Å²	43	50.9 Å²	50.9	30%	0.301	27%	0.273	S	S	.	.	H	α-helix	trans	-56.2	-43	176	-67	0	0	0	0	111.8	S425 E427 I432 Q433	S425-S429 PolarHBondContact O-N 3.33Å; S425-S429 PolarHBondContact O-OG 3.07Å; E427-S429 VanDerWaalsContact C-N 3.33Å; S429-I432 PolarHBondContact O-N 3.11Å; S429-Q433 WeakPolarHBondContact O-CB 3.31Å; S429-Q433 VanDerWaalsContact O-CG 3.31Å; S429-Q433 WeakPolarHBondContact O-CG 3.25Å; S429-Q433 PolarHBondContact O-N 3.29Å
430	F	86.4	Confident	77.8	Confident	3 Å²	3	44.8 Å²	44.8	1%	0.013	24%	0.241	C	C	.	.	H	α-helix	trans	-65	-43.5	178.2	-177.3	-125.4	0	0	0	112.8	I361 K364 V365 L368 L403 I404 P426 E427 I428 Q433 F434	I361-F430 HydrophobicContact CG2-CB 3.73Å; I361-F430 HydrophobicContact CG2-CD1 4.41Å; I361-F430 HydrophobicContact CG2-CG 4.09Å; K364-F430 HydrophobicContact CB-CD2 3.96Å; K364-F430 HydrophobicContact CB-CE2 3.51Å; K364-F430 HydrophobicContact CB-CZ 4.25Å; K364-F430 HydrophobicContact CD-CE2 4.2Å; K364-F430 HydrophobicContact CD-CZ 4.1Å; K364-F430 HydrophobicContact CG-CE2 4.46Å; V365-F430 HydrophobicContact CG2-CB 3.74Å; V365-F430 HydrophobicContact CG2-CD2 4.24Å; V365-F430 HydrophobicContact CG2-CG 4.46Å; L368-F430 HydrophobicContact CD1-CD2 3.87Å; L368-F430 HydrophobicContact CD1-CE2 3.47Å; L368-F430 VanDerWaalsContact CD1-CE2 3.47Å; L368-F430 HydrophobicContact CD1-CZ 4.48Å; L368-F430 HydrophobicContact CG-CE2 4.44Å; L403-F430 HydrophobicContact CD2-CE1 3.84Å; L403-F430 HydrophobicContact CD2-CZ 4.11Å; L403-F430 HydrophobicContact CG-CE1 3.88Å; I404-F430 HydrophobicContact CB-CE1 4.44Å; I404-F430 HydrophobicContact CG1-CE1 3.8Å; I404-F430 HydrophobicContact CG1-CZ 4.12Å; P426-F430 WeakPolarHBondContact O-CB 3.47Å; P426-F430 PolarHBondContact O-N 3.22Å; E427-F430 PolarHBondContact O-N 2.98Å; I428-F430 VanDerWaalsContact C-N 3.28Å; I428-F430 PolarHBondContact O-N 3.15Å; F430-Q433 PolarHBondContact O-N 3.02Å; F430-F434 VanDerWaalsContact O-CB 3.28Å; F430-F434 WeakPolarHBondContact O-CB 3.38Å; F430-F434 PolarHBondContact O-N 3.13Å
431	K	89.4	Confident	80.7	Confident	23 Å²	23	35.4 Å²	35.4	10%	0.1	20%	0.197	C	C	.	.	H	α-helix	trans	-61.3	-45.2	174.4	-74.2	173.7	-173.8	163.1	0	111.9	I404 W405 E427 I428 F434 L435 F507	I404-K431 WeakPolarHBondContact O-CE 3.43Å; I404-K431 VanDerWaalsContact O-CG 3.31Å; I404-K431 WeakPolarHBondContact O-CG 3.4Å; W405-K431 HydrophobicContact CE3-CD 4.24Å; W405-K431 HydrophobicContact CE3-CG 4.12Å; W405-K431 HydrophobicContact CH2-CD 4.22Å; W405-K431 HydrophobicContact CZ3-CB 3.95Å; W405-K431 HydrophobicContact CZ3-CD 3.93Å; W405-K431 HydrophobicContact CZ3-CG 3.81Å; E427-K431 PolarHBondContact O-N 3.18Å; E427-K431 VanDerWaalsContact OE1-CE 3.29Å; E427-K431 WeakPolarHBondContact OE1-CE 3.28Å; E427-K431 IonicContact OE1-NZ 3.08Å; E427-K431 PolarHBondContact OE1-NZ 3.39Å; I428-K431 PolarHBondContact O-N 3Å; K431-F434 PolarHBondContact O-N 3.21Å; K431-L435 WeakPolarHBondContact O-CG 3.41Å; K431-L435 PolarHBondContact O-N 3.03Å; K431-F507 HydrophobicContact CB-CD1 4.27Å; K431-F507 HydrophobicContact CB-CE1 3.57Å; K431-F507 HydrophobicContact CB-CZ 4.12Å; K431-F507 HydrophobicContact CD-CE1 4.06Å; K431-F507 HydrophobicContact CD-CE2 4.34Å; K431-F507 HydrophobicContact CD-CZ 3.78Å; K431-F507 HydrophobicContact CG-CE1 4.47Å
432	I	90.1	Very high	83.4	Confident	21 Å²	21	28.6 Å²	28.6	11%	0.108	16%	0.161	C	C	.	.	H	α-helix	trans	-62.6	-49.1	178.1	-68.8	173.1	0	0	0	110.5	I428 S429 F434 L435 R436 F507 W510	I428-I432 HydrophobicContact CG2-CD1 3.78Å; I428-I432 HydrophobicContact CG2-CG1 4.4Å; I428-I432 WeakPolarHBondContact O-CG1 3.34Å; I428-I432 PolarHBondContact O-N 2.87Å; S429-I432 PolarHBondContact O-N 3.11Å; I432-F434 VanDerWaalsContact C-N 3.3Å; I432-F434 PolarHBondContact O-N 3.32Å; I432-L435 PolarHBondContact O-N 3.29Å; I432-R436 HydrophobicContact CG2-CG 4.34Å; I432-R436 WeakPolarHBondContact O-CB 3.32Å; I432-R436 WeakPolarHBondContact O-CG 3.4Å; I432-R436 PolarHBondContact O-N 3.32Å; I432-F507 HydrophobicContact CG1-CD1 4.27Å; I432-F507 HydrophobicContact CG1-CE1 3.94Å; I432-W510 HydrophobicContact CG2-CD2 4.18Å; I432-W510 HydrophobicContact CG2-CG 4.42Å; I432-W510 HydrophobicContact CG2-CZ2 4.26Å
433	Q	91.5	Very high	85.8	Confident	22 Å²	22	26.4 Å²	26.4	10%	0.103	14%	0.144	C	C	.	.	H	α-helix	trans	-65.5	-34.4	180	-66.3	-56.7	-7.9	0	0	112.5	V365 L368 S429 F430 R436 L437	V365-Q433 HydrophobicContact CG1-CG 3.84Å; L368-Q433 HydrophobicContact CB-CB 4.2Å; L368-Q433 HydrophobicContact CD1-CB 4.5Å; S429-Q433 WeakPolarHBondContact O-CB 3.31Å; S429-Q433 VanDerWaalsContact O-CG 3.31Å; S429-Q433 WeakPolarHBondContact O-CG 3.25Å; S429-Q433 PolarHBondContact O-N 3.29Å; F430-Q433 PolarHBondContact O-N 3.02Å; Q433-R436 PolarHBondContact O-N 3.15Å; Q433-L437 WeakPolarHBondContact O-CB 3.39Å; Q433-L437 PolarHBondContact O-N 3.05Å
434	F	95.1	Very high	87.8	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.7	-48.2	171.3	169.7	-99.7	0	0	0	111.9	L368 L396 F400 I404 F430 K431 I432 L437 L438 L490	L368-F434 HydrophobicContact CD1-CB 4.22Å; L396-F434 HydrophobicContact CB-CE2 4.11Å; L396-F434 HydrophobicContact CD1-CD2 4.4Å; L396-F434 HydrophobicContact CD1-CE2 4.24Å; F400-F434 AromaticContact CD2-CE1 3.9Å; F400-F434 HydrophobicContact CD2-CE1 3.9Å; F400-F434 AromaticContact CD2-CZ 3.74Å; F400-F434 HydrophobicContact CD2-CZ 3.74Å; F400-F434 AromaticContact CE2-CE1 3.82Å; F400-F434 HydrophobicContact CE2-CE1 3.82Å; F400-F434 HydrophobicContact CE2-CZ 4.06Å; I404-F434 HydrophobicContact CD1-CD1 4.44Å; I404-F434 HydrophobicContact CD1-CD2 3.53Å; I404-F434 HydrophobicContact CD1-CE1 4.45Å; I404-F434 HydrophobicContact CD1-CE2 3.54Å; I404-F434 HydrophobicContact CD1-CG 3.98Å; I404-F434 HydrophobicContact CD1-CZ 4.01Å; I404-F434 HydrophobicContact CG2-CB 4.18Å; I404-F434 HydrophobicContact CG2-CD1 3.62Å; I404-F434 HydrophobicContact CG2-CD2 4.41Å; I404-F434 HydrophobicContact CG2-CE1 4.08Å; I404-F434 HydrophobicContact CG2-CG 3.79Å; F430-F434 VanDerWaalsContact O-CB 3.28Å; F430-F434 WeakPolarHBondContact O-CB 3.38Å; F430-F434 PolarHBondContact O-N 3.13Å; K431-F434 PolarHBondContact O-N 3.21Å; I432-F434 VanDerWaalsContact C-N 3.3Å; I432-F434 PolarHBondContact O-N 3.32Å; F434-L437 PolarHBondContact O-N 3.16Å; F434-L438 HydrophobicContact CD1-CD1 4.42Å; F434-L438 HydrophobicContact CE1-CD1 3.57Å; F434-L438 HydrophobicContact CE1-CG 4.11Å; F434-L438 HydrophobicContact CE2-CD1 4.19Å; F434-L438 HydrophobicContact CE2-CD2 4.12Å; F434-L438 HydrophobicContact CE2-CG 4.1Å; F434-L438 HydrophobicContact CZ-CD1 3.44Å; F434-L438 VanDerWaalsContact CZ-CD1 3.44Å; F434-L438 HydrophobicContact CZ-CD2 4.17Å; F434-L438 HydrophobicContact CZ-CG 3.86Å; F434-L438 WeakPolarHBondContact O-CG 3.29Å; F434-L438 PolarHBondContact O-N 3.05Å; F434-L490 HydrophobicContact CE2-CD2 4.19Å; F434-L490 HydrophobicContact CZ-CD1 3.89Å; F434-L490 HydrophobicContact CZ-CD2 3.99Å; F434-L490 HydrophobicContact CZ-CG 4.16Å
435	L	95.9	Very high	89.6	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-64.9	-40	178.3	-67.6	169.9	0	0	0	112	W405 K431 I432 L437 L438 Q439 L494 F507 W510 Q511 A514	W405-L435 HydrophobicContact CH2-CD1 4.35Å; W405-L435 HydrophobicContact CZ3-CD1 4.33Å; K431-L435 WeakPolarHBondContact O-CG 3.41Å; K431-L435 PolarHBondContact O-N 3.03Å; I432-L435 PolarHBondContact O-N 3.29Å; L435-L437 VanDerWaalsContact C-N 3.34Å; L435-L437 PolarHBondContact O-N 2.84Å; L435-L438 PolarHBondContact O-N 3.44Å; L435-Q439 WeakPolarHBondContact O-CB 3.42Å; L435-Q439 PolarHBondContact O-N 3.04Å; L435-L494 HydrophobicContact CD2-CD1 3.49Å; L435-L494 VanDerWaalsContact CD2-CD1 3.49Å; L435-F507 HydrophobicContact CD1-CD1 4.47Å; L435-W510 HydrophobicContact CB-CB 3.81Å; L435-W510 HydrophobicContact CD1-CB 3.52Å; L435-W510 HydrophobicContact CG-CB 4.29Å; L435-Q511 HydrophobicContact CD1-CG 3.96Å; L435-Q511 HydrophobicContact CD2-CG 4.21Å; L435-A514 HydrophobicContact CD2-CB 4.35Å
436	R	94.9	Very high	90.7	Very high	81 Å²	81	27.1 Å²	27.1	31%	0.306	13%	0.133	S	C	.	.	H	α-helix	trans	-59.1	-44.1	172.7	-76.6	173.9	176.8	-176.2	-3.3	111.8	I432 Q433 Q439 S440 W510	I432-R436 HydrophobicContact CG2-CG 4.34Å; I432-R436 WeakPolarHBondContact O-CB 3.32Å; I432-R436 WeakPolarHBondContact O-CG 3.4Å; I432-R436 PolarHBondContact O-N 3.32Å; Q433-R436 PolarHBondContact O-N 3.15Å; R436-Q439 WeakPolarHBondContact O-CB 3.5Å; R436-Q439 PolarHBondContact O-N 2.76Å; R436-S440 PolarHBondContact O-N 2.82Å; R436-S440 PolarHBondContact O-OG 3.45Å; R436-W510 HydrophobicContact CG-CD2 4.29Å; R436-W510 HydrophobicContact CG-CE3 3.56Å; R436-W510 HydrophobicContact CG-CH2 3.88Å; R436-W510 HydrophobicContact CG-CZ3 3.33Å; R436-W510 VanDerWaalsContact NE-CZ2 3.29Å
437	L	96.1	Very high	91.8	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.6	-44.9	176.4	-178.8	72.3	0	0	0	111.2	L368 L371 C372 L375 L392 L396 Q433 F434 L435 Q439 S440 F441	L368-L437 HydrophobicContact CD2-CD2 3.57Å; L371-L437 HydrophobicContact CB-CD1 4.03Å; C372-L437 HydrophobicContact CB-CD1 4.35Å; L375-L437 HydrophobicContact CD1-CD1 3.69Å; L392-L437 HydrophobicContact CD2-CD2 3.95Å; L396-L437 HydrophobicContact CD1-CD2 3.61Å; Q433-L437 WeakPolarHBondContact O-CB 3.39Å; Q433-L437 PolarHBondContact O-N 3.05Å; F434-L437 PolarHBondContact O-N 3.16Å; L435-L437 VanDerWaalsContact C-N 3.34Å; L435-L437 PolarHBondContact O-N 2.84Å; L437-Q439 VanDerWaalsContact C-N 3.31Å; L437-Q439 PolarHBondContact O-N 2.76Å; L437-S440 PolarHBondContact O-N 2.78Å; L437-F441 WeakPolarHBondContact O-CB 3.39Å; L437-F441 PolarHBondContact O-N 3.02Å
438	L	96.5	Very high	92.8	Very high	4 Å²	4	27.2 Å²	27.2	2%	0.021	13%	0.133	C	C	.	.	H	α-helix	trans	-61.8	-40.5	177.1	-68.5	-164.9	0	0	0	112.4	I393 F434 L435 F441 S442 L451 L490 L494 A514	I393-L438 HydrophobicContact CD1-CD2 4.32Å; F434-L438 HydrophobicContact CD1-CD1 4.42Å; F434-L438 HydrophobicContact CE1-CD1 3.57Å; F434-L438 HydrophobicContact CE1-CG 4.11Å; F434-L438 HydrophobicContact CE2-CD1 4.19Å; F434-L438 HydrophobicContact CE2-CD2 4.12Å; F434-L438 HydrophobicContact CE2-CG 4.1Å; F434-L438 HydrophobicContact CZ-CD1 3.44Å; F434-L438 VanDerWaalsContact CZ-CD1 3.44Å; F434-L438 HydrophobicContact CZ-CD2 4.17Å; F434-L438 HydrophobicContact CZ-CG 3.86Å; F434-L438 WeakPolarHBondContact O-CG 3.29Å; F434-L438 PolarHBondContact O-N 3.05Å; L435-L438 PolarHBondContact O-N 3.44Å; L438-F441 PolarHBondContact O-N 3.08Å; L438-S442 PolarHBondContact O-N 3.48Å; L438-S442 PolarHBondContact O-OG 2.64Å; L438-L451 HydrophobicContact CD2-CD2 3.78Å; L438-L490 HydrophobicContact CD1-CD2 4.15Å; L438-L490 HydrophobicContact CD1-CG 4.16Å; L438-L490 HydrophobicContact CD2-CD2 3.59Å; L438-L490 HydrophobicContact CD2-CG 4.45Å; L438-L494 HydrophobicContact CD1-CD2 4.29Å; L438-A514 HydrophobicContact CB-CB 4.26Å
439	Q	95.9	Very high	93.6	Very high	30 Å²	30	25.6 Å²	25.6	14%	0.14	12%	0.124	C	C	.	.	H	α-helix	trans	-58	-56	173.7	-177	-158.2	-40.3	0	0	110.6	L435 R436 L437 F441 S442 D443 R513 S517	L435-Q439 WeakPolarHBondContact O-CB 3.42Å; L435-Q439 PolarHBondContact O-N 3.04Å; R436-Q439 WeakPolarHBondContact O-CB 3.5Å; R436-Q439 PolarHBondContact O-N 2.76Å; L437-Q439 VanDerWaalsContact C-N 3.31Å; L437-Q439 PolarHBondContact O-N 2.76Å; Q439-F441 VanDerWaalsContact C-N 3.29Å; Q439-F441 PolarHBondContact O-N 3.35Å; Q439-S442 PolarHBondContact O-N 3.42Å; Q439-D443 WeakPolarHBondContact O-CB 3.44Å; Q439-D443 PolarHBondContact O-N 2.91Å; Q439-R513 HydrophobicContact CG-CB 4.4Å; Q439-R513 VanDerWaalsContact NE2-NH2 3.12Å; Q439-S517 WeakPolarHBondContact CA-OG 3.46Å; Q439-S517 WeakPolarHBondContact O-CB 3.33Å; Q439-S517 PolarHBondContact O-OG 3.07Å
440	S	95.1	Very high	94.2	Very high	13 Å²	13	23.9 Å²	23.9	9%	0.091	11%	0.112	C	C	.	.	H	α-helix	trans	-63.6	-33.2	-179.1	-62.6	0	0	0	0	112.9	C372 R436 L437 S442	C372-S440 PolarHBondContact SG-OG 3.34Å; R436-S440 PolarHBondContact O-N 2.82Å; R436-S440 PolarHBondContact O-OG 3.45Å; L437-S440 PolarHBondContact O-N 2.78Å; S440-S442 VanDerWaalsContact C-N 3.32Å; S440-S442 PolarHBondContact O-N 3.48Å
441	F	96.8	Very high	94.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-71.4	-25.5	179.1	-174.7	-92.8	0	0	0	113.4	L375 H384 L387 I393 L437 L438 Q439 N447 L450	L375-F441 HydrophobicContact CD1-CB 4.24Å; L375-F441 HydrophobicContact CD1-CD2 4.3Å; H384-F441 PolarHBondContact CE1-O 3.24Å; H384-F441 AromaticContact ND1-CD2 3.83Å; H384-F441 AromaticContact ND1-CE2 3.9Å; L387-F441 HydrophobicContact CB-CE2 4.27Å; L387-F441 HydrophobicContact CD1-CD2 4.32Å; I393-F441 HydrophobicContact CD1-CD1 3.77Å; I393-F441 HydrophobicContact CD1-CD2 4.18Å; I393-F441 HydrophobicContact CD1-CE1 3.82Å; I393-F441 HydrophobicContact CD1-CE2 4.22Å; I393-F441 HydrophobicContact CD1-CG 3.95Å; I393-F441 HydrophobicContact CD1-CZ 4.05Å; I393-F441 HydrophobicContact CG1-CD1 4.02Å; I393-F441 HydrophobicContact CG1-CD2 4.43Å; I393-F441 HydrophobicContact CG1-CE1 3.52Å; I393-F441 HydrophobicContact CG1-CE2 3.97Å; I393-F441 HydrophobicContact CG1-CG 4.45Å; I393-F441 HydrophobicContact CG1-CZ 3.48Å; I393-F441 VanDerWaalsContact CG1-CZ 3.48Å; L437-F441 WeakPolarHBondContact O-CB 3.39Å; L437-F441 PolarHBondContact O-N 3.02Å; L438-F441 PolarHBondContact O-N 3.08Å; Q439-F441 VanDerWaalsContact C-N 3.29Å; Q439-F441 PolarHBondContact O-N 3.35Å; F441-N447 HydrophobicContact CE1-CB 4.1Å; F441-N447 VanDerWaalsContact CE1-O 3.28Å; F441-N447 WeakPolarHBondContact CE1-O 3.28Å; F441-N447 HydrophobicContact CZ-CB 3.82Å; F441-L450 HydrophobicContact CE1-CB 4.47Å; F441-L450 HydrophobicContact CZ-CD1 4.25Å
442	S	95.9	Very high	95.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-101.8	-26.3	-176.2	-43.1	0	0	0	0	113.2	L438 Q439 S440 H444 H445 L451 S517	L438-S442 PolarHBondContact O-N 3.48Å; L438-S442 PolarHBondContact O-OG 2.64Å; Q439-S442 PolarHBondContact O-N 3.42Å; S440-S442 VanDerWaalsContact C-N 3.32Å; S440-S442 PolarHBondContact O-N 3.48Å; S442-H444 PolarHBondContact O-N 3.27Å; S442-H445 PolarHBondContact O-N 2.63Å; S442-L451 WeakPolarHBondContact OG-CD1 3.48Å; S442-S517 CarbonylContact C-O 3.47Å; S442-S517 WeakPolarHBondContact CB-OG 3.35Å
443	D	93.3	Very high	95.6	Very high	32 Å²	32	22.1 Å²	22.1	17%	0.171	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	107.3	-171	-170.4	79.3	0	0	0	112.7	R380 Q439 H445 R520	R380-D443 PolarHBondContact NH1-O 3.15Å; Q439-D443 WeakPolarHBondContact O-CB 3.44Å; Q439-D443 PolarHBondContact O-N 2.91Å; D443-H445 VanDerWaalsContact C-N 3.3Å; D443-H445 PolarHBondContact O-N 2.99Å; D443-R520 WeakPolarHBondContact OD1-CD 3.4Å; D443-R520 IonicContact OD1-CZ 2.64Å; D443-R520 IonicContact OD1-NE 2.99Å; D443-R520 IonicContact OD1-NH1 3.87Å; D443-R520 PolarHBondContact OD1-NH1 3.28Å
444	H	91.4	Very high	95.9	Very high	58 Å²	58	24.2 Å²	24.2	27%	0.269	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	41.1	-179.6	-56.5	84.4	0	0	0	113.2	R380 S442	R380-H444 PolarHBondContact NH2-O 2.94Å; S442-H444 PolarHBondContact O-N 3.27Å
445	H	93.3	Very high	96	Very high	33 Å²	33	31 Å²	31	15%	0.153	15%	0.147	C	C	.	.			trans	-137	144.2	179.8	-162.5	-81	0	0	0	113.3	H384 S442 D443 N447 K448	H384-H445 WeakPolarHBondContact CB-NE2 3.4Å; H384-H445 AromaticContact CD2-CD2 3.21Å; H384-H445 PolarHBondContact CD2-CD2 2.92Å; H384-H445 AromaticContact CD2-CE1 3.95Å; H384-H445 AromaticContact CD2-CG 3.68Å; H384-H445 AromaticContact CD2-NE2 3.42Å; H384-H445 PolarHBondContact CD2-NE2 2.92Å; H384-H445 AromaticContact CE1-CD2 3.95Å; H384-H445 AromaticContact CE1-CG 3.62Å; H384-H445 AromaticContact CE1-ND1 3.92Å; H384-H445 AromaticContact CG-CD2 3.63Å; H384-H445 AromaticContact CG-CE1 3.55Å; H384-H445 AromaticContact CG-CG 3.85Å; H384-H445 AromaticContact CG-ND1 3.78Å; H384-H445 AromaticContact CG-NE2 3.44Å; H384-H445 AromaticContact ND1-CE1 3.89Å; H384-H445 AromaticContact ND1-CG 3.81Å; H384-H445 AromaticContact ND1-ND1 3.67Å; H384-H445 AromaticContact NE2-CD2 3.47Å; H384-H445 PolarHBondContact NE2-CD2 3.04Å; H384-H445 AromaticContact NE2-CG 3.55Å; S442-H445 PolarHBondContact O-N 2.63Å; D443-H445 VanDerWaalsContact C-N 3.3Å; D443-H445 PolarHBondContact O-N 2.99Å; H445-N447 WeakPolarHBondContact ND1-CB 3.43Å; H445-N447 PolarHBondContact ND1-N 3.49Å; H445-K448 WeakPolarHBondContact O-CB 3.41Å; H445-K448 VanDerWaalsContact O-CG 3.29Å; H445-K448 WeakPolarHBondContact O-CG 3.31Å; H445-K448 PolarHBondContact O-N 2.9Å
446	E	93.5	Very high	96.1	Very high	120 Å²	120	31.3 Å²	31.3	56%	0.561	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	-69.3	-34.8	-175	-62.8	-175.3	171.3	0	0	113.6	K448 Y449 A474	E446-K448 PolarHBondContact O-N 3.27Å; E446-Y449 WeakPolarHBondContact O-CD2 3.28Å; E446-Y449 PolarHBondContact O-N 3.01Å; E446-A474 HydrophobicContact CB-CB 3.71Å; E446-A474 HydrophobicContact CG-CB 3.62Å
447	N	95.5	Very high	96.3	Very high	40 Å²	40	27.6 Å²	27.6	21%	0.214	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-59.6	-5.1	175.7	-71.3	-1.9	0	0	0	114.5	H384 F441 H445 Y449 L450	H384-N447 PolarHBondContact O-ND2 3.27Å; F441-N447 HydrophobicContact CE1-CB 4.1Å; F441-N447 VanDerWaalsContact CE1-O 3.28Å; F441-N447 WeakPolarHBondContact CE1-O 3.28Å; F441-N447 HydrophobicContact CZ-CB 3.82Å; H445-N447 WeakPolarHBondContact ND1-CB 3.43Å; H445-N447 PolarHBondContact ND1-N 3.49Å; N447-Y449 PolarHBondContact O-N 3.48Å; N447-Y449 VanDerWaalsContact O-N 3.07Å; N447-L450 HydrophobicContact CB-CD1 4.06Å; N447-L450 HydrophobicContact CB-CG 4.38Å; N447-L450 VanDerWaalsContact O-CB 3.29Å; N447-L450 WeakPolarHBondContact O-CB 3.29Å; N447-L450 WeakPolarHBondContact O-CG 3.41Å; N447-L450 PolarHBondContact O-N 3.38Å
448	K	96.5	Very high	96.3	Very high	13 Å²	13	31.6 Å²	31.6	6%	0.057	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-50.3	-31.4	171.6	67.1	171.8	174.6	169.2	0	113	H445 E446 L450 L451 F518 D527	H445-K448 WeakPolarHBondContact O-CB 3.41Å; H445-K448 VanDerWaalsContact O-CG 3.29Å; H445-K448 WeakPolarHBondContact O-CG 3.31Å; H445-K448 PolarHBondContact O-N 2.9Å; E446-K448 PolarHBondContact O-N 3.27Å; K448-L450 PolarHBondContact O-N 3.46Å; K448-L451 VanDerWaalsContact O-CB 3.28Å; K448-L451 WeakPolarHBondContact O-CB 3.43Å; K448-L451 WeakPolarHBondContact O-CG 3.18Å; K448-L451 PolarHBondContact O-N 3.03Å; K448-L451 VanDerWaalsContact O-N 3.15Å; K448-F518 HydrophobicContact CB-CD2 3.83Å; K448-F518 HydrophobicContact CB-CE2 4.11Å; K448-F518 HydrophobicContact CD-CD2 4.01Å; K448-F518 HydrophobicContact CD-CE2 4.12Å; K448-F518 HydrophobicContact CD-CG 4.39Å; K448-F518 WeakPolarHBondContact CD-O 3.43Å; K448-F518 HydrophobicContact CG-CD2 4.16Å; K448-F518 HydrophobicContact CG-CE2 4.07Å; K448-F518 PolarHBondContact NZ-O 3.34Å; K448-D527 IonicContact NZ-OD2 3.16Å; K448-D527 PolarHBondContact NZ-OD2 3.47Å
449	Y	97.9	Very high	96.4	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.008	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-67.9	-17	178.5	-66.5	-60.5	0	0	0	113.9	E446 N447 L451 L452 L457 L460 A474 L475 T478 F518 D527	E446-Y449 WeakPolarHBondContact O-CD2 3.28Å; E446-Y449 PolarHBondContact O-N 3.01Å; N447-Y449 PolarHBondContact O-N 3.48Å; N447-Y449 VanDerWaalsContact O-N 3.07Å; Y449-L451 PolarHBondContact O-N 2.87Å; Y449-L452 HydrophobicContact CD1-CD1 4.16Å; Y449-L452 WeakPolarHBondContact O-CB 3.47Å; Y449-L452 PolarHBondContact O-N 2.9Å; Y449-L457 HydrophobicContact CD1-CD2 4.35Å; Y449-L457 HydrophobicContact CG-CD2 4.5Å; Y449-L460 HydrophobicContact CD1-CD1 3.86Å; Y449-L460 HydrophobicContact CE1-CD1 3.69Å; Y449-A474 HydrophobicContact CD2-CB 4.29Å; Y449-A474 HydrophobicContact CE2-CB 3.9Å; Y449-L475 HydrophobicContact CD1-CD1 3.92Å; Y449-L475 HydrophobicContact CD2-CB 4.23Å; Y449-L475 HydrophobicContact CE1-CB 4.37Å; Y449-L475 HydrophobicContact CE1-CD1 4.13Å; Y449-L475 HydrophobicContact CE2-CB 3.88Å; Y449-L475 HydrophobicContact CG-CD1 4.17Å; Y449-T478 WeakPolarHBondContact CB-OG1 3.46Å; Y449-F518 HydrophobicContact CD1-CE2 4.4Å; Y449-F518 HydrophobicContact CD1-CZ 4.24Å; Y449-F518 HydrophobicContact CE1-CZ 4.16Å; Y449-D527 WeakPolarHBondContact CE1-OD1 3.34Å; Y449-D527 PolarHBondContact OH-OD1 2.97Å; Y449-D527 PolarHBondContact OH-OD2 2.91Å; Y449-D527 VanDerWaalsContact OH-OD2 3.06Å
450	L	98	Very high	96.5	Very high	6 Å²	6	32.3 Å²	32.3	3%	0.031	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-66.1	-17.2	172.6	-58.8	-176.5	0	0	0	112.8	A388 I393 F441 N447 K448 L452 T478 L482 V483 C484	A388-L450 HydrophobicContact CB-CD1 3.58Å; I393-L450 VanDerWaalsContact CG2-O 3.26Å; I393-L450 WeakPolarHBondContact CG2-O 3.31Å; F441-L450 HydrophobicContact CE1-CB 4.47Å; F441-L450 HydrophobicContact CZ-CD1 4.25Å; N447-L450 HydrophobicContact CB-CD1 4.06Å; N447-L450 HydrophobicContact CB-CG 4.38Å; N447-L450 VanDerWaalsContact O-CB 3.29Å; N447-L450 WeakPolarHBondContact O-CB 3.29Å; N447-L450 WeakPolarHBondContact O-CG 3.41Å; N447-L450 PolarHBondContact O-N 3.38Å; K448-L450 PolarHBondContact O-N 3.46Å; L450-L452 PolarHBondContact O-N 3.11Å; L450-T478 HydrophobicContact CD2-CG2 3.88Å; L450-L482 HydrophobicContact CD2-CB 3.96Å; L450-V483 HydrophobicContact CD2-CG1 3.98Å; L450-C484 PolarHBondContact O-N 3.34Å; L450-C484 PolarHBondContact O-SG 3.25Å
451	L	98	Very high	96.6	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.021	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-69.7	-11.9	172	-65.3	168.9	0	0	0	113.6	I393 L438 S442 K448 Y449 C484 G489 L490 L491 F518	I393-L451 HydrophobicContact CD1-CD2 4.11Å; I393-L451 HydrophobicContact CG2-CD2 3.84Å; I393-L451 HydrophobicContact CG2-CG 4.47Å; L438-L451 HydrophobicContact CD2-CD2 3.78Å; S442-L451 WeakPolarHBondContact OG-CD1 3.48Å; K448-L451 VanDerWaalsContact O-CB 3.28Å; K448-L451 WeakPolarHBondContact O-CB 3.43Å; K448-L451 WeakPolarHBondContact O-CG 3.18Å; K448-L451 PolarHBondContact O-N 3.03Å; K448-L451 VanDerWaalsContact O-N 3.15Å; Y449-L451 PolarHBondContact O-N 2.87Å; L451-C484 VanDerWaalsContact C-SG 3.59Å; L451-C484 PolarHBondContact O-SG 3.3Å; L451-G489 CarbonylContact O-C 3.47Å; L451-G489 WeakPolarHBondContact O-CA 3.5Å; L451-L490 HydrophobicContact CD2-CB 4.08Å; L451-L490 HydrophobicContact CD2-CD2 3.88Å; L451-L490 HydrophobicContact CD2-CG 4.3Å; L451-L490 PolarHBondContact O-N 3.29Å; L451-L491 HydrophobicContact CB-CB 4.26Å; L451-L491 PolarHBondContact O-N 2.62Å; L451-F518 HydrophobicContact CD1-CD2 4.18Å
452	L	98.4	Very high	96.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.184	C	C	.	.	S	Bend	trans	-98.2	165.8	-179.9	-56.3	-175.9	0	0	0	110.5	Y449 L450 E456 L457 L460 V483 C484 L491 F518 F530	Y449-L452 HydrophobicContact CD1-CD1 4.16Å; Y449-L452 WeakPolarHBondContact O-CB 3.47Å; Y449-L452 PolarHBondContact O-N 2.9Å; L450-L452 PolarHBondContact O-N 3.11Å; L452-E456 WeakPolarHBondContact CA-OE2 3.28Å; L452-E456 HydrophobicContact CB-CB 3.97Å; L452-E456 HydrophobicContact CD2-CB 4.42Å; L452-L457 HydrophobicContact CB-CD2 3.95Å; L452-L457 HydrophobicContact CB-CG 4.25Å; L452-L457 HydrophobicContact CD1-CD2 3.87Å; L452-L457 HydrophobicContact CG-CD2 4.44Å; L452-L460 HydrophobicContact CD1-CD1 3.4Å; L452-L460 VanDerWaalsContact CD1-CD1 3.4Å; L452-L460 HydrophobicContact CD1-CG 4.39Å; L452-V483 WeakPolarHBondContact O-CB 3.39Å; L452-C484 WeakPolarHBondContact O-CB 3.32Å; L452-C484 PolarHBondContact O-N 3.45Å; L452-L491 HydrophobicContact CD2-CB 3.87Å; L452-L491 HydrophobicContact CD2-CD2 3.93Å; L452-F518 HydrophobicContact CD1-CZ 4.22Å; L452-F530 HydrophobicContact CD2-CE1 3.92Å; L452-F530 HydrophobicContact CD2-CZ 3.8Å
453	N	97.7	Very high	96.8	Very high	6 Å²	6	35.7 Å²	35.7	3%	0.032	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-99.1	173.6	165.5	74	12.2	0	0	0	111.6	Q455 E456 L457 C484 G486 K487 K488	N453-Q455 VanDerWaalsContact C-N 3.26Å; N453-Q455 PolarHBondContact O-N 3.21Å; N453-Q455 PolarHBondContact OD1-N 3.21Å; N453-Q455 VanDerWaalsContact OD1-N 3.12Å; N453-E456 PolarHBondContact N-OE2 3.5Å; N453-E456 PolarHBondContact O-N 3.14Å; N453-E456 VanDerWaalsContact O-N 3.11Å; N453-E456 WeakPolarHBondContact OD1-CB 3.47Å; N453-E456 VanDerWaalsContact OD1-CG 3.23Å; N453-E456 WeakPolarHBondContact OD1-CG 3.49Å; N453-E456 PolarHBondContact OD1-N 3.44Å; N453-E456 PolarHBondContact OD1-OE2 3.31Å; N453-L457 WeakPolarHBondContact O-CG 3.47Å; N453-L457 PolarHBondContact O-N 3.35Å; N453-C484 WeakPolarHBondContact CA-O 3.4Å; N453-C484 HydrophobicContact CB-CB 4.42Å; N453-C484 WeakPolarHBondContact CB-O 3.37Å; N453-G486 PolarHBondContact ND2-O 2.89Å; N453-K487 VanDerWaalsContact ND2-C 3.25Å; N453-K487 PolarHBondContact ND2-O 3.47Å; N453-K488 PolarHBondContact ND2-N 2.75Å
454	N	97.8	Very high	96.9	Very high	66 Å²	66	34.1 Å²	34.1	35%	0.353	18%	0.178	S	C	.	.	H	α-helix	trans	-57	-35.7	-179.5	-83.4	-55.4	0	0	0	114.2	N458 R480	N454-N458 PolarHBondContact O-N 3.1Å; N454-N458 VanDerWaalsContact O-N 3.15Å; N454-N458 PolarHBondContact O-ND2 2.91Å; N454-N458 PolarHBondContact O-OD1 3.45Å; N454-R480 PolarHBondContact ND2-O 3.35Å; N454-R480 WeakPolarHBondContact OD1-CB 3.46Å
455	Q	97.8	Very high	97.2	Very high	142 Å²	142	38.4 Å²	38.4	66%	0.664	20%	0.199	S	C	*	.	H	α-helix	trans	-69.6	-38.9	178.5	-175.2	178.4	1.9	0	0	111.6	N453 N458 E459	N453-Q455 VanDerWaalsContact C-N 3.26Å; N453-Q455 PolarHBondContact O-N 3.21Å; N453-Q455 PolarHBondContact OD1-N 3.21Å; N453-Q455 VanDerWaalsContact OD1-N 3.12Å; Q455-N458 PolarHBondContact O-N 3.17Å; Q455-E459 PolarHBondContact O-N 3.41Å
456	E	98.4	Very high	97.3	Very high	8 Å²	8	45.9 Å²	45.9	4%	0.037	23%	0.232	C	C	.	.	H	α-helix	trans	-71.5	-36.4	178.7	-71.4	167.4	159.1	0	0	112	L452 N453 N458 E459 L460 G489 T492 F530 R534	L452-E456 WeakPolarHBondContact CA-OE2 3.28Å; L452-E456 HydrophobicContact CB-CB 3.97Å; L452-E456 HydrophobicContact CD2-CB 4.42Å; N453-E456 PolarHBondContact N-OE2 3.5Å; N453-E456 PolarHBondContact O-N 3.14Å; N453-E456 VanDerWaalsContact O-N 3.11Å; N453-E456 WeakPolarHBondContact OD1-CB 3.47Å; N453-E456 VanDerWaalsContact OD1-CG 3.23Å; N453-E456 WeakPolarHBondContact OD1-CG 3.49Å; N453-E456 PolarHBondContact OD1-N 3.44Å; N453-E456 PolarHBondContact OD1-OE2 3.31Å; E456-N458 VanDerWaalsContact C-N 3.35Å; E456-E459 WeakPolarHBondContact O-CB 3.13Å; E456-E459 PolarHBondContact O-N 3.23Å; E456-L460 PolarHBondContact O-N 3.26Å; E456-L460 VanDerWaalsContact O-N 3.08Å; E456-G489 PolarHBondContact OE1-N 2.56Å; E456-G489 WeakPolarHBondContact OE2-CA 3.5Å; E456-G489 PolarHBondContact OE2-N 3.41Å; E456-T492 WeakPolarHBondContact OE1-CB 3.29Å; E456-T492 PolarHBondContact OE1-OG1 2.86Å; E456-F530 HydrophobicContact CB-CE2 3.71Å; E456-F530 HydrophobicContact CB-CZ 3.85Å; E456-F530 HydrophobicContact CG-CE2 3.91Å; E456-F530 HydrophobicContact CG-CZ 3.84Å; E456-R534 IonicContact OE1-NH2 2.79Å
457	L	97.9	Very high	97.4	Very high	2 Å²	2	42 Å²	42	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-43.8	170.2	-65.2	-178.7	0	0	0	111.5	Y449 L452 N453 E459 L460 S461 L475 T478 R480 V483	Y449-L457 HydrophobicContact CD1-CD2 4.35Å; Y449-L457 HydrophobicContact CG-CD2 4.5Å; L452-L457 HydrophobicContact CB-CD2 3.95Å; L452-L457 HydrophobicContact CB-CG 4.25Å; L452-L457 HydrophobicContact CD1-CD2 3.87Å; L452-L457 HydrophobicContact CG-CD2 4.44Å; N453-L457 WeakPolarHBondContact O-CG 3.47Å; N453-L457 PolarHBondContact O-N 3.35Å; L457-E459 PolarHBondContact O-N 2.94Å; L457-L460 WeakPolarHBondContact O-CB 3.5Å; L457-L460 PolarHBondContact O-N 2.81Å; L457-L460 VanDerWaalsContact O-N 3.13Å; L457-S461 PolarHBondContact O-N 3.31Å; L457-S461 VanDerWaalsContact O-N 3.08Å; L457-S461 PolarHBondContact O-OG 3.33Å; L457-L475 HydrophobicContact CB-CD1 4.44Å; L457-L475 HydrophobicContact CD2-CD1 3.56Å; L457-T478 HydrophobicContact CD1-CG2 4.12Å; L457-R480 HydrophobicContact CD1-CG 4.33Å; L457-V483 HydrophobicContact CD1-CG1 3.73Å
458	N	97.6	Very high	97.3	Very high	84 Å²	84	47.4 Å²	47.4	45%	0.449	25%	0.249	S	C	.	.	H	α-helix	trans	-62.9	-32.4	174.8	-66.2	-16.1	0	0	0	112.1	N454 Q455 E456 A462 R480	N454-N458 PolarHBondContact O-N 3.1Å; N454-N458 VanDerWaalsContact O-N 3.15Å; N454-N458 PolarHBondContact O-ND2 2.91Å; N454-N458 PolarHBondContact O-OD1 3.45Å; Q455-N458 PolarHBondContact O-N 3.17Å; E456-N458 VanDerWaalsContact C-N 3.35Å; N458-A462 VanDerWaalsContact O-CB 3.31Å; N458-A462 WeakPolarHBondContact O-CB 3.38Å; N458-A462 PolarHBondContact O-N 3.18Å; N458-R480 PolarHBondContact OD1-NH1 3.1Å; N458-R480 PolarHBondContact OD1-NH2 2.91Å
459	E	98	Very high	97.2	Very high	49 Å²	49	49.8 Å²	49.8	23%	0.229	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-41.7	173.6	-168.3	-170.2	161.5	0	0	111.5	Q455 E456 L457 A462 I463 F530 K533 R534	Q455-E459 PolarHBondContact O-N 3.41Å; E456-E459 WeakPolarHBondContact O-CB 3.13Å; E456-E459 PolarHBondContact O-N 3.23Å; L457-E459 PolarHBondContact O-N 2.94Å; E459-A462 PolarHBondContact O-N 3.27Å; E459-I463 HydrophobicContact CG-CD1 4.24Å; E459-I463 VanDerWaalsContact O-CG1 3.23Å; E459-I463 WeakPolarHBondContact O-CG1 3.33Å; E459-I463 PolarHBondContact O-N 3.16Å; E459-F530 HydrophobicContact CB-CD2 4.47Å; E459-F530 HydrophobicContact CG-CD2 4.39Å; E459-F530 WeakPolarHBondContact OE2-CE2 3.36Å; E459-K533 WeakPolarHBondContact OE1-CD 3.29Å; E459-K533 IonicContact OE1-NZ 2.7Å; E459-R534 IonicContact OE1-NH1 2.69Å; E459-R534 PolarHBondContact OE1-NH1 3.27Å; E459-R534 VanDerWaalsContact OE1-NH1 3.16Å; E459-R534 IonicContact OE2-CZ 3.53Å; E459-R534 IonicContact OE2-NH1 3.54Å; E459-R534 PolarHBondContact OE2-NH1 3.44Å; E459-R534 IonicContact OE2-NH2 2.72Å; E459-R534 PolarHBondContact OE2-NH2 3.44Å
460	L	97.9	Very high	97	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.1	-45.8	175.7	-71.7	173.4	0	0	0	112	Y449 L452 E456 L457 A462 I463 S464 L475 A526 F530	Y449-L460 HydrophobicContact CD1-CD1 3.86Å; Y449-L460 HydrophobicContact CE1-CD1 3.69Å; L452-L460 HydrophobicContact CD1-CD1 3.4Å; L452-L460 VanDerWaalsContact CD1-CD1 3.4Å; L452-L460 HydrophobicContact CD1-CG 4.39Å; E456-L460 PolarHBondContact O-N 3.26Å; E456-L460 VanDerWaalsContact O-N 3.08Å; L457-L460 WeakPolarHBondContact O-CB 3.5Å; L457-L460 PolarHBondContact O-N 2.81Å; L457-L460 VanDerWaalsContact O-N 3.13Å; L460-A462 VanDerWaalsContact C-N 3.32Å; L460-A462 PolarHBondContact O-N 2.77Å; L460-I463 PolarHBondContact O-N 3.22Å; L460-S464 PolarHBondContact O-N 2.85Å; L460-S464 PolarHBondContact O-OG 2.98Å; L460-S464 VanDerWaalsContact O-OG 3.08Å; L460-L475 HydrophobicContact CB-CD1 4.29Å; L460-L475 HydrophobicContact CB-CD2 3.67Å; L460-L475 HydrophobicContact CD1-CD1 3.9Å; L460-L475 HydrophobicContact CD1-CD2 4.44Å; L460-A526 HydrophobicContact CD2-CB 4.14Å; L460-A526 WeakPolarHBondContact CD2-O 3.34Å; L460-F530 HydrophobicContact CD2-CB 3.56Å; L460-F530 HydrophobicContact CD2-CD2 4.06Å; L460-F530 HydrophobicContact CD2-CG 3.97Å; L460-F530 HydrophobicContact CG-CD2 4.2Å
461	S	97.3	Very high	96.7	Very high	18 Å²	18	58.4 Å²	58.4	13%	0.126	31%	0.312	C	S	.	.	H	α-helix	trans	-59	-44.2	173.9	-61	0	0	0	0	111.2	L457 I463 S464 M465 E471	L457-S461 PolarHBondContact O-N 3.31Å; L457-S461 VanDerWaalsContact O-N 3.08Å; L457-S461 PolarHBondContact O-OG 3.33Å; S461-I463 VanDerWaalsContact C-N 3.33Å; S461-I463 PolarHBondContact O-N 2.83Å; S461-S464 PolarHBondContact O-N 3.36Å; S461-M465 WeakPolarHBondContact O-CB 3.09Å; S461-M465 WeakPolarHBondContact O-CG 3.29Å; S461-M465 PolarHBondContact O-N 3.36Å; S461-E471 VanDerWaalsContact CB-OE1 3.26Å; S461-E471 WeakPolarHBondContact CB-OE1 3.38Å; S461-E471 WeakPolarHBondContact CB-OE2 3.43Å; S461-E471 PolarHBondContact OG-OE1 3.25Å; S461-E471 PolarHBondContact OG-OE2 3.36Å
462	A	98	Very high	96.4	Very high	58 Å²	58	60.5 Å²	60.5	48%	0.479	33%	0.325	S	S	.	.	H	α-helix	trans	-64.8	-33.8	177	0	0	0	0	0	113.4	N458 E459 L460 K466	N458-A462 VanDerWaalsContact O-CB 3.31Å; N458-A462 WeakPolarHBondContact O-CB 3.38Å; N458-A462 PolarHBondContact O-N 3.18Å; E459-A462 PolarHBondContact O-N 3.27Å; L460-A462 VanDerWaalsContact C-N 3.32Å; L460-A462 PolarHBondContact O-N 2.77Å; A462-K466 VanDerWaalsContact O-CB 3.3Å; A462-K466 WeakPolarHBondContact O-CB 3.3Å; A462-K466 PolarHBondContact O-N 3.35Å
463	I	98.2	Very high	96.2	Very high	8 Å²	8	67.5 Å²	67.5	4%	0.041	36%	0.358	C	S	.	.	H	α-helix	trans	-64.6	-47.3	173.2	-70.6	161.3	0	0	0	110.3	E459 L460 S461 K466 A467 Y525 A526 M529 F530 K533	E459-I463 HydrophobicContact CG-CD1 4.24Å; E459-I463 VanDerWaalsContact O-CG1 3.23Å; E459-I463 WeakPolarHBondContact O-CG1 3.33Å; E459-I463 PolarHBondContact O-N 3.16Å; L460-I463 PolarHBondContact O-N 3.22Å; S461-I463 VanDerWaalsContact C-N 3.33Å; S461-I463 PolarHBondContact O-N 2.83Å; I463-K466 PolarHBondContact O-N 3.33Å; I463-A467 WeakPolarHBondContact O-CB 3.21Å; I463-A467 PolarHBondContact O-N 3.38Å; I463-Y525 HydrophobicContact CG2-CD1 4.35Å; I463-Y525 HydrophobicContact CG2-CE1 4.23Å; I463-A526 HydrophobicContact CB-CB 4.39Å; I463-A526 HydrophobicContact CG2-CB 4.09Å; I463-M529 HydrophobicContact CD1-CB 4.25Å; I463-M529 HydrophobicContact CG2-CB 3.8Å; I463-M529 HydrophobicContact CG2-CG 4.31Å; I463-F530 HydrophobicContact CD1-CB 4.12Å; I463-K533 HydrophobicContact CD1-CD 4.31Å
464	S	96.9	Very high	96	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-60.8	-47.6	179.9	-53.7	0	0	0	0	111.4	L460 S461 K466 A467 N468 I469 A526	L460-S464 PolarHBondContact O-N 2.85Å; L460-S464 PolarHBondContact O-OG 2.98Å; L460-S464 VanDerWaalsContact O-OG 3.08Å; S461-S464 PolarHBondContact O-N 3.36Å; S464-K466 PolarHBondContact O-N 3.27Å; S464-A467 CarbonylContact O-C 3.51Å; S464-A467 PolarHBondContact O-N 3.4Å; S464-N468 PolarHBondContact O-N 3.47Å; S464-I469 PolarHBondContact O-N 3.16Å; S464-I469 VanDerWaalsContact O-N 3.11Å; S464-A526 WeakPolarHBondContact OG-CB 3.22Å
465	M	96.6	Very high	95.8	Very high	147 Å²	147	65 Å²	65	72%	0.724	35%	0.346	S	S	*	.	H	α-helix	trans	-56.6	-47.4	174.4	-76.5	-77.8	-75.9	0	0	112.4	S461 A467 N468	S461-M465 WeakPolarHBondContact O-CB 3.09Å; S461-M465 WeakPolarHBondContact O-CG 3.29Å; S461-M465 PolarHBondContact O-N 3.36Å; M465-A467 VanDerWaalsContact C-N 3.3Å; M465-A467 PolarHBondContact O-N 3.2Å; M465-N468 PolarHBondContact O-N 3.24Å
466	K	96.5	Very high	95.7	Very high	190 Å²	190	62.5 Å²	62.5	83%	0.826	34%	0.34	S	S	*	.	H	α-helix	trans	-65.7	-33.5	179.9	-176.2	176.2	179.6	179.2	0	112.7	A462 I463 S464 N468	A462-K466 VanDerWaalsContact O-CB 3.3Å; A462-K466 WeakPolarHBondContact O-CB 3.3Å; A462-K466 PolarHBondContact O-N 3.35Å; I463-K466 PolarHBondContact O-N 3.33Å; S464-K466 PolarHBondContact O-N 3.27Å; K466-N468 VanDerWaalsContact C-N 3.28Å
467	A	94	Very high	95.5	Very high	38 Å²	38	67.1 Å²	67.1	31%	0.314	37%	0.365	S	S	.	.	H	α-helix	trans	-83.4	-3.3	178.2	0	0	0	0	0	113.3	I463 S464 M465 I469 Y525	I463-A467 WeakPolarHBondContact O-CB 3.21Å; I463-A467 PolarHBondContact O-N 3.38Å; S464-A467 CarbonylContact O-C 3.51Å; S464-A467 PolarHBondContact O-N 3.4Å; M465-A467 VanDerWaalsContact C-N 3.3Å; M465-A467 PolarHBondContact O-N 3.2Å; A467-I469 VanDerWaalsContact C-N 3.27Å; A467-I469 HydrophobicContact CB-CD1 4.23Å; A467-I469 HydrophobicContact CB-CG1 4.08Å; A467-I469 HydrophobicContact CB-CG2 4.35Å; A467-I469 PolarHBondContact O-N 3.23Å; A467-Y525 HydrophobicContact CB-CD1 4Å; A467-Y525 HydrophobicContact CB-CE1 3.6Å
468	N	94.4	Very high	95.4	Very high	154 Å²	154	67.9 Å²	67.9	82%	0.824	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	44	-174.6	-166.2	46.4	0	0	0	112.5	S464 M465 K466	S464-N468 PolarHBondContact O-N 3.47Å; M465-N468 PolarHBondContact O-N 3.24Å; K466-N468 VanDerWaalsContact C-N 3.28Å
469	I	93.7	Very high	95.3	Very high	63 Å²	63	67.9 Å²	67.9	32%	0.323	37%	0.37	S	S	.	.			trans	-118.1	149.7	175.8	63.3	177.7	0	0	0	110.1	S464 A467 Y525	S464-I469 PolarHBondContact O-N 3.16Å; S464-I469 VanDerWaalsContact O-N 3.11Å; A467-I469 VanDerWaalsContact C-N 3.27Å; A467-I469 HydrophobicContact CB-CD1 4.23Å; A467-I469 HydrophobicContact CB-CG1 4.08Å; A467-I469 HydrophobicContact CB-CG2 4.35Å; A467-I469 PolarHBondContact O-N 3.23Å; I469-Y525 HydrophobicContact CD1-CD1 3.73Å; I469-Y525 HydrophobicContact CD1-CG 4.15Å
470	P	93.8	Very high	95.2	Very high	120 Å²	120	70.7 Å²	70.7	78%	0.779	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-58	141.7	172.7	-22.4	33.4	0	0	0	111.5
471	E	91.9	Very high	95.1	Very high	70 Å²	70	73.8 Å²	73.8	33%	0.327	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-66	145.6	169	-72.6	-170.1	-142.5	0	0	110.3	S461 E473 V476	S461-E471 VanDerWaalsContact CB-OE1 3.26Å; S461-E471 WeakPolarHBondContact CB-OE1 3.38Å; S461-E471 WeakPolarHBondContact CB-OE2 3.43Å; S461-E471 PolarHBondContact OG-OE1 3.25Å; S461-E471 PolarHBondContact OG-OE2 3.36Å; E471-E473 PolarHBondContact O-N 3.25Å; E471-V476 HydrophobicContact CB-CG2 3.75Å
472	V	92.4	Very high	95.1	Very high	47 Å²	47	74.2 Å²	74.2	29%	0.285	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-65.6	129.1	176.4	-178.8	0	0	0	0	108.8	A474 L475 V476	V472-A474 VanDerWaalsContact C-N 3.3Å; V472-A474 HydrophobicContact CG1-CB 4.18Å; V472-A474 PolarHBondContact O-N 3.3Å; V472-L475 HydrophobicContact CB-CB 4.17Å; V472-L475 WeakPolarHBondContact O-CA 3.39Å; V472-L475 VanDerWaalsContact O-CB 3.27Å; V472-L475 WeakPolarHBondContact O-CB 3.24Å; V472-L475 PolarHBondContact O-N 3.32Å; V472-V476 PolarHBondContact O-N 3.21Å; V472-V476 VanDerWaalsContact O-N 3.14Å
473	E	93.6	Very high	95	Very high	147 Å²	147	71.7 Å²	71.7	69%	0.687	38%	0.379	S	S	*	.	H	α-helix	trans	-54.7	-44.9	-177.5	179.6	174	-172.4	0	0	112.5	E471 L475 V476 N477	E471-E473 PolarHBondContact O-N 3.25Å; E473-L475 VanDerWaalsContact C-N 3.25Å; E473-L475 PolarHBondContact O-N 3.44Å; E473-V476 PolarHBondContact O-N 3.42Å; E473-V476 VanDerWaalsContact O-N 3.11Å; E473-N477 VanDerWaalsContact CG-ND2 3.33Å; E473-N477 WeakPolarHBondContact CG-ND2 3.47Å; E473-N477 WeakPolarHBondContact O-CB 3.49Å; E473-N477 PolarHBondContact O-N 2.93Å; E473-N477 PolarHBondContact O-ND2 2.91Å
474	A	93.1	Very high	95	Very high	11 Å²	11	71.4 Å²	71.4	9%	0.091	38%	0.378	C	S	.	.	H	α-helix	trans	-57.4	-35.2	175.1	0	0	0	0	0	113.5	E446 Y449 V472 T478	E446-A474 HydrophobicContact CB-CB 3.71Å; E446-A474 HydrophobicContact CG-CB 3.62Å; Y449-A474 HydrophobicContact CD2-CB 4.29Å; Y449-A474 HydrophobicContact CE2-CB 3.9Å; V472-A474 VanDerWaalsContact C-N 3.3Å; V472-A474 HydrophobicContact CG1-CB 4.18Å; V472-A474 PolarHBondContact O-N 3.3Å; A474-T478 PolarHBondContact O-N 3.42Å; A474-T478 PolarHBondContact O-OG1 3.49Å
475	L	94.6	Very high	94.7	Very high	8 Å²	8	75.9 Å²	75.9	4%	0.042	40%	0.402	C	S	.	.	H	α-helix	trans	-67.8	-45.8	175.5	173	65.7	0	0	0	110.7	Y449 L457 L460 V472 E473 N477 T478	Y449-L475 HydrophobicContact CD1-CD1 3.92Å; Y449-L475 HydrophobicContact CD2-CB 4.23Å; Y449-L475 HydrophobicContact CE1-CB 4.37Å; Y449-L475 HydrophobicContact CE1-CD1 4.13Å; Y449-L475 HydrophobicContact CE2-CB 3.88Å; Y449-L475 HydrophobicContact CG-CD1 4.17Å; L457-L475 HydrophobicContact CB-CD1 4.44Å; L457-L475 HydrophobicContact CD2-CD1 3.56Å; L460-L475 HydrophobicContact CB-CD1 4.29Å; L460-L475 HydrophobicContact CB-CD2 3.67Å; L460-L475 HydrophobicContact CD1-CD1 3.9Å; L460-L475 HydrophobicContact CD1-CD2 4.44Å; V472-L475 HydrophobicContact CB-CB 4.17Å; V472-L475 WeakPolarHBondContact O-CA 3.39Å; V472-L475 VanDerWaalsContact O-CB 3.27Å; V472-L475 WeakPolarHBondContact O-CB 3.24Å; V472-L475 PolarHBondContact O-N 3.32Å; E473-L475 VanDerWaalsContact C-N 3.25Å; E473-L475 PolarHBondContact O-N 3.44Å; L475-N477 VanDerWaalsContact C-N 3.33Å; L475-N477 PolarHBondContact O-N 2.97Å; L475-T478 WeakPolarHBondContact O-CB 3.43Å; L475-T478 PolarHBondContact O-N 3.12Å; L475-T478 PolarHBondContact O-OG1 3.08Å
476	V	94.2	Very high	94.4	Very high	91 Å²	91	71.9 Å²	71.9	55%	0.552	40%	0.398	S	S	*	.	H	α-helix	trans	-63.3	-41.3	179.5	178	0	0	0	0	111.1	E471 V472 E473 T478	E471-V476 HydrophobicContact CB-CG2 3.75Å; V472-V476 PolarHBondContact O-N 3.21Å; V472-V476 VanDerWaalsContact O-N 3.14Å; E473-V476 PolarHBondContact O-N 3.42Å; E473-V476 VanDerWaalsContact O-N 3.11Å; V476-T478 PolarHBondContact O-N 3.22Å
477	N	95.1	Very high	94.2	Very high	104 Å²	104	72.2 Å²	72.2	56%	0.556	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-1.1	-178.5	-67.5	-19.9	0	0	0	113.7	E473 L475 D479	E473-N477 VanDerWaalsContact CG-ND2 3.33Å; E473-N477 WeakPolarHBondContact CG-ND2 3.47Å; E473-N477 WeakPolarHBondContact O-CB 3.49Å; E473-N477 PolarHBondContact O-N 2.93Å; E473-N477 PolarHBondContact O-ND2 2.91Å; L475-N477 VanDerWaalsContact C-N 3.33Å; L475-N477 PolarHBondContact O-N 2.97Å; N477-D479 PolarHBondContact O-N 3.3Å
478	T	96.1	Very high	94.3	Very high	18 Å²	18	74.9 Å²	74.9	11%	0.11	40%	0.404	C	S	.	.			trans	-66.7	122.5	179.5	-66.1	0	0	0	0	110.8	Y449 L450 L457 A474 L475 V476 R480 V483	Y449-T478 WeakPolarHBondContact CB-OG1 3.46Å; L450-T478 HydrophobicContact CD2-CG2 3.88Å; L457-T478 HydrophobicContact CD1-CG2 4.12Å; A474-T478 PolarHBondContact O-N 3.42Å; A474-T478 PolarHBondContact O-OG1 3.49Å; L475-T478 WeakPolarHBondContact O-CB 3.43Å; L475-T478 PolarHBondContact O-N 3.12Å; L475-T478 PolarHBondContact O-OG1 3.08Å; V476-T478 PolarHBondContact O-N 3.22Å; T478-R480 PolarHBondContact O-N 2.89Å; T478-V483 HydrophobicContact CG2-CG1 3.97Å
479	D	95.8	Very high	94.4	Very high	84 Å²	84	67.5 Å²	67.5	45%	0.449	37%	0.365	S	S	.	.			trans	-69.1	105.4	173.4	-175.7	-12.1	0	0	0	110.9	N477 S481 L482	N477-D479 PolarHBondContact O-N 3.3Å; D479-S481 VanDerWaalsContact CG-OG 3.26Å; D479-S481 PolarHBondContact O-N 3.45Å; D479-S481 VanDerWaalsContact O-N 3.1Å; D479-S481 VanDerWaalsContact OD1-CB 3.25Å; D479-S481 WeakPolarHBondContact OD1-CB 3.48Å; D479-S481 PolarHBondContact OD1-N 3.33Å; D479-S481 PolarHBondContact OD1-OG 2.9Å; D479-S481 PolarHBondContact OD2-OG 3.2Å; D479-L482 HydrophobicContact CB-CD1 4.01Å; D479-L482 HydrophobicContact CB-CG 4.14Å; D479-L482 PolarHBondContact O-N 3.32Å
480	R	95.8	Very high	94.5	Very high	108 Å²	108	64.5 Å²	64.5	41%	0.408	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-11.2	-179.7	-69.3	178.2	178.3	-105.5	5.5	114.5	N454 L457 N458 T478 V483	N454-R480 PolarHBondContact ND2-O 3.35Å; N454-R480 WeakPolarHBondContact OD1-CB 3.46Å; L457-R480 HydrophobicContact CD1-CG 4.33Å; N458-R480 PolarHBondContact OD1-NH1 3.1Å; N458-R480 PolarHBondContact OD1-NH2 2.91Å; T478-R480 PolarHBondContact O-N 2.89Å; R480-V483 VanDerWaalsContact O-CG2 3.32Å; R480-V483 WeakPolarHBondContact O-CG2 3.5Å
481	S	95.4	Very high	94.7	Very high	66 Å²	66	59 Å²	59	46%	0.462	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-12.4	174.1	79.6	0	0	0	0	113.5	R391 D479	R391-S481 PolarHBondContact NH2-O 3.26Å; D479-S481 VanDerWaalsContact CG-OG 3.26Å; D479-S481 PolarHBondContact O-N 3.45Å; D479-S481 VanDerWaalsContact O-N 3.1Å; D479-S481 VanDerWaalsContact OD1-CB 3.25Å; D479-S481 WeakPolarHBondContact OD1-CB 3.48Å; D479-S481 PolarHBondContact OD1-N 3.33Å; D479-S481 PolarHBondContact OD1-OG 2.9Å; D479-S481 PolarHBondContact OD2-OG 3.2Å
482	L	96.4	Very high	95	Very high	27 Å²	27	56.2 Å²	56.2	14%	0.141	30%	0.301	C	S	.	.	S	Bend	trans	-107.6	1.1	-177.1	-55.9	179.9	0	0	0	113.4	A388 R391 P394 L450 D479	A388-L482 HydrophobicContact CB-CD1 4.35Å; R391-L482 HydrophobicContact CG-CD2 3.95Å; P394-L482 WeakPolarHBondContact CG-O 3.41Å; L450-L482 HydrophobicContact CD2-CB 3.96Å; D479-L482 HydrophobicContact CB-CD1 4.01Å; D479-L482 HydrophobicContact CB-CG 4.14Å; D479-L482 PolarHBondContact O-N 3.32Å
483	V	97.3	Very high	95.2	Very high	4 Å²	4	55.5 Å²	55.5	2%	0.024	29%	0.293	C	S	.	.	S	Bend	trans	-81.9	167.8	-176.8	-54.4	0	0	0	0	111.8	P394 L450 L452 L457 T478 R480	P394-V483 WeakPolarHBondContact CG-O 3.31Å; L450-V483 HydrophobicContact CD2-CG1 3.98Å; L452-V483 WeakPolarHBondContact O-CB 3.39Å; L457-V483 HydrophobicContact CD1-CG1 3.73Å; T478-V483 HydrophobicContact CG2-CG1 3.97Å; R480-V483 VanDerWaalsContact O-CG2 3.32Å; R480-V483 WeakPolarHBondContact O-CG2 3.5Å
484	C	96.8	Very high	95.3	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.014	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-60.4	138.7	179.3	-66	0	0	0	0	112.6	N397 L450 L451 L452 N453	N397-C484 HydrophobicContact CB-CB 4.28Å; L450-C484 PolarHBondContact O-N 3.34Å; L450-C484 PolarHBondContact O-SG 3.25Å; L451-C484 VanDerWaalsContact C-SG 3.59Å; L451-C484 PolarHBondContact O-SG 3.3Å; L452-C484 WeakPolarHBondContact O-CB 3.32Å; L452-C484 PolarHBondContact O-N 3.45Å; N453-C484 WeakPolarHBondContact CA-O 3.4Å; N453-C484 HydrophobicContact CB-CB 4.42Å; N453-C484 WeakPolarHBondContact CB-O 3.37Å
485	D	90.9	Very high	95.5	Very high	94 Å²	94	48.3 Å²	48.3	50%	0.503	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-82.3	165.9	170.3	-63.9	-50.1	0	0	0	112.9	N397	N397-D485 PolarHBondContact ND2-O 2.75Å
486	G	90.6	Very high	95.5	Very high	63 Å²	63	49.6 Å²	49.6	65%	0.649	27%	0.266	S	S	*	.	S	Bend	trans	84.9	-166.5	171.6	0	0	0	0	0	114.9	N453 K488	N453-G486 PolarHBondContact ND2-O 2.89Å; G486-K488 PolarHBondContact O-N 3.26Å
487	K	91.9	Very high	95.5	Very high	197 Å²	197	45.8 Å²	45.8	86%	0.857	24%	0.244	S	C	*	.	S	Bend	trans	-73.9	-24.1	-169.7	-65.8	-173.6	179.9	-178.7	0	114.7	N453	N453-K487 VanDerWaalsContact ND2-C 3.25Å; N453-K487 PolarHBondContact ND2-O 3.47Å
488	K	95.5	Very high	95.4	Very high	94 Å²	94	40.9 Å²	40.9	41%	0.409	22%	0.217	S	C	.	.	S	Bend	trans	-141.3	136.5	-177.7	-68.5	179.2	170.4	-172.4	0	109.1	N453 G486 T492 R493 T496	N453-K488 PolarHBondContact ND2-N 2.75Å; G486-K488 PolarHBondContact O-N 3.26Å; K488-T492 HydrophobicContact CB-CG2 4.32Å; K488-T492 HydrophobicContact CD-CG2 3.92Å; K488-T492 HydrophobicContact CG-CG2 4.06Å; K488-R493 HydrophobicContact CB-CG 3.78Å; K488-R493 HydrophobicContact CD-CG 4.29Å; K488-T496 PolarHBondContact NZ-OG1 2.96Å
489	G	97.1	Very high	95.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.			trans	-69.1	169.1	166	0	0	0	0	0	111.9	L451 E456 L491 T492 R493	L451-G489 CarbonylContact O-C 3.47Å; L451-G489 WeakPolarHBondContact O-CA 3.5Å; E456-G489 PolarHBondContact OE1-N 2.56Å; E456-G489 WeakPolarHBondContact OE2-CA 3.5Å; E456-G489 PolarHBondContact OE2-N 3.41Å; G489-L491 VanDerWaalsContact C-N 3.32Å; G489-L491 PolarHBondContact O-N 3.37Å; G489-T492 PolarHBondContact O-N 3.05Å; G489-R493 WeakPolarHBondContact O-CG 3.32Å; G489-R493 PolarHBondContact O-N 3.37Å; G489-R493 VanDerWaalsContact O-N 3.14Å
490	L	96.9	Very high	94.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-38.4	-177	-162.6	52.3	0	0	0	112.3	I393 L396 N397 F400 F434 L438 L451 R493 L494	I393-L490 HydrophobicContact CG2-CD2 4.31Å; L396-L490 HydrophobicContact CB-CD2 4.4Å; N397-L490 HydrophobicContact CB-CB 4.47Å; N397-L490 HydrophobicContact CB-CD1 4.3Å; F400-L490 HydrophobicContact CB-CD1 4.08Å; F400-L490 HydrophobicContact CD2-CD1 3.4Å; F400-L490 VanDerWaalsContact CD2-CD1 3.4Å; F400-L490 HydrophobicContact CE2-CD1 4.05Å; F400-L490 HydrophobicContact CG-CD1 3.95Å; F434-L490 HydrophobicContact CE2-CD2 4.19Å; F434-L490 HydrophobicContact CZ-CD1 3.89Å; F434-L490 HydrophobicContact CZ-CD2 3.99Å; F434-L490 HydrophobicContact CZ-CG 4.16Å; L438-L490 HydrophobicContact CD1-CD2 4.15Å; L438-L490 HydrophobicContact CD1-CG 4.16Å; L438-L490 HydrophobicContact CD2-CD2 3.59Å; L438-L490 HydrophobicContact CD2-CG 4.45Å; L451-L490 HydrophobicContact CD2-CB 4.08Å; L451-L490 HydrophobicContact CD2-CD2 3.88Å; L451-L490 HydrophobicContact CD2-CG 4.3Å; L451-L490 PolarHBondContact O-N 3.29Å; L490-R493 PolarHBondContact O-N 3.24Å; L490-L494 WeakPolarHBondContact O-CB 3.38Å; L490-L494 PolarHBondContact O-N 3.11Å
491	L	98	Very high	94.6	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-63.1	-47.1	177.1	-176.4	62.9	0	0	0	111.9	L451 L452 G489 R493 L494 L495 V515 F518 F530 L531	L451-L491 HydrophobicContact CB-CB 4.26Å; L451-L491 PolarHBondContact O-N 2.62Å; L452-L491 HydrophobicContact CD2-CB 3.87Å; L452-L491 HydrophobicContact CD2-CD2 3.93Å; G489-L491 VanDerWaalsContact C-N 3.32Å; G489-L491 PolarHBondContact O-N 3.37Å; L491-R493 VanDerWaalsContact C-N 3.25Å; L491-R493 PolarHBondContact O-N 3.46Å; L491-L494 WeakPolarHBondContact O-CB 3.34Å; L491-L494 PolarHBondContact O-N 3.07Å; L491-L495 WeakPolarHBondContact O-CG 2.96Å; L491-L495 PolarHBondContact O-N 3.43Å; L491-V515 HydrophobicContact CD1-CG2 4.41Å; L491-F518 HydrophobicContact CD1-CB 4.36Å; L491-F518 HydrophobicContact CD1-CG 4.4Å; L491-F518 HydrophobicContact CD2-CB 4.44Å; L491-F518 HydrophobicContact CD2-CD1 3.59Å; L491-F518 HydrophobicContact CD2-CD2 3.7Å; L491-F518 HydrophobicContact CD2-CE1 3.64Å; L491-F518 HydrophobicContact CD2-CE2 3.75Å; L491-F518 HydrophobicContact CD2-CG 3.63Å; L491-F518 HydrophobicContact CD2-CZ 3.73Å; L491-F530 HydrophobicContact CD2-CE1 4.21Å; L491-L531 HydrophobicContact CD2-CD2 4.01Å; L491-L531 HydrophobicContact CG-CD2 4.32Å
492	T	97.6	Very high	94.1	Very high	11 Å²	11	43.7 Å²	43.7	7%	0.067	22%	0.221	C	C	.	.	H	α-helix	trans	-64.4	-32.1	178	-62.9	0	0	0	0	112.2	E456 K488 G489 T496 R534	E456-T492 WeakPolarHBondContact OE1-CB 3.29Å; E456-T492 PolarHBondContact OE1-OG1 2.86Å; K488-T492 HydrophobicContact CB-CG2 4.32Å; K488-T492 HydrophobicContact CD-CG2 3.92Å; K488-T492 HydrophobicContact CG-CG2 4.06Å; G489-T492 PolarHBondContact O-N 3.05Å; T492-T496 PolarHBondContact O-N 3.33Å; T492-T496 VanDerWaalsContact O-N 3.14Å; T492-T496 PolarHBondContact O-OG1 2.99Å; T492-R534 PolarHBondContact OG1-NE 3.43Å
493	R	96.4	Very high	93.2	Very high	32 Å²	32	45.7 Å²	45.7	12%	0.121	24%	0.236	C	C	.	.	H	α-helix	trans	-71.8	-42.5	175.1	-68.4	173.9	79	-172.9	8.2	111.8	N397 F400 D401 K488 G489 L490 L491 L495 T496 V497	N397-R493 PolarHBondContact O-NH1 3.39Å; N397-R493 WeakPolarHBondContact OD1-CD 3.37Å; N397-R493 PolarHBondContact OD1-NH1 3.44Å; F400-R493 HydrophobicContact CD1-CB 4Å; F400-R493 HydrophobicContact CE1-CB 3.7Å; F400-R493 HydrophobicContact CZ-CB 4Å; D401-R493 IonicContact OD1-NE 3.42Å; D401-R493 IonicContact OD1-NH2 2.98Å; D401-R493 PolarHBondContact OD1-NH2 3.39Å; D401-R493 IonicContact OD2-CZ 3.53Å; D401-R493 IonicContact OD2-NE 3.51Å; D401-R493 IonicContact OD2-NH2 3.77Å; D401-R493 PolarHBondContact OD2-NH2 2.87Å; K488-R493 HydrophobicContact CB-CG 3.78Å; K488-R493 HydrophobicContact CD-CG 4.29Å; G489-R493 WeakPolarHBondContact O-CG 3.32Å; G489-R493 PolarHBondContact O-N 3.37Å; G489-R493 VanDerWaalsContact O-N 3.14Å; L490-R493 PolarHBondContact O-N 3.24Å; L491-R493 VanDerWaalsContact C-N 3.25Å; L491-R493 PolarHBondContact O-N 3.46Å; R493-L495 VanDerWaalsContact C-N 3.31Å; R493-L495 PolarHBondContact O-N 2.87Å; R493-T496 WeakPolarHBondContact O-CA 3.13Å; R493-T496 WeakPolarHBondContact O-CB 3.36Å; R493-T496 PolarHBondContact O-N 3.14Å; R493-V497 PolarHBondContact O-N 3.25Å; R493-V497 VanDerWaalsContact O-N 3.08Å
494	L	96.5	Very high	92.3	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-55.1	-46.1	172	-179.8	59.2	0	0	0	111.5	L435 L438 L490 L491 T496 V497 M498 Q511 A514 V515	L435-L494 HydrophobicContact CD2-CD1 3.49Å; L435-L494 VanDerWaalsContact CD2-CD1 3.49Å; L438-L494 HydrophobicContact CD1-CD2 4.29Å; L490-L494 WeakPolarHBondContact O-CB 3.38Å; L490-L494 PolarHBondContact O-N 3.11Å; L491-L494 WeakPolarHBondContact O-CB 3.34Å; L491-L494 PolarHBondContact O-N 3.07Å; L494-T496 VanDerWaalsContact C-N 3.27Å; L494-T496 PolarHBondContact O-N 3.33Å; L494-V497 HydrophobicContact CD1-CG2 4.16Å; L494-V497 WeakPolarHBondContact O-CG2 3.49Å; L494-V497 PolarHBondContact O-N 2.99Å; L494-M498 VanDerWaalsContact O-CB 3.31Å; L494-M498 WeakPolarHBondContact O-CB 3.11Å; L494-M498 PolarHBondContact O-N 3.41Å; L494-Q511 HydrophobicContact CD1-CB 4.45Å; L494-Q511 HydrophobicContact CD1-CG 4.09Å; L494-A514 HydrophobicContact CD2-CB 3.77Å; L494-V515 HydrophobicContact CD2-CG2 3.68Å; L494-V515 HydrophobicContact CG-CG2 4Å
495	L	96.7	Very high	91.7	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-62.6	-34.2	175.5	-64.9	168	0	0	0	112.9	L491 R493 V497 M498 K499 V515 L531 R534 L536	L491-L495 WeakPolarHBondContact O-CG 2.96Å; L491-L495 PolarHBondContact O-N 3.43Å; R493-L495 VanDerWaalsContact C-N 3.31Å; R493-L495 PolarHBondContact O-N 2.87Å; L495-V497 VanDerWaalsContact C-N 3.35Å; L495-M498 HydrophobicContact CD2-SD 4.46Å; L495-K499 WeakPolarHBondContact O-CD 3.36Å; L495-K499 VanDerWaalsContact O-CG 3.27Å; L495-K499 WeakPolarHBondContact O-CG 3.45Å; L495-K499 PolarHBondContact O-N 3.29Å; L495-V515 HydrophobicContact CD2-CG1 3.92Å; L495-V515 HydrophobicContact CD2-CG2 3.93Å; L495-L531 HydrophobicContact CD1-CD2 3.47Å; L495-L531 VanDerWaalsContact CD1-CD2 3.47Å; L495-L531 HydrophobicContact CD2-CD2 4.31Å; L495-L531 HydrophobicContact CG-CD2 4.41Å; L495-R534 HydrophobicContact CD1-CB 4.2Å; L495-L536 HydrophobicContact CD2-CD1 3.88Å; L495-L536 HydrophobicContact CD2-CD2 4.1Å; L495-L536 HydrophobicContact CD2-CG 4.39Å
496	T	94.6	Very high	91.2	Very high	35 Å²	35	51 Å²	51	22%	0.215	27%	0.269	C	S	.	.	H	α-helix	trans	-67.4	-37.9	178.8	-58.2	0	0	0	0	111.1	K488 T492 R493 L494	K488-T496 PolarHBondContact NZ-OG1 2.96Å; T492-T496 PolarHBondContact O-N 3.33Å; T492-T496 VanDerWaalsContact O-N 3.14Å; T492-T496 PolarHBondContact O-OG1 2.99Å; R493-T496 WeakPolarHBondContact O-CA 3.13Å; R493-T496 WeakPolarHBondContact O-CB 3.36Å; R493-T496 PolarHBondContact O-N 3.14Å; L494-T496 VanDerWaalsContact C-N 3.27Å; L494-T496 PolarHBondContact O-N 3.33Å
497	V	93.2	Very high	91.1	Very high	12 Å²	12	49.1 Å²	49.1	7%	0.073	24%	0.243	C	C	.	.	H	α-helix	trans	-78.7	-40.8	179.2	-59	0	0	0	0	111.9	F400 W405 R493 L494 L495 K499 R500 E501	F400-V497 HydrophobicContact CE1-CG1 3.78Å; F400-V497 HydrophobicContact CZ-CG1 3.86Å; F400-V497 HydrophobicContact CZ-CG2 3.89Å; W405-V497 HydrophobicContact CB-CG1 4.19Å; W405-V497 HydrophobicContact CD2-CB 4.18Å; W405-V497 HydrophobicContact CD2-CG1 4.25Å; W405-V497 HydrophobicContact CD2-CG2 4.07Å; W405-V497 HydrophobicContact CG-CB 4.02Å; W405-V497 HydrophobicContact CG-CG1 3.6Å; W405-V497 HydrophobicContact CG-CG2 4.28Å; W405-V497 HydrophobicContact CZ2-CG2 4.42Å; R493-V497 PolarHBondContact O-N 3.25Å; R493-V497 VanDerWaalsContact O-N 3.08Å; L494-V497 HydrophobicContact CD1-CG2 4.16Å; L494-V497 WeakPolarHBondContact O-CG2 3.49Å; L494-V497 PolarHBondContact O-N 2.99Å; L495-V497 VanDerWaalsContact C-N 3.35Å; V497-K499 PolarHBondContact O-N 2.94Å; V497-R500 CarbonylContact O-C 3.58Å; V497-R500 WeakPolarHBondContact O-CA 3.38Å; V497-R500 PolarHBondContact O-N 3.46Å; V497-E501 PolarHBondContact O-N 3.05Å
498	M	93.5	Very high	91.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-54.1	-41.8	175.7	-179.4	-172.2	-179.7	0	0	112.4	L494 L495 R500 E501 Q511 A512 V515 L536 H539 Y558 L561	L494-M498 VanDerWaalsContact O-CB 3.31Å; L494-M498 WeakPolarHBondContact O-CB 3.11Å; L494-M498 PolarHBondContact O-N 3.41Å; L495-M498 HydrophobicContact CD2-SD 4.46Å; M498-R500 PolarHBondContact O-N 3.16Å; M498-E501 WeakPolarHBondContact O-CB 3.36Å; M498-E501 PolarHBondContact O-N 3.43Å; M498-Q511 HydrophobicContact CB-CB 4.4Å; M498-Q511 HydrophobicContact CG-CB 4.21Å; M498-A512 HydrophobicContact CE-CB 4.41Å; M498-V515 HydrophobicContact SD-CG2 4.15Å; M498-L536 HydrophobicContact CE-CD1 4.01Å; M498-L536 HydrophobicContact SD-CD1 4.02Å; M498-H539 PolarHBondContact O-NE2 3.26Å; M498-Y558 HydrophobicContact CE-CD1 4.38Å; M498-Y558 HydrophobicContact CE-CE1 3.53Å; M498-L561 HydrophobicContact CE-CD2 3.9Å
499	K	92.4	Very high	91	Very high	82 Å²	82	38.4 Å²	38.4	36%	0.357	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.6	177.5	-75.2	174.5	171.2	-131.2	0	115	L495 V497 R534 G535 H539	L495-K499 WeakPolarHBondContact O-CD 3.36Å; L495-K499 VanDerWaalsContact O-CG 3.27Å; L495-K499 WeakPolarHBondContact O-CG 3.45Å; L495-K499 PolarHBondContact O-N 3.29Å; V497-K499 PolarHBondContact O-N 2.94Å; K499-R534 WeakPolarHBondContact CE-O 3.26Å; K499-R534 PolarHBondContact NZ-O 3.49Å; K499-G535 WeakPolarHBondContact CE-O 3.48Å; K499-G535 VanDerWaalsContact NZ-C 3.27Å; K499-G535 PolarHBondContact NZ-O 3.22Å; K499-H539 HydrophobicContact CG-CB 4.35Å
500	R	90.3	Very high	90.8	Very high	164 Å²	164	40.6 Å²	40.6	62%	0.619	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-6.2	-178.8	-65.2	175.6	176.8	168.6	1.3	112.5	V497 M498	V497-R500 CarbonylContact O-C 3.58Å; V497-R500 WeakPolarHBondContact O-CA 3.38Å; V497-R500 PolarHBondContact O-N 3.46Å; M498-R500 PolarHBondContact O-N 3.16Å
501	E	88.6	Confident	90.8	Very high	23 Å²	23	40.6 Å²	40.6	11%	0.107	21%	0.205	C	C	.	.	S	Bend	trans	-63.1	139.8	-178.1	-162	60.9	-144.7	0	0	110.3	W405 V497 M498 S505 F507 R508 Q511	W405-E501 WeakPolarHBondContact CZ2-OE2 3.48Å; V497-E501 PolarHBondContact O-N 3.05Å; M498-E501 WeakPolarHBondContact O-CB 3.36Å; M498-E501 PolarHBondContact O-N 3.43Å; E501-S505 WeakPolarHBondContact OE1-CB 3.23Å; E501-S505 PolarHBondContact OE1-OG 3.36Å; E501-F507 HydrophobicContact CG-CB 4.49Å; E501-R508 HydrophobicContact CB-CG 4.17Å; E501-R508 HydrophobicContact CG-CG 3.74Å; E501-R508 PolarHBondContact O-NH2 2.62Å; E501-Q511 PolarHBondContact OE2-NE2 3.4Å; E501-Q511 VanDerWaalsContact OE2-NE2 3.08Å
502	P	84.4	Confident	90.7	Very high	66 Å²	66	40.4 Å²	40.4	43%	0.429	20%	0.204	S	C	.	.			trans	-61.2	145.6	172.6	-25.4	36.4	0	0	0	112.5	D504 S505 R508	P502-D504 WeakPolarHBondContact CB-OD1 3.4Å; P502-D504 PolarHBondContact O-N 3.39Å; P502-S505 WeakPolarHBondContact O-CB 3.46Å; P502-S505 PolarHBondContact O-N 3.01Å; P502-R508 WeakPolarHBondContact O-CD 3.18Å; P502-R508 PolarHBondContact O-NE 2.93Å
503	P	77.4	Confident	90.7	Very high	69 Å²	69	41.7 Å²	41.7	45%	0.448	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.5	-178.7	-26	35.6	0	0	0	115.5
504	D	78.4	Confident	90.7	Very high	146 Å²	146	40.3 Å²	40.3	78%	0.781	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-6	-177.8	55.8	-29.4	0	0	0	113.9	P502	P502-D504 WeakPolarHBondContact CB-OD1 3.4Å; P502-D504 PolarHBondContact O-N 3.39Å
505	S	84.4	Confident	90.8	Very high	19 Å²	19	40.1 Å²	40.1	13%	0.133	20%	0.202	C	C	.	.			trans	-71	129.6	-177.3	175.3	0	0	0	0	113.4	E501 P502 F507 R508	E501-S505 WeakPolarHBondContact OE1-CB 3.23Å; E501-S505 PolarHBondContact OE1-OG 3.36Å; P502-S505 WeakPolarHBondContact O-CB 3.46Å; P502-S505 PolarHBondContact O-N 3.01Å; S505-F507 PolarHBondContact O-N 3.32Å; S505-F507 WeakPolarHBondContact OG-CB 3.26Å; S505-F507 VanDerWaalsContact OG-CD2 3.32Å; S505-F507 WeakPolarHBondContact OG-CD2 3.39Å; S505-F507 PolarHBondContact OG-N 2.85Å; S505-R508 WeakPolarHBondContact O-CB 3.37Å; S505-R508 PolarHBondContact O-N 3.24Å
506	S	81.4	Confident	90.8	Very high	48 Å²	48	40.1 Å²	40.1	34%	0.336	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-21	172.9	63.3	0	0	0	0	112.9	D423 R508 F509	D423-S506 PolarHBondContact OD1-OG 2.85Å; S506-R508 PolarHBondContact O-N 3.41Å; S506-F509 PolarHBondContact O-N 2.99Å
507	F	88.8	Confident	90.9	Very high	23 Å²	23	38.5 Å²	38.5	10%	0.101	19%	0.192	C	C	.	.	H	α-helix	trans	-65.3	-24.3	176.8	-65.2	-61.9	0	0	0	113.4	W405 I428 K431 I432 L435 E501 S505 F509 W510 Q511	W405-F507 HydrophobicContact CH2-CB 4.2Å; W405-F507 HydrophobicContact CH2-CD1 4.2Å; W405-F507 HydrophobicContact CH2-CD2 4.48Å; W405-F507 HydrophobicContact CH2-CG 4.05Å; I428-F507 HydrophobicContact CB-CZ 4.21Å; I428-F507 HydrophobicContact CG1-CZ 4.03Å; I428-F507 HydrophobicContact CG2-CE1 4.13Å; I428-F507 HydrophobicContact CG2-CZ 3.89Å; K431-F507 HydrophobicContact CB-CD1 4.27Å; K431-F507 HydrophobicContact CB-CE1 3.57Å; K431-F507 HydrophobicContact CB-CZ 4.12Å; K431-F507 HydrophobicContact CD-CE1 4.06Å; K431-F507 HydrophobicContact CD-CE2 4.34Å; K431-F507 HydrophobicContact CD-CZ 3.78Å; K431-F507 HydrophobicContact CG-CE1 4.47Å; I432-F507 HydrophobicContact CG1-CD1 4.27Å; I432-F507 HydrophobicContact CG1-CE1 3.94Å; L435-F507 HydrophobicContact CD1-CD1 4.47Å; E501-F507 HydrophobicContact CG-CB 4.49Å; S505-F507 PolarHBondContact O-N 3.32Å; S505-F507 WeakPolarHBondContact OG-CB 3.26Å; S505-F507 VanDerWaalsContact OG-CD2 3.32Å; S505-F507 WeakPolarHBondContact OG-CD2 3.39Å; S505-F507 PolarHBondContact OG-N 2.85Å; F507-F509 PolarHBondContact O-N 3.31Å; F507-W510 PolarHBondContact O-N 3.18Å; F507-W510 VanDerWaalsContact O-N 3.16Å; F507-Q511 WeakPolarHBondContact O-CB 3.24Å; F507-Q511 VanDerWaalsContact O-CG 3.26Å; F507-Q511 WeakPolarHBondContact O-CG 3.36Å; F507-Q511 PolarHBondContact O-N 3.01Å
508	R	91.3	Very high	91.2	Very high	11 Å²	11	37.9 Å²	37.9	4%	0.042	19%	0.188	C	C	.	.	H	α-helix	trans	-56.6	-39.7	-180	-75.6	-172.3	166.7	-89.1	9.9	112.3	E501 P502 S505 S506 Q511 A512 H539 C543 V554 Y558	E501-R508 HydrophobicContact CB-CG 4.17Å; E501-R508 HydrophobicContact CG-CG 3.74Å; E501-R508 PolarHBondContact O-NH2 2.62Å; P502-R508 WeakPolarHBondContact O-CD 3.18Å; P502-R508 PolarHBondContact O-NE 2.93Å; S505-R508 WeakPolarHBondContact O-CB 3.37Å; S505-R508 PolarHBondContact O-N 3.24Å; S506-R508 PolarHBondContact O-N 3.41Å; R508-Q511 PolarHBondContact O-N 2.9Å; R508-A512 VanDerWaalsContact O-CB 3.31Å; R508-A512 WeakPolarHBondContact O-CB 3.3Å; R508-A512 PolarHBondContact O-N 3.22Å; R508-H539 PolarHBondContact NH1-NE2 3.49Å; R508-C543 PolarHBondContact NH1-SG 3.35Å; R508-V554 HydrophobicContact CB-CG1 3.87Å; R508-V554 HydrophobicContact CB-CG2 4.2Å; R508-Y558 WeakPolarHBondContact CD-OH 3.11Å; R508-Y558 PolarHBondContact NH1-OH 3.39Å
509	F	92.7	Very high	91.3	Very high	54 Å²	54	38.2 Å²	38.2	24%	0.237	19%	0.19	C	C	.	.	H	α-helix	trans	-57.8	-55.3	175.7	169.3	-104.5	0	0	0	111.2	S506 F507 Q511 A512 R513 D553 V554	S506-F509 PolarHBondContact O-N 2.99Å; F507-F509 PolarHBondContact O-N 3.31Å; F509-Q511 PolarHBondContact O-N 3.39Å; F509-A512 PolarHBondContact O-N 2.92Å; F509-R513 HydrophobicContact CD2-CG 4.4Å; F509-R513 HydrophobicContact CE2-CG 4.09Å; F509-R513 HydrophobicContact CZ-CG 4.19Å; F509-R513 VanDerWaalsContact O-CG 3.31Å; F509-R513 WeakPolarHBondContact O-CG 3.49Å; F509-R513 PolarHBondContact O-N 3.08Å; F509-D553 HydrophobicContact CD2-CB 3.88Å; F509-D553 WeakPolarHBondContact CD2-O 3.18Å; F509-D553 HydrophobicContact CE2-CB 4.19Å; F509-D553 HydrophobicContact CG-CB 4.49Å; F509-V554 HydrophobicContact CB-CG2 4.07Å
510	W	94	Very high	91.3	Very high	46 Å²	46	37 Å²	37	17%	0.174	18%	0.183	C	C	.	.	H	α-helix	trans	-66.1	-36.9	-178.4	-67.7	109.2	0	0	0	112.8	I432 L435 R436 F507 A514	I432-W510 HydrophobicContact CG2-CD2 4.18Å; I432-W510 HydrophobicContact CG2-CG 4.42Å; I432-W510 HydrophobicContact CG2-CZ2 4.26Å; L435-W510 HydrophobicContact CB-CB 3.81Å; L435-W510 HydrophobicContact CD1-CB 3.52Å; L435-W510 HydrophobicContact CG-CB 4.29Å; R436-W510 HydrophobicContact CG-CD2 4.29Å; R436-W510 HydrophobicContact CG-CE3 3.56Å; R436-W510 HydrophobicContact CG-CH2 3.88Å; R436-W510 HydrophobicContact CG-CZ3 3.33Å; R436-W510 VanDerWaalsContact NE-CZ2 3.29Å; F507-W510 PolarHBondContact O-N 3.18Å; F507-W510 VanDerWaalsContact O-N 3.16Å; W510-A514 WeakPolarHBondContact O-CB 3.33Å; W510-A514 PolarHBondContact O-N 3.32Å
511	Q	95.9	Very high	91.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.8	-46.5	175.6	-71.6	169.7	-10.1	0	0	111.4	L435 L494 M498 E501 F507 R508 F509 A514 V515	L435-Q511 HydrophobicContact CD1-CG 3.96Å; L435-Q511 HydrophobicContact CD2-CG 4.21Å; L494-Q511 HydrophobicContact CD1-CB 4.45Å; L494-Q511 HydrophobicContact CD1-CG 4.09Å; M498-Q511 HydrophobicContact CB-CB 4.4Å; M498-Q511 HydrophobicContact CG-CB 4.21Å; E501-Q511 PolarHBondContact OE2-NE2 3.4Å; E501-Q511 VanDerWaalsContact OE2-NE2 3.08Å; F507-Q511 WeakPolarHBondContact O-CB 3.24Å; F507-Q511 VanDerWaalsContact O-CG 3.26Å; F507-Q511 WeakPolarHBondContact O-CG 3.36Å; F507-Q511 PolarHBondContact O-N 3.01Å; R508-Q511 PolarHBondContact O-N 2.9Å; F509-Q511 PolarHBondContact O-N 3.39Å; Q511-A514 PolarHBondContact O-N 3Å; Q511-V515 WeakPolarHBondContact O-CG2 3.41Å; Q511-V515 PolarHBondContact O-N 3.24Å
512	A	96.8	Very high	91	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.3	-46.1	178	0	0	0	0	0	111.2	M498 R508 F509 A514 V515 E516 S557 Y558 L561	M498-A512 HydrophobicContact CE-CB 4.41Å; R508-A512 VanDerWaalsContact O-CB 3.31Å; R508-A512 WeakPolarHBondContact O-CB 3.3Å; R508-A512 PolarHBondContact O-N 3.22Å; F509-A512 PolarHBondContact O-N 2.92Å; A512-A514 PolarHBondContact O-N 3.14Å; A512-V515 PolarHBondContact O-N 3.39Å; A512-E516 VanDerWaalsContact O-CB 3.23Å; A512-E516 WeakPolarHBondContact O-CB 3.48Å; A512-E516 PolarHBondContact O-N 2.92Å; A512-S557 WeakPolarHBondContact CB-OG 3.42Å; A512-Y558 HydrophobicContact CB-CD1 4.27Å; A512-Y558 HydrophobicContact CB-CE1 4.2Å; A512-L561 HydrophobicContact CB-CD2 4.27Å
513	R	96.3	Very high	91.3	Very high	38 Å²	38	31.2 Å²	31.2	14%	0.143	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-40.5	177.3	-67.3	-70.8	-70.7	107.8	3	112.8	Q439 F509 E516 S517	Q439-R513 HydrophobicContact CG-CB 4.4Å; Q439-R513 VanDerWaalsContact NE2-NH2 3.12Å; F509-R513 HydrophobicContact CD2-CG 4.4Å; F509-R513 HydrophobicContact CE2-CG 4.09Å; F509-R513 HydrophobicContact CZ-CG 4.19Å; F509-R513 VanDerWaalsContact O-CG 3.31Å; F509-R513 WeakPolarHBondContact O-CG 3.49Å; F509-R513 PolarHBondContact O-N 3.08Å; R513-E516 WeakPolarHBondContact CD-OE2 3.44Å; R513-E516 IonicContact CZ-OE2 3.59Å; R513-E516 IonicContact NE-OE2 2.63Å; R513-E516 IonicContact NH1-OE1 3.5Å; R513-E516 IonicContact NH1-OE2 3.84Å; R513-E516 PolarHBondContact NH1-OE2 2.85Å; R513-E516 PolarHBondContact O-N 2.85Å; R513-S517 WeakPolarHBondContact O-CB 3.33Å; R513-S517 PolarHBondContact O-N 3.34Å
514	A	97.2	Very high	92.1	Very high	3 Å²	3	28.4 Å²	28.4	3%	0.025	16%	0.159	C	C	.	.	H	α-helix	trans	-64.5	-42.8	175.9	0	0	0	0	0	112	L435 L438 L494 W510 Q511 A512 S517	L435-A514 HydrophobicContact CD2-CB 4.35Å; L438-A514 HydrophobicContact CB-CB 4.26Å; L494-A514 HydrophobicContact CD2-CB 3.77Å; W510-A514 WeakPolarHBondContact O-CB 3.33Å; W510-A514 PolarHBondContact O-N 3.32Å; Q511-A514 PolarHBondContact O-N 3Å; A512-A514 PolarHBondContact O-N 3.14Å; A514-S517 PolarHBondContact O-OG 3.32Å
515	V	98.4	Very high	93	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-69.4	-39.9	175.8	178.5	0	0	0	0	111.5	L491 L494 L495 M498 Q511 A512 S517 F518 L531 L536 L561	L491-V515 HydrophobicContact CD1-CG2 4.41Å; L494-V515 HydrophobicContact CD2-CG2 3.68Å; L494-V515 HydrophobicContact CG-CG2 4Å; L495-V515 HydrophobicContact CD2-CG1 3.92Å; L495-V515 HydrophobicContact CD2-CG2 3.93Å; M498-V515 HydrophobicContact SD-CG2 4.15Å; Q511-V515 WeakPolarHBondContact O-CG2 3.41Å; Q511-V515 PolarHBondContact O-N 3.24Å; A512-V515 PolarHBondContact O-N 3.39Å; V515-S517 VanDerWaalsContact C-N 3.32Å; V515-S517 PolarHBondContact O-N 3.49Å; V515-F518 WeakPolarHBondContact O-CB 3.37Å; V515-F518 PolarHBondContact O-N 2.89Å; V515-L531 HydrophobicContact CG1-CD1 4.14Å; V515-L536 HydrophobicContact CG1-CD2 3.71Å; V515-L561 HydrophobicContact CB-CD1 4.26Å; V515-L561 HydrophobicContact CB-CD2 4.31Å; V515-L561 HydrophobicContact CG1-CD1 3.85Å; V515-L561 HydrophobicContact CG1-CD2 4.29Å
516	E	97.8	Very high	93.6	Very high	4 Å²	4	23.6 Å²	23.6	2%	0.019	13%	0.128	C	C	.	.	H	α-helix	trans	-61.2	-43.2	178.2	-176.9	-150.8	161	0	0	111	A512 R513 F518 L519 R520 L561 E564	A512-E516 VanDerWaalsContact O-CB 3.23Å; A512-E516 WeakPolarHBondContact O-CB 3.48Å; A512-E516 PolarHBondContact O-N 2.92Å; R513-E516 WeakPolarHBondContact CD-OE2 3.44Å; R513-E516 IonicContact CZ-OE2 3.59Å; R513-E516 IonicContact NE-OE2 2.63Å; R513-E516 IonicContact NH1-OE1 3.5Å; R513-E516 IonicContact NH1-OE2 3.84Å; R513-E516 PolarHBondContact NH1-OE2 2.85Å; R513-E516 PolarHBondContact O-N 2.85Å; E516-F518 PolarHBondContact O-N 3.47Å; E516-F518 VanDerWaalsContact O-N 3.13Å; E516-L519 WeakPolarHBondContact O-CA 3.38Å; E516-L519 WeakPolarHBondContact O-CB 3.45Å; E516-L519 PolarHBondContact O-N 3.47Å; E516-R520 PolarHBondContact O-N 2.89Å; E516-R520 VanDerWaalsContact O-N 3.1Å; E516-R520 IonicContact OE1-CZ 2.85Å; E516-R520 IonicContact OE1-NE 2.95Å; E516-R520 PolarHBondContact OE1-NE 3.4Å; E516-R520 IonicContact OE1-NH2 3.22Å; E516-R520 PolarHBondContact OE1-NH2 2.92Å; E516-R520 IonicContact OE2-NH2 3.7Å; E516-L561 HydrophobicContact CB-CB 4.17Å; E516-L561 HydrophobicContact CB-CD1 3.9Å; E516-L561 HydrophobicContact CG-CB 4.48Å; E516-E564 HydrophobicContact CG-CG 4.26Å
517	S	96.7	Very high	94.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58.2	-28.1	179.2	72.4	0	0	0	0	113.5	Q439 S442 R513 A514 V515 L519	Q439-S517 WeakPolarHBondContact CA-OG 3.46Å; Q439-S517 WeakPolarHBondContact O-CB 3.33Å; Q439-S517 PolarHBondContact O-OG 3.07Å; S442-S517 CarbonylContact C-O 3.47Å; S442-S517 WeakPolarHBondContact CB-OG 3.35Å; R513-S517 WeakPolarHBondContact O-CB 3.33Å; R513-S517 PolarHBondContact O-N 3.34Å; A514-S517 PolarHBondContact O-OG 3.32Å; V515-S517 VanDerWaalsContact C-N 3.32Å; V515-S517 PolarHBondContact O-N 3.49Å; S517-L519 VanDerWaalsContact C-N 3.34Å
518	F	97.8	Very high	94.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-68.5	-32.7	172.9	178.9	-91	0	0	0	112.5	K448 Y449 L451 L452 L491 V515 E516 D527	K448-F518 HydrophobicContact CB-CD2 3.83Å; K448-F518 HydrophobicContact CB-CE2 4.11Å; K448-F518 HydrophobicContact CD-CD2 4.01Å; K448-F518 HydrophobicContact CD-CE2 4.12Å; K448-F518 HydrophobicContact CD-CG 4.39Å; K448-F518 WeakPolarHBondContact CD-O 3.43Å; K448-F518 HydrophobicContact CG-CD2 4.16Å; K448-F518 HydrophobicContact CG-CE2 4.07Å; K448-F518 PolarHBondContact NZ-O 3.34Å; Y449-F518 HydrophobicContact CD1-CE2 4.4Å; Y449-F518 HydrophobicContact CD1-CZ 4.24Å; Y449-F518 HydrophobicContact CE1-CZ 4.16Å; L451-F518 HydrophobicContact CD1-CD2 4.18Å; L452-F518 HydrophobicContact CD1-CZ 4.22Å; L491-F518 HydrophobicContact CD1-CB 4.36Å; L491-F518 HydrophobicContact CD1-CG 4.4Å; L491-F518 HydrophobicContact CD2-CB 4.44Å; L491-F518 HydrophobicContact CD2-CD1 3.59Å; L491-F518 HydrophobicContact CD2-CD2 3.7Å; L491-F518 HydrophobicContact CD2-CE1 3.64Å; L491-F518 HydrophobicContact CD2-CE2 3.75Å; L491-F518 HydrophobicContact CD2-CG 3.63Å; L491-F518 HydrophobicContact CD2-CZ 3.73Å; V515-F518 WeakPolarHBondContact O-CB 3.37Å; V515-F518 PolarHBondContact O-N 2.89Å; E516-F518 PolarHBondContact O-N 3.47Å; E516-F518 VanDerWaalsContact O-N 3.13Å; F518-D527 HydrophobicContact CE1-CB 3.97Å
519	L	96.4	Very high	95.2	Very high	7 Å²	7	20.9 Å²	20.9	4%	0.037	11%	0.111	C	C	.	.	H	α-helix	trans	-82.5	-22.4	178.3	-68.4	174.5	0	0	0	113.3	E516 S517 D527 Q528 L531 L561 E564 L565	E516-L519 WeakPolarHBondContact O-CA 3.38Å; E516-L519 WeakPolarHBondContact O-CB 3.45Å; E516-L519 PolarHBondContact O-N 3.47Å; S517-L519 VanDerWaalsContact C-N 3.34Å; L519-D527 HydrophobicContact CD2-CB 4.09Å; L519-Q528 HydrophobicContact CD2-CG 4.12Å; L519-L531 HydrophobicContact CD1-CD1 3.76Å; L519-L531 HydrophobicContact CD2-CD1 3.68Å; L519-L531 HydrophobicContact CG-CD1 3.72Å; L519-L561 HydrophobicContact CD1-CD1 3.99Å; L519-E564 HydrophobicContact CB-CB 3.83Å; L519-E564 HydrophobicContact CD1-CB 4.07Å; L519-L565 HydrophobicContact CD1-CB 4.03Å; L519-L565 HydrophobicContact CD1-CD1 4.15Å
520	R	92.6	Very high	95.5	Very high	56 Å²	56	18.3 Å²	18.3	21%	0.211	10%	0.099	C	C	.	.			trans	-64.1	152.6	178.7	-73.5	-179.5	173.6	-162.6	-4.3	112.7	D443 E516 E564	D443-R520 WeakPolarHBondContact OD1-CD 3.4Å; D443-R520 IonicContact OD1-CZ 2.64Å; D443-R520 IonicContact OD1-NE 2.99Å; D443-R520 IonicContact OD1-NH1 3.87Å; D443-R520 PolarHBondContact OD1-NH1 3.28Å; E516-R520 PolarHBondContact O-N 2.89Å; E516-R520 VanDerWaalsContact O-N 3.1Å; E516-R520 IonicContact OE1-CZ 2.85Å; E516-R520 IonicContact OE1-NE 2.95Å; E516-R520 PolarHBondContact OE1-NE 3.4Å; E516-R520 IonicContact OE1-NH2 3.22Å; E516-R520 PolarHBondContact OE1-NH2 2.92Å; E516-R520 IonicContact OE2-NH2 3.7Å; R520-E564 HydrophobicContact CG-CG 4.45Å
521	G	86.9	Confident	95.7	Very high	14 Å²	14	16.1 Å²	16.1	14%	0.144	9%	0.091	C	C	.	.	S	Bend	trans	107.7	-148.3	-171.2	0	0	0	0	0	112
522	A	85.6	Confident	95.8	Very high	75 Å²	75	16.1 Å²	16.1	62%	0.62	9%	0.091	S	C	*	.	S	Bend	trans	-65.5	133.5	172.7	0	0	0	0	0	110.3	S524	A522-S524 PolarHBondContact O-N 3.08Å
523	T	90.8	Very high	95.9	Very high	42 Å²	42	21 Å²	21	26%	0.258	11%	0.112	S	C	.	.			trans	-67.5	121.6	-177.2	-53.2	0	0	0	0	110.6	K567 F568	T523-K567 WeakPolarHBondContact OG1-CE 3.39Å; T523-F568 HydrophobicContact CG2-CD2 4.23Å
524	S	94.5	Very high	96	Very high	11 Å²	11	21.9 Å²	21.9	8%	0.077	12%	0.115	C	C	.	.			trans	-114.7	115.7	179.5	170	0	0	0	0	110.8	A522 A526 D527 Q528	A522-S524 PolarHBondContact O-N 3.08Å; S524-A526 VanDerWaalsContact C-N 3.25Å; S524-A526 PolarHBondContact O-N 2.9Å; S524-A526 PolarHBondContact OG-N 3.23Å; S524-D527 WeakPolarHBondContact CB-OD2 3.28Å; S524-D527 PolarHBondContact O-N 3.42Å; S524-D527 PolarHBondContact OG-N 3.07Å; S524-D527 VanDerWaalsContact OG-N 3.13Å; S524-D527 PolarHBondContact OG-OD1 2.91Å; S524-Q528 WeakPolarHBondContact O-CG 3.48Å; S524-Q528 PolarHBondContact O-N 3.05Å; S524-Q528 VanDerWaalsContact O-N 3.11Å
525	Y	96.7	Very high	96	Very high	63 Å²	63	22.4 Å²	22.4	25%	0.247	12%	0.122	C	C	.	.	H	α-helix	trans	-60.5	-37.5	173.8	175.5	-91.4	0	0	0	111.4	I463 A467 I469 Q528 M529 N569 D571	I463-Y525 HydrophobicContact CG2-CD1 4.35Å; I463-Y525 HydrophobicContact CG2-CE1 4.23Å; A467-Y525 HydrophobicContact CB-CD1 4Å; A467-Y525 HydrophobicContact CB-CE1 3.6Å; I469-Y525 HydrophobicContact CD1-CD1 3.73Å; I469-Y525 HydrophobicContact CD1-CG 4.15Å; Y525-Q528 PolarHBondContact O-N 3.42Å; Y525-M529 HydrophobicContact CD1-CG 3.91Å; Y525-M529 HydrophobicContact CD2-CG 4.27Å; Y525-M529 HydrophobicContact CE1-CB 4.48Å; Y525-M529 HydrophobicContact CE1-CG 3.45Å; Y525-M529 VanDerWaalsContact CE1-CG 3.45Å; Y525-M529 HydrophobicContact CE2-CG 3.84Å; Y525-M529 HydrophobicContact CE2-SD 4.2Å; Y525-M529 HydrophobicContact CG-CG 4.3Å; Y525-M529 VanDerWaalsContact CZ-CG 3.41Å; Y525-M529 VanDerWaalsContact O-CB 3.31Å; Y525-M529 WeakPolarHBondContact O-CB 3.27Å; Y525-M529 VanDerWaalsContact O-CG 3.27Å; Y525-M529 WeakPolarHBondContact O-CG 3.45Å; Y525-M529 PolarHBondContact O-N 3.48Å; Y525-N569 VanDerWaalsContact CD2-ND2 3.33Å; Y525-N569 WeakPolarHBondContact CD2-ND2 3.48Å; Y525-D571 PolarHBondContact OH-OD2 3.48Å
526	A	97.8	Very high	96	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.008	12%	0.122	C	C	.	.	H	α-helix	trans	-64.1	-45	178.7	0	0	0	0	0	112.1	L460 I463 S464 S524 M529 F530	L460-A526 HydrophobicContact CD2-CB 4.14Å; L460-A526 WeakPolarHBondContact CD2-O 3.34Å; I463-A526 HydrophobicContact CB-CB 4.39Å; I463-A526 HydrophobicContact CG2-CB 4.09Å; S464-A526 WeakPolarHBondContact OG-CB 3.22Å; S524-A526 VanDerWaalsContact C-N 3.25Å; S524-A526 PolarHBondContact O-N 2.9Å; S524-A526 PolarHBondContact OG-N 3.23Å; A526-M529 PolarHBondContact O-N 3.22Å; A526-F530 WeakPolarHBondContact O-CB 3.41Å; A526-F530 PolarHBondContact O-N 3.29Å
527	D	97.8	Very high	96	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.011	12%	0.121	C	C	.	.	H	α-helix	trans	-62.2	-46.5	178.4	-63	6.3	0	0	0	110.7	K448 Y449 F518 L519 S524 F530 L531	K448-D527 IonicContact NZ-OD2 3.16Å; K448-D527 PolarHBondContact NZ-OD2 3.47Å; Y449-D527 WeakPolarHBondContact CE1-OD1 3.34Å; Y449-D527 PolarHBondContact OH-OD1 2.97Å; Y449-D527 PolarHBondContact OH-OD2 2.91Å; Y449-D527 VanDerWaalsContact OH-OD2 3.06Å; F518-D527 HydrophobicContact CE1-CB 3.97Å; L519-D527 HydrophobicContact CD2-CB 4.09Å; S524-D527 WeakPolarHBondContact CB-OD2 3.28Å; S524-D527 PolarHBondContact O-N 3.42Å; S524-D527 PolarHBondContact OG-N 3.07Å; S524-D527 VanDerWaalsContact OG-N 3.13Å; S524-D527 PolarHBondContact OG-OD1 2.91Å; D527-F530 WeakPolarHBondContact O-CB 3.48Å; D527-F530 PolarHBondContact O-N 3.07Å; D527-L531 PolarHBondContact O-N 3.19Å
528	Q	98.5	Very high	96.1	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.019	13%	0.133	C	C	.	.	H	α-helix	trans	-60.7	-48.7	176.5	-70.1	169.8	-28.1	0	0	111.2	L519 S524 Y525 F530 L531 L532 E564 L565 K567 N569	L519-Q528 HydrophobicContact CD2-CG 4.12Å; S524-Q528 WeakPolarHBondContact O-CG 3.48Å; S524-Q528 PolarHBondContact O-N 3.05Å; S524-Q528 VanDerWaalsContact O-N 3.11Å; Y525-Q528 PolarHBondContact O-N 3.42Å; Q528-F530 VanDerWaalsContact C-N 3.3Å; Q528-F530 PolarHBondContact O-N 3.22Å; Q528-L531 PolarHBondContact O-N 2.88Å; Q528-L531 VanDerWaalsContact O-N 3.14Å; Q528-L532 VanDerWaalsContact O-CG 3.27Å; Q528-L532 WeakPolarHBondContact O-CG 3.33Å; Q528-L532 PolarHBondContact O-N 2.9Å; Q528-E564 PolarHBondContact NE2-O 3.25Å; Q528-L565 HydrophobicContact CB-CD1 4.36Å; Q528-L565 WeakPolarHBondContact CG-O 3.5Å; Q528-L565 PolarHBondContact NE2-O 3.22Å; Q528-K567 PolarHBondContact NE2-O 3.15Å; Q528-N569 PolarHBondContact OE1-ND2 3.38Å
529	M	98.6	Very high	96	Very high	19 Å²	19	25.8 Å²	25.8	9%	0.094	14%	0.137	C	C	.	.	H	α-helix	trans	-63.3	-34.7	-179.8	-77.4	-56.9	-68	0	0	113.1	I463 Y525 A526 L531 L532 K533 D571	I463-M529 HydrophobicContact CD1-CB 4.25Å; I463-M529 HydrophobicContact CG2-CB 3.8Å; I463-M529 HydrophobicContact CG2-CG 4.31Å; Y525-M529 HydrophobicContact CD1-CG 3.91Å; Y525-M529 HydrophobicContact CD2-CG 4.27Å; Y525-M529 HydrophobicContact CE1-CB 4.48Å; Y525-M529 HydrophobicContact CE1-CG 3.45Å; Y525-M529 VanDerWaalsContact CE1-CG 3.45Å; Y525-M529 HydrophobicContact CE2-CG 3.84Å; Y525-M529 HydrophobicContact CE2-SD 4.2Å; Y525-M529 HydrophobicContact CG-CG 4.3Å; Y525-M529 VanDerWaalsContact CZ-CG 3.41Å; Y525-M529 VanDerWaalsContact O-CB 3.31Å; Y525-M529 WeakPolarHBondContact O-CB 3.27Å; Y525-M529 VanDerWaalsContact O-CG 3.27Å; Y525-M529 WeakPolarHBondContact O-CG 3.45Å; Y525-M529 PolarHBondContact O-N 3.48Å; A526-M529 PolarHBondContact O-N 3.22Å; M529-L531 VanDerWaalsContact C-N 3.3Å; M529-L531 PolarHBondContact O-N 3.35Å; M529-L532 PolarHBondContact O-N 3.35Å; M529-L532 HydrophobicContact SD-CD1 3.62Å; M529-K533 WeakPolarHBondContact O-CB 3.31Å; M529-K533 VanDerWaalsContact O-CG 3.27Å; M529-K533 WeakPolarHBondContact O-CG 3.1Å; M529-K533 PolarHBondContact O-N 3.22Å; M529-D571 HydrophobicContact CE-CB 4.27Å; M529-D571 HydrophobicContact SD-CB 3.72Å
530	F	98.6	Very high	96	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.5	-41.6	174.1	176.7	-91.1	0	0	0	112	L452 E456 E459 L460 I463 L491 A526 D527 Q528 R534	L452-F530 HydrophobicContact CD2-CE1 3.92Å; L452-F530 HydrophobicContact CD2-CZ 3.8Å; E456-F530 HydrophobicContact CB-CE2 3.71Å; E456-F530 HydrophobicContact CB-CZ 3.85Å; E456-F530 HydrophobicContact CG-CE2 3.91Å; E456-F530 HydrophobicContact CG-CZ 3.84Å; E459-F530 HydrophobicContact CB-CD2 4.47Å; E459-F530 HydrophobicContact CG-CD2 4.39Å; E459-F530 WeakPolarHBondContact OE2-CE2 3.36Å; L460-F530 HydrophobicContact CD2-CB 3.56Å; L460-F530 HydrophobicContact CD2-CD2 4.06Å; L460-F530 HydrophobicContact CD2-CG 3.97Å; L460-F530 HydrophobicContact CG-CD2 4.2Å; I463-F530 HydrophobicContact CD1-CB 4.12Å; L491-F530 HydrophobicContact CD2-CE1 4.21Å; A526-F530 WeakPolarHBondContact O-CB 3.41Å; A526-F530 PolarHBondContact O-N 3.29Å; D527-F530 WeakPolarHBondContact O-CB 3.48Å; D527-F530 PolarHBondContact O-N 3.07Å; Q528-F530 VanDerWaalsContact C-N 3.3Å; Q528-F530 PolarHBondContact O-N 3.22Å; F530-R534 VanDerWaalsContact CD2-NH1 3.25Å; F530-R534 VanDerWaalsContact CE2-NH1 3.27Å; F530-R534 WeakPolarHBondContact O-CD 3.26Å; F530-R534 PolarHBondContact O-N 2.58Å; F530-R534 PolarHBondContact O-NH1 2.62Å
531	L	98.6	Very high	96.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-76	-38.4	176.5	-61.7	-177.8	0	0	0	112.6	L491 L495 V515 L519 D527 Q528 M529 K533 R534 G535 L536 L565	L491-L531 HydrophobicContact CD2-CD2 4.01Å; L491-L531 HydrophobicContact CG-CD2 4.32Å; L495-L531 HydrophobicContact CD1-CD2 3.47Å; L495-L531 VanDerWaalsContact CD1-CD2 3.47Å; L495-L531 HydrophobicContact CD2-CD2 4.31Å; L495-L531 HydrophobicContact CG-CD2 4.41Å; V515-L531 HydrophobicContact CG1-CD1 4.14Å; L519-L531 HydrophobicContact CD1-CD1 3.76Å; L519-L531 HydrophobicContact CD2-CD1 3.68Å; L519-L531 HydrophobicContact CG-CD1 3.72Å; D527-L531 PolarHBondContact O-N 3.19Å; Q528-L531 PolarHBondContact O-N 2.88Å; Q528-L531 VanDerWaalsContact O-N 3.14Å; M529-L531 VanDerWaalsContact C-N 3.3Å; M529-L531 PolarHBondContact O-N 3.35Å; L531-K533 PolarHBondContact O-N 2.86Å; L531-R534 CarbonylContact O-C 3.6Å; L531-R534 WeakPolarHBondContact O-CA 3.38Å; L531-R534 WeakPolarHBondContact O-CB 3.31Å; L531-R534 PolarHBondContact O-N 2.86Å; L531-R534 VanDerWaalsContact O-N 3.08Å; L531-G535 PolarHBondContact O-N 3.46Å; L531-L536 HydrophobicContact CB-CB 4.29Å; L531-L536 HydrophobicContact CB-CD2 3.87Å; L531-L536 HydrophobicContact CD1-CD2 3.84Å; L531-L536 HydrophobicContact CG-CD2 4.31Å; L531-L536 WeakPolarHBondContact O-CB 3.21Å; L531-L536 PolarHBondContact O-N 3.25Å; L531-L565 HydrophobicContact CB-CD1 3.89Å; L531-L565 HydrophobicContact CD1-CD1 4.36Å
532	L	98.6	Very high	96.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.9	-43	174.2	-69.8	170.4	0	0	0	111.4	Q528 M529 R534 G535 L537 L565 A572 R575	Q528-L532 VanDerWaalsContact O-CG 3.27Å; Q528-L532 WeakPolarHBondContact O-CG 3.33Å; Q528-L532 PolarHBondContact O-N 2.9Å; M529-L532 PolarHBondContact O-N 3.35Å; M529-L532 HydrophobicContact SD-CD1 3.62Å; L532-R534 PolarHBondContact O-N 3.42Å; L532-G535 WeakPolarHBondContact O-CA 3.33Å; L532-G535 PolarHBondContact O-N 3.35Å; L532-L537 HydrophobicContact CD2-CB 3.55Å; L532-L537 HydrophobicContact CD2-CD1 3.73Å; L532-L537 HydrophobicContact CD2-CG 4.29Å; L532-L565 HydrophobicContact CD2-CD1 4.15Å; L532-L565 HydrophobicContact CD2-CD2 4.01Å; L532-L565 HydrophobicContact CD2-CG 3.99Å; L532-L565 HydrophobicContact CG-CD1 4.04Å; L532-L565 HydrophobicContact CG-CG 4.4Å; L532-A572 HydrophobicContact CD1-CB 3.88Å; L532-A572 HydrophobicContact CD2-CB 4.25Å; L532-R575 PolarHBondContact O-NH1 3.41Å
533	K	98.1	Very high	97	Very high	103 Å²	103	22.2 Å²	22.2	45%	0.448	11%	0.108	S	C	.	.	H	α-helix	trans	-61.1	-27.2	174.6	-76.9	177.1	-179.9	-178.1	0	113	E459 I463 M529 L531 G535	E459-K533 WeakPolarHBondContact OE1-CD 3.29Å; E459-K533 IonicContact OE1-NZ 2.7Å; I463-K533 HydrophobicContact CD1-CD 4.31Å; M529-K533 WeakPolarHBondContact O-CB 3.31Å; M529-K533 VanDerWaalsContact O-CG 3.27Å; M529-K533 WeakPolarHBondContact O-CG 3.1Å; M529-K533 PolarHBondContact O-N 3.22Å; L531-K533 PolarHBondContact O-N 2.86Å; K533-G535 VanDerWaalsContact C-N 3.26Å
534	R	97.7	Very high	97.1	Very high	55 Å²	55	20.5 Å²	20.5	21%	0.208	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	3	174.3	-71.9	162.9	177.1	60.7	7.6	112.8	E456 E459 T492 L495 K499 F530 L531 L532	E456-R534 IonicContact OE1-NH2 2.79Å; E459-R534 IonicContact OE1-NH1 2.69Å; E459-R534 PolarHBondContact OE1-NH1 3.27Å; E459-R534 VanDerWaalsContact OE1-NH1 3.16Å; E459-R534 IonicContact OE2-CZ 3.53Å; E459-R534 IonicContact OE2-NH1 3.54Å; E459-R534 PolarHBondContact OE2-NH1 3.44Å; E459-R534 IonicContact OE2-NH2 2.72Å; E459-R534 PolarHBondContact OE2-NH2 3.44Å; T492-R534 PolarHBondContact OG1-NE 3.43Å; L495-R534 HydrophobicContact CD1-CB 4.2Å; K499-R534 WeakPolarHBondContact CE-O 3.26Å; K499-R534 PolarHBondContact NZ-O 3.49Å; F530-R534 VanDerWaalsContact CD2-NH1 3.25Å; F530-R534 VanDerWaalsContact CE2-NH1 3.27Å; F530-R534 WeakPolarHBondContact O-CD 3.26Å; F530-R534 PolarHBondContact O-N 2.58Å; F530-R534 PolarHBondContact O-NH1 2.62Å; L531-R534 CarbonylContact O-C 3.6Å; L531-R534 WeakPolarHBondContact O-CA 3.38Å; L531-R534 WeakPolarHBondContact O-CB 3.31Å; L531-R534 PolarHBondContact O-N 2.86Å; L531-R534 VanDerWaalsContact O-N 3.08Å; L532-R534 PolarHBondContact O-N 3.42Å
535	G	97.9	Very high	97.1	Very high	15 Å²	15	21.1 Å²	21.1	16%	0.155	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	32.7	174.4	0	0	0	0	0	113.9	K499 L531 L532 K533 E538 H539	K499-G535 WeakPolarHBondContact CE-O 3.48Å; K499-G535 VanDerWaalsContact NZ-C 3.27Å; K499-G535 PolarHBondContact NZ-O 3.22Å; L531-G535 PolarHBondContact O-N 3.46Å; L532-G535 WeakPolarHBondContact O-CA 3.33Å; L532-G535 PolarHBondContact O-N 3.35Å; K533-G535 VanDerWaalsContact C-N 3.26Å; G535-E538 VanDerWaalsContact C-OE2 3.3Å; G535-E538 WeakPolarHBondContact CA-OE2 3.39Å; G535-H539 PolarHBondContact O-N 3.26Å
536	L	98.4	Very high	96.8	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-69.2	-42.8	-178.7	177.7	58.5	0	0	0	111.9	L495 M498 V515 L531 E538 H539 I540 L561 L565	L495-L536 HydrophobicContact CD2-CD1 3.88Å; L495-L536 HydrophobicContact CD2-CD2 4.1Å; L495-L536 HydrophobicContact CD2-CG 4.39Å; M498-L536 HydrophobicContact CE-CD1 4.01Å; M498-L536 HydrophobicContact SD-CD1 4.02Å; V515-L536 HydrophobicContact CG1-CD2 3.71Å; L531-L536 HydrophobicContact CB-CB 4.29Å; L531-L536 HydrophobicContact CB-CD2 3.87Å; L531-L536 HydrophobicContact CD1-CD2 3.84Å; L531-L536 HydrophobicContact CG-CD2 4.31Å; L531-L536 WeakPolarHBondContact O-CB 3.21Å; L531-L536 PolarHBondContact O-N 3.25Å; L536-E538 PolarHBondContact O-N 2.98Å; L536-H539 WeakPolarHBondContact O-CB 3.41Å; L536-H539 PolarHBondContact O-N 3.5Å; L536-I540 HydrophobicContact CD1-CD1 3.94Å; L536-I540 HydrophobicContact CD1-CG1 4.06Å; L536-I540 HydrophobicContact CD2-CD1 4.41Å; L536-I540 HydrophobicContact CG-CD1 3.76Å; L536-I540 HydrophobicContact CG-CG1 4.35Å; L536-I540 WeakPolarHBondContact O-CG1 3.47Å; L536-I540 PolarHBondContact O-N 2.65Å; L536-L561 HydrophobicContact CD1-CD2 4.27Å; L536-L561 HydrophobicContact CD2-CD1 4.3Å; L536-L561 HydrophobicContact CD2-CD2 4.4Å; L536-L565 HydrophobicContact CB-CD2 4.21Å; L536-L565 HydrophobicContact CD2-CD1 4.47Å; L536-L565 HydrophobicContact CD2-CD2 4.04Å; L536-L565 HydrophobicContact CG-CD2 3.97Å
537	L	98.4	Very high	96	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.3	-47.7	-177.8	178.4	150.9	0	0	0	111.6	L532 H539 I540 L541 L562 L565 M566 A572 R575	L532-L537 HydrophobicContact CD2-CB 3.55Å; L532-L537 HydrophobicContact CD2-CD1 3.73Å; L532-L537 HydrophobicContact CD2-CG 4.29Å; L537-H539 PolarHBondContact O-N 3.04Å; L537-I540 PolarHBondContact O-N 2.88Å; L537-L541 HydrophobicContact CD2-CD1 3.49Å; L537-L541 VanDerWaalsContact CD2-CD1 3.49Å; L537-L541 HydrophobicContact CD2-CG 4.27Å; L537-L541 HydrophobicContact CG-CD1 4.28Å; L537-L541 WeakPolarHBondContact O-CG 3.38Å; L537-L541 PolarHBondContact O-N 2.63Å; L537-L562 HydrophobicContact CG-CD1 4.28Å; L537-L565 HydrophobicContact CB-CD2 3.79Å; L537-M566 HydrophobicContact CD1-CG 4.04Å; L537-M566 HydrophobicContact CD1-SD 4.35Å; L537-A572 HydrophobicContact CD1-CB 4.1Å; L537-A572 WeakPolarHBondContact CD1-O 3.23Å; L537-R575 HydrophobicContact CD1-CB 4.32Å; L537-R575 HydrophobicContact CD2-CB 3.99Å
538	E	97.6	Very high	95	Very high	55 Å²	55	26.3 Å²	26.3	26%	0.257	15%	0.149	S	C	.	.	H	α-helix	trans	-63.4	-34	180	-60.2	82.1	176.8	0	0	111.2	G535 L536 L542 R575 Y579	G535-E538 VanDerWaalsContact C-OE2 3.3Å; G535-E538 WeakPolarHBondContact CA-OE2 3.39Å; L536-E538 PolarHBondContact O-N 2.98Å; E538-L542 WeakPolarHBondContact O-CB 3.36Å; E538-L542 PolarHBondContact O-N 3.47Å; E538-R575 IonicContact OE1-NH1 2.85Å; E538-R575 PolarHBondContact OE1-NH1 3.21Å; E538-Y579 HydrophobicContact CB-CD2 3.99Å; E538-Y579 HydrophobicContact CB-CE2 4.19Å; E538-Y579 HydrophobicContact CG-CD2 4.14Å
539	H	96.5	Very high	94.1	Very high	18 Å²	18	26.9 Å²	26.9	8%	0.083	15%	0.153	C	C	.	.	H	α-helix	trans	-68.4	-43.8	174.7	178.5	67.7	0	0	0	112.5	M498 K499 R508 G535 L536 L537 L541 L542 C543	M498-H539 PolarHBondContact O-NE2 3.26Å; K499-H539 HydrophobicContact CG-CB 4.35Å; R508-H539 PolarHBondContact NH1-NE2 3.49Å; G535-H539 PolarHBondContact O-N 3.26Å; L536-H539 WeakPolarHBondContact O-CB 3.41Å; L536-H539 PolarHBondContact O-N 3.5Å; L537-H539 PolarHBondContact O-N 3.04Å; H539-L541 VanDerWaalsContact C-N 3.35Å; H539-L542 WeakPolarHBondContact O-CB 3.22Å; H539-L542 PolarHBondContact O-N 2.97Å; H539-C543 PolarHBondContact O-N 3.04Å; H539-C543 PolarHBondContact O-SG 3.42Å
540	I	96.8	Very high	93.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.7	-45	178.1	-64.7	162.7	0	0	0	110.4	L536 L537 L542 C543 I544 Y558 L561 L562 L565	L536-I540 HydrophobicContact CD1-CD1 3.94Å; L536-I540 HydrophobicContact CD1-CG1 4.06Å; L536-I540 HydrophobicContact CD2-CD1 4.41Å; L536-I540 HydrophobicContact CG-CD1 3.76Å; L536-I540 HydrophobicContact CG-CG1 4.35Å; L536-I540 WeakPolarHBondContact O-CG1 3.47Å; L536-I540 PolarHBondContact O-N 2.65Å; L537-I540 PolarHBondContact O-N 2.88Å; I540-L542 VanDerWaalsContact C-N 3.34Å; I540-L542 PolarHBondContact O-N 3.33Å; I540-C543 WeakPolarHBondContact O-CB 3.37Å; I540-C543 PolarHBondContact O-N 3.35Å; I540-I544 HydrophobicContact CG2-CD1 3.66Å; I540-I544 HydrophobicContact CG2-CG1 4.32Å; I540-I544 WeakPolarHBondContact O-CG1 3.39Å; I540-I544 PolarHBondContact O-N 3.01Å; I540-Y558 HydrophobicContact CB-CD1 4.37Å; I540-Y558 HydrophobicContact CG1-CD1 4.01Å; I540-Y558 HydrophobicContact CG1-CE1 4.44Å; I540-Y558 HydrophobicContact CG2-CD1 3.94Å; I540-Y558 HydrophobicContact CG2-CG 4.19Å; I540-L561 HydrophobicContact CD1-CB 4.41Å; I540-L561 HydrophobicContact CD1-CD2 3.68Å; I540-L561 HydrophobicContact CD1-CG 3.64Å; I540-L561 HydrophobicContact CG1-CD2 4.18Å; I540-L562 HydrophobicContact CG2-CB 4.03Å; I540-L562 HydrophobicContact CG2-CD1 4.32Å; I540-L562 HydrophobicContact CG2-CD2 4.47Å; I540-L565 HydrophobicContact CD1-CD2 4.11Å
541	L	96.8	Very high	92.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.4	-38.9	178.1	-66.5	178.3	0	0	0	112.2	L537 H539 C543 I544 I545 L562 F576 Y579 V580 F589	L537-L541 HydrophobicContact CD2-CD1 3.49Å; L537-L541 VanDerWaalsContact CD2-CD1 3.49Å; L537-L541 HydrophobicContact CD2-CG 4.27Å; L537-L541 HydrophobicContact CG-CD1 4.28Å; L537-L541 WeakPolarHBondContact O-CG 3.38Å; L537-L541 PolarHBondContact O-N 2.63Å; H539-L541 VanDerWaalsContact C-N 3.35Å; L541-C543 PolarHBondContact O-N 3.23Å; L541-I544 PolarHBondContact O-N 3.15Å; L541-I545 HydrophobicContact CB-CD1 4.38Å; L541-I545 HydrophobicContact CD2-CD1 4.39Å; L541-I545 VanDerWaalsContact O-CB 3.28Å; L541-I545 WeakPolarHBondContact O-CB 3.35Å; L541-I545 WeakPolarHBondContact O-CG1 3.11Å; L541-I545 PolarHBondContact O-N 3.47Å; L541-L562 HydrophobicContact CD2-CD2 3.88Å; L541-F576 HydrophobicContact CD1-CD2 3.78Å; L541-F576 HydrophobicContact CD1-CE2 4.3Å; L541-F576 HydrophobicContact CD1-CG 4.44Å; L541-F576 HydrophobicContact CD2-CD2 3.77Å; L541-F576 HydrophobicContact CD2-CE2 3.64Å; L541-F576 HydrophobicContact CG-CD2 4.4Å; L541-Y579 HydrophobicContact CB-CD1 3.55Å; L541-Y579 HydrophobicContact CB-CE1 3.61Å; L541-Y579 HydrophobicContact CB-CG 4.06Å; L541-Y579 HydrophobicContact CD1-CD1 3.77Å; L541-Y579 HydrophobicContact CD1-CG 3.76Å; L541-Y579 HydrophobicContact CG-CD1 4.31Å; L541-V580 HydrophobicContact CD1-CG2 4.16Å; L541-F589 HydrophobicContact CD2-CD2 4.24Å; L541-F589 HydrophobicContact CD2-CE2 3.9Å
542	L	95.1	Very high	92.2	Very high	77 Å²	77	40.7 Å²	40.7	40%	0.403	23%	0.227	S	C	.	.	I	π-helix	trans	-57.2	-41	171	-177.8	139.2	0	0	0	111.3	E538 H539 I540 D546 S547 Y579	E538-L542 WeakPolarHBondContact O-CB 3.36Å; E538-L542 PolarHBondContact O-N 3.47Å; H539-L542 WeakPolarHBondContact O-CB 3.22Å; H539-L542 PolarHBondContact O-N 2.97Å; I540-L542 VanDerWaalsContact C-N 3.34Å; I540-L542 PolarHBondContact O-N 3.33Å; L542-D546 HydrophobicContact CG-CB 4.37Å; L542-D546 CarbonylContact O-C 3.6Å; L542-D546 WeakPolarHBondContact O-CA 3.26Å; L542-D546 PolarHBondContact O-N 2.91Å; L542-S547 PolarHBondContact O-N 2.75Å; L542-Y579 WeakPolarHBondContact CA-OH 3.32Å; L542-Y579 VanDerWaalsContact CB-OH 3.27Å; L542-Y579 WeakPolarHBondContact CB-OH 3.35Å; L542-Y579 PolarHBondContact N-OH 3.48Å
543	C	92.8	Very high	91.8	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.007	25%	0.251	C	S	.	.	I	π-helix	trans	-68.7	-44.9	178.6	-62.2	0	0	0	0	112.1	R508 H539 I540 L541 S547 Y558	R508-C543 PolarHBondContact NH1-SG 3.35Å; H539-C543 PolarHBondContact O-N 3.04Å; H539-C543 PolarHBondContact O-SG 3.42Å; I540-C543 WeakPolarHBondContact O-CB 3.37Å; I540-C543 PolarHBondContact O-N 3.35Å; L541-C543 PolarHBondContact O-N 3.23Å; C543-S547 WeakPolarHBondContact CA-OG 3.32Å; C543-S547 PolarHBondContact O-OG 2.98Å; C543-Y558 HydrophobicContact CB-CD2 3.97Å; C543-Y558 HydrophobicContact CB-CE2 3.63Å
544	I	93.5	Very high	91.5	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.026	23%	0.231	C	C	.	.	I	π-helix	trans	-69.5	-39.9	-179	-65.5	168.3	0	0	0	111.8	I540 L541 L555 F559 L562 F589 Q592	I540-I544 HydrophobicContact CG2-CD1 3.66Å; I540-I544 HydrophobicContact CG2-CG1 4.32Å; I540-I544 WeakPolarHBondContact O-CG1 3.39Å; I540-I544 PolarHBondContact O-N 3.01Å; L541-I544 PolarHBondContact O-N 3.15Å; I544-L555 HydrophobicContact CG1-CD2 4.45Å; I544-F559 HydrophobicContact CD1-CD1 3.94Å; I544-F559 HydrophobicContact CD1-CE1 3.97Å; I544-F559 HydrophobicContact CG1-CE1 4.49Å; I544-F559 HydrophobicContact CG2-CE1 4.03Å; I544-F559 HydrophobicContact CG2-CZ 4.29Å; I544-L562 HydrophobicContact CD1-CD2 4.05Å; I544-F589 HydrophobicContact CD1-CE2 4.42Å; I544-F589 HydrophobicContact CG2-CD2 3.92Å; I544-F589 HydrophobicContact CG2-CE2 4.26Å; I544-Q592 HydrophobicContact CG2-CB 4.03Å; I544-Q592 HydrophobicContact CG2-CG 4.07Å
545	I	94.2	Very high	91.2	Very high	25 Å²	25	38.3 Å²	38.3	13%	0.128	22%	0.224	C	C	.	.	I	π-helix	trans	-100.5	-47.4	-168.3	-58.5	173	0	0	0	112	L541 Y579 V580 K585 A588 F589	L541-I545 HydrophobicContact CB-CD1 4.38Å; L541-I545 HydrophobicContact CD2-CD1 4.39Å; L541-I545 VanDerWaalsContact O-CB 3.28Å; L541-I545 WeakPolarHBondContact O-CB 3.35Å; L541-I545 WeakPolarHBondContact O-CG1 3.11Å; L541-I545 PolarHBondContact O-N 3.47Å; I545-Y579 HydrophobicContact CD1-CD1 4.46Å; I545-Y579 HydrophobicContact CD1-CE1 4.37Å; I545-V580 HydrophobicContact CD1-CG2 3.79Å; I545-K585 HydrophobicContact CG2-CB 4.37Å; I545-K585 HydrophobicContact CG2-CG 4.28Å; I545-A588 HydrophobicContact CG2-CB 3.98Å; I545-F589 HydrophobicContact CD1-CB 3.91Å; I545-F589 HydrophobicContact CD1-CD2 4.07Å; I545-F589 HydrophobicContact CD1-CG 4.36Å; I545-F589 HydrophobicContact CG1-CB 4.05Å; I545-F589 HydrophobicContact CG1-CD2 4.12Å
546	D	90.1	Very high	91.1	Very high	77 Å²	77	40.1 Å²	40.1	41%	0.412	23%	0.228	S	C	.	.	I	π-helix	trans	-107	-20.5	-162.8	-57.3	-56.5	0	0	0	113.6	L542 Y579	L542-D546 HydrophobicContact CG-CB 4.37Å; L542-D546 CarbonylContact O-C 3.6Å; L542-D546 WeakPolarHBondContact O-CA 3.26Å; L542-D546 PolarHBondContact O-N 2.91Å; D546-Y579 WeakPolarHBondContact OD2-CE1 3.27Å; D546-Y579 PolarHBondContact OD2-OH 2.99Å
547	S	81.9	Confident	90.9	Very high	35 Å²	35	40.1 Å²	40.1	25%	0.245	23%	0.228	C	C	.	.	S	Bend	trans	-81.5	-13.5	-171.7	78.8	0	0	0	0	115.3	L542 C543 C549	L542-S547 PolarHBondContact O-N 2.75Å; C543-S547 WeakPolarHBondContact CA-OG 3.32Å; C543-S547 PolarHBondContact O-OG 2.98Å; S547-C549 PolarHBondContact O-N 3.27Å; S547-C549 WeakPolarHBondContact OG-CB 3.44Å; S547-C549 PolarHBondContact OG-N 3.2Å
548	G	75.6	Confident	90.8	Very high	62 Å²	62	40.1 Å²	40.1	64%	0.639	23%	0.228	S	C	*	.			trans	67.4	18.9	-172.6	0	0	0	0	0	114.2	T550	G548-T550 PolarHBondContact O-N 3.33Å
549	C	80.3	Confident	90.8	Very high	16 Å²	16	37.6 Å²	37.6	11%	0.108	22%	0.216	C	C	.	.			trans	-57.2	122.8	177.4	-173.4	0	0	0	0	111	S547 L555	S547-C549 PolarHBondContact O-N 3.27Å; S547-C549 WeakPolarHBondContact OG-CB 3.44Å; S547-C549 PolarHBondContact OG-N 3.2Å; C549-L555 HydrophobicContact CB-CD2 4.45Å
550	T	78.2	Confident	90.8	Very high	135 Å²	135	37.6 Å²	37.6	83%	0.828	22%	0.217	S	C	*	.			trans	-107.8	-7.7	178.8	54.2	0	0	0	0	113.1	G548 R552	G548-T550 PolarHBondContact O-N 3.33Å; T550-R552 PolarHBondContact O-N 3.49Å
551	S	87.8	Confident	90.9	Very high	49 Å²	49	37.6 Å²	37.6	34%	0.343	22%	0.217	S	C	.	.			trans	-70.3	117.4	179.5	172.9	0	0	0	0	110.4	V554 L555	S551-V554 PolarHBondContact O-N 3.24Å; S551-V554 WeakPolarHBondContact OG-CG2 3.23Å; S551-L555 WeakPolarHBondContact O-CG 3.39Å; S551-L555 PolarHBondContact O-N 2.95Å
552	R	89.2	Confident	90.9	Very high	125 Å²	125	37.6 Å²	37.6	47%	0.472	22%	0.217	S	C	.	.	H	α-helix	trans	-59.6	-47.4	-179.2	-173.7	-179.5	175	-147.3	-16.6	111.7	T550 V554 L555 Q556 D599	T550-R552 PolarHBondContact O-N 3.49Å; R552-V554 VanDerWaalsContact C-N 3.33Å; R552-V554 PolarHBondContact O-N 2.64Å; R552-L555 PolarHBondContact O-N 3.01Å; R552-Q556 WeakPolarHBondContact O-CB 3.22Å; R552-Q556 PolarHBondContact O-N 3.38Å; R552-D599 VanDerWaalsContact CG-OD2 3.28Å; R552-D599 WeakPolarHBondContact CG-OD2 3.45Å; R552-D599 IonicContact CZ-OD1 3.38Å; R552-D599 IonicContact CZ-OD2 3.94Å; R552-D599 IonicContact NE-OD1 3.05Å; R552-D599 PolarHBondContact NE-OD1 3.2Å; R552-D599 IonicContact NE-OD2 3.59Å; R552-D599 PolarHBondContact NE-OD2 2.99Å; R552-D599 IonicContact NH2-OD1 3.99Å; R552-D599 PolarHBondContact NH2-OD1 2.67Å; R552-D599 IonicContact NH2-OD2 3.02Å
553	D	90.6	Very high	91.1	Very high	93 Å²	93	34.1 Å²	34.1	50%	0.497	20%	0.199	S	C	.	.	H	α-helix	trans	-63.7	-40.8	-178.2	-57	-27.6	0	0	0	111.5	F509 Q556 S557	F509-D553 HydrophobicContact CD2-CB 3.88Å; F509-D553 WeakPolarHBondContact CD2-O 3.18Å; F509-D553 HydrophobicContact CE2-CB 4.19Å; F509-D553 HydrophobicContact CG-CB 4.49Å; D553-Q556 PolarHBondContact O-N 3.45Å; D553-S557 WeakPolarHBondContact O-CB 3.27Å; D553-S557 PolarHBondContact O-N 2.88Å; D553-S557 PolarHBondContact O-OG 3.36Å
554	V	92.1	Very high	91.3	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.03	20%	0.204	C	C	.	.	H	α-helix	trans	-65.2	-47	176.8	174.9	0	0	0	0	110.4	R508 F509 S551 R552 Q556 S557 Y558	R508-V554 HydrophobicContact CB-CG1 3.87Å; R508-V554 HydrophobicContact CB-CG2 4.2Å; F509-V554 HydrophobicContact CB-CG2 4.07Å; S551-V554 PolarHBondContact O-N 3.24Å; S551-V554 WeakPolarHBondContact OG-CG2 3.23Å; R552-V554 VanDerWaalsContact C-N 3.33Å; R552-V554 PolarHBondContact O-N 2.64Å; V554-Q556 PolarHBondContact O-N 3.04Å; V554-S557 PolarHBondContact O-N 3.25Å; V554-S557 PolarHBondContact O-OG 3.22Å; V554-Y558 HydrophobicContact CG1-CD2 3.7Å; V554-Y558 HydrophobicContact CG1-CE2 3.27Å; V554-Y558 VanDerWaalsContact O-CD2 3.25Å; V554-Y558 WeakPolarHBondContact O-CD2 3.31Å; V554-Y558 PolarHBondContact O-N 3.04Å
555	L	92.5	Very high	91.5	Very high	11 Å²	11	34.9 Å²	34.9	6%	0.058	20%	0.203	C	C	.	.	H	α-helix	trans	-60.7	-44.4	176.8	-74.8	172.6	0	0	0	112.2	I544 C549 S551 R552 S557 Y558 F559	I544-L555 HydrophobicContact CG1-CD2 4.45Å; C549-L555 HydrophobicContact CB-CD2 4.45Å; S551-L555 WeakPolarHBondContact O-CG 3.39Å; S551-L555 PolarHBondContact O-N 2.95Å; R552-L555 PolarHBondContact O-N 3.01Å; L555-S557 PolarHBondContact O-N 3.38Å; L555-Y558 PolarHBondContact O-N 3.23Å; L555-F559 HydrophobicContact CB-CE2 4.35Å; L555-F559 WeakPolarHBondContact O-CD2 3.26Å; L555-F559 WeakPolarHBondContact O-CG 3.49Å; L555-F559 PolarHBondContact O-N 3.31Å
556	Q	94.1	Very high	91.7	Very high	52 Å²	52	33.7 Å²	33.7	24%	0.243	20%	0.197	C	C	.	.	H	α-helix	trans	-55.2	-51.7	174.4	-175.8	178.1	-26.2	0	0	111	R552 D553 V554 Y558 F559 D560 D599	R552-Q556 WeakPolarHBondContact O-CB 3.22Å; R552-Q556 PolarHBondContact O-N 3.38Å; D553-Q556 PolarHBondContact O-N 3.45Å; V554-Q556 PolarHBondContact O-N 3.04Å; Q556-Y558 PolarHBondContact O-N 2.91Å; Q556-F559 PolarHBondContact O-N 3.36Å; Q556-F559 VanDerWaalsContact O-N 3.07Å; Q556-D560 PolarHBondContact O-N 3.42Å; Q556-D599 HydrophobicContact CB-CB 3.83Å; Q556-D599 HydrophobicContact CG-CB 3.86Å; Q556-D599 PolarHBondContact OE1-OD1 2.75Å
557	S	95.3	Very high	92.1	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.007	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-32.4	-179.7	71.1	0	0	0	0	113	A512 D553 V554 L555 L561	A512-S557 WeakPolarHBondContact CB-OG 3.42Å; D553-S557 WeakPolarHBondContact O-CB 3.27Å; D553-S557 PolarHBondContact O-N 2.88Å; D553-S557 PolarHBondContact O-OG 3.36Å; V554-S557 PolarHBondContact O-N 3.25Å; V554-S557 PolarHBondContact O-OG 3.22Å; L555-S557 PolarHBondContact O-N 3.38Å; S557-L561 VanDerWaalsContact O-CB 3.26Å; S557-L561 WeakPolarHBondContact O-CB 3.39Å; S557-L561 PolarHBondContact O-N 2.84Å
558	Y	96.4	Very high	92.8	Very high	1 Å²	1	29.8 Å²	29.8	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-72.9	-37.5	173.5	-78.7	-47.5	0	0	0	113.3	M498 R508 A512 I540 C543 V554 L555 Q556 L562	M498-Y558 HydrophobicContact CE-CD1 4.38Å; M498-Y558 HydrophobicContact CE-CE1 3.53Å; R508-Y558 WeakPolarHBondContact CD-OH 3.11Å; R508-Y558 PolarHBondContact NH1-OH 3.39Å; A512-Y558 HydrophobicContact CB-CD1 4.27Å; A512-Y558 HydrophobicContact CB-CE1 4.2Å; I540-Y558 HydrophobicContact CB-CD1 4.37Å; I540-Y558 HydrophobicContact CG1-CD1 4.01Å; I540-Y558 HydrophobicContact CG1-CE1 4.44Å; I540-Y558 HydrophobicContact CG2-CD1 3.94Å; I540-Y558 HydrophobicContact CG2-CG 4.19Å; C543-Y558 HydrophobicContact CB-CD2 3.97Å; C543-Y558 HydrophobicContact CB-CE2 3.63Å; V554-Y558 HydrophobicContact CG1-CD2 3.7Å; V554-Y558 HydrophobicContact CG1-CE2 3.27Å; V554-Y558 VanDerWaalsContact O-CD2 3.25Å; V554-Y558 WeakPolarHBondContact O-CD2 3.31Å; V554-Y558 PolarHBondContact O-N 3.04Å; L555-Y558 PolarHBondContact O-N 3.23Å; Q556-Y558 PolarHBondContact O-N 2.91Å; Y558-L562 WeakPolarHBondContact O-CB 3.47Å; Y558-L562 PolarHBondContact O-N 3.16Å
559	F	97.3	Very high	93.8	Very high	1 Å²	1	26.9 Å²	26.9	0%	0.004	14%	0.141	C	C	.	.	H	α-helix	trans	-64.3	-44.1	173.8	-71.6	-50.2	0	0	0	111.7	I544 L555 Q556 L562 G563 Q592 I593 L603	I544-F559 HydrophobicContact CD1-CD1 3.94Å; I544-F559 HydrophobicContact CD1-CE1 3.97Å; I544-F559 HydrophobicContact CG1-CE1 4.49Å; I544-F559 HydrophobicContact CG2-CE1 4.03Å; I544-F559 HydrophobicContact CG2-CZ 4.29Å; L555-F559 HydrophobicContact CB-CE2 4.35Å; L555-F559 WeakPolarHBondContact O-CD2 3.26Å; L555-F559 WeakPolarHBondContact O-CG 3.49Å; L555-F559 PolarHBondContact O-N 3.31Å; Q556-F559 PolarHBondContact O-N 3.36Å; Q556-F559 VanDerWaalsContact O-N 3.07Å; F559-L562 PolarHBondContact O-N 3.31Å; F559-G563 PolarHBondContact O-N 2.99Å; F559-Q592 HydrophobicContact CZ-CB 3.87Å; F559-I593 HydrophobicContact CE1-CG1 3.92Å; F559-I593 HydrophobicContact CZ-CG1 4.26Å; F559-L603 HydrophobicContact CB-CB 4.34Å; F559-L603 HydrophobicContact CD1-CD2 3.53Å; F559-L603 HydrophobicContact CE1-CD2 4.16Å; F559-L603 HydrophobicContact CG-CD2 4.43Å
560	D	96.9	Very high	94.6	Very high	19 Å²	19	27.4 Å²	27.4	10%	0.102	14%	0.143	C	C	.	.	H	α-helix	trans	-61.2	-48.7	176.2	-73.3	-25.1	0	0	0	111.1	Q556 L562 G563 E564 M602	Q556-D560 PolarHBondContact O-N 3.42Å; D560-L562 PolarHBondContact O-N 3.1Å; D560-G563 PolarHBondContact O-N 2.64Å; D560-E564 PolarHBondContact O-N 2.93Å; D560-M602 VanDerWaalsContact OD1-CB 3.31Å; D560-M602 WeakPolarHBondContact OD1-CB 3.38Å
561	L	98.1	Very high	95.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.1	-43	177	177.6	58.1	0	0	0	112.7	M498 A512 V515 E516 L519 L536 I540 S557 G563 E564 L565	M498-L561 HydrophobicContact CE-CD2 3.9Å; A512-L561 HydrophobicContact CB-CD2 4.27Å; V515-L561 HydrophobicContact CB-CD1 4.26Å; V515-L561 HydrophobicContact CB-CD2 4.31Å; V515-L561 HydrophobicContact CG1-CD1 3.85Å; V515-L561 HydrophobicContact CG1-CD2 4.29Å; E516-L561 HydrophobicContact CB-CB 4.17Å; E516-L561 HydrophobicContact CB-CD1 3.9Å; E516-L561 HydrophobicContact CG-CB 4.48Å; L519-L561 HydrophobicContact CD1-CD1 3.99Å; L536-L561 HydrophobicContact CD1-CD2 4.27Å; L536-L561 HydrophobicContact CD2-CD1 4.3Å; L536-L561 HydrophobicContact CD2-CD2 4.4Å; I540-L561 HydrophobicContact CD1-CB 4.41Å; I540-L561 HydrophobicContact CD1-CD2 3.68Å; I540-L561 HydrophobicContact CD1-CG 3.64Å; I540-L561 HydrophobicContact CG1-CD2 4.18Å; S557-L561 VanDerWaalsContact O-CB 3.26Å; S557-L561 WeakPolarHBondContact O-CB 3.39Å; S557-L561 PolarHBondContact O-N 2.84Å; L561-G563 VanDerWaalsContact C-N 3.31Å; L561-E564 PolarHBondContact O-N 3.28Å; L561-L565 VanDerWaalsContact O-CB 3.26Å; L561-L565 WeakPolarHBondContact O-CB 3.32Å; L561-L565 PolarHBondContact O-N 3.04Å
562	L	98.4	Very high	96	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.1	-39.7	176.8	-173.7	62.6	0	0	0	111	L537 I540 L541 I544 Y558 F559 D560 L565 M566 F589 L603	L537-L562 HydrophobicContact CG-CD1 4.28Å; I540-L562 HydrophobicContact CG2-CB 4.03Å; I540-L562 HydrophobicContact CG2-CD1 4.32Å; I540-L562 HydrophobicContact CG2-CD2 4.47Å; L541-L562 HydrophobicContact CD2-CD2 3.88Å; I544-L562 HydrophobicContact CD1-CD2 4.05Å; Y558-L562 WeakPolarHBondContact O-CB 3.47Å; Y558-L562 PolarHBondContact O-N 3.16Å; F559-L562 PolarHBondContact O-N 3.31Å; D560-L562 PolarHBondContact O-N 3.1Å; L562-L565 PolarHBondContact O-N 3.5Å; L562-M566 HydrophobicContact CD1-CG 3.91Å; L562-M566 HydrophobicContact CD1-SD 3.49Å; L562-M566 WeakPolarHBondContact CD1-SD 3.45Å; L562-M566 HydrophobicContact CD2-SD 4.23Å; L562-M566 HydrophobicContact CG-CG 4.31Å; L562-M566 HydrophobicContact CG-SD 3.65Å; L562-M566 WeakPolarHBondContact O-CB 3.38Å; L562-M566 WeakPolarHBondContact O-CG 3.48Å; L562-M566 PolarHBondContact O-N 3.48Å; L562-F589 HydrophobicContact CD2-CE2 3.93Å; L562-F589 HydrophobicContact CD2-CZ 4.05Å; L562-L603 HydrophobicContact CB-CD1 4.46Å; L562-L603 HydrophobicContact CD2-CD1 4.32Å; L562-L603 HydrophobicContact CD2-CD2 3.98Å; L562-L603 HydrophobicContact CG-CD1 4.17Å
563	G	97.7	Very high	96.4	Very high	3 Å²	3	15 Å²	15	3%	0.031	8%	0.077	C	C	.	.	H	α-helix	trans	-56.5	-54.6	174.4	0	0	0	0	0	111.3	F559 D560 L561 L565 M566 K567 C606	F559-G563 PolarHBondContact O-N 2.99Å; D560-G563 PolarHBondContact O-N 2.64Å; L561-G563 VanDerWaalsContact C-N 3.31Å; G563-L565 VanDerWaalsContact C-N 3.32Å; G563-L565 PolarHBondContact O-N 2.65Å; G563-M566 PolarHBondContact O-N 3.22Å; G563-K567 WeakPolarHBondContact O-CB 3.5Å; G563-K567 PolarHBondContact O-N 3.43Å; G563-C606 PolarHBondContact O-SG 3.2Å
564	E	97.4	Very high	96.7	Very high	23 Å²	23	13.7 Å²	13.7	11%	0.107	7%	0.067	C	C	.	.	H	α-helix	trans	-64.1	-35.1	178.7	-70.9	-57.8	129.6	0	0	113	E516 L519 R520 Q528 D560 L561 K567	E516-E564 HydrophobicContact CG-CG 4.26Å; L519-E564 HydrophobicContact CB-CB 3.83Å; L519-E564 HydrophobicContact CD1-CB 4.07Å; R520-E564 HydrophobicContact CG-CG 4.45Å; Q528-E564 PolarHBondContact NE2-O 3.25Å; D560-E564 PolarHBondContact O-N 2.93Å; L561-E564 PolarHBondContact O-N 3.28Å; E564-K567 IonicContact OE1-NZ 2.72Å; E564-K567 PolarHBondContact OE1-NZ 3.16Å; E564-K567 WeakPolarHBondContact OE2-CE 3.33Å; E564-K567 IonicContact OE2-NZ 3.87Å; E564-K567 PolarHBondContact OE2-NZ 3.33Å
565	L	98.5	Very high	97	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-70.3	-35.9	179.4	-174.3	62.4	0	0	0	113.3	L519 Q528 L531 L532 L536 L537 I540 L561 L562 G563	L519-L565 HydrophobicContact CD1-CB 4.03Å; L519-L565 HydrophobicContact CD1-CD1 4.15Å; Q528-L565 HydrophobicContact CB-CD1 4.36Å; Q528-L565 WeakPolarHBondContact CG-O 3.5Å; Q528-L565 PolarHBondContact NE2-O 3.22Å; L531-L565 HydrophobicContact CB-CD1 3.89Å; L531-L565 HydrophobicContact CD1-CD1 4.36Å; L532-L565 HydrophobicContact CD2-CD1 4.15Å; L532-L565 HydrophobicContact CD2-CD2 4.01Å; L532-L565 HydrophobicContact CD2-CG 3.99Å; L532-L565 HydrophobicContact CG-CD1 4.04Å; L532-L565 HydrophobicContact CG-CG 4.4Å; L536-L565 HydrophobicContact CB-CD2 4.21Å; L536-L565 HydrophobicContact CD2-CD1 4.47Å; L536-L565 HydrophobicContact CD2-CD2 4.04Å; L536-L565 HydrophobicContact CG-CD2 3.97Å; L537-L565 HydrophobicContact CB-CD2 3.79Å; I540-L565 HydrophobicContact CD1-CD2 4.11Å; L561-L565 VanDerWaalsContact O-CB 3.26Å; L561-L565 WeakPolarHBondContact O-CB 3.32Å; L561-L565 PolarHBondContact O-N 3.04Å; L562-L565 PolarHBondContact O-N 3.5Å; G563-L565 VanDerWaalsContact C-N 3.32Å; G563-L565 PolarHBondContact O-N 2.65Å
566	M	98.3	Very high	97.3	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-92.5	-21.4	-175.3	-68.3	-178	65.4	0	0	114	L537 L562 G563 F568 N569 A572 F573 F576 L632	L537-M566 HydrophobicContact CD1-CG 4.04Å; L537-M566 HydrophobicContact CD1-SD 4.35Å; L562-M566 HydrophobicContact CD1-CG 3.91Å; L562-M566 HydrophobicContact CD1-SD 3.49Å; L562-M566 WeakPolarHBondContact CD1-SD 3.45Å; L562-M566 HydrophobicContact CD2-SD 4.23Å; L562-M566 HydrophobicContact CG-CG 4.31Å; L562-M566 HydrophobicContact CG-SD 3.65Å; L562-M566 WeakPolarHBondContact O-CB 3.38Å; L562-M566 WeakPolarHBondContact O-CG 3.48Å; L562-M566 PolarHBondContact O-N 3.48Å; G563-M566 PolarHBondContact O-N 3.22Å; M566-F568 PolarHBondContact O-N 2.87Å; M566-F568 VanDerWaalsContact O-N 3.14Å; M566-N569 PolarHBondContact O-N 3.48Å; M566-A572 HydrophobicContact CB-CB 4.19Å; M566-A572 HydrophobicContact CG-CB 3.94Å; M566-F573 HydrophobicContact CB-CE2 4.27Å; M566-F573 HydrophobicContact CE-CD1 3.56Å; M566-F573 HydrophobicContact CE-CD2 4.25Å; M566-F573 HydrophobicContact CE-CE1 3.58Å; M566-F573 HydrophobicContact CE-CE2 4.26Å; M566-F573 HydrophobicContact CE-CG 3.91Å; M566-F573 HydrophobicContact CE-CZ 3.94Å; M566-F573 WeakPolarHBondContact O-CE2 3.32Å; M566-F576 HydrophobicContact CE-CB 3.7Å; M566-F576 HydrophobicContact CE-CD2 3.94Å; M566-F576 HydrophobicContact CE-CG 3.88Å; M566-F576 HydrophobicContact SD-CB 4.48Å; M566-F576 HydrophobicContact SD-CD2 4.09Å; M566-L632 HydrophobicContact CE-CD2 4.44Å
567	K	97.1	Very high	97.4	Very high	5 Å²	5	15.5 Å²	15.5	2%	0.022	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	118.6	-172.2	-171.9	168.3	58.9	-171.7	0	111.9	T523 Q528 G563 E564 N569 C606	T523-K567 WeakPolarHBondContact OG1-CE 3.39Å; Q528-K567 PolarHBondContact NE2-O 3.15Å; G563-K567 WeakPolarHBondContact O-CB 3.5Å; G563-K567 PolarHBondContact O-N 3.43Å; E564-K567 IonicContact OE1-NZ 2.72Å; E564-K567 PolarHBondContact OE1-NZ 3.16Å; E564-K567 WeakPolarHBondContact OE2-CE 3.33Å; E564-K567 IonicContact OE2-NZ 3.87Å; E564-K567 PolarHBondContact OE2-NZ 3.33Å; K567-N569 PolarHBondContact O-N 3.25Å; K567-N569 VanDerWaalsContact O-N 3.16Å; K567-C606 WeakPolarHBondContact CA-SG 3.46Å; K567-C606 PolarHBondContact N-SG 3.24Å; K567-C606 VanDerWaalsContact N-SG 3.44Å
568	F	96.7	Very high	97.5	Very high	25 Å²	25	23.7 Å²	23.7	11%	0.11	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	14.7	-179.4	-49.8	-52.1	0	0	0	116.2	T523 M566 L609 S610 R613 C732	T523-F568 HydrophobicContact CG2-CD2 4.23Å; M566-F568 PolarHBondContact O-N 2.87Å; M566-F568 VanDerWaalsContact O-N 3.14Å; F568-L609 HydrophobicContact CE1-CB 3.76Å; F568-L609 HydrophobicContact CZ-CB 4.01Å; F568-S610 PolarHBondContact N-OG 3.43Å; F568-R613 HydrophobicContact CD1-CB 3.96Å; F568-R613 HydrophobicContact CD1-CG 4.29Å; F568-R613 HydrophobicContact CE1-CB 4.19Å; F568-R613 VanDerWaalsContact CG-NH1 3.32Å; F568-C732 HydrophobicContact CE2-CB 4.15Å; F568-C732 VanDerWaalsContact CE2-SG 3.6Å; F568-C732 HydrophobicContact CZ-CB 4.23Å
569	N	97.3	Very high	97.6	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.116	C	C	.	.			trans	-109.3	103.5	-172.6	-167.5	-49.4	0	0	0	112.5	Y525 Q528 M566 K567 D571 A572 F573	Y525-N569 VanDerWaalsContact CD2-ND2 3.33Å; Y525-N569 WeakPolarHBondContact CD2-ND2 3.48Å; Q528-N569 PolarHBondContact OE1-ND2 3.38Å; M566-N569 PolarHBondContact O-N 3.48Å; K567-N569 PolarHBondContact O-N 3.25Å; K567-N569 VanDerWaalsContact O-N 3.16Å; N569-D571 VanDerWaalsContact C-N 3.3Å; N569-D571 PolarHBondContact O-N 3Å; N569-D571 WeakPolarHBondContact OD1-CB 3.37Å; N569-D571 PolarHBondContact OD1-N 2.77Å; N569-D571 VanDerWaalsContact OD1-N 3.1Å; N569-A572 HydrophobicContact CB-CB 3.83Å; N569-A572 WeakPolarHBondContact O-CB 3.37Å; N569-A572 PolarHBondContact O-N 3.13Å; N569-A572 VanDerWaalsContact O-N 3.15Å; N569-A572 PolarHBondContact OD1-N 2.62Å; N569-F573 WeakPolarHBondContact O-CD2 3.5Å; N569-F573 PolarHBondContact O-N 3.11Å
570	I	96.6	Very high	97.6	Very high	28 Å²	28	25.7 Å²	25.7	14%	0.144	12%	0.116	C	C	.	.	H	α-helix	trans	-58.7	-37.9	-179	58.1	174.3	0	0	0	113.2	A572 F573 K574 F614 K622 V623 V626	I570-A572 VanDerWaalsContact C-N 3.31Å; I570-A572 PolarHBondContact O-N 3.14Å; I570-F573 PolarHBondContact O-N 2.88Å; I570-K574 WeakPolarHBondContact O-CG 3.41Å; I570-K574 PolarHBondContact O-N 2.95Å; I570-F614 HydrophobicContact CG2-CD1 3.94Å; I570-F614 HydrophobicContact CG2-CE1 3.43Å; I570-F614 VanDerWaalsContact CG2-CE1 3.43Å; I570-F614 HydrophobicContact CG2-CE2 4.29Å; I570-F614 HydrophobicContact CG2-CZ 3.63Å; I570-K622 HydrophobicContact CD1-CB 4.14Å; I570-V623 HydrophobicContact CG2-CG2 4.13Å; I570-V626 HydrophobicContact CB-CG2 4.39Å
571	D	97.4	Very high	97.4	Very high	48 Å²	48	30.1 Å²	30.1	26%	0.257	14%	0.14	S	C	.	.	H	α-helix	trans	-68.6	-33.5	179.9	-66.1	-80.9	0	0	0	111.6	Y525 M529 N569 K574 R575	Y525-D571 PolarHBondContact OH-OD2 3.48Å; M529-D571 HydrophobicContact CE-CB 4.27Å; M529-D571 HydrophobicContact SD-CB 3.72Å; N569-D571 VanDerWaalsContact C-N 3.3Å; N569-D571 PolarHBondContact O-N 3Å; N569-D571 WeakPolarHBondContact OD1-CB 3.37Å; N569-D571 PolarHBondContact OD1-N 2.77Å; N569-D571 VanDerWaalsContact OD1-N 3.1Å; D571-K574 PolarHBondContact O-N 3.09Å; D571-R575 VanDerWaalsContact O-CG 3.32Å; D571-R575 WeakPolarHBondContact O-CG 3.34Å; D571-R575 PolarHBondContact O-N 3.17Å
572	A	98.3	Very high	97.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.9	-44.9	173.3	0	0	0	0	0	111.2	L532 L537 M566 N569 I570 R575 F576	L532-A572 HydrophobicContact CD1-CB 3.88Å; L532-A572 HydrophobicContact CD2-CB 4.25Å; L537-A572 HydrophobicContact CD1-CB 4.1Å; L537-A572 WeakPolarHBondContact CD1-O 3.23Å; M566-A572 HydrophobicContact CB-CB 4.19Å; M566-A572 HydrophobicContact CG-CB 3.94Å; N569-A572 HydrophobicContact CB-CB 3.83Å; N569-A572 WeakPolarHBondContact O-CB 3.37Å; N569-A572 PolarHBondContact O-N 3.13Å; N569-A572 VanDerWaalsContact O-N 3.15Å; N569-A572 PolarHBondContact OD1-N 2.62Å; I570-A572 VanDerWaalsContact C-N 3.31Å; I570-A572 PolarHBondContact O-N 3.14Å; A572-R575 PolarHBondContact O-N 3.05Å; A572-F576 WeakPolarHBondContact O-CB 3.46Å; A572-F576 PolarHBondContact O-N 3.45Å
573	F	98.4	Very high	97.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66.1	-36.8	175.8	-79.4	-85.3	0	0	0	112.8	M566 N569 I570 F576 N577 F614 V626 L632 L633	M566-F573 HydrophobicContact CB-CE2 4.27Å; M566-F573 HydrophobicContact CE-CD1 3.56Å; M566-F573 HydrophobicContact CE-CD2 4.25Å; M566-F573 HydrophobicContact CE-CE1 3.58Å; M566-F573 HydrophobicContact CE-CE2 4.26Å; M566-F573 HydrophobicContact CE-CG 3.91Å; M566-F573 HydrophobicContact CE-CZ 3.94Å; M566-F573 WeakPolarHBondContact O-CE2 3.32Å; N569-F573 WeakPolarHBondContact O-CD2 3.5Å; N569-F573 PolarHBondContact O-N 3.11Å; I570-F573 PolarHBondContact O-N 2.88Å; F573-F576 PolarHBondContact O-N 3.4Å; F573-N577 WeakPolarHBondContact O-CB 3.14Å; F573-N577 PolarHBondContact O-N 3.15Å; F573-F614 AromaticContact CD2-CE2 3.68Å; F573-F614 HydrophobicContact CD2-CE2 3.68Å; F573-F614 HydrophobicContact CD2-CZ 4.02Å; F573-F614 AromaticContact CE2-CE2 3.9Å; F573-F614 HydrophobicContact CE2-CE2 3.9Å; F573-F614 HydrophobicContact CE2-CZ 4.24Å; F573-F614 HydrophobicContact CG-CE2 4.31Å; F573-V626 HydrophobicContact CB-CG1 3.89Å; F573-L632 HydrophobicContact CE1-CD2 4.2Å; F573-L633 HydrophobicContact CB-CD1 4.43Å; F573-L633 HydrophobicContact CD1-CD1 3.96Å; F573-L633 HydrophobicContact CD1-CD2 3.95Å; F573-L633 HydrophobicContact CD1-CG 3.77Å; F573-L633 HydrophobicContact CE1-CD1 4.45Å; F573-L633 HydrophobicContact CE1-CD2 3.6Å; F573-L633 HydrophobicContact CE1-CG 3.94Å; F573-L633 HydrophobicContact CG-CD1 4.18Å; F573-L633 HydrophobicContact CG-CG 4.48Å; F573-L633 HydrophobicContact CZ-CD2 4.08Å
574	K	97.3	Very high	97.2	Very high	65 Å²	65	42.9 Å²	42.9	28%	0.283	21%	0.21	S	C	.	.	H	α-helix	trans	-59.4	-46.4	171.2	-73.8	-170.3	175.3	-156	0	111.6	I570 D571 N577 K578 E625 V626	I570-K574 WeakPolarHBondContact O-CG 3.41Å; I570-K574 PolarHBondContact O-N 2.95Å; D571-K574 PolarHBondContact O-N 3.09Å; K574-N577 PolarHBondContact O-N 2.96Å; K574-K578 PolarHBondContact O-N 2.63Å; K574-E625 IonicContact NZ-OE1 2.63Å; K574-E625 PolarHBondContact NZ-OE1 3.24Å; K574-E625 IonicContact NZ-OE2 2.76Å; K574-E625 PolarHBondContact NZ-OE2 3.36Å; K574-V626 HydrophobicContact CD-CG2 3.88Å; K574-V626 HydrophobicContact CG-CG2 3.4Å
575	R	97.9	Very high	97.1	Very high	69 Å²	69	44.4 Å²	44.4	26%	0.26	22%	0.216	S	C	.	.	H	α-helix	trans	-66.9	-39.8	178.2	-72.5	172.9	176.8	-123.4	13.6	112.6	L532 L537 E538 D571 A572 N577 K578 Y579	L532-R575 PolarHBondContact O-NH1 3.41Å; L537-R575 HydrophobicContact CD1-CB 4.32Å; L537-R575 HydrophobicContact CD2-CB 3.99Å; E538-R575 IonicContact OE1-NH1 2.85Å; E538-R575 PolarHBondContact OE1-NH1 3.21Å; D571-R575 VanDerWaalsContact O-CG 3.32Å; D571-R575 WeakPolarHBondContact O-CG 3.34Å; D571-R575 PolarHBondContact O-N 3.17Å; A572-R575 PolarHBondContact O-N 3.05Å; R575-N577 VanDerWaalsContact C-N 3.35Å; R575-K578 PolarHBondContact O-N 3.04Å; R575-Y579 PolarHBondContact O-N 3.4Å
576	F	98.4	Very high	97.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-55.1	-52	171.8	176.8	-82.5	0	0	0	110.6	L541 M566 A572 F573 K578 Y579 V580 F589 L632	L541-F576 HydrophobicContact CD1-CD2 3.78Å; L541-F576 HydrophobicContact CD1-CE2 4.3Å; L541-F576 HydrophobicContact CD1-CG 4.44Å; L541-F576 HydrophobicContact CD2-CD2 3.77Å; L541-F576 HydrophobicContact CD2-CE2 3.64Å; L541-F576 HydrophobicContact CG-CD2 4.4Å; M566-F576 HydrophobicContact CE-CB 3.7Å; M566-F576 HydrophobicContact CE-CD2 3.94Å; M566-F576 HydrophobicContact CE-CG 3.88Å; M566-F576 HydrophobicContact SD-CB 4.48Å; M566-F576 HydrophobicContact SD-CD2 4.09Å; A572-F576 WeakPolarHBondContact O-CB 3.46Å; A572-F576 PolarHBondContact O-N 3.45Å; F573-F576 PolarHBondContact O-N 3.4Å; F576-K578 VanDerWaalsContact C-N 3.26Å; F576-K578 PolarHBondContact O-N 3.37Å; F576-Y579 PolarHBondContact O-N 3.35Å; F576-V580 HydrophobicContact CD1-CB 4.42Å; F576-V580 HydrophobicContact CD1-CG2 4.3Å; F576-V580 HydrophobicContact CD2-CG2 4.26Å; F576-V580 HydrophobicContact CE1-CB 3.9Å; F576-V580 HydrophobicContact CE1-CG1 4.32Å; F576-V580 HydrophobicContact CE1-CG2 3.84Å; F576-V580 HydrophobicContact CE2-CG2 3.82Å; F576-V580 HydrophobicContact CG-CG2 4.47Å; F576-V580 HydrophobicContact CZ-CB 4.08Å; F576-V580 HydrophobicContact CZ-CG1 4.31Å; F576-V580 HydrophobicContact CZ-CG2 3.59Å; F576-V580 PolarHBondContact O-N 3.46Å; F576-F589 HydrophobicContact CE2-CD1 4.12Å; F576-F589 HydrophobicContact CE2-CD2 4.31Å; F576-F589 AromaticContact CE2-CE1 3.69Å; F576-F589 HydrophobicContact CE2-CE1 3.69Å; F576-F589 AromaticContact CE2-CE2 3.91Å; F576-F589 HydrophobicContact CE2-CE2 3.91Å; F576-F589 HydrophobicContact CE2-CG 4.39Å; F576-F589 AromaticContact CE2-CZ 3.56Å; F576-F589 HydrophobicContact CE2-CZ 3.56Å; F576-F589 AromaticContact CZ-CD1 3.74Å; F576-F589 HydrophobicContact CZ-CD1 3.74Å; F576-F589 AromaticContact CZ-CE1 3.6Å; F576-F589 HydrophobicContact CZ-CE1 3.6Å; F576-F589 HydrophobicContact CZ-CE2 4.49Å; F576-F589 HydrophobicContact CZ-CG 4.21Å; F576-F589 AromaticContact CZ-CZ 3.99Å; F576-F589 HydrophobicContact CZ-CZ 3.99Å; F576-L632 HydrophobicContact CD1-CB 4.17Å; F576-L632 HydrophobicContact CD1-CD2 4.23Å; F576-L632 HydrophobicContact CD2-CD2 4.49Å; F576-L632 HydrophobicContact CE1-CB 3.65Å; F576-L632 HydrophobicContact CE1-CD2 3.87Å; F576-L632 HydrophobicContact CE1-CG 4.32Å; F576-L632 HydrophobicContact CE2-CD2 4.12Å; F576-L632 HydrophobicContact CZ-CB 4.25Å; F576-L632 HydrophobicContact CZ-CD2 3.8Å; F576-L632 HydrophobicContact CZ-CG 4.48Å
577	N	97	Very high	97	Very high	37 Å²	37	50.8 Å²	50.8	20%	0.198	25%	0.246	C	C	.	.	H	α-helix	trans	-61.8	-36.6	-178.6	-158.6	55.8	0	0	0	112.2	F573 K574 R575 Y579 V580 E629 C630 C631	F573-N577 WeakPolarHBondContact O-CB 3.14Å; F573-N577 PolarHBondContact O-N 3.15Å; K574-N577 PolarHBondContact O-N 2.96Å; R575-N577 VanDerWaalsContact C-N 3.35Å; N577-Y579 VanDerWaalsContact C-N 3.34Å; N577-V580 CarbonylContact O-C 3.56Å; N577-E629 PolarHBondContact ND2-O 2.69Å; N577-E629 PolarHBondContact OD1-O 3.02Å; N577-C630 WeakPolarHBondContact OD1-CA 3.02Å; N577-C631 PolarHBondContact OD1-N 3.17Å; N577-C631 PolarHBondContact OD1-SG 3.37Å; N577-C631 VanDerWaalsContact OD1-SG 3.39Å
578	K	97.3	Very high	96.9	Very high	174 Å²	174	52.3 Å²	52.3	76%	0.757	26%	0.259	S	S	*	.	H	α-helix	trans	-65.4	-35.5	174.8	-174.3	177.3	178.8	178.7	0	112.9	K574 R575 F576	K574-K578 PolarHBondContact O-N 2.63Å; R575-K578 PolarHBondContact O-N 3.04Å; F576-K578 VanDerWaalsContact C-N 3.26Å; F576-K578 PolarHBondContact O-N 3.37Å
579	Y	97.7	Very high	96.9	Very high	40 Å²	40	51.1 Å²	51.1	16%	0.157	25%	0.254	C	S	.	.	H	α-helix	trans	-77.5	-44.4	178	-168.9	-82.4	0	0	0	112	E538 L541 L542 I545 D546 R575 F576 N577 N581 K585	E538-Y579 HydrophobicContact CB-CD2 3.99Å; E538-Y579 HydrophobicContact CB-CE2 4.19Å; E538-Y579 HydrophobicContact CG-CD2 4.14Å; L541-Y579 HydrophobicContact CB-CD1 3.55Å; L541-Y579 HydrophobicContact CB-CE1 3.61Å; L541-Y579 HydrophobicContact CB-CG 4.06Å; L541-Y579 HydrophobicContact CD1-CD1 3.77Å; L541-Y579 HydrophobicContact CD1-CG 3.76Å; L541-Y579 HydrophobicContact CG-CD1 4.31Å; L542-Y579 WeakPolarHBondContact CA-OH 3.32Å; L542-Y579 VanDerWaalsContact CB-OH 3.27Å; L542-Y579 WeakPolarHBondContact CB-OH 3.35Å; L542-Y579 PolarHBondContact N-OH 3.48Å; I545-Y579 HydrophobicContact CD1-CD1 4.46Å; I545-Y579 HydrophobicContact CD1-CE1 4.37Å; D546-Y579 WeakPolarHBondContact OD2-CE1 3.27Å; D546-Y579 PolarHBondContact OD2-OH 2.99Å; R575-Y579 PolarHBondContact O-N 3.4Å; F576-Y579 PolarHBondContact O-N 3.35Å; N577-Y579 VanDerWaalsContact C-N 3.34Å; Y579-N581 VanDerWaalsContact C-N 3.26Å; Y579-N581 PolarHBondContact O-N 3.36Å; Y579-K585 WeakPolarHBondContact O-CD 3.28Å
580	V	96.6	Very high	96.9	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.018	26%	0.255	C	S	.	.	S	Bend	trans	-94	58.2	-178.8	-167.9	0	0	0	0	109.1	L541 I545 F576 N577 K585 F586	L541-V580 HydrophobicContact CD1-CG2 4.16Å; I545-V580 HydrophobicContact CD1-CG2 3.79Å; F576-V580 HydrophobicContact CD1-CB 4.42Å; F576-V580 HydrophobicContact CD1-CG2 4.3Å; F576-V580 HydrophobicContact CD2-CG2 4.26Å; F576-V580 HydrophobicContact CE1-CB 3.9Å; F576-V580 HydrophobicContact CE1-CG1 4.32Å; F576-V580 HydrophobicContact CE1-CG2 3.84Å; F576-V580 HydrophobicContact CE2-CG2 3.82Å; F576-V580 HydrophobicContact CG-CG2 4.47Å; F576-V580 HydrophobicContact CZ-CB 4.08Å; F576-V580 HydrophobicContact CZ-CG1 4.31Å; F576-V580 HydrophobicContact CZ-CG2 3.59Å; F576-V580 PolarHBondContact O-N 3.46Å; N577-V580 CarbonylContact O-C 3.56Å; V580-K585 HydrophobicContact CG1-CB 4Å; V580-F586 VanDerWaalsContact CG1-CA 3.41Å; V580-F586 HydrophobicContact CG1-CB 3.77Å; V580-F586 HydrophobicContact CG1-CD2 3.98Å; V580-F586 HydrophobicContact CG1-CG 4.4Å
581	N	94	Very high	96.8	Very high	113 Å²	113	53.9 Å²	53.9	60%	0.604	27%	0.272	S	S	*	.			trans	-91.2	-1.8	-170.9	65.5	-17.4	0	0	0	114.5	Y579	Y579-N581 VanDerWaalsContact C-N 3.26Å; Y579-N581 PolarHBondContact O-N 3.36Å
582	T	96.1	Very high	96.6	Very high	48 Å²	48	54.2 Å²	54.2	29%	0.294	27%	0.272	S	S	.	.	S	Bend	trans	-120.9	152.1	175.6	84.8	0	0	0	0	111.5	E584 K585 F586	T582-E584 WeakPolarHBondContact CB-OE2 3.41Å; T582-E584 PolarHBondContact O-N 3.36Å; T582-E584 PolarHBondContact OG1-N 3.22Å; T582-E584 PolarHBondContact OG1-OE2 2.93Å; T582-K585 PolarHBondContact O-N 3.06Å; T582-K585 PolarHBondContact OG1-N 3.43Å; T582-F586 PolarHBondContact O-N 3.07Å; T582-F586 VanDerWaalsContact O-N 3.11Å
583	P	96.3	Very high	96.4	Very high	91 Å²	91	54.3 Å²	54.3	59%	0.591	27%	0.273	S	S	*	.	H	α-helix	trans	-55.7	-37	175.1	-25.6	35.5	0	0	0	113.1	F586 Q587	P583-F586 PolarHBondContact O-N 2.94Å; P583-Q587 WeakPolarHBondContact O-CB 3.45Å; P583-Q587 VanDerWaalsContact O-CG 3.31Å; P583-Q587 WeakPolarHBondContact O-CG 3.34Å; P583-Q587 PolarHBondContact O-N 3.1Å
584	E	96.6	Very high	96.1	Very high	132 Å²	132	56.4 Å²	56.4	62%	0.617	28%	0.284	S	S	*	.	H	α-helix	trans	-65.5	-46.4	-178.3	-57.8	69.1	-146.2	0	0	111	T582 F586 Q587 A588	T582-E584 WeakPolarHBondContact CB-OE2 3.41Å; T582-E584 PolarHBondContact O-N 3.36Å; T582-E584 PolarHBondContact OG1-N 3.22Å; T582-E584 PolarHBondContact OG1-OE2 2.93Å; E584-F586 VanDerWaalsContact C-N 3.3Å; E584-F586 PolarHBondContact O-N 3.06Å; E584-Q587 PolarHBondContact O-N 3.19Å; E584-A588 WeakPolarHBondContact O-CB 3.32Å; E584-A588 PolarHBondContact O-N 2.99Å
585	K	96.6	Very high	95.8	Very high	54 Å²	54	57 Å²	57	24%	0.235	30%	0.297	C	S	.	.	H	α-helix	trans	-62.4	-40.3	175.4	-74.1	-169.2	169.2	-166.7	0	111.7	I545 Y579 V580 T582 A588 F589	I545-K585 HydrophobicContact CG2-CB 4.37Å; I545-K585 HydrophobicContact CG2-CG 4.28Å; Y579-K585 WeakPolarHBondContact O-CD 3.28Å; V580-K585 HydrophobicContact CG1-CB 4Å; T582-K585 PolarHBondContact O-N 3.06Å; T582-K585 PolarHBondContact OG1-N 3.43Å; K585-A588 PolarHBondContact O-N 3.29Å; K585-F589 WeakPolarHBondContact O-CB 3.48Å; K585-F589 PolarHBondContact O-N 3.32Å
586	F	97.4	Very high	95.4	Very high	25 Å²	25	55.2 Å²	55.2	11%	0.11	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-43.5	177.9	-172.7	-116.3	0	0	0	111.7	V580 T582 P583 E584 F589 L590 C631 L632 Y635	V580-F586 VanDerWaalsContact CG1-CA 3.41Å; V580-F586 HydrophobicContact CG1-CB 3.77Å; V580-F586 HydrophobicContact CG1-CD2 3.98Å; V580-F586 HydrophobicContact CG1-CG 4.4Å; T582-F586 PolarHBondContact O-N 3.07Å; T582-F586 VanDerWaalsContact O-N 3.11Å; P583-F586 PolarHBondContact O-N 2.94Å; E584-F586 VanDerWaalsContact C-N 3.3Å; E584-F586 PolarHBondContact O-N 3.06Å; F586-F589 PolarHBondContact O-N 2.72Å; F586-L590 HydrophobicContact CD1-CD1 3.99Å; F586-L590 HydrophobicContact CE1-CD1 3.46Å; F586-L590 VanDerWaalsContact CE1-CD1 3.46Å; F586-L590 HydrophobicContact CE1-CG 4.18Å; F586-L590 HydrophobicContact CE2-CD1 4.46Å; F586-L590 HydrophobicContact CE2-CG 4.34Å; F586-L590 HydrophobicContact CZ-CD1 3.73Å; F586-L590 HydrophobicContact CZ-CD2 4.31Å; F586-L590 HydrophobicContact CZ-CG 4.07Å; F586-L590 WeakPolarHBondContact O-CG 3.3Å; F586-L590 PolarHBondContact O-N 3.31Å; F586-C631 HydrophobicContact CD2-CB 4.26Å; F586-C631 WeakPolarHBondContact CD2-SG 3.18Å; F586-C631 HydrophobicContact CE2-CB 4.22Å; F586-C631 HydrophobicContact CZ-CB 4.47Å; F586-L632 HydrophobicContact CE2-CB 4.15Å; F586-L632 HydrophobicContact CE2-CD1 4.17Å; F586-Y635 HydrophobicContact CE1-CD2 4.34Å; F586-Y635 HydrophobicContact CE1-CG 4.42Å; F586-Y635 HydrophobicContact CZ-CD2 4.41Å; F586-Y635 HydrophobicContact CZ-CG 4.05Å
587	Q	96.5	Very high	95.2	Very high	110 Å²	110	55.5 Å²	55.5	51%	0.514	30%	0.296	S	S	.	.	H	α-helix	trans	-65.9	-39.9	175.6	-70.3	-56.1	-31.9	0	0	112.4	P583 E584 L590 T591	P583-Q587 WeakPolarHBondContact O-CB 3.45Å; P583-Q587 VanDerWaalsContact O-CG 3.31Å; P583-Q587 WeakPolarHBondContact O-CG 3.34Å; P583-Q587 PolarHBondContact O-N 3.1Å; E584-Q587 PolarHBondContact O-N 3.19Å; Q587-L590 PolarHBondContact O-N 3.01Å; Q587-T591 WeakPolarHBondContact O-CB 3.45Å; Q587-T591 PolarHBondContact O-N 3.36Å; Q587-T591 PolarHBondContact O-OG1 3.03Å
588	A	95.5	Very high	95.1	Very high	36 Å²	36	55 Å²	55	30%	0.298	29%	0.294	S	S	.	.	H	α-helix	trans	-59.8	-47.1	174.3	0	0	0	0	0	111.2	I545 E584 K585 L590 T591 Q592	I545-A588 HydrophobicContact CG2-CB 3.98Å; E584-A588 WeakPolarHBondContact O-CB 3.32Å; E584-A588 PolarHBondContact O-N 2.99Å; K585-A588 PolarHBondContact O-N 3.29Å; A588-L590 PolarHBondContact O-N 3.34Å; A588-T591 WeakPolarHBondContact O-CB 3.32Å; A588-T591 PolarHBondContact O-N 3.28Å; A588-Q592 WeakPolarHBondContact O-CG 3.32Å; A588-Q592 PolarHBondContact O-N 3.2Å; A588-Q592 VanDerWaalsContact O-N 3.08Å
589	F	96.3	Very high	95	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60	-47	176	-177.2	-105.3	0	0	0	112.9	L541 I544 I545 L562 F576 K585 F586 T591 Q592 I593 L603 L632	L541-F589 HydrophobicContact CD2-CD2 4.24Å; L541-F589 HydrophobicContact CD2-CE2 3.9Å; I544-F589 HydrophobicContact CD1-CE2 4.42Å; I544-F589 HydrophobicContact CG2-CD2 3.92Å; I544-F589 HydrophobicContact CG2-CE2 4.26Å; I545-F589 HydrophobicContact CD1-CB 3.91Å; I545-F589 HydrophobicContact CD1-CD2 4.07Å; I545-F589 HydrophobicContact CD1-CG 4.36Å; I545-F589 HydrophobicContact CG1-CB 4.05Å; I545-F589 HydrophobicContact CG1-CD2 4.12Å; L562-F589 HydrophobicContact CD2-CE2 3.93Å; L562-F589 HydrophobicContact CD2-CZ 4.05Å; F576-F589 HydrophobicContact CE2-CD1 4.12Å; F576-F589 HydrophobicContact CE2-CD2 4.31Å; F576-F589 AromaticContact CE2-CE1 3.69Å; F576-F589 HydrophobicContact CE2-CE1 3.69Å; F576-F589 AromaticContact CE2-CE2 3.91Å; F576-F589 HydrophobicContact CE2-CE2 3.91Å; F576-F589 HydrophobicContact CE2-CG 4.39Å; F576-F589 AromaticContact CE2-CZ 3.56Å; F576-F589 HydrophobicContact CE2-CZ 3.56Å; F576-F589 AromaticContact CZ-CD1 3.74Å; F576-F589 HydrophobicContact CZ-CD1 3.74Å; F576-F589 AromaticContact CZ-CE1 3.6Å; F576-F589 HydrophobicContact CZ-CE1 3.6Å; F576-F589 HydrophobicContact CZ-CE2 4.49Å; F576-F589 HydrophobicContact CZ-CG 4.21Å; F576-F589 AromaticContact CZ-CZ 3.99Å; F576-F589 HydrophobicContact CZ-CZ 3.99Å; K585-F589 WeakPolarHBondContact O-CB 3.48Å; K585-F589 PolarHBondContact O-N 3.32Å; F586-F589 PolarHBondContact O-N 2.72Å; F589-T591 VanDerWaalsContact C-N 3.3Å; F589-T591 PolarHBondContact O-N 3.26Å; F589-Q592 PolarHBondContact O-N 2.93Å; F589-I593 HydrophobicContact CD1-CD1 3.92Å; F589-I593 HydrophobicContact CE1-CD1 3.42Å; F589-I593 VanDerWaalsContact CE1-CD1 3.42Å; F589-I593 HydrophobicContact CE1-CG1 4.47Å; F589-I593 HydrophobicContact CZ-CD1 3.84Å; F589-I593 PolarHBondContact O-N 3.25Å; F589-L603 HydrophobicContact CZ-CD2 3.88Å; F589-L632 HydrophobicContact CE1-CD1 4.09Å; F589-L632 HydrophobicContact CE1-CD2 4.21Å
590	L	96	Very high	94.9	Very high	5 Å²	5	45 Å²	45	3%	0.026	25%	0.252	C	S	.	.	H	α-helix	trans	-64.4	-35	176.7	-73.5	-177.3	0	0	0	112.4	F586 Q587 A588 Q592 I593 N594 Y635	F586-L590 HydrophobicContact CD1-CD1 3.99Å; F586-L590 HydrophobicContact CE1-CD1 3.46Å; F586-L590 VanDerWaalsContact CE1-CD1 3.46Å; F586-L590 HydrophobicContact CE1-CG 4.18Å; F586-L590 HydrophobicContact CE2-CD1 4.46Å; F586-L590 HydrophobicContact CE2-CG 4.34Å; F586-L590 HydrophobicContact CZ-CD1 3.73Å; F586-L590 HydrophobicContact CZ-CD2 4.31Å; F586-L590 HydrophobicContact CZ-CG 4.07Å; F586-L590 WeakPolarHBondContact O-CG 3.3Å; F586-L590 PolarHBondContact O-N 3.31Å; Q587-L590 PolarHBondContact O-N 3.01Å; A588-L590 PolarHBondContact O-N 3.34Å; L590-Q592 VanDerWaalsContact C-N 3.32Å; L590-I593 PolarHBondContact O-N 3.46Å; L590-N594 VanDerWaalsContact O-CB 3.31Å; L590-N594 WeakPolarHBondContact O-CB 3.17Å; L590-N594 PolarHBondContact O-N 3.27Å; L590-N594 PolarHBondContact O-ND2 3.13Å; L590-Y635 HydrophobicContact CD1-CD1 4.49Å; L590-Y635 HydrophobicContact CD1-CD2 4.07Å; L590-Y635 HydrophobicContact CD1-CE1 4.29Å; L590-Y635 HydrophobicContact CD1-CE2 3.85Å; L590-Y635 HydrophobicContact CD1-CG 4.4Å; L590-Y635 HydrophobicContact CD2-CD1 4.1Å; L590-Y635 HydrophobicContact CD2-CE1 3.89Å
591	T	94.9	Very high	94.9	Very high	82 Å²	82	45 Å²	45	50%	0.503	25%	0.252	S	S	.	.	H	α-helix	trans	-62.7	-42.4	176.3	-60.8	0	0	0	0	110.5	Q587 A588 F589 N594 S595	Q587-T591 WeakPolarHBondContact O-CB 3.45Å; Q587-T591 PolarHBondContact O-N 3.36Å; Q587-T591 PolarHBondContact O-OG1 3.03Å; A588-T591 WeakPolarHBondContact O-CB 3.32Å; A588-T591 PolarHBondContact O-N 3.28Å; F589-T591 VanDerWaalsContact C-N 3.3Å; F589-T591 PolarHBondContact O-N 3.26Å; T591-N594 PolarHBondContact O-N 3.35Å; T591-S595 WeakPolarHBondContact O-CB 3.45Å; T591-S595 PolarHBondContact O-N 3.32Å; T591-S595 PolarHBondContact O-OG 2.84Å
592	Q	93.9	Very high	94.9	Very high	54 Å²	54	42.1 Å²	42.1	25%	0.252	24%	0.235	S	C	.	.	H	α-helix	trans	-61.4	-48.6	176.6	-65.7	-62	-21.8	0	0	111.8	I544 F559 A588 F589 L590 N594 S595 S596	I544-Q592 HydrophobicContact CG2-CB 4.03Å; I544-Q592 HydrophobicContact CG2-CG 4.07Å; F559-Q592 HydrophobicContact CZ-CB 3.87Å; A588-Q592 WeakPolarHBondContact O-CG 3.32Å; A588-Q592 PolarHBondContact O-N 3.2Å; A588-Q592 VanDerWaalsContact O-N 3.08Å; F589-Q592 PolarHBondContact O-N 2.93Å; L590-Q592 VanDerWaalsContact C-N 3.32Å; Q592-N594 VanDerWaalsContact C-N 3.32Å; Q592-N594 PolarHBondContact O-N 3.42Å; Q592-S595 PolarHBondContact O-N 3.42Å; Q592-S595 PolarHBondContact O-OG 2.83Å; Q592-S596 PolarHBondContact O-N 3.09Å
593	I	94.5	Very high	95	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.015	22%	0.221	C	C	.	.	H	α-helix	trans	-56.8	-46.8	174.5	-68.2	173.9	0	0	0	111	F559 F589 L590 S596 L597 S600 L603 V604 F645	F559-I593 HydrophobicContact CE1-CG1 3.92Å; F559-I593 HydrophobicContact CZ-CG1 4.26Å; F589-I593 HydrophobicContact CD1-CD1 3.92Å; F589-I593 HydrophobicContact CE1-CD1 3.42Å; F589-I593 VanDerWaalsContact CE1-CD1 3.42Å; F589-I593 HydrophobicContact CE1-CG1 4.47Å; F589-I593 HydrophobicContact CZ-CD1 3.84Å; F589-I593 PolarHBondContact O-N 3.25Å; L590-I593 PolarHBondContact O-N 3.46Å; I593-S596 CarbonylContact O-C 3.35Å; I593-L597 PolarHBondContact O-N 3.25Å; I593-S600 PolarHBondContact O-OG 3.49Å; I593-L603 HydrophobicContact CD1-CD2 4.2Å; I593-V604 HydrophobicContact CG2-CG2 3.91Å; I593-F645 HydrophobicContact CG2-CE1 3.94Å; I593-F645 HydrophobicContact CG2-CZ 4.24Å
594	N	92.1	Very high	95.1	Very high	44 Å²	44	35.7 Å²	35.7	24%	0.235	19%	0.194	C	C	.	.	H	α-helix	trans	-73.2	-30.2	-174.5	-76.7	-55.2	0	0	0	113.5	L590 T591 Q592 S596 R648	L590-N594 VanDerWaalsContact O-CB 3.31Å; L590-N594 WeakPolarHBondContact O-CB 3.17Å; L590-N594 PolarHBondContact O-N 3.27Å; L590-N594 PolarHBondContact O-ND2 3.13Å; T591-N594 PolarHBondContact O-N 3.35Å; Q592-N594 VanDerWaalsContact C-N 3.32Å; Q592-N594 PolarHBondContact O-N 3.42Å; N594-S596 VanDerWaalsContact C-N 3.32Å; N594-R648 PolarHBondContact O-NH2 3.48Å; N594-R648 PolarHBondContact OD1-NH1 3.35Å
595	S	91.2	Very high	95.2	Very high	78 Å²	78	29.9 Å²	29.9	55%	0.545	17%	0.167	S	C	.	.	H	α-helix	trans	-68.7	-32.5	178.6	70.6	0	0	0	0	112.6	T591 Q592	T591-S595 WeakPolarHBondContact O-CB 3.45Å; T591-S595 PolarHBondContact O-N 3.32Å; T591-S595 PolarHBondContact O-OG 2.84Å; Q592-S595 PolarHBondContact O-N 3.42Å; Q592-S595 PolarHBondContact O-OG 2.83Å
596	S	88.4	Confident	95.2	Very high	31 Å²	31	27.6 Å²	27.6	22%	0.217	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134	65.6	-172.7	-57.9	0	0	0	0	110	Q592 I593 N594 V598 D599 S600	Q592-S596 PolarHBondContact O-N 3.09Å; I593-S596 CarbonylContact O-C 3.35Å; N594-S596 VanDerWaalsContact C-N 3.32Å; S596-V598 VanDerWaalsContact C-N 3.32Å; S596-V598 PolarHBondContact O-N 2.06Å; S596-D599 WeakPolarHBondContact CB-OD2 3.47Å; S596-D599 PolarHBondContact O-N 2.82Å; S596-S600 WeakPolarHBondContact O-CB 3.2Å; S596-S600 PolarHBondContact O-N 3.44Å; S596-S600 PolarHBondContact O-OG 2.91Å
597	L	95.1	Very high	95.3	Very high	5 Å²	5	26.6 Å²	26.6	3%	0.026	15%	0.153	C	C	.	.	H	α-helix	trans	-67.6	-32	-172.9	-174.1	59.4	0	0	0	112.8	I593 D599 S600 N601 V604 F645 R648 L649 I652	I593-L597 PolarHBondContact O-N 3.25Å; L597-D599 VanDerWaalsContact C-N 3.3Å; L597-D599 PolarHBondContact O-N 3.5Å; L597-S600 WeakPolarHBondContact CA-OG 3.42Å; L597-N601 VanDerWaalsContact O-CB 3.32Å; L597-N601 WeakPolarHBondContact O-CB 3.48Å; L597-N601 PolarHBondContact O-N 3.18Å; L597-V604 HydrophobicContact CD1-CG2 4.28Å; L597-F645 HydrophobicContact CD1-CD1 3.88Å; L597-F645 HydrophobicContact CD1-CE1 4.15Å; L597-R648 HydrophobicContact CD2-CB 3.51Å; L597-L649 HydrophobicContact CD1-CD2 4.2Å; L597-L649 HydrophobicContact CD2-CD2 4.01Å; L597-L649 HydrophobicContact CD2-CG 4.06Å; L597-L649 HydrophobicContact CG-CD2 3.82Å; L597-L649 HydrophobicContact CG-CG 4.37Å; L597-I652 HydrophobicContact CB-CD1 4.11Å; L597-I652 HydrophobicContact CD2-CD1 3.99Å; L597-I652 HydrophobicContact CG-CD1 4.46Å
598	V	94.9	Very high	95.4	Very high	26 Å²	26	21.7 Å²	21.7	16%	0.158	13%	0.13	C	C	.	.	H	α-helix	trans	-59.6	-45.9	173.8	178	0	0	0	0	109.9	S596 N601 I652 N662	S596-V598 VanDerWaalsContact C-N 3.32Å; S596-V598 PolarHBondContact O-N 2.06Å; V598-N601 PolarHBondContact O-ND2 3.15Å; V598-I652 HydrophobicContact CG2-CG2 3.6Å; V598-N662 HydrophobicContact CG1-CB 3.86Å
599	D	94.6	Very high	95.5	Very high	6 Å²	6	20.3 Å²	20.3	3%	0.032	12%	0.118	C	C	.	.	H	α-helix	trans	-78.1	-28.5	-174.1	-50.5	-28.9	0	0	0	112.3	R552 Q556 S596 L597	R552-D599 VanDerWaalsContact CG-OD2 3.28Å; R552-D599 WeakPolarHBondContact CG-OD2 3.45Å; R552-D599 IonicContact CZ-OD1 3.38Å; R552-D599 IonicContact CZ-OD2 3.94Å; R552-D599 IonicContact NE-OD1 3.05Å; R552-D599 PolarHBondContact NE-OD1 3.2Å; R552-D599 IonicContact NE-OD2 3.59Å; R552-D599 PolarHBondContact NE-OD2 2.99Å; R552-D599 IonicContact NH2-OD1 3.99Å; R552-D599 PolarHBondContact NH2-OD1 2.67Å; R552-D599 IonicContact NH2-OD2 3.02Å; Q556-D599 HydrophobicContact CB-CB 3.83Å; Q556-D599 HydrophobicContact CG-CB 3.86Å; Q556-D599 PolarHBondContact OE1-OD1 2.75Å; S596-D599 WeakPolarHBondContact CB-OD2 3.47Å; S596-D599 PolarHBondContact O-N 2.82Å; L597-D599 VanDerWaalsContact C-N 3.3Å; L597-D599 PolarHBondContact O-N 3.5Å
600	S	96.3	Very high	95.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-94.9	-3.3	-179	62	0	0	0	0	114.6	I593 S596 L597 M602 L603 V604	I593-S600 PolarHBondContact O-OG 3.49Å; S596-S600 WeakPolarHBondContact O-CB 3.2Å; S596-S600 PolarHBondContact O-N 3.44Å; S596-S600 PolarHBondContact O-OG 2.91Å; L597-S600 WeakPolarHBondContact CA-OG 3.42Å; S600-M602 PolarHBondContact O-N 2.7Å; S600-M602 VanDerWaalsContact O-N 3.15Å; S600-L603 WeakPolarHBondContact O-CB 3.46Å; S600-L603 PolarHBondContact O-N 3.41Å; S600-V604 PolarHBondContact O-N 3.02Å; S600-V604 VanDerWaalsContact O-N 3.1Å
601	N	96.3	Very high	95.6	Very high	3 Å²	3	20.2 Å²	20.2	2%	0.016	12%	0.118	C	C	.	.	H	α-helix	trans	-59.3	-32.4	-172.3	86.3	94.2	0	0	0	113.6	L597 V598 L603 V604 R605 L649 S664 T668	L597-N601 VanDerWaalsContact O-CB 3.32Å; L597-N601 WeakPolarHBondContact O-CB 3.48Å; L597-N601 PolarHBondContact O-N 3.18Å; V598-N601 PolarHBondContact O-ND2 3.15Å; N601-L603 VanDerWaalsContact C-N 3.35Å; N601-V604 PolarHBondContact O-N 3.09Å; N601-R605 PolarHBondContact O-N 3.49Å; N601-L649 HydrophobicContact CB-CD2 3.84Å; N601-S664 PolarHBondContact ND2-OG 3Å; N601-S664 VanDerWaalsContact OD1-CB 3.27Å; N601-S664 WeakPolarHBondContact OD1-CB 3.25Å; N601-S664 PolarHBondContact OD1-O 2.88Å; N601-S664 VanDerWaalsContact OD1-O 3.08Å; N601-S664 PolarHBondContact OD1-OG 3.13Å; N601-T668 PolarHBondContact O-OG1 3.27Å; N601-T668 PolarHBondContact OD1-OG1 3.39Å
602	M	94.5	Very high	95.7	Very high	52 Å²	52	17.6 Å²	17.6	26%	0.256	10%	0.1	S	C	.	.	H	α-helix	trans	-67.5	-37.1	179	-68.9	-62.6	-71.2	0	0	111.5	D560 S600 R605 C606	D560-M602 VanDerWaalsContact OD1-CB 3.31Å; D560-M602 WeakPolarHBondContact OD1-CB 3.38Å; S600-M602 PolarHBondContact O-N 2.7Å; S600-M602 VanDerWaalsContact O-N 3.15Å; M602-R605 WeakPolarHBondContact O-CB 2.96Å; M602-R605 PolarHBondContact O-N 3.45Å; M602-C606 PolarHBondContact O-N 3.12Å
603	L	97.8	Very high	95.8	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-66.8	-42.9	170.9	176.3	61.5	0	0	0	111.6	F559 L562 F589 I593 S600 N601 R605 C606 I607	F559-L603 HydrophobicContact CB-CB 4.34Å; F559-L603 HydrophobicContact CD1-CD2 3.53Å; F559-L603 HydrophobicContact CE1-CD2 4.16Å; F559-L603 HydrophobicContact CG-CD2 4.43Å; L562-L603 HydrophobicContact CB-CD1 4.46Å; L562-L603 HydrophobicContact CD2-CD1 4.32Å; L562-L603 HydrophobicContact CD2-CD2 3.98Å; L562-L603 HydrophobicContact CG-CD1 4.17Å; F589-L603 HydrophobicContact CZ-CD2 3.88Å; I593-L603 HydrophobicContact CD1-CD2 4.2Å; S600-L603 WeakPolarHBondContact O-CB 3.46Å; S600-L603 PolarHBondContact O-N 3.41Å; N601-L603 VanDerWaalsContact C-N 3.35Å; L603-R605 VanDerWaalsContact C-N 3.28Å; L603-R605 PolarHBondContact O-N 3.17Å; L603-C606 WeakPolarHBondContact O-CB 3.29Å; L603-C606 PolarHBondContact O-N 2.97Å; L603-C606 VanDerWaalsContact O-N 3.13Å; L603-I607 HydrophobicContact CD1-CD1 4.09Å; L603-I607 HydrophobicContact CD1-CG1 4.19Å; L603-I607 HydrophobicContact CG-CD1 3.88Å; L603-I607 HydrophobicContact CG-CG1 4.46Å; L603-I607 WeakPolarHBondContact O-CD1 3.33Å; L603-I607 VanDerWaalsContact O-CG1 3.29Å; L603-I607 WeakPolarHBondContact O-CG1 3.31Å; L603-I607 PolarHBondContact O-N 3.4Å
604	V	98.1	Very high	95.9	Very high	3 Å²	3	19.8 Å²	19.8	2%	0.018	11%	0.106	C	C	.	.	H	α-helix	trans	-57.2	-45	174.7	176.4	0	0	0	0	110.4	I593 L597 S600 N601 C606 I607 V608 F645 T668	I593-V604 HydrophobicContact CG2-CG2 3.91Å; L597-V604 HydrophobicContact CD1-CG2 4.28Å; S600-V604 PolarHBondContact O-N 3.02Å; S600-V604 VanDerWaalsContact O-N 3.1Å; N601-V604 PolarHBondContact O-N 3.09Å; V604-C606 PolarHBondContact O-N 3.38Å; V604-I607 PolarHBondContact O-N 3.15Å; V604-V608 HydrophobicContact CG1-CG2 4.43Å; V604-V608 WeakPolarHBondContact O-CG2 3.4Å; V604-V608 PolarHBondContact O-N 3.01Å; V604-F645 HydrophobicContact CG1-CB 4.41Å; V604-F645 HydrophobicContact CG1-CD1 4.3Å; V604-F645 HydrophobicContact CG1-CD2 4.19Å; V604-F645 HydrophobicContact CG1-CG 4.07Å; V604-F645 HydrophobicContact CG2-CD1 4.38Å; V604-F645 HydrophobicContact CG2-CE1 4.16Å; V604-F645 HydrophobicContact CG2-CZ 4.46Å; V604-T668 HydrophobicContact CG1-CG2 4.45Å
605	R	97.9	Very high	96.1	Very high	11 Å²	11	21.2 Å²	21.2	4%	0.042	11%	0.111	C	C	.	.	H	α-helix	trans	-57.5	-48	174.5	-168.4	-172.3	-62.1	166.1	10.8	111.7	N601 M602 L603 I607 V608 L609 S664 N667 T668 V671	N601-R605 PolarHBondContact O-N 3.49Å; M602-R605 WeakPolarHBondContact O-CB 2.96Å; M602-R605 PolarHBondContact O-N 3.45Å; L603-R605 VanDerWaalsContact C-N 3.28Å; L603-R605 PolarHBondContact O-N 3.17Å; R605-I607 VanDerWaalsContact C-N 3.33Å; R605-I607 PolarHBondContact O-N 3.45Å; R605-V608 PolarHBondContact O-N 3.37Å; R605-L609 HydrophobicContact CG-CD1 3.82Å; R605-L609 HydrophobicContact CG-CG 4.37Å; R605-L609 WeakPolarHBondContact O-CB 3.33Å; R605-L609 VanDerWaalsContact O-CG 3.3Å; R605-L609 WeakPolarHBondContact O-CG 3.35Å; R605-L609 PolarHBondContact O-N 3.29Å; R605-S664 PolarHBondContact NH2-O 2.65Å; R605-N667 VanDerWaalsContact NH2-CB 3.3Å; R605-T668 HydrophobicContact CB-CG2 3.88Å; R605-T668 HydrophobicContact CG-CG2 4.49Å; R605-T668 PolarHBondContact NE-OG1 3.04Å; R605-T668 PolarHBondContact NH2-OG1 3.01Å; R605-V671 HydrophobicContact CG-CB 4.28Å; R605-V671 HydrophobicContact CG-CG1 4.17Å; R605-V671 HydrophobicContact CG-CG2 4.08Å
606	C	97.6	Very high	96.1	Very high	5 Å²	5	21.8 Å²	21.8	3%	0.034	12%	0.115	C	C	.	.	H	α-helix	trans	-55.3	-47.1	176.9	164.3	0	0	0	0	111.9	G563 K567 M602 L603 V604 S610	G563-C606 PolarHBondContact O-SG 3.2Å; K567-C606 WeakPolarHBondContact CA-SG 3.46Å; K567-C606 PolarHBondContact N-SG 3.24Å; K567-C606 VanDerWaalsContact N-SG 3.44Å; M602-C606 PolarHBondContact O-N 3.12Å; L603-C606 WeakPolarHBondContact O-CB 3.29Å; L603-C606 PolarHBondContact O-N 2.97Å; L603-C606 VanDerWaalsContact O-N 3.13Å; V604-C606 PolarHBondContact O-N 3.38Å; C606-S610 VanDerWaalsContact O-CB 3.28Å; C606-S610 WeakPolarHBondContact O-CB 3.34Å; C606-S610 PolarHBondContact O-N 3.32Å; C606-S610 PolarHBondContact O-OG 3.3Å
607	I	98.4	Very high	96.3	Very high	4 Å²	4	24 Å²	24	2%	0.021	12%	0.122	C	C	.	.	H	α-helix	trans	-65.3	-45.1	-177.9	-61.3	156.8	0	0	0	110.7	L603 V604 R605 S610 L611 L632 L633 V636	L603-I607 HydrophobicContact CD1-CD1 4.09Å; L603-I607 HydrophobicContact CD1-CG1 4.19Å; L603-I607 HydrophobicContact CG-CD1 3.88Å; L603-I607 HydrophobicContact CG-CG1 4.46Å; L603-I607 WeakPolarHBondContact O-CD1 3.33Å; L603-I607 VanDerWaalsContact O-CG1 3.29Å; L603-I607 WeakPolarHBondContact O-CG1 3.31Å; L603-I607 PolarHBondContact O-N 3.4Å; V604-I607 PolarHBondContact O-N 3.15Å; R605-I607 VanDerWaalsContact C-N 3.33Å; R605-I607 PolarHBondContact O-N 3.45Å; I607-S610 PolarHBondContact O-N 3.02Å; I607-L611 WeakPolarHBondContact O-CB 3.15Å; I607-L611 PolarHBondContact O-N 3.09Å; I607-L632 HydrophobicContact CD1-CD1 4.09Å; I607-L632 HydrophobicContact CD1-CD2 3.82Å; I607-L632 HydrophobicContact CD1-CG 4.2Å; I607-L632 HydrophobicContact CG1-CD2 4.02Å; I607-L632 HydrophobicContact CG1-CG 4.5Å; I607-L632 HydrophobicContact CG2-CD2 4.5Å; I607-L632 HydrophobicContact CG2-CG 4.18Å; I607-L633 HydrophobicContact CG2-CD2 4.36Å; I607-V636 HydrophobicContact CG2-CB 4.04Å; I607-V636 HydrophobicContact CG2-CG1 4.2Å; I607-V636 HydrophobicContact CG2-CG2 3.68Å
608	V	98.2	Very high	95.9	Very high	7 Å²	7	27.2 Å²	27.2	4%	0.042	14%	0.142	C	C	.	.	H	α-helix	trans	-65.9	-42.7	-179.4	176.8	0	0	0	0	111.4	V604 R605 D612 V636 I672 L675	V604-V608 HydrophobicContact CG1-CG2 4.43Å; V604-V608 WeakPolarHBondContact O-CG2 3.4Å; V604-V608 PolarHBondContact O-N 3.01Å; R605-V608 PolarHBondContact O-N 3.37Å; V608-D612 PolarHBondContact O-N 3.39Å; V608-D612 VanDerWaalsContact O-N 3.08Å; V608-V636 HydrophobicContact CG2-CG1 3.71Å; V608-I672 HydrophobicContact CG1-CG1 4.26Å; V608-I672 HydrophobicContact CG2-CG1 4.44Å; V608-L675 HydrophobicContact CG1-CD1 3.59Å
609	L	98.1	Very high	95.6	Very high	7 Å²	7	35 Å²	35	4%	0.037	18%	0.177	C	C	.	.	H	α-helix	trans	-63.5	-43.5	175.3	-75	169.3	0	0	0	111.8	F568 R605 D612 R613 V671 L675 I733	F568-L609 HydrophobicContact CE1-CB 3.76Å; F568-L609 HydrophobicContact CZ-CB 4.01Å; R605-L609 HydrophobicContact CG-CD1 3.82Å; R605-L609 HydrophobicContact CG-CG 4.37Å; R605-L609 WeakPolarHBondContact O-CB 3.33Å; R605-L609 VanDerWaalsContact O-CG 3.3Å; R605-L609 WeakPolarHBondContact O-CG 3.35Å; R605-L609 PolarHBondContact O-N 3.29Å; L609-D612 PolarHBondContact O-N 3.35Å; L609-R613 PolarHBondContact O-N 3.11Å; L609-V671 HydrophobicContact CD1-CG1 4.46Å; L609-V671 HydrophobicContact CD2-CG1 3.63Å; L609-V671 HydrophobicContact CG-CG1 3.81Å; L609-L675 HydrophobicContact CD2-CD1 4.3Å; L609-I733 HydrophobicContact CD2-CD1 3.98Å; L609-I733 HydrophobicContact CD2-CG1 4.44Å
610	S	98.1	Very high	95.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.8	-43.1	179.5	-57.7	0	0	0	0	111.3	F568 C606 I607 D612 R613 F614	F568-S610 PolarHBondContact N-OG 3.43Å; C606-S610 VanDerWaalsContact O-CB 3.28Å; C606-S610 WeakPolarHBondContact O-CB 3.34Å; C606-S610 PolarHBondContact O-N 3.32Å; C606-S610 PolarHBondContact O-OG 3.3Å; I607-S610 PolarHBondContact O-N 3.02Å; S610-D612 PolarHBondContact O-N 2.86Å; S610-R613 PolarHBondContact O-N 2.83Å; S610-F614 WeakPolarHBondContact O-CB 3.15Å; S610-F614 VanDerWaalsContact O-CD2 3.24Å; S610-F614 WeakPolarHBondContact O-CD2 3.45Å; S610-F614 WeakPolarHBondContact O-CG 3.21Å; S610-F614 PolarHBondContact O-N 2.87Å
611	L	97.9	Very high	95.2	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-56.9	-50	173.7	175.3	66.4	0	0	0	111.5	I607 R613 F614 E615 L627 L633 V636 A637	I607-L611 WeakPolarHBondContact O-CB 3.15Å; I607-L611 PolarHBondContact O-N 3.09Å; L611-R613 VanDerWaalsContact C-N 3.3Å; L611-R613 PolarHBondContact O-N 3.36Å; L611-F614 PolarHBondContact O-N 3.16Å; L611-E615 HydrophobicContact CD1-CG 4.1Å; L611-E615 HydrophobicContact CG-CG 4.44Å; L611-E615 WeakPolarHBondContact O-CG 3.13Å; L611-E615 PolarHBondContact O-N 3.48Å; L611-L627 HydrophobicContact CD1-CD2 3.79Å; L611-L633 HydrophobicContact CB-CD2 4.1Å; L611-L633 HydrophobicContact CD1-CB 4.47Å; L611-L633 HydrophobicContact CD1-CD2 4.39Å; L611-V636 HydrophobicContact CD2-CB 4.41Å; L611-V636 HydrophobicContact CD2-CG1 4.04Å; L611-A637 HydrophobicContact CD1-CB 4.36Å; L611-A637 HydrophobicContact CD2-CB 4.26Å
612	D	96.7	Very high	94.9	Very high	26 Å²	26	49.7 Å²	49.7	14%	0.139	25%	0.254	C	S	.	.	H	α-helix	trans	-59.3	-42.3	179.8	-172.6	71.8	0	0	0	112.2	V608 L609 S610 E615 S616 L675 R678 K679	V608-D612 PolarHBondContact O-N 3.39Å; V608-D612 VanDerWaalsContact O-N 3.08Å; L609-D612 PolarHBondContact O-N 3.35Å; S610-D612 PolarHBondContact O-N 2.86Å; D612-E615 PolarHBondContact O-N 3.02Å; D612-S616 PolarHBondContact O-N 3.48Å; D612-L675 HydrophobicContact CB-CD1 3.95Å; D612-L675 HydrophobicContact CB-CD2 4.05Å; D612-L675 HydrophobicContact CB-CG 4.47Å; D612-L675 VanDerWaalsContact OD2-CD2 3.26Å; D612-L675 WeakPolarHBondContact OD2-CD2 3.09Å; D612-R678 IonicContact OD2-NH1 3.63Å; D612-K679 WeakPolarHBondContact OD1-CE 3.46Å; D612-K679 IonicContact OD1-NZ 3Å; D612-K679 PolarHBondContact OD1-NZ 2.84Å
613	R	95.8	Very high	94.9	Very high	102 Å²	102	47.2 Å²	47.2	39%	0.385	24%	0.242	S	C	.	.	H	α-helix	trans	-63.6	-45.3	176.4	-173.7	174.2	-177.9	165.7	-1	111.8	F568 L609 S610 L611 S616 Q617	F568-R613 HydrophobicContact CD1-CB 3.96Å; F568-R613 HydrophobicContact CD1-CG 4.29Å; F568-R613 HydrophobicContact CE1-CB 4.19Å; F568-R613 VanDerWaalsContact CG-NH1 3.32Å; L609-R613 PolarHBondContact O-N 3.11Å; S610-R613 PolarHBondContact O-N 2.83Å; L611-R613 VanDerWaalsContact C-N 3.3Å; L611-R613 PolarHBondContact O-N 3.36Å; R613-S616 PolarHBondContact O-N 3.45Å; R613-S616 VanDerWaalsContact O-N 3.14Å; R613-S616 PolarHBondContact O-OG 3.42Å; R613-Q617 WeakPolarHBondContact O-CG 3.41Å; R613-Q617 PolarHBondContact O-N 3.5Å
614	F	96.8	Very high	94.7	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.009	26%	0.262	C	S	.	.	H	α-helix	trans	-66.5	-39.4	180	-62.8	-20.9	0	0	0	112.1	I570 F573 S610 L611 S616 Q617 V623 L627 L633	I570-F614 HydrophobicContact CG2-CD1 3.94Å; I570-F614 HydrophobicContact CG2-CE1 3.43Å; I570-F614 VanDerWaalsContact CG2-CE1 3.43Å; I570-F614 HydrophobicContact CG2-CE2 4.29Å; I570-F614 HydrophobicContact CG2-CZ 3.63Å; F573-F614 AromaticContact CD2-CE2 3.68Å; F573-F614 HydrophobicContact CD2-CE2 3.68Å; F573-F614 HydrophobicContact CD2-CZ 4.02Å; F573-F614 AromaticContact CE2-CE2 3.9Å; F573-F614 HydrophobicContact CE2-CE2 3.9Å; F573-F614 HydrophobicContact CE2-CZ 4.24Å; F573-F614 HydrophobicContact CG-CE2 4.31Å; S610-F614 WeakPolarHBondContact O-CB 3.15Å; S610-F614 VanDerWaalsContact O-CD2 3.24Å; S610-F614 WeakPolarHBondContact O-CD2 3.45Å; S610-F614 WeakPolarHBondContact O-CG 3.21Å; S610-F614 PolarHBondContact O-N 2.87Å; L611-F614 PolarHBondContact O-N 3.16Å; F614-S616 PolarHBondContact O-N 2.69Å; F614-Q617 PolarHBondContact O-N 2.91Å; F614-V623 HydrophobicContact CB-CG1 3.66Å; F614-V623 HydrophobicContact CD1-CG1 4.37Å; F614-V623 HydrophobicContact CG-CG1 4.2Å; F614-V623 WeakPolarHBondContact O-CG1 3.45Å; F614-L627 HydrophobicContact CB-CD1 4.21Å; F614-L627 HydrophobicContact CB-CD2 3.91Å; F614-L627 HydrophobicContact CB-CG 4.14Å; F614-L633 HydrophobicContact CD2-CD1 3.9Å; F614-L633 HydrophobicContact CE2-CD1 4.13Å
615	E	94.8	Very high	94.4	Very high	73 Å²	73	54.6 Å²	54.6	34%	0.341	28%	0.277	S	S	.	.	H	α-helix	trans	-62.5	-22.1	173.4	-73.7	179.8	166.5	0	0	112.9	L611 D612 T618 K679	L611-E615 HydrophobicContact CD1-CG 4.1Å; L611-E615 HydrophobicContact CG-CG 4.44Å; L611-E615 WeakPolarHBondContact O-CG 3.13Å; L611-E615 PolarHBondContact O-N 3.48Å; D612-E615 PolarHBondContact O-N 3.02Å; E615-T618 WeakPolarHBondContact O-CG2 3.25Å; E615-K679 IonicContact OE2-NZ 3.57Å; E615-K679 PolarHBondContact OE2-NZ 2.99Å
616	S	91.8	Very high	94.3	Very high	90 Å²	90	54.3 Å²	54.3	63%	0.629	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-5.7	173.5	74.8	0	0	0	0	114.3	D612 R613 F614	D612-S616 PolarHBondContact O-N 3.48Å; R613-S616 PolarHBondContact O-N 3.45Å; R613-S616 VanDerWaalsContact O-N 3.14Å; R613-S616 PolarHBondContact O-OG 3.42Å; F614-S616 PolarHBondContact O-N 2.69Å
617	Q	92.1	Very high	94.2	Very high	77 Å²	77	55.6 Å²	55.6	36%	0.36	28%	0.282	S	S	.	.			trans	-122.5	30.1	-173	-65.7	-178.8	-20.7	0	0	112.3	R613 F614 E619 D620 V623	R613-Q617 WeakPolarHBondContact O-CG 3.41Å; R613-Q617 PolarHBondContact O-N 3.5Å; F614-Q617 PolarHBondContact O-N 2.91Å; Q617-E619 PolarHBondContact O-N 2.94Å; Q617-D620 PolarHBondContact O-N 3.3Å; Q617-V623 HydrophobicContact CB-CG1 4.37Å; Q617-V623 HydrophobicContact CB-CG2 4.34Å
618	T	87.5	Confident	93.9	Very high	73 Å²	73	59.4 Å²	59.4	45%	0.448	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-10.1	-175	53.9	0	0	0	0	114.6	E615 D620 M624 L627	E615-T618 WeakPolarHBondContact O-CG2 3.25Å; T618-D620 VanDerWaalsContact C-N 3.27Å; T618-M624 WeakPolarHBondContact CB-SD 3.42Å; T618-M624 HydrophobicContact CG2-SD 3.53Å; T618-M624 VanDerWaalsContact CG2-SD 3.53Å; T618-M624 WeakPolarHBondContact O-CG 3.33Å; T618-L627 HydrophobicContact CG2-CD1 4.45Å
619	E	89.4	Confident	93.6	Very high	189 Å²	189	64.6 Å²	64.6	88%	0.883	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-24.1	172.9	-63.1	179.3	-177.9	0	0	112.3	Q617 V621	Q617-E619 PolarHBondContact O-N 2.94Å; E619-V621 PolarHBondContact O-N 2.83Å
620	D	89.8	Confident	93.5	Very high	75 Å²	75	64.3 Å²	64.3	40%	0.401	33%	0.332	S	S	.	.	S	Bend	trans	-81.5	114.9	174.5	-173.2	-23.3	0	0	0	110.3	Q617 T618 K622 V623 M624	Q617-D620 PolarHBondContact O-N 3.3Å; T618-D620 VanDerWaalsContact C-N 3.27Å; D620-K622 PolarHBondContact O-N 3.17Å; D620-K622 VanDerWaalsContact O-N 3.16Å; D620-K622 VanDerWaalsContact OD1-CB 3.32Å; D620-K622 WeakPolarHBondContact OD1-CB 3.22Å; D620-K622 PolarHBondContact OD1-N 2.99Å; D620-V623 HydrophobicContact CB-CB 4.12Å; D620-V623 HydrophobicContact CB-CG2 3.73Å; D620-V623 WeakPolarHBondContact O-CB 3.42Å; D620-V623 PolarHBondContact O-N 2.67Å; D620-M624 PolarHBondContact O-N 3.36Å; D620-M624 VanDerWaalsContact O-N 3.08Å
621	V	91.6	Very high	93.4	Very high	118 Å²	118	66 Å²	66	72%	0.715	34%	0.344	S	S	*	.	H	α-helix	trans	-54.1	-36	179	-179.7	0	0	0	0	112	E619 V623 M624 E625	E619-V621 PolarHBondContact O-N 2.83Å; V621-V623 VanDerWaalsContact C-N 3.35Å; V621-M624 PolarHBondContact O-N 2.97Å; V621-E625 WeakPolarHBondContact O-CB 3.45Å; V621-E625 PolarHBondContact O-N 3.27Å
622	K	91.2	Very high	93.4	Very high	125 Å²	125	66 Å²	66	54%	0.543	34%	0.343	S	S	.	.	H	α-helix	trans	-69.2	-34.7	178.9	-62.7	176.4	-178.4	171.2	0	111.8	I570 D620 V626	I570-K622 HydrophobicContact CD1-CB 4.14Å; D620-K622 PolarHBondContact O-N 3.17Å; D620-K622 VanDerWaalsContact O-N 3.16Å; D620-K622 VanDerWaalsContact OD1-CB 3.32Å; D620-K622 WeakPolarHBondContact OD1-CB 3.22Å; D620-K622 PolarHBondContact OD1-N 2.99Å; K622-V626 WeakPolarHBondContact O-CG2 3.47Å; K622-V626 PolarHBondContact O-N 3.06Å
623	V	93.2	Very high	93.5	Very high	1 Å²	1	64.8 Å²	64.8	1%	0.006	34%	0.337	C	S	.	.	H	α-helix	trans	-68.7	-44.3	176.6	176.3	0	0	0	0	109.7	I570 F614 Q617 D620 V621 E625 V626 L627	I570-V623 HydrophobicContact CG2-CG2 4.13Å; F614-V623 HydrophobicContact CB-CG1 3.66Å; F614-V623 HydrophobicContact CD1-CG1 4.37Å; F614-V623 HydrophobicContact CG-CG1 4.2Å; F614-V623 WeakPolarHBondContact O-CG1 3.45Å; Q617-V623 HydrophobicContact CB-CG1 4.37Å; Q617-V623 HydrophobicContact CB-CG2 4.34Å; D620-V623 HydrophobicContact CB-CB 4.12Å; D620-V623 HydrophobicContact CB-CG2 3.73Å; D620-V623 WeakPolarHBondContact O-CB 3.42Å; D620-V623 PolarHBondContact O-N 2.67Å; V621-V623 VanDerWaalsContact C-N 3.35Å; V623-E625 PolarHBondContact O-N 3.37Å; V623-V626 PolarHBondContact O-N 3.04Å; V623-L627 HydrophobicContact CG1-CD1 4.07Å; V623-L627 HydrophobicContact CG1-CG 4.45Å; V623-L627 WeakPolarHBondContact O-CG 3.14Å; V623-L627 PolarHBondContact O-N 2.88Å
624	M	93.3	Very high	93.5	Very high	85 Å²	85	62.3 Å²	62.3	42%	0.419	34%	0.336	S	S	.	.	H	α-helix	trans	-61.5	-43.1	177.9	-75.5	-57.8	-60.1	0	0	113	T618 D620 V621 V626 L627 S628	T618-M624 WeakPolarHBondContact CB-SD 3.42Å; T618-M624 HydrophobicContact CG2-SD 3.53Å; T618-M624 VanDerWaalsContact CG2-SD 3.53Å; T618-M624 WeakPolarHBondContact O-CG 3.33Å; D620-M624 PolarHBondContact O-N 3.36Å; D620-M624 VanDerWaalsContact O-N 3.08Å; V621-M624 PolarHBondContact O-N 2.97Å; M624-V626 VanDerWaalsContact C-N 3.34Å; M624-V626 PolarHBondContact O-N 2.81Å; M624-L627 PolarHBondContact O-N 3.01Å; M624-L627 HydrophobicContact SD-CD1 4.29Å; M624-S628 WeakPolarHBondContact O-CB 3.32Å; M624-S628 PolarHBondContact O-N 3.37Å; M624-S628 PolarHBondContact O-OG 3.42Å
625	E	93.3	Very high	93.5	Very high	73 Å²	73	64.6 Å²	64.6	34%	0.341	34%	0.344	S	S	.	.	H	α-helix	trans	-54.9	-50.1	173.5	-174.5	-166	155.2	0	0	110.6	K574 V621 V623 L627 S628 E629	K574-E625 IonicContact NZ-OE1 2.63Å; K574-E625 PolarHBondContact NZ-OE1 3.24Å; K574-E625 IonicContact NZ-OE2 2.76Å; K574-E625 PolarHBondContact NZ-OE2 3.36Å; V621-E625 WeakPolarHBondContact O-CB 3.45Å; V621-E625 PolarHBondContact O-N 3.27Å; V623-E625 PolarHBondContact O-N 3.37Å; E625-L627 PolarHBondContact O-N 3.07Å; E625-S628 PolarHBondContact O-N 2.98Å; E625-S628 VanDerWaalsContact O-N 3.17Å; E625-S628 PolarHBondContact O-OG 2.76Å; E625-E629 WeakPolarHBondContact O-CB 3.31Å; E625-E629 WeakPolarHBondContact O-CG 3.39Å; E625-E629 PolarHBondContact O-N 3.12Å
626	V	94.8	Very high	93.6	Very high	4 Å²	4	61.3 Å²	61.3	2%	0.024	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-43.2	179.7	174.3	0	0	0	0	112.6	I570 F573 K574 K622 V623 M624 S628 E629 C630 L633	I570-V626 HydrophobicContact CB-CG2 4.39Å; F573-V626 HydrophobicContact CB-CG1 3.89Å; K574-V626 HydrophobicContact CD-CG2 3.88Å; K574-V626 HydrophobicContact CG-CG2 3.4Å; K622-V626 WeakPolarHBondContact O-CG2 3.47Å; K622-V626 PolarHBondContact O-N 3.06Å; V623-V626 PolarHBondContact O-N 3.04Å; M624-V626 VanDerWaalsContact C-N 3.34Å; M624-V626 PolarHBondContact O-N 2.81Å; V626-S628 PolarHBondContact O-N 3.14Å; V626-E629 PolarHBondContact O-N 3.45Å; V626-C630 HydrophobicContact CG1-CB 4.25Å; V626-C630 WeakPolarHBondContact O-CB 3.46Å; V626-C630 PolarHBondContact O-N 2.98Å; V626-L633 HydrophobicContact CG1-CD1 3.68Å
627	L	94.8	Very high	93.9	Very high	32 Å²	32	58.9 Å²	58.9	17%	0.168	32%	0.315	C	S	.	.	H	α-helix	trans	-60.9	-36.1	176.7	-76.1	171.6	0	0	0	111.8	L611 F614 T618 V623 M624 E625 L633	L611-L627 HydrophobicContact CD1-CD2 3.79Å; F614-L627 HydrophobicContact CB-CD1 4.21Å; F614-L627 HydrophobicContact CB-CD2 3.91Å; F614-L627 HydrophobicContact CB-CG 4.14Å; T618-L627 HydrophobicContact CG2-CD1 4.45Å; V623-L627 HydrophobicContact CG1-CD1 4.07Å; V623-L627 HydrophobicContact CG1-CG 4.45Å; V623-L627 WeakPolarHBondContact O-CG 3.14Å; V623-L627 PolarHBondContact O-N 2.88Å; M624-L627 PolarHBondContact O-N 3.01Å; M624-L627 HydrophobicContact SD-CD1 4.29Å; E625-L627 PolarHBondContact O-N 3.07Å; L627-L633 HydrophobicContact CD2-CD1 4.37Å
628	S	92.1	Very high	94.1	Very high	85 Å²	85	62.6 Å²	62.6	59%	0.594	33%	0.325	S	S	*	.	H	α-helix	trans	-78.5	-32.9	-179.2	70.5	0	0	0	0	114.1	M624 E625 V626	M624-S628 WeakPolarHBondContact O-CB 3.32Å; M624-S628 PolarHBondContact O-N 3.37Å; M624-S628 PolarHBondContact O-OG 3.42Å; E625-S628 PolarHBondContact O-N 2.98Å; E625-S628 VanDerWaalsContact O-N 3.17Å; E625-S628 PolarHBondContact O-OG 2.76Å; V626-S628 PolarHBondContact O-N 3.14Å
629	E	93.2	Very high	94.5	Very high	115 Å²	115	60.5 Å²	60.5	54%	0.537	31%	0.312	S	S	.	.	H	α-helix	trans	-99.9	-27.8	-172.8	-67	-176.7	178.9	0	0	113.7	N577 E625 V626 C631	N577-E629 PolarHBondContact ND2-O 2.69Å; N577-E629 PolarHBondContact OD1-O 3.02Å; E625-E629 WeakPolarHBondContact O-CB 3.31Å; E625-E629 WeakPolarHBondContact O-CG 3.39Å; E625-E629 PolarHBondContact O-N 3.12Å; V626-E629 PolarHBondContact O-N 3.45Å; E629-C631 PolarHBondContact O-N 2.9Å
630	C	96.4	Very high	94.8	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.014	30%	0.295	C	S	.	.			trans	-74.6	112.8	-173	-174.9	0	0	0	0	111.2	N577 V626 L632 L633 S634	N577-C630 WeakPolarHBondContact OD1-CA 3.02Å; V626-C630 HydrophobicContact CG1-CB 4.25Å; V626-C630 WeakPolarHBondContact O-CB 3.46Å; V626-C630 PolarHBondContact O-N 2.98Å; C630-L632 VanDerWaalsContact C-N 3.27Å; C630-L632 PolarHBondContact O-N 3.08Å; C630-L633 HydrophobicContact CB-CB 4.04Å; C630-L633 HydrophobicContact CB-CD1 3.9Å; C630-L633 HydrophobicContact CB-CG 4.07Å; C630-L633 PolarHBondContact O-N 2.93Å; C630-S634 WeakPolarHBondContact O-CB 3.48Å; C630-S634 PolarHBondContact O-N 3.2Å; C630-S634 PolarHBondContact O-OG 2.69Å; C630-S634 VanDerWaalsContact O-OG 3.07Å
631	C	96	Very high	95.2	Very high	36 Å²	36	54.5 Å²	54.5	24%	0.243	28%	0.283	C	S	.	.	H	α-helix	trans	-59.2	-37.7	179.9	61.8	0	0	0	0	112.6	N577 F586 E629 Y635	N577-C631 PolarHBondContact OD1-N 3.17Å; N577-C631 PolarHBondContact OD1-SG 3.37Å; N577-C631 VanDerWaalsContact OD1-SG 3.39Å; F586-C631 HydrophobicContact CD2-CB 4.26Å; F586-C631 WeakPolarHBondContact CD2-SG 3.18Å; F586-C631 HydrophobicContact CE2-CB 4.22Å; F586-C631 HydrophobicContact CZ-CB 4.47Å; E629-C631 PolarHBondContact O-N 2.9Å; C631-Y635 WeakPolarHBondContact O-CB 3.28Å; C631-Y635 PolarHBondContact O-N 3.08Å
632	L	97.3	Very high	95.4	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-68.8	-45.9	179.8	-176.9	61.3	0	0	0	112.3	M566 F573 F576 F586 F589 I607 C630 Y635 V636	M566-L632 HydrophobicContact CE-CD2 4.44Å; F573-L632 HydrophobicContact CE1-CD2 4.2Å; F576-L632 HydrophobicContact CD1-CB 4.17Å; F576-L632 HydrophobicContact CD1-CD2 4.23Å; F576-L632 HydrophobicContact CD2-CD2 4.49Å; F576-L632 HydrophobicContact CE1-CB 3.65Å; F576-L632 HydrophobicContact CE1-CD2 3.87Å; F576-L632 HydrophobicContact CE1-CG 4.32Å; F576-L632 HydrophobicContact CE2-CD2 4.12Å; F576-L632 HydrophobicContact CZ-CB 4.25Å; F576-L632 HydrophobicContact CZ-CD2 3.8Å; F576-L632 HydrophobicContact CZ-CG 4.48Å; F586-L632 HydrophobicContact CE2-CB 4.15Å; F586-L632 HydrophobicContact CE2-CD1 4.17Å; F589-L632 HydrophobicContact CE1-CD1 4.09Å; F589-L632 HydrophobicContact CE1-CD2 4.21Å; I607-L632 HydrophobicContact CD1-CD1 4.09Å; I607-L632 HydrophobicContact CD1-CD2 3.82Å; I607-L632 HydrophobicContact CD1-CG 4.2Å; I607-L632 HydrophobicContact CG1-CD2 4.02Å; I607-L632 HydrophobicContact CG1-CG 4.5Å; I607-L632 HydrophobicContact CG2-CD2 4.5Å; I607-L632 HydrophobicContact CG2-CG 4.18Å; C630-L632 VanDerWaalsContact C-N 3.27Å; C630-L632 PolarHBondContact O-N 3.08Å; L632-Y635 PolarHBondContact O-N 3.49Å; L632-V636 PolarHBondContact O-N 3.3Å
633	L	97.6	Very high	95.7	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-66.3	-42.5	176.9	-67.5	174.9	0	0	0	110.7	F573 I607 L611 F614 V626 L627 C630 Y635 V636 A637	F573-L633 HydrophobicContact CB-CD1 4.43Å; F573-L633 HydrophobicContact CD1-CD1 3.96Å; F573-L633 HydrophobicContact CD1-CD2 3.95Å; F573-L633 HydrophobicContact CD1-CG 3.77Å; F573-L633 HydrophobicContact CE1-CD1 4.45Å; F573-L633 HydrophobicContact CE1-CD2 3.6Å; F573-L633 HydrophobicContact CE1-CG 3.94Å; F573-L633 HydrophobicContact CG-CD1 4.18Å; F573-L633 HydrophobicContact CG-CG 4.48Å; F573-L633 HydrophobicContact CZ-CD2 4.08Å; I607-L633 HydrophobicContact CG2-CD2 4.36Å; L611-L633 HydrophobicContact CB-CD2 4.1Å; L611-L633 HydrophobicContact CD1-CB 4.47Å; L611-L633 HydrophobicContact CD1-CD2 4.39Å; F614-L633 HydrophobicContact CD2-CD1 3.9Å; F614-L633 HydrophobicContact CE2-CD1 4.13Å; V626-L633 HydrophobicContact CG1-CD1 3.68Å; L627-L633 HydrophobicContact CD2-CD1 4.37Å; C630-L633 HydrophobicContact CB-CB 4.04Å; C630-L633 HydrophobicContact CB-CD1 3.9Å; C630-L633 HydrophobicContact CB-CG 4.07Å; C630-L633 PolarHBondContact O-N 2.93Å; L633-Y635 VanDerWaalsContact C-N 3.3Å; L633-Y635 PolarHBondContact O-N 2.9Å; L633-V636 CarbonylContact O-C 3.43Å; L633-V636 PolarHBondContact O-N 3.15Å; L633-A637 VanDerWaalsContact O-CB 3.25Å; L633-A637 WeakPolarHBondContact O-CB 3.32Å; L633-A637 PolarHBondContact O-N 2.9Å
634	S	96.6	Very high	95.9	Very high	51 Å²	51	48 Å²	48	36%	0.357	25%	0.251	S	S	.	.	H	α-helix	trans	-58.8	-40.7	174.7	-68.4	0	0	0	0	112.2	C630 A637	C630-S634 WeakPolarHBondContact O-CB 3.48Å; C630-S634 PolarHBondContact O-N 3.2Å; C630-S634 PolarHBondContact O-OG 2.69Å; C630-S634 VanDerWaalsContact O-OG 3.07Å; S634-A637 PolarHBondContact O-N 3.34Å
635	Y	97.5	Very high	96.1	Very high	49 Å²	49	44.4 Å²	44.4	19%	0.192	23%	0.233	C	C	.	.	H	α-helix	trans	-63.1	-49.1	175.1	177.2	-95.7	0	0	0	111.7	F586 L590 C631 L632 L633 A637 R638 N641 F645	F586-Y635 HydrophobicContact CE1-CD2 4.34Å; F586-Y635 HydrophobicContact CE1-CG 4.42Å; F586-Y635 HydrophobicContact CZ-CD2 4.41Å; F586-Y635 HydrophobicContact CZ-CG 4.05Å; L590-Y635 HydrophobicContact CD1-CD1 4.49Å; L590-Y635 HydrophobicContact CD1-CD2 4.07Å; L590-Y635 HydrophobicContact CD1-CE1 4.29Å; L590-Y635 HydrophobicContact CD1-CE2 3.85Å; L590-Y635 HydrophobicContact CD1-CG 4.4Å; L590-Y635 HydrophobicContact CD2-CD1 4.1Å; L590-Y635 HydrophobicContact CD2-CE1 3.89Å; C631-Y635 WeakPolarHBondContact O-CB 3.28Å; C631-Y635 PolarHBondContact O-N 3.08Å; L632-Y635 PolarHBondContact O-N 3.49Å; L633-Y635 VanDerWaalsContact C-N 3.3Å; L633-Y635 PolarHBondContact O-N 2.9Å; Y635-A637 VanDerWaalsContact C-N 3.31Å; Y635-A637 PolarHBondContact O-N 2.99Å; Y635-R638 WeakPolarHBondContact O-CB 3.34Å; Y635-R638 PolarHBondContact O-N 3.1Å; Y635-N641 HydrophobicContact CD1-CB 4.41Å; Y635-N641 WeakPolarHBondContact CD2-ND2 3.32Å; Y635-N641 HydrophobicContact CE1-CB 4Å; Y635-N641 HydrophobicContact CE2-CB 4.48Å; Y635-N641 WeakPolarHBondContact CE2-ND2 3.27Å; Y635-N641 VanDerWaalsContact CZ-CG 3.49Å; Y635-N641 PolarHBondContact O-ND2 3Å; Y635-F645 AromaticContact CE1-CE2 4Å; Y635-F645 HydrophobicContact CE1-CE2 4Å; Y635-F645 HydrophobicContact CE1-CZ 4.27Å
636	V	97.2	Very high	96.3	Very high	5 Å²	5	40.9 Å²	40.9	3%	0.03	22%	0.217	C	C	.	.	H	α-helix	trans	-75.3	-18.6	-179.2	179.7	0	0	0	0	112.8	I607 V608 L611 L632 L633 R638 R642	I607-V636 HydrophobicContact CG2-CB 4.04Å; I607-V636 HydrophobicContact CG2-CG1 4.2Å; I607-V636 HydrophobicContact CG2-CG2 3.68Å; V608-V636 HydrophobicContact CG2-CG1 3.71Å; L611-V636 HydrophobicContact CD2-CB 4.41Å; L611-V636 HydrophobicContact CD2-CG1 4.04Å; L632-V636 PolarHBondContact O-N 3.3Å; L633-V636 CarbonylContact O-C 3.43Å; L633-V636 PolarHBondContact O-N 3.15Å; V636-R638 PolarHBondContact O-N 3.32Å; V636-R642 HydrophobicContact CG1-CG 4.13Å; V636-R642 WeakPolarHBondContact O-CD 3.32Å; V636-R642 VanDerWaalsContact O-CG 3.22Å; V636-R642 WeakPolarHBondContact O-CG 3.46Å; V636-R642 PolarHBondContact O-NH1 3.14Å
637	A	96.6	Very high	96.4	Very high	38 Å²	38	41.6 Å²	41.6	31%	0.314	22%	0.219	S	C	.	.	H	α-helix	trans	-63.9	-27.2	172.9	0	0	0	0	0	112.7	L611 L633 S634 Y635 R642	L611-A637 HydrophobicContact CD1-CB 4.36Å; L611-A637 HydrophobicContact CD2-CB 4.26Å; L633-A637 VanDerWaalsContact O-CB 3.25Å; L633-A637 WeakPolarHBondContact O-CB 3.32Å; L633-A637 PolarHBondContact O-N 2.9Å; S634-A637 PolarHBondContact O-N 3.34Å; Y635-A637 VanDerWaalsContact C-N 3.31Å; Y635-A637 PolarHBondContact O-N 2.99Å; A637-R642 VanDerWaalsContact C-NH1 3.29Å; A637-R642 VanDerWaalsContact CA-NH1 3.31Å; A637-R642 PolarHBondContact O-NH1 3.27Å; A637-R642 PolarHBondContact O-NH2 3.47Å
638	R	96.9	Very high	96.5	Very high	156 Å²	156	43.5 Å²	43.5	59%	0.589	23%	0.225	S	C	*	.	S	Bend	trans	-71.6	126.8	176.4	-60.1	-178.9	73.4	170.4	5.1	110.6	Y635 V636 E640 N641 R642	Y635-R638 WeakPolarHBondContact O-CB 3.34Å; Y635-R638 PolarHBondContact O-N 3.1Å; V636-R638 PolarHBondContact O-N 3.32Å; R638-E640 PolarHBondContact O-N 3.08Å; R638-N641 PolarHBondContact O-N 3.44Å; R638-R642 PolarHBondContact O-N 2.96Å
639	V	95.4	Very high	96.7	Very high	29 Å²	29	39.5 Å²	39.5	18%	0.176	20%	0.196	C	C	.	.	H	α-helix	trans	-65.8	-31.5	-174.2	76.9	0	0	0	0	111.8	N641 R642 L643 F684 Y685	V639-N641 VanDerWaalsContact C-N 3.32Å; V639-N641 PolarHBondContact O-N 3.18Å; V639-R642 PolarHBondContact O-N 3.15Å; V639-L643 HydrophobicContact CG2-CD1 4.35Å; V639-L643 WeakPolarHBondContact O-CB 3.39Å; V639-L643 WeakPolarHBondContact O-CG 3.39Å; V639-L643 PolarHBondContact O-N 3.34Å; V639-F684 HydrophobicContact CG1-CE1 4.29Å; V639-F684 HydrophobicContact CG1-CZ 4.35Å; V639-F684 HydrophobicContact CG2-CD1 4.46Å; V639-F684 HydrophobicContact CG2-CE1 3.69Å; V639-Y685 HydrophobicContact CG2-CE2 3.94Å
640	E	96.5	Very high	96.9	Very high	111 Å²	111	34 Å²	34	52%	0.519	17%	0.171	S	C	.	.	H	α-helix	trans	-63.1	-39.7	179.1	-55.5	75.8	-162.5	0	0	111.2	R638 L643 S644	R638-E640 PolarHBondContact O-N 3.08Å; E640-L643 PolarHBondContact O-N 2.96Å; E640-S644 WeakPolarHBondContact O-CB 3.41Å; E640-S644 PolarHBondContact O-N 3.33Å
641	N	97.3	Very high	96.8	Very high	26 Å²	26	37.7 Å²	37.7	14%	0.139	19%	0.19	C	C	.	.	H	α-helix	trans	-70.4	-41.2	178.3	-68.8	-29.3	0	0	0	111.3	Y635 R638 V639 L643 S644 F645	Y635-N641 HydrophobicContact CD1-CB 4.41Å; Y635-N641 WeakPolarHBondContact CD2-ND2 3.32Å; Y635-N641 HydrophobicContact CE1-CB 4Å; Y635-N641 HydrophobicContact CE2-CB 4.48Å; Y635-N641 WeakPolarHBondContact CE2-ND2 3.27Å; Y635-N641 VanDerWaalsContact CZ-CG 3.49Å; Y635-N641 PolarHBondContact O-ND2 3Å; R638-N641 PolarHBondContact O-N 3.44Å; V639-N641 VanDerWaalsContact C-N 3.32Å; V639-N641 PolarHBondContact O-N 3.18Å; N641-L643 VanDerWaalsContact C-N 3.34Å; N641-L643 PolarHBondContact O-N 3.45Å; N641-S644 WeakPolarHBondContact O-CB 3.4Å; N641-S644 PolarHBondContact O-N 3.01Å; N641-F645 VanDerWaalsContact O-CD2 3.24Å; N641-F645 WeakPolarHBondContact O-CD2 3.5Å; N641-F645 PolarHBondContact O-N 3.42Å
642	R	97.3	Very high	96.7	Very high	32 Å²	32	39.5 Å²	39.5	12%	0.121	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-41.6	173.2	-67.8	-173.8	-69	-108.6	-4.2	112	V636 A637 R638 V639 F645 L646 Y685	V636-R642 HydrophobicContact CG1-CG 4.13Å; V636-R642 WeakPolarHBondContact O-CD 3.32Å; V636-R642 VanDerWaalsContact O-CG 3.22Å; V636-R642 WeakPolarHBondContact O-CG 3.46Å; V636-R642 PolarHBondContact O-NH1 3.14Å; A637-R642 VanDerWaalsContact C-NH1 3.29Å; A637-R642 VanDerWaalsContact CA-NH1 3.31Å; A637-R642 PolarHBondContact O-NH1 3.27Å; A637-R642 PolarHBondContact O-NH2 3.47Å; R638-R642 PolarHBondContact O-N 2.96Å; V639-R642 PolarHBondContact O-N 3.15Å; R642-F645 PolarHBondContact O-N 2.59Å; R642-L646 WeakPolarHBondContact O-CB 3.39Å; R642-L646 PolarHBondContact O-N 3.13Å; R642-Y685 HydrophobicContact CB-CE1 4.44Å; R642-Y685 PolarHBondContact NE-OH 2.95Å
643	L	97.3	Very high	96.6	Very high	28 Å²	28	39.4 Å²	39.4	15%	0.147	20%	0.196	C	C	.	.	H	α-helix	trans	-64.9	-39.4	175.8	-77	169.3	0	0	0	111.9	V639 E640 N641 L646 F647 F684 Y685 A688	V639-L643 HydrophobicContact CG2-CD1 4.35Å; V639-L643 WeakPolarHBondContact O-CB 3.39Å; V639-L643 WeakPolarHBondContact O-CG 3.39Å; V639-L643 PolarHBondContact O-N 3.34Å; E640-L643 PolarHBondContact O-N 2.96Å; N641-L643 VanDerWaalsContact C-N 3.34Å; N641-L643 PolarHBondContact O-N 3.45Å; L643-L646 PolarHBondContact O-N 2.83Å; L643-F647 VanDerWaalsContact O-CB 3.25Å; L643-F647 WeakPolarHBondContact O-CB 3.49Å; L643-F647 PolarHBondContact O-N 3.16Å; L643-F684 HydrophobicContact CD1-CE1 4.01Å; L643-F684 HydrophobicContact CD1-CZ 4.46Å; L643-Y685 HydrophobicContact CD2-CD1 3.43Å; L643-Y685 VanDerWaalsContact CD2-CD1 3.43Å; L643-Y685 HydrophobicContact CD2-CE1 3.85Å; L643-Y685 HydrophobicContact CD2-CG 4Å; L643-Y685 HydrophobicContact CG-CD1 4.22Å; L643-Y685 HydrophobicContact CG-CE1 4.14Å; L643-A688 HydrophobicContact CD1-CB 3.7Å; L643-A688 HydrophobicContact CD2-CB 3.75Å; L643-A688 HydrophobicContact CG-CB 4.38Å
644	S	96.4	Very high	96.5	Very high	48 Å²	48	41.8 Å²	41.8	34%	0.336	21%	0.209	S	C	.	.	H	α-helix	trans	-60.1	-47.2	174.8	-174.1	0	0	0	0	111.8	E640 N641 R648	E640-S644 WeakPolarHBondContact O-CB 3.41Å; E640-S644 PolarHBondContact O-N 3.33Å; N641-S644 WeakPolarHBondContact O-CB 3.4Å; N641-S644 PolarHBondContact O-N 3.01Å; S644-R648 VanDerWaalsContact O-CG 3.31Å; S644-R648 WeakPolarHBondContact O-CG 3.3Å; S644-R648 PolarHBondContact O-N 2.98Å; S644-R648 VanDerWaalsContact O-N 3.13Å
645	F	97.8	Very high	96.2	Very high	9 Å²	9	39.7 Å²	39.7	4%	0.039	19%	0.194	C	C	.	.	H	α-helix	trans	-61.6	-49.2	173.9	-74.8	-57.5	0	0	0	112.1	I593 L597 V604 Y635 N641 R642 F647 R648 L649	I593-F645 HydrophobicContact CG2-CE1 3.94Å; I593-F645 HydrophobicContact CG2-CZ 4.24Å; L597-F645 HydrophobicContact CD1-CD1 3.88Å; L597-F645 HydrophobicContact CD1-CE1 4.15Å; V604-F645 HydrophobicContact CG1-CB 4.41Å; V604-F645 HydrophobicContact CG1-CD1 4.3Å; V604-F645 HydrophobicContact CG1-CD2 4.19Å; V604-F645 HydrophobicContact CG1-CG 4.07Å; V604-F645 HydrophobicContact CG2-CD1 4.38Å; V604-F645 HydrophobicContact CG2-CE1 4.16Å; V604-F645 HydrophobicContact CG2-CZ 4.46Å; Y635-F645 AromaticContact CE1-CE2 4Å; Y635-F645 HydrophobicContact CE1-CE2 4Å; Y635-F645 HydrophobicContact CE1-CZ 4.27Å; N641-F645 VanDerWaalsContact O-CD2 3.24Å; N641-F645 WeakPolarHBondContact O-CD2 3.5Å; N641-F645 PolarHBondContact O-N 3.42Å; R642-F645 PolarHBondContact O-N 2.59Å; F645-F647 VanDerWaalsContact C-N 3.35Å; F645-F647 PolarHBondContact O-N 3.02Å; F645-R648 PolarHBondContact O-N 3.34Å; F645-L649 WeakPolarHBondContact O-CB 3.35Å; F645-L649 VanDerWaalsContact O-CG 3.22Å; F645-L649 WeakPolarHBondContact O-CG 3.36Å; F645-L649 PolarHBondContact O-N 3.14Å
646	L	98	Very high	95.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-56.5	-49.4	-179.5	178.5	63.3	0	0	0	111.7	R642 L643 R648 L649 I650 I672 L673 Y685 L689	R642-L646 WeakPolarHBondContact O-CB 3.39Å; R642-L646 PolarHBondContact O-N 3.13Å; L643-L646 PolarHBondContact O-N 2.83Å; L646-R648 PolarHBondContact O-N 3.22Å; L646-L649 PolarHBondContact O-N 3.06Å; L646-I650 HydrophobicContact CD1-CD1 3.74Å; L646-I650 HydrophobicContact CD1-CG1 4.3Å; L646-I650 HydrophobicContact CG-CD1 3.98Å; L646-I650 WeakPolarHBondContact O-CG1 3.38Å; L646-I650 PolarHBondContact O-N 3.19Å; L646-I650 VanDerWaalsContact O-N 3.14Å; L646-I672 HydrophobicContact CB-CD1 4.35Å; L646-I672 HydrophobicContact CB-CG2 4.36Å; L646-I672 HydrophobicContact CD1-CB 4.44Å; L646-I672 HydrophobicContact CD1-CG2 4.49Å; L646-I672 HydrophobicContact CD2-CG2 4.37Å; L646-L673 HydrophobicContact CD1-CG 4.21Å; L646-L673 HydrophobicContact CD2-CD2 3.65Å; L646-L673 HydrophobicContact CD2-CG 4.1Å; L646-Y685 HydrophobicContact CD2-CD1 3.77Å; L646-Y685 HydrophobicContact CD2-CE1 4.47Å; L646-L689 HydrophobicContact CD2-CD1 4.09Å; L646-L689 HydrophobicContact CD2-CD2 4.22Å; L646-L689 HydrophobicContact CD2-CG 4.38Å; L646-L689 HydrophobicContact CG-CD1 4.49Å; L646-L689 HydrophobicContact CG-CD2 4.3Å
647	F	96.8	Very high	95.4	Very high	18 Å²	18	44.6 Å²	44.6	8%	0.079	22%	0.223	C	C	.	.	H	α-helix	trans	-56.1	-50.4	178	172.9	-100.3	0	0	0	111.5	L643 F645 I650 N651 L689 K692 Y698 L702	L643-F647 VanDerWaalsContact O-CB 3.25Å; L643-F647 WeakPolarHBondContact O-CB 3.49Å; L643-F647 PolarHBondContact O-N 3.16Å; F645-F647 VanDerWaalsContact C-N 3.35Å; F645-F647 PolarHBondContact O-N 3.02Å; F647-I650 PolarHBondContact O-N 3.29Å; F647-N651 VanDerWaalsContact O-CB 3.3Å; F647-N651 WeakPolarHBondContact O-CB 3.39Å; F647-N651 PolarHBondContact O-N 3.47Å; F647-L689 HydrophobicContact CB-CD2 4.22Å; F647-K692 HydrophobicContact CD1-CG 4.49Å; F647-K692 HydrophobicContact CD2-CB 4.29Å; F647-K692 HydrophobicContact CD2-CD 4.39Å; F647-K692 HydrophobicContact CD2-CG 3.6Å; F647-K692 HydrophobicContact CE2-CB 4.44Å; F647-K692 HydrophobicContact CE2-CG 3.63Å; F647-K692 HydrophobicContact CG-CD 4.38Å; F647-K692 HydrophobicContact CG-CG 4.07Å; F647-K692 HydrophobicContact CZ-CG 4.13Å; F647-Y698 HydrophobicContact CZ-CE2 4.43Å; F647-Y698 VanDerWaalsContact CZ-OH 3.27Å; F647-Y698 WeakPolarHBondContact CZ-OH 3.44Å; F647-L702 HydrophobicContact CD2-CD1 4.18Å; F647-L702 HydrophobicContact CD2-CD2 3.48Å; F647-L702 VanDerWaalsContact CD2-CD2 3.48Å; F647-L702 HydrophobicContact CD2-CG 4.45Å; F647-L702 HydrophobicContact CE2-CD1 4.04Å; F647-L702 HydrophobicContact CE2-CD2 3.75Å; F647-L702 HydrophobicContact CE2-CG 4.4Å
648	R	96.3	Very high	95.2	Very high	73 Å²	73	42.8 Å²	42.8	28%	0.275	21%	0.208	S	C	.	.	H	α-helix	trans	-67.4	-41.3	-178.4	-68	178.2	67.6	-157.7	-1.7	112.8	N594 L597 S644 F645 L646 I650 N651 I652	N594-R648 PolarHBondContact O-NH2 3.48Å; N594-R648 PolarHBondContact OD1-NH1 3.35Å; L597-R648 HydrophobicContact CD2-CB 3.51Å; S644-R648 VanDerWaalsContact O-CG 3.31Å; S644-R648 WeakPolarHBondContact O-CG 3.3Å; S644-R648 PolarHBondContact O-N 2.98Å; S644-R648 VanDerWaalsContact O-N 3.13Å; F645-R648 PolarHBondContact O-N 3.34Å; L646-R648 PolarHBondContact O-N 3.22Å; R648-I650 VanDerWaalsContact C-N 3.32Å; R648-I650 PolarHBondContact O-N 2.89Å; R648-N651 PolarHBondContact O-N 2.63Å; R648-I652 WeakPolarHBondContact O-CD1 3.25Å; R648-I652 WeakPolarHBondContact O-CG1 3.42Å; R648-I652 PolarHBondContact O-N 3.41Å
649	L	97.4	Very high	94.9	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.8	-41.3	179.3	-74.4	167.7	0	0	0	111.8	L597 N601 F645 L646 I653 C665 T668 S669 I672	L597-L649 HydrophobicContact CD1-CD2 4.2Å; L597-L649 HydrophobicContact CD2-CD2 4.01Å; L597-L649 HydrophobicContact CD2-CG 4.06Å; L597-L649 HydrophobicContact CG-CD2 3.82Å; L597-L649 HydrophobicContact CG-CG 4.37Å; N601-L649 HydrophobicContact CB-CD2 3.84Å; F645-L649 WeakPolarHBondContact O-CB 3.35Å; F645-L649 VanDerWaalsContact O-CG 3.22Å; F645-L649 WeakPolarHBondContact O-CG 3.36Å; F645-L649 PolarHBondContact O-N 3.14Å; L646-L649 PolarHBondContact O-N 3.06Å; L649-I653 WeakPolarHBondContact O-CG1 3.43Å; L649-C665 HydrophobicContact CD2-CB 3.95Å; L649-T668 HydrophobicContact CD1-CG2 3.64Å; L649-S669 WeakPolarHBondContact CB-OG 3.4Å; L649-I672 HydrophobicContact CD1-CD1 4.11Å
650	I	96.7	Very high	94.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-69.6	-41	176.3	-64.3	168.7	0	0	0	110.4	L646 F647 R648 I652 L689 L702 N705 F706	L646-I650 HydrophobicContact CD1-CD1 3.74Å; L646-I650 HydrophobicContact CD1-CG1 4.3Å; L646-I650 HydrophobicContact CG-CD1 3.98Å; L646-I650 WeakPolarHBondContact O-CG1 3.38Å; L646-I650 PolarHBondContact O-N 3.19Å; L646-I650 VanDerWaalsContact O-N 3.14Å; F647-I650 PolarHBondContact O-N 3.29Å; R648-I650 VanDerWaalsContact C-N 3.32Å; R648-I650 PolarHBondContact O-N 2.89Å; I650-I652 PolarHBondContact O-N 2.95Å; I650-L689 HydrophobicContact CD1-CD1 4.09Å; I650-L702 HydrophobicContact CB-CD1 3.95Å; I650-L702 HydrophobicContact CG2-CD1 3.56Å; I650-L702 HydrophobicContact CG2-CG 3.89Å; I650-N705 PolarHBondContact O-ND2 2.98Å; I650-N705 VanDerWaalsContact O-ND2 3.15Å; I650-F706 HydrophobicContact CD1-CB 4.46Å; I650-F706 HydrophobicContact CD1-CD1 3.94Å; I650-F706 HydrophobicContact CD1-CD2 3.96Å; I650-F706 HydrophobicContact CD1-CE1 4.17Å; I650-F706 HydrophobicContact CD1-CE2 4.19Å; I650-F706 HydrophobicContact CD1-CG 3.85Å; I650-F706 HydrophobicContact CD1-CZ 4.3Å; I650-F706 HydrophobicContact CG1-CD2 3.97Å; I650-F706 HydrophobicContact CG1-CE2 4.26Å; I650-F706 HydrophobicContact CG1-CG 4.29Å; I650-F706 HydrophobicContact CG2-CB 3.76Å; I650-F706 HydrophobicContact CG2-CD2 4.17Å; I650-F706 HydrophobicContact CG2-CG 4.12Å
651	N	94.4	Very high	93.8	Very high	79 Å²	79	40.8 Å²	40.8	42%	0.422	21%	0.205	S	C	.	.	H	α-helix	trans	-73.6	-23.5	-173.4	-160.7	52.6	0	0	0	114.4	F647 R648 I653 L702	F647-N651 VanDerWaalsContact O-CB 3.3Å; F647-N651 WeakPolarHBondContact O-CB 3.39Å; F647-N651 PolarHBondContact O-N 3.47Å; R648-N651 PolarHBondContact O-N 2.63Å; N651-I653 VanDerWaalsContact C-N 3.34Å; N651-L702 HydrophobicContact CB-CD1 3.81Å
652	I	94.6	Very high	93.5	Very high	74 Å²	74	40.7 Å²	40.7	38%	0.379	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-18.2	-178.9	-69.2	164.5	0	0	0	112.4	L597 V598 R648 I650	L597-I652 HydrophobicContact CB-CD1 4.11Å; L597-I652 HydrophobicContact CD2-CD1 3.99Å; L597-I652 HydrophobicContact CG-CD1 4.46Å; V598-I652 HydrophobicContact CG2-CG2 3.6Å; R648-I652 WeakPolarHBondContact O-CD1 3.25Å; R648-I652 WeakPolarHBondContact O-CG1 3.42Å; R648-I652 PolarHBondContact O-N 3.41Å; I650-I652 PolarHBondContact O-N 2.95Å
653	I	95.1	Very high	93.3	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.201	C	C	.	.			trans	-120.1	151.4	-176.2	59.9	171.2	0	0	0	111.6	L649 N651 L658 N662 C665 L666 N705 L709	L649-I653 WeakPolarHBondContact O-CG1 3.43Å; N651-I653 VanDerWaalsContact C-N 3.34Å; I653-L658 HydrophobicContact CB-CD2 4.12Å; I653-L658 HydrophobicContact CD1-CD2 4.11Å; I653-L658 HydrophobicContact CG2-CD2 4.39Å; I653-N662 HydrophobicContact CG2-CB 4.12Å; I653-C665 HydrophobicContact CD1-CB 4.03Å; I653-C665 HydrophobicContact CG2-CB 4.12Å; I653-L666 HydrophobicContact CD1-CB 3.68Å; I653-N705 PolarHBondContact O-ND2 3.03Å; I653-L709 HydrophobicContact CD1-CD1 3.99Å; I653-L709 HydrophobicContact CD1-CD2 4.17Å; I653-L709 HydrophobicContact CG1-CD1 3.85Å; I653-L709 HydrophobicContact CG1-CD2 4.3Å
654	N	93.8	Very high	93.2	Very high	51 Å²	51	39.1 Å²	39.1	27%	0.273	20%	0.2	S	C	.	.			trans	-146.2	165.5	166.1	62.7	66.7	0	0	0	109.1	Q656 T657 L658 N705	N654-Q656 PolarHBondContact O-N 2.93Å; N654-Q656 VanDerWaalsContact O-N 3.13Å; N654-Q656 WeakPolarHBondContact OD1-CA 3.43Å; N654-Q656 WeakPolarHBondContact OD1-CB 3.43Å; N654-Q656 PolarHBondContact OD1-N 2.99Å; N654-Q656 VanDerWaalsContact OD1-N 3.07Å; N654-Q656 PolarHBondContact OD1-OE1 3.47Å; N654-Q656 VanDerWaalsContact OD1-OE1 3.13Å; N654-T657 PolarHBondContact N-OG1 3.22Å; N654-T657 PolarHBondContact ND2-OG1 2.94Å; N654-T657 PolarHBondContact O-N 2.85Å; N654-T657 PolarHBondContact O-OG1 3.3Å; N654-T657 WeakPolarHBondContact OD1-CG2 3.41Å; N654-T657 PolarHBondContact OD1-N 2.8Å; N654-T657 VanDerWaalsContact OD1-N 3.08Å; N654-T657 PolarHBondContact OD1-OG1 3.11Å; N654-L658 WeakPolarHBondContact O-CG 3.33Å; N654-L658 PolarHBondContact O-N 3.38Å; N654-L658 VanDerWaalsContact O-N 3.08Å; N654-N705 WeakPolarHBondContact CA-OD1 3.37Å; N654-N705 WeakPolarHBondContact CB-OD1 3.36Å
655	V	91.8	Very high	93.2	Very high	6 Å²	6	36.8 Å²	36.8	4%	0.036	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-33.2	-174	178	0	0	0	0	112.4	L253 T657 N708 L709 F712	L253-V655 HydrophobicContact CD1-CG1 4.47Å; L253-V655 HydrophobicContact CD2-CG1 4.16Å; V655-T657 VanDerWaalsContact C-N 3.32Å; V655-N708 HydrophobicContact CG2-CB 4.06Å; V655-L709 HydrophobicContact CG2-CD2 4.08Å; V655-L709 HydrophobicContact CG2-CG 4.37Å; V655-F712 HydrophobicContact CG1-CB 4.24Å; V655-F712 HydrophobicContact CG1-CD2 4.15Å; V655-F712 HydrophobicContact CG1-CG 4.39Å; V655-F712 HydrophobicContact CG2-CB 4.06Å
656	Q	89.2	Confident	93.2	Very high	96 Å²	96	36.4 Å²	36.4	45%	0.449	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-7.8	-179.9	-58.3	81.8	-0.6	0	0	113.7	T251 N654	T251-Q656 WeakPolarHBondContact CG2-O 3.38Å; N654-Q656 PolarHBondContact O-N 2.93Å; N654-Q656 VanDerWaalsContact O-N 3.13Å; N654-Q656 WeakPolarHBondContact OD1-CA 3.43Å; N654-Q656 WeakPolarHBondContact OD1-CB 3.43Å; N654-Q656 PolarHBondContact OD1-N 2.99Å; N654-Q656 VanDerWaalsContact OD1-N 3.07Å; N654-Q656 PolarHBondContact OD1-OE1 3.47Å; N654-Q656 VanDerWaalsContact OD1-OE1 3.13Å
657	T	88.9	Confident	93.1	Very high	62 Å²	62	36.7 Å²	36.7	38%	0.38	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.3	2.8	178.4	62.1	0	0	0	0	113.3	N654 V655 T659 N662	N654-T657 PolarHBondContact N-OG1 3.22Å; N654-T657 PolarHBondContact ND2-OG1 2.94Å; N654-T657 PolarHBondContact O-N 2.85Å; N654-T657 PolarHBondContact O-OG1 3.3Å; N654-T657 WeakPolarHBondContact OD1-CG2 3.41Å; N654-T657 PolarHBondContact OD1-N 2.8Å; N654-T657 VanDerWaalsContact OD1-N 3.08Å; N654-T657 PolarHBondContact OD1-OG1 3.11Å; V655-T657 VanDerWaalsContact C-N 3.32Å; T657-T659 PolarHBondContact O-N 3.09Å; T657-N662 PolarHBondContact O-ND2 2.72Å
658	L	91.4	Very high	93.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.181	C	C	.	.			trans	-63.8	125.3	176.9	-81.7	179.8	0	0	0	111.2	T251 L252 I653 N654 N662 V663 L709 F712	T251-L658 CarbonylContact C-O 3.43Å; T251-L658 VanDerWaalsContact CA-O 3.26Å; T251-L658 WeakPolarHBondContact CA-O 3.49Å; L252-L658 HydrophobicContact CD1-CB 4.44Å; L252-L658 PolarHBondContact N-O 3.36Å; I653-L658 HydrophobicContact CB-CD2 4.12Å; I653-L658 HydrophobicContact CD1-CD2 4.11Å; I653-L658 HydrophobicContact CG2-CD2 4.39Å; N654-L658 WeakPolarHBondContact O-CG 3.33Å; N654-L658 PolarHBondContact O-N 3.38Å; N654-L658 VanDerWaalsContact O-N 3.08Å; L658-N662 WeakPolarHBondContact CA-OD1 3.4Å; L658-V663 HydrophobicContact CD2-CB 4.37Å; L658-V663 HydrophobicContact CD2-CG2 4.48Å; L658-L709 HydrophobicContact CD1-CD2 3.69Å; L658-L709 HydrophobicContact CD2-CD2 4.33Å; L658-L709 HydrophobicContact CG-CD2 4.05Å; L658-F712 HydrophobicContact CD1-CD1 3.34Å; L658-F712 HydrophobicContact CD1-CE1 3.42Å; L658-F712 VanDerWaalsContact CD1-CE1 3.42Å; L658-F712 HydrophobicContact CD1-CG 4.02Å; L658-F712 HydrophobicContact CD1-CZ 4.12Å
659	T	90.1	Very high	93.3	Very high	29 Å²	29	32.4 Å²	32.4	18%	0.178	17%	0.168	C	C	.	.			trans	-125.3	174.8	173.9	67.1	0	0	0	0	109.7	L252 T657 E661 N662 V663	L252-T659 WeakPolarHBondContact CD1-O 3.25Å; T657-T659 PolarHBondContact O-N 3.09Å; T659-E661 PolarHBondContact O-N 3.32Å; T659-E661 PolarHBondContact OG1-N 3.18Å; T659-N662 PolarHBondContact N-OD1 3.21Å; T659-N662 PolarHBondContact O-N 2.77Å; T659-N662 PolarHBondContact O-OD1 3.41Å; T659-V663 WeakPolarHBondContact O-CB 3.48Å; T659-V663 PolarHBondContact O-N 3.27Å
660	Q	84.4	Confident	93.3	Very high	111 Å²	111	32.4 Å²	32.4	52%	0.519	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.5	172.5	-72.4	-63.3	-5	0	0	112.4	L252	L252-Q660 HydrophobicContact CD2-CG 3.79Å
661	E	84.4	Confident	93.4	Very high	113 Å²	113	32.4 Å²	32.4	53%	0.528	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-31.5	-176.6	-55.8	-170.8	150.2	0	0	113.4	T659	T659-E661 PolarHBondContact O-N 3.32Å; T659-E661 PolarHBondContact OG1-N 3.18Å
662	N	91.9	Very high	93.6	Very high	24 Å²	24	28.9 Å²	28.9	13%	0.128	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-9	-171.6	69.5	20.1	0	0	0	114.7	V598 I653 T657 L658 T659 S664 C665	V598-N662 HydrophobicContact CG1-CB 3.86Å; I653-N662 HydrophobicContact CG2-CB 4.12Å; T657-N662 PolarHBondContact O-ND2 2.72Å; L658-N662 WeakPolarHBondContact CA-OD1 3.4Å; T659-N662 PolarHBondContact N-OD1 3.21Å; T659-N662 PolarHBondContact O-N 2.77Å; T659-N662 PolarHBondContact O-OD1 3.41Å; N662-S664 PolarHBondContact O-N 3Å; N662-S664 VanDerWaalsContact O-N 3.11Å; N662-C665 VanDerWaalsContact O-CB 3.3Å; N662-C665 WeakPolarHBondContact O-CB 3.37Å; N662-C665 PolarHBondContact O-N 3.25Å
663	V	93.4	Very high	93.8	Very high	7 Å²	7	25.3 Å²	25.3	4%	0.042	13%	0.131	C	C	.	.	H	α-helix	trans	-60.1	-24.4	179	69.1	0	0	0	0	113	L252 L658 T659 C665 L666 N667 Y717	L252-V663 HydrophobicContact CD1-CB 3.65Å; L252-V663 HydrophobicContact CD1-CG1 4.04Å; L252-V663 HydrophobicContact CD1-CG2 3.78Å; L658-V663 HydrophobicContact CD2-CB 4.37Å; L658-V663 HydrophobicContact CD2-CG2 4.48Å; T659-V663 WeakPolarHBondContact O-CB 3.48Å; T659-V663 PolarHBondContact O-N 3.27Å; V663-C665 PolarHBondContact O-N 3.02Å; V663-L666 WeakPolarHBondContact O-CB 3.33Å; V663-L666 PolarHBondContact O-N 3.32Å; V663-L666 VanDerWaalsContact O-N 3.14Å; V663-N667 PolarHBondContact O-N 3Å; V663-Y717 HydrophobicContact CG2-CE2 4.43Å
664	S	94.3	Very high	94	Very high	20 Å²	20	25.3 Å²	25.3	14%	0.14	13%	0.13	C	C	.	.	H	α-helix	trans	-60.2	-27.6	173.7	53.6	0	0	0	0	113.2	N601 R605 N662 L666 N667 T668	N601-S664 PolarHBondContact ND2-OG 3Å; N601-S664 VanDerWaalsContact OD1-CB 3.27Å; N601-S664 WeakPolarHBondContact OD1-CB 3.25Å; N601-S664 PolarHBondContact OD1-O 2.88Å; N601-S664 VanDerWaalsContact OD1-O 3.08Å; N601-S664 PolarHBondContact OD1-OG 3.13Å; R605-S664 PolarHBondContact NH2-O 2.65Å; N662-S664 PolarHBondContact O-N 3Å; N662-S664 VanDerWaalsContact O-N 3.11Å; S664-L666 VanDerWaalsContact C-N 3.3Å; S664-L666 PolarHBondContact O-N 3.13Å; S664-N667 PolarHBondContact O-N 3.47Å; S664-T668 WeakPolarHBondContact O-CB 3.44Å; S664-T668 PolarHBondContact O-N 2.9Å; S664-T668 PolarHBondContact O-OG1 3.47Å
665	C	97.2	Very high	94.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61	-39.8	175	-68	0	0	0	0	111.9	L649 I653 N662 V663 T668 S669	L649-C665 HydrophobicContact CD2-CB 3.95Å; I653-C665 HydrophobicContact CD1-CB 4.03Å; I653-C665 HydrophobicContact CG2-CB 4.12Å; N662-C665 VanDerWaalsContact O-CB 3.3Å; N662-C665 WeakPolarHBondContact O-CB 3.37Å; N662-C665 PolarHBondContact O-N 3.25Å; V663-C665 PolarHBondContact O-N 3.02Å; C665-T668 PolarHBondContact O-N 3.46Å; C665-S669 WeakPolarHBondContact O-CB 3.45Å; C665-S669 PolarHBondContact O-N 3.33Å; C665-S669 PolarHBondContact O-OG 2.86Å
666	L	97.3	Very high	94.4	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-64.7	-46.2	175.4	-178.7	54	0	0	0	111.1	I653 V663 S664 T668 S669 L670 F706 L709 L710 W713	I653-L666 HydrophobicContact CD1-CB 3.68Å; V663-L666 WeakPolarHBondContact O-CB 3.33Å; V663-L666 PolarHBondContact O-N 3.32Å; V663-L666 VanDerWaalsContact O-N 3.14Å; S664-L666 VanDerWaalsContact C-N 3.3Å; S664-L666 PolarHBondContact O-N 3.13Å; L666-T668 VanDerWaalsContact C-N 3.33Å; L666-T668 PolarHBondContact O-N 2.95Å; L666-S669 WeakPolarHBondContact O-CB 3.35Å; L666-S669 PolarHBondContact O-N 2.6Å; L666-L670 PolarHBondContact O-N 3.28Å; L666-F706 HydrophobicContact CD1-CD2 4.23Å; L666-F706 HydrophobicContact CD1-CE2 3.83Å; L666-L709 HydrophobicContact CD1-CB 3.83Å; L666-L709 HydrophobicContact CD1-CD1 4.47Å; L666-L709 HydrophobicContact CD2-CB 4.02Å; L666-L709 HydrophobicContact CD2-CD2 4.44Å; L666-L709 WeakPolarHBondContact CD2-O 3.3Å; L666-L710 HydrophobicContact CD1-CD2 4.24Å; L666-W713 HydrophobicContact CD2-CB 3.99Å; L666-W713 HydrophobicContact CD2-CG 4.44Å
667	N	96.8	Very high	94.7	Very high	6 Å²	6	21.2 Å²	21.2	3%	0.032	11%	0.108	C	C	.	.	H	α-helix	trans	-62.7	-39.7	178.2	-68	-31	0	0	0	111.8	R605 V663 S664 L670 V671 W713 Y717 L727 W738	R605-N667 VanDerWaalsContact NH2-CB 3.3Å; V663-N667 PolarHBondContact O-N 3Å; S664-N667 PolarHBondContact O-N 3.47Å; N667-L670 PolarHBondContact O-N 2.99Å; N667-V671 WeakPolarHBondContact O-CG2 3.37Å; N667-V671 PolarHBondContact O-N 3.48Å; N667-W713 PolarHBondContact OD1-NE1 3.35Å; N667-Y717 PolarHBondContact ND2-OH 3.21Å; N667-L727 HydrophobicContact CB-CD2 4.13Å; N667-W738 HydrophobicContact CB-CH2 4.33Å; N667-W738 HydrophobicContact CB-CZ3 4.38Å
668	T	98	Very high	95.1	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-67	-39.3	176.2	-60.3	0	0	0	0	111.6	N601 V604 R605 L649 S664 C665 L666 L670 V671 I672	N601-T668 PolarHBondContact O-OG1 3.27Å; N601-T668 PolarHBondContact OD1-OG1 3.39Å; V604-T668 HydrophobicContact CG1-CG2 4.45Å; R605-T668 HydrophobicContact CB-CG2 3.88Å; R605-T668 HydrophobicContact CG-CG2 4.49Å; R605-T668 PolarHBondContact NE-OG1 3.04Å; R605-T668 PolarHBondContact NH2-OG1 3.01Å; L649-T668 HydrophobicContact CD1-CG2 3.64Å; S664-T668 WeakPolarHBondContact O-CB 3.44Å; S664-T668 PolarHBondContact O-N 2.9Å; S664-T668 PolarHBondContact O-OG1 3.47Å; C665-T668 PolarHBondContact O-N 3.46Å; L666-T668 VanDerWaalsContact C-N 3.33Å; L666-T668 PolarHBondContact O-N 2.95Å; T668-L670 VanDerWaalsContact C-N 3.34Å; T668-L670 PolarHBondContact O-N 3.44Å; T668-V671 PolarHBondContact O-N 3.22Å; T668-I672 WeakPolarHBondContact O-CG1 3.43Å; T668-I672 PolarHBondContact O-N 3.04Å; T668-I672 VanDerWaalsContact O-N 3.13Å
669	S	98.4	Very high	95.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.4	-44.2	173.3	-57.9	0	0	0	0	111.7	L649 C665 L666 I672 L673	L649-S669 WeakPolarHBondContact CB-OG 3.4Å; C665-S669 WeakPolarHBondContact O-CB 3.45Å; C665-S669 PolarHBondContact O-N 3.33Å; C665-S669 PolarHBondContact O-OG 2.86Å; L666-S669 WeakPolarHBondContact O-CB 3.35Å; L666-S669 PolarHBondContact O-N 2.6Å; S669-I672 PolarHBondContact O-N 3.33Å; S669-L673 PolarHBondContact O-N 3.33Å
670	L	98.2	Very high	95.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.4	-44.3	175	-85.8	171.8	0	0	0	112.2	L666 N667 T668 I672 L673 M674 L710 W713 W738 V742 L745	L666-L670 PolarHBondContact O-N 3.28Å; N667-L670 PolarHBondContact O-N 2.99Å; T668-L670 VanDerWaalsContact C-N 3.34Å; T668-L670 PolarHBondContact O-N 3.44Å; L670-I672 VanDerWaalsContact C-N 3.33Å; L670-I672 PolarHBondContact O-N 3Å; L670-L673 PolarHBondContact O-N 2.94Å; L670-M674 HydrophobicContact CB-SD 4.34Å; L670-M674 VanDerWaalsContact O-CB 3.28Å; L670-M674 WeakPolarHBondContact O-CB 3.35Å; L670-M674 WeakPolarHBondContact O-CG 3.5Å; L670-M674 PolarHBondContact O-N 2.92Å; L670-L710 HydrophobicContact CD1-CD2 3.92Å; L670-L710 HydrophobicContact CD2-CD2 3.6Å; L670-L710 HydrophobicContact CG-CD2 3.88Å; L670-W713 HydrophobicContact CD1-CD2 4.15Å; L670-W713 HydrophobicContact CD1-CG 4.06Å; L670-W738 HydrophobicContact CB-CE3 4.23Å; L670-W738 HydrophobicContact CB-CZ3 3.74Å; L670-W738 HydrophobicContact CD1-CE3 4.29Å; L670-W738 HydrophobicContact CD1-CZ3 4.22Å; L670-V742 HydrophobicContact CD1-CG2 3.91Å; L670-V742 HydrophobicContact CD2-CG2 3.81Å; L670-L745 HydrophobicContact CD2-CD1 3.88Å
671	V	98.4	Very high	96.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.2	-46.9	175.8	169	0	0	0	0	111.3	R605 L609 N667 T668 L673 M674 L675 W738	R605-V671 HydrophobicContact CG-CB 4.28Å; R605-V671 HydrophobicContact CG-CG1 4.17Å; R605-V671 HydrophobicContact CG-CG2 4.08Å; L609-V671 HydrophobicContact CD1-CG1 4.46Å; L609-V671 HydrophobicContact CD2-CG1 3.63Å; L609-V671 HydrophobicContact CG-CG1 3.81Å; N667-V671 WeakPolarHBondContact O-CG2 3.37Å; N667-V671 PolarHBondContact O-N 3.48Å; T668-V671 PolarHBondContact O-N 3.22Å; V671-L673 VanDerWaalsContact C-N 3.3Å; V671-L673 PolarHBondContact O-N 2.72Å; V671-M674 PolarHBondContact O-N 2.85Å; V671-L675 HydrophobicContact CG1-CD1 3.93Å; V671-L675 HydrophobicContact CG1-CG 4.37Å; V671-L675 VanDerWaalsContact O-CG 3.25Å; V671-L675 WeakPolarHBondContact O-CG 3.03Å; V671-L675 PolarHBondContact O-N 3.37Å; V671-W738 HydrophobicContact CG2-CH2 3.37Å; V671-W738 HydrophobicContact CG2-CZ2 3.65Å; V671-W738 HydrophobicContact CG2-CZ3 4.3Å
672	I	98.5	Very high	96.8	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.021	13%	0.128	C	C	.	.	H	α-helix	trans	-57.2	-45.2	179	-66.8	165.3	0	0	0	110.9	V608 L646 L649 T668 S669 L670 A676 Y685	V608-I672 HydrophobicContact CG1-CG1 4.26Å; V608-I672 HydrophobicContact CG2-CG1 4.44Å; L646-I672 HydrophobicContact CB-CD1 4.35Å; L646-I672 HydrophobicContact CB-CG2 4.36Å; L646-I672 HydrophobicContact CD1-CB 4.44Å; L646-I672 HydrophobicContact CD1-CG2 4.49Å; L646-I672 HydrophobicContact CD2-CG2 4.37Å; L649-I672 HydrophobicContact CD1-CD1 4.11Å; T668-I672 WeakPolarHBondContact O-CG1 3.43Å; T668-I672 PolarHBondContact O-N 3.04Å; T668-I672 VanDerWaalsContact O-N 3.13Å; S669-I672 PolarHBondContact O-N 3.33Å; L670-I672 VanDerWaalsContact C-N 3.33Å; L670-I672 PolarHBondContact O-N 3Å; I672-A676 PolarHBondContact O-N 2.98Å; I672-Y685 HydrophobicContact CG2-CD1 4.44Å; I672-Y685 HydrophobicContact CG2-CE1 3.87Å
673	L	98.4	Very high	97	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-72.6	-35.8	179.5	-69.6	179.1	0	0	0	113.4	L646 S669 L670 V671 L675 A676 R677 L682 Y685 F706 L745	L646-L673 HydrophobicContact CD1-CG 4.21Å; L646-L673 HydrophobicContact CD2-CD2 3.65Å; L646-L673 HydrophobicContact CD2-CG 4.1Å; S669-L673 PolarHBondContact O-N 3.33Å; L670-L673 PolarHBondContact O-N 2.94Å; V671-L673 VanDerWaalsContact C-N 3.3Å; V671-L673 PolarHBondContact O-N 2.72Å; L673-L675 VanDerWaalsContact C-N 3.3Å; L673-L675 PolarHBondContact O-N 3.11Å; L673-A676 PolarHBondContact O-N 3.23Å; L673-R677 WeakPolarHBondContact O-CB 3.43Å; L673-R677 PolarHBondContact O-N 3.37Å; L673-L682 HydrophobicContact CB-CD1 4.2Å; L673-L682 HydrophobicContact CD2-CD1 3.87Å; L673-L682 HydrophobicContact CG-CD1 4.49Å; L673-Y685 HydrophobicContact CD2-CD1 4.13Å; L673-Y685 HydrophobicContact CD2-CG 4.22Å; L673-F706 HydrophobicContact CD1-CE1 3.34Å; L673-F706 HydrophobicContact CD1-CZ 3.5Å; L673-L745 HydrophobicContact CD1-CD1 4.27Å; L673-L745 HydrophobicContact CD1-CD2 4.47Å
674	M	98.3	Very high	97.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.9	-41.1	175.4	-78.3	167.6	71.2	0	0	111.3	L670 V671 R677 R678 I733 Y737 W738 T741	L670-M674 HydrophobicContact CB-SD 4.34Å; L670-M674 VanDerWaalsContact O-CB 3.28Å; L670-M674 WeakPolarHBondContact O-CB 3.35Å; L670-M674 WeakPolarHBondContact O-CG 3.5Å; L670-M674 PolarHBondContact O-N 2.92Å; V671-M674 PolarHBondContact O-N 2.85Å; M674-R677 WeakPolarHBondContact O-CB 3.29Å; M674-R677 PolarHBondContact O-N 3.27Å; M674-R678 WeakPolarHBondContact O-CG 3.33Å; M674-R678 PolarHBondContact O-N 3.1Å; M674-I733 HydrophobicContact CE-CB 4.16Å; M674-I733 HydrophobicContact CE-CD1 3.93Å; M674-I733 HydrophobicContact CE-CG2 3.34Å; M674-Y737 HydrophobicContact CB-CD1 4.49Å; M674-Y737 HydrophobicContact CB-CE1 3.88Å; M674-Y737 HydrophobicContact CE-CD1 3.49Å; M674-Y737 VanDerWaalsContact CE-CD1 3.49Å; M674-Y737 HydrophobicContact CE-CE1 4.04Å; M674-Y737 HydrophobicContact CG-CD1 4.48Å; M674-Y737 HydrophobicContact CG-CE1 4.19Å; M674-Y737 PolarHBondContact O-OH 2.85Å; M674-Y737 VanDerWaalsContact O-OH 3.05Å; M674-W738 HydrophobicContact CE-CB 4.22Å; M674-W738 HydrophobicContact CE-CD2 3.57Å; M674-W738 HydrophobicContact CE-CE3 4.2Å; M674-W738 HydrophobicContact CE-CG 3.54Å; M674-W738 HydrophobicContact SD-CD2 3.56Å; M674-W738 VanDerWaalsContact SD-CD2 3.56Å; M674-W738 HydrophobicContact SD-CE3 3.53Å; M674-W738 VanDerWaalsContact SD-CE3 3.53Å; M674-W738 HydrophobicContact SD-CG 4.04Å; M674-W738 HydrophobicContact SD-CH2 4.4Å; M674-W738 HydrophobicContact SD-CZ2 4.39Å; M674-W738 HydrophobicContact SD-CZ3 3.97Å; M674-T741 HydrophobicContact CG-CG2 3.61Å
675	L	97.6	Very high	97.4	Very high	9 Å²	9	30 Å²	30	5%	0.047	15%	0.148	C	C	.	.	H	α-helix	trans	-71.8	-39.4	175.4	-62.5	176.3	0	0	0	111.8	V608 L609 D612 V671 L673 R677 R678 K679 I733	V608-L675 HydrophobicContact CG1-CD1 3.59Å; L609-L675 HydrophobicContact CD2-CD1 4.3Å; D612-L675 HydrophobicContact CB-CD1 3.95Å; D612-L675 HydrophobicContact CB-CD2 4.05Å; D612-L675 HydrophobicContact CB-CG 4.47Å; D612-L675 VanDerWaalsContact OD2-CD2 3.26Å; D612-L675 WeakPolarHBondContact OD2-CD2 3.09Å; V671-L675 HydrophobicContact CG1-CD1 3.93Å; V671-L675 HydrophobicContact CG1-CG 4.37Å; V671-L675 VanDerWaalsContact O-CG 3.25Å; V671-L675 WeakPolarHBondContact O-CG 3.03Å; V671-L675 PolarHBondContact O-N 3.37Å; L673-L675 VanDerWaalsContact C-N 3.3Å; L673-L675 PolarHBondContact O-N 3.11Å; L675-R677 VanDerWaalsContact C-N 3.28Å; L675-R677 PolarHBondContact O-N 3.03Å; L675-R678 PolarHBondContact O-N 2.91Å; L675-K679 PolarHBondContact O-N 3.22Å; L675-I733 HydrophobicContact CD2-CD1 4.3Å
676	A	97.1	Very high	97.5	Very high	6 Å²	6	30 Å²	30	5%	0.05	15%	0.148	C	C	.	.	H	α-helix	trans	-60	-39.7	171	0	0	0	0	0	111.8	I672 L673 K679 A680 K681 L682 Y685	I672-A676 PolarHBondContact O-N 2.98Å; L673-A676 PolarHBondContact O-N 3.23Å; A676-K679 CarbonylContact O-C 3.55Å; A676-K679 PolarHBondContact O-N 2.96Å; A676-A680 PolarHBondContact O-N 3.48Å; A676-K681 HydrophobicContact CB-CB 4.4Å; A676-K681 WeakPolarHBondContact O-CA 3.36Å; A676-K681 PolarHBondContact O-N 3.05Å; A676-L682 PolarHBondContact O-N 2.93Å; A676-Y685 HydrophobicContact CB-CD2 3.61Å; A676-Y685 HydrophobicContact CB-CE2 3.65Å; A676-Y685 HydrophobicContact CB-CG 4.06Å
677	R	96.7	Very high	97.5	Very high	52 Å²	52	33 Å²	33	20%	0.196	16%	0.164	C	C	.	.	H	α-helix	trans	-63.1	-44.3	176.2	-177.1	-177.8	176.7	-130.6	-10.4	111.9	L673 M674 L675 K679 A680 L682 Y737 E740 T741	L673-R677 WeakPolarHBondContact O-CB 3.43Å; L673-R677 PolarHBondContact O-N 3.37Å; M674-R677 WeakPolarHBondContact O-CB 3.29Å; M674-R677 PolarHBondContact O-N 3.27Å; L675-R677 VanDerWaalsContact C-N 3.28Å; L675-R677 PolarHBondContact O-N 3.03Å; R677-K679 PolarHBondContact O-N 3.27Å; R677-K679 VanDerWaalsContact O-N 3.17Å; R677-A680 PolarHBondContact O-N 2.84Å; R677-L682 HydrophobicContact CB-CB 4.11Å; R677-L682 HydrophobicContact CB-CD2 4.22Å; R677-L682 HydrophobicContact CG-CD2 4.21Å; R677-Y737 WeakPolarHBondContact CG-OH 3.38Å; R677-E740 IonicContact CZ-OE1 3.56Å; R677-E740 IonicContact CZ-OE2 3.89Å; R677-E740 VanDerWaalsContact NH1-CD 3.26Å; R677-E740 IonicContact NH1-OE1 3.77Å; R677-E740 IonicContact NH1-OE2 4Å; R677-E740 PolarHBondContact NH1-OE2 2.81Å; R677-E740 IonicContact NH2-OE1 2.74Å; R677-E740 PolarHBondContact NH2-OE1 3.43Å; R677-E740 IonicContact NH2-OE2 3.39Å; R677-E740 PolarHBondContact NH2-OE2 3.14Å; R677-T741 PolarHBondContact NH1-OG1 3.08Å
678	R	95.6	Very high	97.5	Very high	114 Å²	114	33.9 Å²	33.9	43%	0.43	17%	0.173	S	C	.	.	H	α-helix	trans	-55.8	-32.7	174.6	-73.2	179.4	-179.1	173.5	-5.3	112.4	D612 M674 L675 I733 Y737	D612-R678 IonicContact OD2-NH1 3.63Å; M674-R678 WeakPolarHBondContact O-CG 3.33Å; M674-R678 PolarHBondContact O-N 3.1Å; L675-R678 PolarHBondContact O-N 2.91Å; R678-I733 VanDerWaalsContact NH2-CG2 3.29Å; R678-Y737 HydrophobicContact CG-CE1 4.11Å; R678-Y737 WeakPolarHBondContact CG-OH 3.45Å; R678-Y737 PolarHBondContact N-OH 2.85Å
679	K	95.1	Very high	97.4	Very high	86 Å²	86	34 Å²	34	37%	0.374	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	12.1	179	-65.1	176.9	-179.1	161.3	0	113.8	D612 E615 L675 A676 R677 K681	D612-K679 WeakPolarHBondContact OD1-CE 3.46Å; D612-K679 IonicContact OD1-NZ 3Å; D612-K679 PolarHBondContact OD1-NZ 2.84Å; E615-K679 IonicContact OE2-NZ 3.57Å; E615-K679 PolarHBondContact OE2-NZ 2.99Å; L675-K679 PolarHBondContact O-N 3.22Å; A676-K679 CarbonylContact O-C 3.55Å; A676-K679 PolarHBondContact O-N 2.96Å; R677-K679 PolarHBondContact O-N 3.27Å; R677-K679 VanDerWaalsContact O-N 3.17Å; K679-K681 HydrophobicContact CB-CG 4.38Å; K679-K681 WeakPolarHBondContact O-CG 3.47Å; K679-K681 PolarHBondContact O-N 3.48Å; K679-K681 VanDerWaalsContact O-N 3.15Å
680	A	96.4	Very high	97.3	Very high	88 Å²	88	37 Å²	37	73%	0.727	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	26.2	-175.5	0	0	0	0	0	114.7	A676 R677	A676-A680 PolarHBondContact O-N 3.48Å; R677-A680 PolarHBondContact O-N 2.84Å
681	K	96.9	Very high	97.2	Very high	108 Å²	108	41.4 Å²	41.4	47%	0.47	21%	0.205	S	C	.	.			trans	-102.3	1.9	179.6	-66.7	-175.9	-177.6	-178.7	0	113.8	A676 K679 F684 Y685	A676-K681 HydrophobicContact CB-CB 4.4Å; A676-K681 WeakPolarHBondContact O-CA 3.36Å; A676-K681 PolarHBondContact O-N 3.05Å; K679-K681 HydrophobicContact CB-CG 4.38Å; K679-K681 WeakPolarHBondContact O-CG 3.47Å; K679-K681 PolarHBondContact O-N 3.48Å; K679-K681 VanDerWaalsContact O-N 3.15Å; K681-F684 WeakPolarHBondContact O-CB 3.47Å; K681-F684 PolarHBondContact O-N 3.29Å; K681-F684 VanDerWaalsContact O-N 3.08Å; K681-Y685 HydrophobicContact CB-CD2 4.31Å; K681-Y685 HydrophobicContact CB-CE2 4.31Å; K681-Y685 WeakPolarHBondContact O-CD2 3.48Å; K681-Y685 PolarHBondContact O-N 3.31Å
682	L	97.3	Very high	97	Very high	2 Å²	2	45 Å²	45	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-53	-46.8	-179.2	177.1	61.5	0	0	0	113.5	L673 A676 R677 F684 Y685 L686 V744 L745 C754	L673-L682 HydrophobicContact CB-CD1 4.2Å; L673-L682 HydrophobicContact CD2-CD1 3.87Å; L673-L682 HydrophobicContact CG-CD1 4.49Å; A676-L682 PolarHBondContact O-N 2.93Å; R677-L682 HydrophobicContact CB-CB 4.11Å; R677-L682 HydrophobicContact CB-CD2 4.22Å; R677-L682 HydrophobicContact CG-CD2 4.21Å; L682-F684 VanDerWaalsContact C-N 3.26Å; L682-F684 PolarHBondContact O-N 3.37Å; L682-Y685 PolarHBondContact O-N 3.45Å; L682-Y685 VanDerWaalsContact O-N 3.11Å; L682-L686 HydrophobicContact CD1-CD1 4.32Å; L682-L686 HydrophobicContact CD1-CD2 4.48Å; L682-L686 HydrophobicContact CD1-CG 4.13Å; L682-L686 HydrophobicContact CG-CD1 4.26Å; L682-L686 HydrophobicContact CG-CG 4.48Å; L682-L686 PolarHBondContact O-N 3.39Å; L682-L686 VanDerWaalsContact O-N 3.08Å; L682-V744 HydrophobicContact CD2-CG1 4.38Å; L682-L745 HydrophobicContact CD1-CD2 4.04Å; L682-L745 HydrophobicContact CD2-CD2 4.22Å; L682-C754 HydrophobicContact CD2-CB 3.91Å
683	P	97.8	Very high	96.7	Very high	37 Å²	37	44.9 Å²	44.9	24%	0.24	22%	0.22	C	C	.	.	H	α-helix	trans	-58.1	-35.8	177.1	-26.9	36.1	0	0	0	114.2	N687 R753 Y759	P683-N687 WeakPolarHBondContact O-CB 3.2Å; P683-N687 PolarHBondContact O-N 3.47Å; P683-R753 HydrophobicContact CB-CB 4.11Å; P683-R753 WeakPolarHBondContact CB-O 3.28Å; P683-R753 HydrophobicContact CG-CB 4.05Å; P683-R753 WeakPolarHBondContact CG-O 3.5Å; P683-Y759 WeakPolarHBondContact CA-OH 3.43Å; P683-Y759 WeakPolarHBondContact CB-OH 3.23Å; P683-Y759 PolarHBondContact O-OH 3.49Å
684	F	98.1	Very high	96.4	Very high	108 Å²	108	49.1 Å²	49.1	47%	0.474	24%	0.237	S	C	.	.	H	α-helix	trans	-65.5	-42.5	177.6	168.8	-91.6	0	0	0	111.1	V639 L643 K681 L682 N687 A688	V639-F684 HydrophobicContact CG1-CE1 4.29Å; V639-F684 HydrophobicContact CG1-CZ 4.35Å; V639-F684 HydrophobicContact CG2-CD1 4.46Å; V639-F684 HydrophobicContact CG2-CE1 3.69Å; L643-F684 HydrophobicContact CD1-CE1 4.01Å; L643-F684 HydrophobicContact CD1-CZ 4.46Å; K681-F684 WeakPolarHBondContact O-CB 3.47Å; K681-F684 PolarHBondContact O-N 3.29Å; K681-F684 VanDerWaalsContact O-N 3.08Å; L682-F684 VanDerWaalsContact C-N 3.26Å; L682-F684 PolarHBondContact O-N 3.37Å; F684-N687 PolarHBondContact O-N 3.4Å; F684-A688 WeakPolarHBondContact O-CB 3.48Å; F684-A688 PolarHBondContact O-N 3.49Å
685	Y	98.3	Very high	96.2	Very high	8 Å²	8	54.1 Å²	54.1	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-65.3	-44.8	178.1	-86.1	-107.2	0	0	0	111.9	V639 R642 L643 L646 I672 L673 A676 K681 L682 N687 A688 L689	V639-Y685 HydrophobicContact CG2-CE2 3.94Å; R642-Y685 HydrophobicContact CB-CE1 4.44Å; R642-Y685 PolarHBondContact NE-OH 2.95Å; L643-Y685 HydrophobicContact CD2-CD1 3.43Å; L643-Y685 VanDerWaalsContact CD2-CD1 3.43Å; L643-Y685 HydrophobicContact CD2-CE1 3.85Å; L643-Y685 HydrophobicContact CD2-CG 4Å; L643-Y685 HydrophobicContact CG-CD1 4.22Å; L643-Y685 HydrophobicContact CG-CE1 4.14Å; L646-Y685 HydrophobicContact CD2-CD1 3.77Å; L646-Y685 HydrophobicContact CD2-CE1 4.47Å; I672-Y685 HydrophobicContact CG2-CD1 4.44Å; I672-Y685 HydrophobicContact CG2-CE1 3.87Å; L673-Y685 HydrophobicContact CD2-CD1 4.13Å; L673-Y685 HydrophobicContact CD2-CG 4.22Å; A676-Y685 HydrophobicContact CB-CD2 3.61Å; A676-Y685 HydrophobicContact CB-CE2 3.65Å; A676-Y685 HydrophobicContact CB-CG 4.06Å; K681-Y685 HydrophobicContact CB-CD2 4.31Å; K681-Y685 HydrophobicContact CB-CE2 4.31Å; K681-Y685 WeakPolarHBondContact O-CD2 3.48Å; K681-Y685 PolarHBondContact O-N 3.31Å; L682-Y685 PolarHBondContact O-N 3.45Å; L682-Y685 VanDerWaalsContact O-N 3.11Å; Y685-N687 VanDerWaalsContact C-N 3.35Å; Y685-N687 PolarHBondContact O-N 3.27Å; Y685-A688 PolarHBondContact O-N 3.15Å; Y685-L689 WeakPolarHBondContact O-CG 3.32Å; Y685-L689 PolarHBondContact O-N 3.35Å
686	L	97.8	Very high	95.9	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.7	-42.1	177.4	-64.3	179	0	0	0	111.6	L682 A688 L689 R690 L745 I756 Y759	L682-L686 HydrophobicContact CD1-CD1 4.32Å; L682-L686 HydrophobicContact CD1-CD2 4.48Å; L682-L686 HydrophobicContact CD1-CG 4.13Å; L682-L686 HydrophobicContact CG-CD1 4.26Å; L682-L686 HydrophobicContact CG-CG 4.48Å; L682-L686 PolarHBondContact O-N 3.39Å; L682-L686 VanDerWaalsContact O-N 3.08Å; L686-A688 PolarHBondContact O-N 2.98Å; L686-L689 PolarHBondContact O-N 2.88Å; L686-R690 PolarHBondContact O-N 3.38Å; L686-R690 VanDerWaalsContact O-N 3.1Å; L686-L745 HydrophobicContact CD1-CD2 4.34Å; L686-L745 HydrophobicContact CD2-CD2 4.16Å; L686-I756 HydrophobicContact CD2-CG1 4.11Å; L686-Y759 HydrophobicContact CB-CD1 4.25Å; L686-Y759 HydrophobicContact CB-CD2 3.62Å; L686-Y759 HydrophobicContact CB-CE1 4.16Å; L686-Y759 HydrophobicContact CB-CE2 3.51Å; L686-Y759 HydrophobicContact CB-CG 4Å; L686-Y759 HydrophobicContact CD1-CD2 3.93Å; L686-Y759 HydrophobicContact CD1-CE2 3.61Å; L686-Y759 HydrophobicContact CG-CD2 4.39Å; L686-Y759 HydrophobicContact CG-CE2 4.22Å
687	N	97.4	Very high	95.6	Very high	63 Å²	63	66.6 Å²	66.6	34%	0.337	32%	0.322	S	S	.	.	H	α-helix	trans	-62.1	-43.9	174.1	-164.5	77.1	0	0	0	111.9	P683 F684 Y685 L689 R690 E691 Y759	P683-N687 WeakPolarHBondContact O-CB 3.2Å; P683-N687 PolarHBondContact O-N 3.47Å; F684-N687 PolarHBondContact O-N 3.4Å; Y685-N687 VanDerWaalsContact C-N 3.35Å; Y685-N687 PolarHBondContact O-N 3.27Å; N687-L689 VanDerWaalsContact C-N 3.29Å; N687-L689 PolarHBondContact O-N 3.33Å; N687-R690 WeakPolarHBondContact O-CB 3.32Å; N687-R690 PolarHBondContact O-N 3.22Å; N687-R690 VanDerWaalsContact O-N 3.14Å; N687-E691 WeakPolarHBondContact O-CG 3.49Å; N687-E691 PolarHBondContact O-N 2.83Å; N687-Y759 HydrophobicContact CB-CD1 4.32Å; N687-Y759 HydrophobicContact CB-CE1 3.79Å
688	A	97.6	Very high	95.3	Very high	26 Å²	26	67.4 Å²	67.4	22%	0.215	33%	0.325	C	S	.	.	H	α-helix	trans	-63	-34.3	179.1	0	0	0	0	0	112.8	L643 F684 Y685 L686 K692	L643-A688 HydrophobicContact CD1-CB 3.7Å; L643-A688 HydrophobicContact CD2-CB 3.75Å; L643-A688 HydrophobicContact CG-CB 4.38Å; F684-A688 WeakPolarHBondContact O-CB 3.48Å; F684-A688 PolarHBondContact O-N 3.49Å; Y685-A688 PolarHBondContact O-N 3.15Å; L686-A688 PolarHBondContact O-N 2.98Å; A688-K692 WeakPolarHBondContact O-CB 3.16Å; A688-K692 PolarHBondContact O-N 3.09Å; A688-K692 VanDerWaalsContact O-N 3.08Å
689	L	96.5	Very high	95.1	Very high	3 Å²	3	63.7 Å²	63.7	2%	0.016	32%	0.316	C	S	.	.	H	α-helix	trans	-65.1	-44.7	171.9	-68.2	-179.3	0	0	0	111.4	L646 F647 I650 Y685 L686 N687 K692 E693 L702 L703	L646-L689 HydrophobicContact CD2-CD1 4.09Å; L646-L689 HydrophobicContact CD2-CD2 4.22Å; L646-L689 HydrophobicContact CD2-CG 4.38Å; L646-L689 HydrophobicContact CG-CD1 4.49Å; L646-L689 HydrophobicContact CG-CD2 4.3Å; F647-L689 HydrophobicContact CB-CD2 4.22Å; I650-L689 HydrophobicContact CD1-CD1 4.09Å; Y685-L689 WeakPolarHBondContact O-CG 3.32Å; Y685-L689 PolarHBondContact O-N 3.35Å; L686-L689 PolarHBondContact O-N 2.88Å; N687-L689 VanDerWaalsContact C-N 3.29Å; N687-L689 PolarHBondContact O-N 3.33Å; L689-K692 WeakPolarHBondContact O-CB 3.49Å; L689-K692 PolarHBondContact O-N 3.02Å; L689-E693 PolarHBondContact O-N 2.91Å; L689-E693 VanDerWaalsContact O-N 3.09Å; L689-L702 HydrophobicContact CB-CD2 4.2Å; L689-L702 HydrophobicContact CD2-CD2 3.9Å; L689-L702 HydrophobicContact CG-CD2 4.43Å; L689-L703 HydrophobicContact CB-CD2 3.98Å; L689-L703 HydrophobicContact CD1-CD2 4.21Å
690	R	95.8	Very high	94.8	Very high	63 Å²	63	59.8 Å²	59.8	24%	0.238	30%	0.3	C	S	.	.	H	α-helix	trans	-57.9	-50.6	174.8	-177.9	-176	-178.6	-133	2.9	111.8	L686 N687 K692 E693 Y694 L703 Y759 D761	L686-R690 PolarHBondContact O-N 3.38Å; L686-R690 VanDerWaalsContact O-N 3.1Å; N687-R690 WeakPolarHBondContact O-CB 3.32Å; N687-R690 PolarHBondContact O-N 3.22Å; N687-R690 VanDerWaalsContact O-N 3.14Å; R690-K692 PolarHBondContact O-N 3.13Å; R690-E693 WeakPolarHBondContact O-CB 3.12Å; R690-E693 PolarHBondContact O-N 2.95Å; R690-E693 VanDerWaalsContact O-N 3.09Å; R690-Y694 HydrophobicContact CG-CD2 4.16Å; R690-Y694 HydrophobicContact CG-CE2 3.7Å; R690-Y694 PolarHBondContact NH2-OH 3.45Å; R690-Y694 VanDerWaalsContact O-CD2 3.23Å; R690-Y694 WeakPolarHBondContact O-CD2 3.44Å; R690-Y694 PolarHBondContact O-N 3.21Å; R690-L703 HydrophobicContact CB-CD1 3.99Å; R690-Y759 WeakPolarHBondContact CD-O 3.34Å; R690-Y759 WeakPolarHBondContact CG-O 3.47Å; R690-Y759 PolarHBondContact NE-O 3.28Å; R690-D761 IonicContact CZ-OD1 3.85Å; R690-D761 IonicContact NE-OD1 3.59Å; R690-D761 IonicContact NH2-OD1 2.67Å; R690-D761 PolarHBondContact NH2-OD1 3.14Å; R690-D761 IonicContact NH2-OD2 2.73Å
691	E	95.7	Very high	94.6	Very high	92 Å²	92	59.2 Å²	59.2	43%	0.43	29%	0.289	S	S	.	.	H	α-helix	trans	-58.3	-35.8	177.7	-67	-55.5	135.5	0	0	112.3	N687 Y694 T695	N687-E691 WeakPolarHBondContact O-CG 3.49Å; N687-E691 PolarHBondContact O-N 2.83Å; E691-Y694 PolarHBondContact O-N 2.79Å; E691-T695 WeakPolarHBondContact O-CB 3.42Å; E691-T695 PolarHBondContact O-N 3.22Å; E691-T695 PolarHBondContact O-OG1 3.06Å
692	K	93.4	Very high	94.5	Very high	75 Å²	75	54.1 Å²	54.1	33%	0.326	27%	0.267	S	S	.	.	H	α-helix	trans	-64.5	-43.8	175.6	-169.1	97.3	-174.5	176.8	0	111.5	F647 A688 L689 R690 Y694 T695 E696	F647-K692 HydrophobicContact CD1-CG 4.49Å; F647-K692 HydrophobicContact CD2-CB 4.29Å; F647-K692 HydrophobicContact CD2-CD 4.39Å; F647-K692 HydrophobicContact CD2-CG 3.6Å; F647-K692 HydrophobicContact CE2-CB 4.44Å; F647-K692 HydrophobicContact CE2-CG 3.63Å; F647-K692 HydrophobicContact CG-CD 4.38Å; F647-K692 HydrophobicContact CG-CG 4.07Å; F647-K692 HydrophobicContact CZ-CG 4.13Å; A688-K692 WeakPolarHBondContact O-CB 3.16Å; A688-K692 PolarHBondContact O-N 3.09Å; A688-K692 VanDerWaalsContact O-N 3.08Å; L689-K692 WeakPolarHBondContact O-CB 3.49Å; L689-K692 PolarHBondContact O-N 3.02Å; R690-K692 PolarHBondContact O-N 3.13Å; K692-Y694 VanDerWaalsContact C-N 3.31Å; K692-Y694 PolarHBondContact O-N 3.35Å; K692-T695 WeakPolarHBondContact O-CB 3.27Å; K692-T695 PolarHBondContact O-N 3.34Å; K692-E696 WeakPolarHBondContact CE-OE1 3.32Å; K692-E696 HydrophobicContact CG-CG 4.28Å; K692-E696 IonicContact NZ-OE1 3.19Å; K692-E696 WeakPolarHBondContact O-CB 3.19Å; K692-E696 VanDerWaalsContact O-CG 3.25Å; K692-E696 WeakPolarHBondContact O-CG 3.38Å; K692-E696 PolarHBondContact O-N 2.68Å
693	E	92.6	Very high	94.4	Very high	2 Å²	2	54 Å²	54	1%	0.009	27%	0.267	C	S	.	.	H	α-helix	trans	-58.7	-41.4	176.5	-64.3	-178.8	137.4	0	0	112.5	L689 R690 E696 K697 Y698 G700 C701 L702 L703	L689-E693 PolarHBondContact O-N 2.91Å; L689-E693 VanDerWaalsContact O-N 3.09Å; R690-E693 WeakPolarHBondContact O-CB 3.12Å; R690-E693 PolarHBondContact O-N 2.95Å; R690-E693 VanDerWaalsContact O-N 3.09Å; E693-E696 PolarHBondContact O-N 2.74Å; E693-K697 PolarHBondContact O-N 2.91Å; E693-Y698 HydrophobicContact CB-CD2 4.49Å; E693-Y698 PolarHBondContact O-N 3.17Å; E693-G700 VanDerWaalsContact CD-N 3.32Å; E693-G700 WeakPolarHBondContact OE1-CA 3.39Å; E693-G700 PolarHBondContact OE1-N 3.25Å; E693-G700 PolarHBondContact OE2-N 3.26Å; E693-C701 PolarHBondContact OE1-N 3.09Å; E693-L702 HydrophobicContact CG-CB 3.82Å; E693-L702 VanDerWaalsContact OE1-CA 3.27Å; E693-L702 WeakPolarHBondContact OE1-CA 3.27Å; E693-L702 WeakPolarHBondContact OE1-CB 3.46Å; E693-L702 PolarHBondContact OE1-N 3.39Å; E693-L703 PolarHBondContact OE1-N 2.95Å
694	Y	92.8	Very high	94.2	Very high	90 Å²	90	52.8 Å²	52.8	35%	0.353	26%	0.258	S	S	.	.	H	α-helix	trans	-66	-43.3	175.2	-74.3	-77.1	0	0	0	112.2	R690 E691 K692 E696 K697 P699 D761	R690-Y694 HydrophobicContact CG-CD2 4.16Å; R690-Y694 HydrophobicContact CG-CE2 3.7Å; R690-Y694 PolarHBondContact NH2-OH 3.45Å; R690-Y694 VanDerWaalsContact O-CD2 3.23Å; R690-Y694 WeakPolarHBondContact O-CD2 3.44Å; R690-Y694 PolarHBondContact O-N 3.21Å; E691-Y694 PolarHBondContact O-N 2.79Å; K692-Y694 VanDerWaalsContact C-N 3.31Å; K692-Y694 PolarHBondContact O-N 3.35Å; Y694-E696 PolarHBondContact O-N 3.31Å; Y694-K697 PolarHBondContact O-N 3.12Å; Y694-K697 VanDerWaalsContact O-N 3.15Å; Y694-P699 HydrophobicContact CD1-CB 4.2Å; Y694-P699 HydrophobicContact CE1-CB 4.02Å; Y694-D761 VanDerWaalsContact OH-CG 3.25Å; Y694-D761 PolarHBondContact OH-OD1 2.89Å; Y694-D761 PolarHBondContact OH-OD2 3.35Å
695	T	93.7	Very high	94.1	Very high	105 Å²	105	49 Å²	49	64%	0.644	24%	0.243	S	C	*	.	H	α-helix	trans	-58.9	-39.1	178.6	-59.1	0	0	0	0	111.2	E691 K692	E691-T695 WeakPolarHBondContact O-CB 3.42Å; E691-T695 PolarHBondContact O-N 3.22Å; E691-T695 PolarHBondContact O-OG1 3.06Å; K692-T695 WeakPolarHBondContact O-CB 3.27Å; K692-T695 PolarHBondContact O-N 3.34Å
696	E	91.1	Very high	94	Very high	89 Å²	89	48.6 Å²	48.6	42%	0.416	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	1.1	-177.5	-58	-88	174.1	0	0	113.4	K692 E693 Y694 Y698	K692-E696 WeakPolarHBondContact CE-OE1 3.32Å; K692-E696 HydrophobicContact CG-CG 4.28Å; K692-E696 IonicContact NZ-OE1 3.19Å; K692-E696 WeakPolarHBondContact O-CB 3.19Å; K692-E696 VanDerWaalsContact O-CG 3.25Å; K692-E696 WeakPolarHBondContact O-CG 3.38Å; K692-E696 PolarHBondContact O-N 2.68Å; E693-E696 PolarHBondContact O-N 2.74Å; Y694-E696 PolarHBondContact O-N 3.31Å; E696-Y698 HydrophobicContact CB-CD1 3.97Å; E696-Y698 HydrophobicContact CB-CE1 3.17Å; E696-Y698 HydrophobicContact CB-CE2 3.94Å; E696-Y698 WeakPolarHBondContact CB-OH 3.43Å; E696-Y698 HydrophobicContact CG-CE1 4.27Å; E696-Y698 VanDerWaalsContact CG-OH 3.24Å; E696-Y698 WeakPolarHBondContact CG-OH 3.38Å; E696-Y698 WeakPolarHBondContact O-CD1 3.44Å; E696-Y698 WeakPolarHBondContact O-CE1 3.5Å
697	K	90.9	Very high	93.9	Very high	188 Å²	188	49.4 Å²	49.4	82%	0.817	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.1	37.4	174	-51.9	179.7	-179.8	178.1	0	115.7	E693 Y694	E693-K697 PolarHBondContact O-N 2.91Å; Y694-K697 PolarHBondContact O-N 3.12Å; Y694-K697 VanDerWaalsContact O-N 3.15Å
698	Y	90.8	Very high	93.7	Very high	69 Å²	69	47.8 Å²	47.8	27%	0.271	24%	0.236	S	C	.	.			trans	-140.6	62.5	172.1	42.8	-100	0	0	0	112.4	F647 E693 E696 G700 C701	F647-Y698 HydrophobicContact CZ-CE2 4.43Å; F647-Y698 VanDerWaalsContact CZ-OH 3.27Å; F647-Y698 WeakPolarHBondContact CZ-OH 3.44Å; E693-Y698 HydrophobicContact CB-CD2 4.49Å; E693-Y698 PolarHBondContact O-N 3.17Å; E696-Y698 HydrophobicContact CB-CD1 3.97Å; E696-Y698 HydrophobicContact CB-CE1 3.17Å; E696-Y698 HydrophobicContact CB-CE2 3.94Å; E696-Y698 WeakPolarHBondContact CB-OH 3.43Å; E696-Y698 HydrophobicContact CG-CE1 4.27Å; E696-Y698 VanDerWaalsContact CG-OH 3.24Å; E696-Y698 WeakPolarHBondContact CG-OH 3.38Å; E696-Y698 WeakPolarHBondContact O-CD1 3.44Å; E696-Y698 WeakPolarHBondContact O-CE1 3.5Å; Y698-G700 PolarHBondContact O-N 3.44Å; Y698-C701 HydrophobicContact CD2-CB 3.96Å; Y698-C701 HydrophobicContact CG-CB 4.38Å; Y698-C701 WeakPolarHBondContact O-CB 3.48Å; Y698-C701 PolarHBondContact O-N 3.13Å
699	P	90.9	Very high	93.6	Very high	36 Å²	36	46.5 Å²	46.5	23%	0.234	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	135.5	-177.7	27.8	-36.9	0	0	0	112	Y694 C701 F764	Y694-P699 HydrophobicContact CD1-CB 4.2Å; Y694-P699 HydrophobicContact CE1-CB 4.02Å; P699-C701 VanDerWaalsContact C-N 3.29Å; P699-C701 PolarHBondContact O-N 3.5Å; P699-F764 HydrophobicContact CB-CD2 3.66Å; P699-F764 HydrophobicContact CB-CE2 3.53Å; P699-F764 HydrophobicContact CB-CG 4.25Å; P699-F764 HydrophobicContact CB-CZ 3.99Å; P699-F764 HydrophobicContact CG-CD1 4.17Å; P699-F764 HydrophobicContact CG-CD2 3.94Å; P699-F764 HydrophobicContact CG-CE1 3.73Å; P699-F764 HydrophobicContact CG-CE2 3.49Å; P699-F764 VanDerWaalsContact CG-CE2 3.49Å; P699-F764 HydrophobicContact CG-CG 4.28Å; P699-F764 HydrophobicContact CG-CZ 3.38Å
700	G	89.1	Confident	93.6	Very high	4 Å²	4	46.4 Å²	46.4	4%	0.041	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.9	-14.6	-179.5	0	0	0	0	0	115.8	E693 Y698 N704	E693-G700 VanDerWaalsContact CD-N 3.32Å; E693-G700 WeakPolarHBondContact OE1-CA 3.39Å; E693-G700 PolarHBondContact OE1-N 3.25Å; E693-G700 PolarHBondContact OE2-N 3.26Å; Y698-G700 PolarHBondContact O-N 3.44Å; G700-N704 VanDerWaalsContact O-CB 3.22Å; G700-N704 WeakPolarHBondContact O-CB 3.45Å; G700-N704 PolarHBondContact O-N 3.32Å; G700-N704 PolarHBondContact O-ND2 3.45Å
701	C	91.9	Very high	93.5	Very high	75 Å²	75	48 Å²	48	51%	0.507	23%	0.232	S	C	.	.	H	α-helix	trans	-64.8	-46.7	-175.1	-173.9	0	0	0	0	113.3	E693 Y698 P699 N705	E693-C701 PolarHBondContact OE1-N 3.09Å; Y698-C701 HydrophobicContact CD2-CB 3.96Å; Y698-C701 HydrophobicContact CG-CB 4.38Å; Y698-C701 WeakPolarHBondContact O-CB 3.48Å; Y698-C701 PolarHBondContact O-N 3.13Å; P699-C701 VanDerWaalsContact C-N 3.29Å; P699-C701 PolarHBondContact O-N 3.5Å; C701-N705 VanDerWaalsContact O-CB 3.26Å; C701-N705 WeakPolarHBondContact O-CB 3.4Å; C701-N705 PolarHBondContact O-N 2.98Å
702	L	94.1	Very high	93.3	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-74.2	-45.5	-177.7	-174.2	83.6	0	0	0	111.3	F647 I650 N651 L689 E693 N705 F706	F647-L702 HydrophobicContact CD2-CD1 4.18Å; F647-L702 HydrophobicContact CD2-CD2 3.48Å; F647-L702 VanDerWaalsContact CD2-CD2 3.48Å; F647-L702 HydrophobicContact CD2-CG 4.45Å; F647-L702 HydrophobicContact CE2-CD1 4.04Å; F647-L702 HydrophobicContact CE2-CD2 3.75Å; F647-L702 HydrophobicContact CE2-CG 4.4Å; I650-L702 HydrophobicContact CB-CD1 3.95Å; I650-L702 HydrophobicContact CG2-CD1 3.56Å; I650-L702 HydrophobicContact CG2-CG 3.89Å; N651-L702 HydrophobicContact CB-CD1 3.81Å; L689-L702 HydrophobicContact CB-CD2 4.2Å; L689-L702 HydrophobicContact CD2-CD2 3.9Å; L689-L702 HydrophobicContact CG-CD2 4.43Å; E693-L702 HydrophobicContact CG-CB 3.82Å; E693-L702 VanDerWaalsContact OE1-CA 3.27Å; E693-L702 WeakPolarHBondContact OE1-CA 3.27Å; E693-L702 WeakPolarHBondContact OE1-CB 3.46Å; E693-L702 PolarHBondContact OE1-N 3.39Å; L702-N705 PolarHBondContact O-N 3.09Å; L702-F706 WeakPolarHBondContact O-CB 3.31Å; L702-F706 PolarHBondContact O-N 3.38Å
703	L	95.4	Very high	93.4	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-70.7	-38.3	-176	-70.8	178.1	0	0	0	111.9	L689 R690 E693 F706 H707 I756 Y759 I760	L689-L703 HydrophobicContact CB-CD2 3.98Å; L689-L703 HydrophobicContact CD1-CD2 4.21Å; R690-L703 HydrophobicContact CB-CD1 3.99Å; E693-L703 PolarHBondContact OE1-N 2.95Å; L703-F706 PolarHBondContact O-N 3.39Å; L703-H707 WeakPolarHBondContact O-CB 3.47Å; L703-H707 PolarHBondContact O-N 2.76Å; L703-I756 HydrophobicContact CB-CG2 4.09Å; L703-I756 HydrophobicContact CD2-CG2 4.22Å; L703-Y759 WeakPolarHBondContact CD1-O 3.4Å; L703-I760 HydrophobicContact CB-CD1 3.91Å; L703-I760 HydrophobicContact CB-CG1 3.62Å; L703-I760 HydrophobicContact CD1-CG1 4.19Å
704	N	94.6	Very high	93.3	Very high	11 Å²	11	42.8 Å²	42.8	6%	0.059	21%	0.208	C	C	.	.	H	α-helix	trans	-64.7	-44.7	170.3	-77.5	-66.2	0	0	0	111.3	G700 F706 H707 N708 F764 D766	G700-N704 VanDerWaalsContact O-CB 3.22Å; G700-N704 WeakPolarHBondContact O-CB 3.45Å; G700-N704 PolarHBondContact O-N 3.32Å; G700-N704 PolarHBondContact O-ND2 3.45Å; N704-F706 VanDerWaalsContact C-N 3.3Å; N704-F706 PolarHBondContact O-N 3.37Å; N704-H707 WeakPolarHBondContact O-CB 3.44Å; N704-H707 PolarHBondContact O-N 2.91Å; N704-N708 PolarHBondContact O-N 3.08Å; N704-N708 PolarHBondContact O-ND2 2.96Å; N704-F764 PolarHBondContact ND2-O 3.46Å; N704-D766 PolarHBondContact OD1-N 3.17Å
705	N	95.1	Very high	92.9	Very high	28 Å²	28	43.6 Å²	43.6	15%	0.15	21%	0.211	C	C	.	.	H	α-helix	trans	-56.8	-46.5	175.1	178.4	46.8	0	0	0	111.1	I650 I653 N654 C701 L702 H707 N708 L709	I650-N705 PolarHBondContact O-ND2 2.98Å; I650-N705 VanDerWaalsContact O-ND2 3.15Å; I653-N705 PolarHBondContact O-ND2 3.03Å; N654-N705 WeakPolarHBondContact CA-OD1 3.37Å; N654-N705 WeakPolarHBondContact CB-OD1 3.36Å; C701-N705 VanDerWaalsContact O-CB 3.26Å; C701-N705 WeakPolarHBondContact O-CB 3.4Å; C701-N705 PolarHBondContact O-N 2.98Å; L702-N705 PolarHBondContact O-N 3.09Å; N705-H707 PolarHBondContact O-N 3.49Å; N705-N708 PolarHBondContact O-N 3.09Å; N705-L709 WeakPolarHBondContact O-CB 3.35Å; N705-L709 VanDerWaalsContact O-CG 3.29Å; N705-L709 WeakPolarHBondContact O-CG 3.43Å; N705-L709 PolarHBondContact O-N 2.78Å
706	F	96.4	Very high	92.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-64	-42.6	179.7	-169	-143.1	0	0	0	112.2	I650 L666 L673 L702 L703 N704 N708 L709 L710 I756	I650-F706 HydrophobicContact CD1-CB 4.46Å; I650-F706 HydrophobicContact CD1-CD1 3.94Å; I650-F706 HydrophobicContact CD1-CD2 3.96Å; I650-F706 HydrophobicContact CD1-CE1 4.17Å; I650-F706 HydrophobicContact CD1-CE2 4.19Å; I650-F706 HydrophobicContact CD1-CG 3.85Å; I650-F706 HydrophobicContact CD1-CZ 4.3Å; I650-F706 HydrophobicContact CG1-CD2 3.97Å; I650-F706 HydrophobicContact CG1-CE2 4.26Å; I650-F706 HydrophobicContact CG1-CG 4.29Å; I650-F706 HydrophobicContact CG2-CB 3.76Å; I650-F706 HydrophobicContact CG2-CD2 4.17Å; I650-F706 HydrophobicContact CG2-CG 4.12Å; L666-F706 HydrophobicContact CD1-CD2 4.23Å; L666-F706 HydrophobicContact CD1-CE2 3.83Å; L673-F706 HydrophobicContact CD1-CE1 3.34Å; L673-F706 HydrophobicContact CD1-CZ 3.5Å; L702-F706 WeakPolarHBondContact O-CB 3.31Å; L702-F706 PolarHBondContact O-N 3.38Å; L703-F706 PolarHBondContact O-N 3.39Å; N704-F706 VanDerWaalsContact C-N 3.3Å; N704-F706 PolarHBondContact O-N 3.37Å; F706-N708 VanDerWaalsContact C-N 3.32Å; F706-N708 PolarHBondContact O-N 3.44Å; F706-L709 WeakPolarHBondContact O-CB 3.28Å; F706-L709 PolarHBondContact O-N 3.46Å; F706-L710 HydrophobicContact CD2-CD2 4.49Å; F706-L710 HydrophobicContact CD2-CG 4.22Å; F706-L710 HydrophobicContact CE1-CD1 4.16Å; F706-L710 HydrophobicContact CE2-CD1 4.26Å; F706-L710 HydrophobicContact CE2-CD2 3.77Å; F706-L710 HydrophobicContact CE2-CG 3.92Å; F706-L710 HydrophobicContact CZ-CD1 4Å; F706-L710 HydrophobicContact CZ-CD2 4.02Å; F706-L710 HydrophobicContact CZ-CG 4.15Å; F706-L710 WeakPolarHBondContact O-CG 3Å; F706-L710 PolarHBondContact O-N 2.99Å; F706-I756 HydrophobicContact CD1-CD1 3.45Å; F706-I756 VanDerWaalsContact CD1-CD1 3.45Å; F706-I756 HydrophobicContact CD1-CG1 4.38Å; F706-I756 HydrophobicContact CE1-CD1 3.76Å; F706-I756 HydrophobicContact CG-CD1 4.19Å
707	H	95.3	Very high	92.5	Very high	17 Å²	17	35 Å²	35	8%	0.079	16%	0.163	C	C	.	.	H	α-helix	trans	-57.3	-44.5	173.8	-177.4	-97.6	0	0	0	112	L703 N704 N705 L710 R711 L746 I756	L703-H707 WeakPolarHBondContact O-CB 3.47Å; L703-H707 PolarHBondContact O-N 2.76Å; N704-H707 WeakPolarHBondContact O-CB 3.44Å; N704-H707 PolarHBondContact O-N 2.91Å; N705-H707 PolarHBondContact O-N 3.49Å; H707-L710 PolarHBondContact O-N 3.47Å; H707-R711 VanDerWaalsContact CE1-CZ 3.48Å; H707-R711 PolarHBondContact CE1-NE 3.17Å; H707-R711 PolarHBondContact CE1-NH2 2.88Å; H707-R711 PolarHBondContact O-N 2.88Å; H707-R711 VanDerWaalsContact O-N 3.11Å; H707-L746 VanDerWaalsContact CD2-CD2 3.45Å; H707-L746 WeakPolarHBondContact CD2-CD2 3.3Å; H707-I756 HydrophobicContact CB-CG2 4.19Å
708	N	94.3	Very high	92.1	Very high	29 Å²	29	29.8 Å²	29.8	16%	0.155	14%	0.143	C	C	.	.	H	α-helix	trans	-65.6	-41.3	176.4	-70.3	-29.5	0	0	0	112.7	V655 N704 N705 F706 L710 R711 F712	V655-N708 HydrophobicContact CG2-CB 4.06Å; N704-N708 PolarHBondContact O-N 3.08Å; N704-N708 PolarHBondContact O-ND2 2.96Å; N705-N708 PolarHBondContact O-N 3.09Å; F706-N708 VanDerWaalsContact C-N 3.32Å; F706-N708 PolarHBondContact O-N 3.44Å; N708-L710 VanDerWaalsContact C-N 3.3Å; N708-L710 PolarHBondContact O-N 3.29Å; N708-R711 PolarHBondContact O-N 3.26Å; N708-F712 PolarHBondContact O-N 3.34Å
709	L	96	Very high	91.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.7	-40	174.3	-73.8	166.9	0	0	0	111.8	I653 V655 L658 L666 N705 F706 F712 W713	I653-L709 HydrophobicContact CD1-CD1 3.99Å; I653-L709 HydrophobicContact CD1-CD2 4.17Å; I653-L709 HydrophobicContact CG1-CD1 3.85Å; I653-L709 HydrophobicContact CG1-CD2 4.3Å; V655-L709 HydrophobicContact CG2-CD2 4.08Å; V655-L709 HydrophobicContact CG2-CG 4.37Å; L658-L709 HydrophobicContact CD1-CD2 3.69Å; L658-L709 HydrophobicContact CD2-CD2 4.33Å; L658-L709 HydrophobicContact CG-CD2 4.05Å; L666-L709 HydrophobicContact CD1-CB 3.83Å; L666-L709 HydrophobicContact CD1-CD1 4.47Å; L666-L709 HydrophobicContact CD2-CB 4.02Å; L666-L709 HydrophobicContact CD2-CD2 4.44Å; L666-L709 WeakPolarHBondContact CD2-O 3.3Å; N705-L709 WeakPolarHBondContact O-CB 3.35Å; N705-L709 VanDerWaalsContact O-CG 3.29Å; N705-L709 WeakPolarHBondContact O-CG 3.43Å; N705-L709 PolarHBondContact O-N 2.78Å; F706-L709 WeakPolarHBondContact O-CB 3.28Å; F706-L709 PolarHBondContact O-N 3.46Å; L709-F712 WeakPolarHBondContact O-CB 3.48Å; L709-F712 PolarHBondContact O-N 3.18Å; L709-W713 WeakPolarHBondContact O-CB 3.21Å; L709-W713 PolarHBondContact O-N 2.94Å
710	L	95.8	Very high	90.4	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-69.7	-37.3	177.7	-68.2	-174.9	0	0	0	112.9	L666 L670 F706 H707 N708 F712 W713 Q714 V742 L745 L746 I756	L666-L710 HydrophobicContact CD1-CD2 4.24Å; L670-L710 HydrophobicContact CD1-CD2 3.92Å; L670-L710 HydrophobicContact CD2-CD2 3.6Å; L670-L710 HydrophobicContact CG-CD2 3.88Å; F706-L710 HydrophobicContact CD2-CD2 4.49Å; F706-L710 HydrophobicContact CD2-CG 4.22Å; F706-L710 HydrophobicContact CE1-CD1 4.16Å; F706-L710 HydrophobicContact CE2-CD1 4.26Å; F706-L710 HydrophobicContact CE2-CD2 3.77Å; F706-L710 HydrophobicContact CE2-CG 3.92Å; F706-L710 HydrophobicContact CZ-CD1 4Å; F706-L710 HydrophobicContact CZ-CD2 4.02Å; F706-L710 HydrophobicContact CZ-CG 4.15Å; F706-L710 WeakPolarHBondContact O-CG 3Å; F706-L710 PolarHBondContact O-N 2.99Å; H707-L710 PolarHBondContact O-N 3.47Å; N708-L710 VanDerWaalsContact C-N 3.3Å; N708-L710 PolarHBondContact O-N 3.29Å; L710-F712 VanDerWaalsContact C-N 3.33Å; L710-W713 WeakPolarHBondContact O-CB 3.3Å; L710-W713 PolarHBondContact O-N 3.41Å; L710-Q714 PolarHBondContact O-N 3.13Å; L710-V742 HydrophobicContact CB-CG1 4.38Å; L710-V742 HydrophobicContact CD2-CG2 4.42Å; L710-L745 HydrophobicContact CD1-CB 3.6Å; L710-L745 HydrophobicContact CD1-CD1 3.77Å; L710-L745 HydrophobicContact CD1-CG 4.28Å; L710-L746 HydrophobicContact CB-CD1 4.07Å; L710-L746 HydrophobicContact CB-CD2 3.8Å; L710-L746 HydrophobicContact CB-CG 3.99Å; L710-I756 HydrophobicContact CD1-CD1 3.52Å
711	R	93.2	Very high	89.6	Confident	97 Å²	97	39.2 Å²	39.2	37%	0.366	19%	0.194	S	C	.	.	H	α-helix	trans	-61.7	-42.5	170.9	-74.9	-173.8	174.3	176.4	-4.1	111.5	H707 N708 R715 L746 L772	H707-R711 VanDerWaalsContact CE1-CZ 3.48Å; H707-R711 PolarHBondContact CE1-NE 3.17Å; H707-R711 PolarHBondContact CE1-NH2 2.88Å; H707-R711 PolarHBondContact O-N 2.88Å; H707-R711 VanDerWaalsContact O-N 3.11Å; N708-R711 PolarHBondContact O-N 3.26Å; R711-R715 PolarHBondContact O-N 3.47Å; R711-L746 HydrophobicContact CG-CD1 4.27Å; R711-L746 HydrophobicContact CG-CD2 4.01Å; R711-L772 HydrophobicContact CB-CD1 4.08Å
712	F	92.3	Very high	88.9	Confident	3 Å²	3	42.2 Å²	42.2	1%	0.013	20%	0.198	C	C	.	.	H	α-helix	trans	-60.3	-45.8	172	170.1	-89.5	0	0	0	111.3	L252 L253 V655 L658 N708 L709 L710 Q714 R715 H716	L252-F712 HydrophobicContact CB-CE2 4.21Å; L252-F712 HydrophobicContact CB-CZ 3.56Å; L252-F712 HydrophobicContact CD1-CE1 4.5Å; L252-F712 HydrophobicContact CD1-CZ 4.26Å; L253-F712 HydrophobicContact CB-CE2 4.33Å; L253-F712 HydrophobicContact CD1-CD2 4.36Å; V655-F712 HydrophobicContact CG1-CB 4.24Å; V655-F712 HydrophobicContact CG1-CD2 4.15Å; V655-F712 HydrophobicContact CG1-CG 4.39Å; V655-F712 HydrophobicContact CG2-CB 4.06Å; L658-F712 HydrophobicContact CD1-CD1 3.34Å; L658-F712 HydrophobicContact CD1-CE1 3.42Å; L658-F712 VanDerWaalsContact CD1-CE1 3.42Å; L658-F712 HydrophobicContact CD1-CG 4.02Å; L658-F712 HydrophobicContact CD1-CZ 4.12Å; N708-F712 PolarHBondContact O-N 3.34Å; L709-F712 WeakPolarHBondContact O-CB 3.48Å; L709-F712 PolarHBondContact O-N 3.18Å; L710-F712 VanDerWaalsContact C-N 3.33Å; F712-Q714 VanDerWaalsContact C-N 3.33Å; F712-Q714 PolarHBondContact O-N 3.38Å; F712-R715 PolarHBondContact O-N 3.11Å; F712-R715 VanDerWaalsContact O-N 3.13Å; F712-H716 HydrophobicContact CD1-CB 4.35Å; F712-H716 HydrophobicContact CE1-CB 3.79Å; F712-H716 AromaticContact CE1-CG 3.95Å; F712-H716 AromaticContact CE1-ND1 3.98Å; F712-H716 HydrophobicContact CE2-CB 4.5Å; F712-H716 HydrophobicContact CZ-CB 3.87Å; F712-H716 AromaticContact CZ-CG 3.87Å; F712-H716 AromaticContact CZ-ND1 3.47Å; F712-H716 WeakPolarHBondContact CZ-ND1 3.42Å; F712-H716 WeakPolarHBondContact O-CB 3.39Å; F712-H716 PolarHBondContact O-N 3.5Å
713	W	94.2	Very high	88.4	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	21%	0.212	C	C	.	.	H	α-helix	trans	-55.6	-45.9	179.7	-173.8	98.4	0	0	0	112	L666 N667 L670 L709 L710 R715 H716 Y717 L727 F735 W738 V742	L666-W713 HydrophobicContact CD2-CB 3.99Å; L666-W713 HydrophobicContact CD2-CG 4.44Å; N667-W713 PolarHBondContact OD1-NE1 3.35Å; L670-W713 HydrophobicContact CD1-CD2 4.15Å; L670-W713 HydrophobicContact CD1-CG 4.06Å; L709-W713 WeakPolarHBondContact O-CB 3.21Å; L709-W713 PolarHBondContact O-N 2.94Å; L710-W713 WeakPolarHBondContact O-CB 3.3Å; L710-W713 PolarHBondContact O-N 3.41Å; W713-R715 VanDerWaalsContact C-N 3.33Å; W713-R715 PolarHBondContact O-N 3.22Å; W713-H716 PolarHBondContact O-N 3.23Å; W713-Y717 AromaticContact CD1-CD2 3.43Å; W713-Y717 VanDerWaalsContact CD1-CD2 3.43Å; W713-Y717 AromaticContact CD1-CE2 3.55Å; W713-Y717 AromaticContact CD2-CD2 3.92Å; W713-Y717 HydrophobicContact CD2-CD2 3.92Å; W713-Y717 HydrophobicContact CD2-CG 4.48Å; W713-Y717 AromaticContact CE2-CD2 3.63Å; W713-Y717 AromaticContact CG-CD2 3.8Å; W713-Y717 HydrophobicContact CG-CD2 3.8Å; W713-Y717 HydrophobicContact CG-CE2 4.31Å; W713-Y717 HydrophobicContact CZ2-CD2 4.33Å; W713-Y717 HydrophobicContact CZ2-CG 4.25Å; W713-Y717 AromaticContact NE1-CD2 3.3Å; W713-Y717 VanDerWaalsContact NE1-CD2 3.3Å; W713-Y717 AromaticContact NE1-CE2 3.52Å; W713-Y717 PolarHBondContact O-N 3.25Å; W713-L727 HydrophobicContact CZ2-CD1 4.06Å; W713-F735 AromaticContact CH2-CE2 3.63Å; W713-F735 HydrophobicContact CH2-CE2 3.63Å; W713-F735 AromaticContact CH2-CZ 3.86Å; W713-F735 HydrophobicContact CH2-CZ 3.86Å; W713-F735 AromaticContact CZ2-CE2 3.85Å; W713-F735 HydrophobicContact CZ2-CE2 3.85Å; W713-F735 HydrophobicContact CZ2-CZ 4.42Å; W713-W738 HydrophobicContact CH2-CB 3.9Å; W713-W738 HydrophobicContact CZ2-CB 4.14Å; W713-W738 AromaticContact CZ2-CE3 3.92Å; W713-W738 HydrophobicContact CZ2-CE3 3.92Å; W713-V742 HydrophobicContact CD2-CG2 4.12Å; W713-V742 HydrophobicContact CE3-CB 4.19Å; W713-V742 HydrophobicContact CE3-CG1 4Å; W713-V742 HydrophobicContact CE3-CG2 3.67Å; W713-V742 HydrophobicContact CH2-CG2 4.3Å; W713-V742 HydrophobicContact CZ3-CB 4.2Å; W713-V742 HydrophobicContact CZ3-CG1 4.41Å; W713-V742 HydrophobicContact CZ3-CG2 3.78Å
714	Q	90.9	Very high	87.9	Confident	56 Å²	56	45.3 Å²	45.3	26%	0.262	22%	0.216	S	C	.	.	H	α-helix	trans	-56.4	-48.1	177.2	-74.2	-175	-43.1	0	0	111.1	L710 F712 H716 L718 V742 L746	L710-Q714 PolarHBondContact O-N 3.13Å; F712-Q714 VanDerWaalsContact C-N 3.33Å; F712-Q714 PolarHBondContact O-N 3.38Å; Q714-H716 VanDerWaalsContact C-N 3.32Å; Q714-H716 PolarHBondContact O-N 3.43Å; Q714-L718 HydrophobicContact CB-CD1 3.94Å; Q714-L718 HydrophobicContact CG-CD1 4.39Å; Q714-L718 WeakPolarHBondContact O-CB 3.41Å; Q714-L718 WeakPolarHBondContact O-CD1 3.45Å; Q714-L718 WeakPolarHBondContact O-CG 3.38Å; Q714-L718 PolarHBondContact O-N 3.46Å; Q714-L718 VanDerWaalsContact O-N 3.14Å; Q714-V742 HydrophobicContact CG-CG1 3.49Å; Q714-V742 VanDerWaalsContact CG-CG1 3.49Å; Q714-L746 HydrophobicContact CG-CD1 4.05Å; Q714-L746 VanDerWaalsContact OE1-CD1 3.22Å
715	R	85.8	Confident	87.4	Confident	106 Å²	106	48.3 Å²	48.3	40%	0.4	23%	0.234	S	C	.	.	H	α-helix	trans	-67.8	-34	-179.2	-66.7	162	173.2	-131.8	4.4	112.6	R711 F712 W713 L772	R711-R715 PolarHBondContact O-N 3.47Å; F712-R715 PolarHBondContact O-N 3.11Å; F712-R715 VanDerWaalsContact O-N 3.13Å; W713-R715 VanDerWaalsContact C-N 3.33Å; W713-R715 PolarHBondContact O-N 3.22Å; R715-L772 VanDerWaalsContact NH1-CB 3.29Å; R715-L772 PolarHBondContact NH1-O 3.39Å
716	H	87.3	Confident	87	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.009	24%	0.24	C	C	.	.	H	α-helix	trans	-76.4	-45.6	-177.3	-172	94.2	0	0	0	112.9	N256 F712 W713 Q714 K720	N256-H716 PolarHBondContact ND2-ND1 2.87Å; N256-H716 PolarHBondContact OD1-ND1 3.5Å; F712-H716 HydrophobicContact CD1-CB 4.35Å; F712-H716 HydrophobicContact CE1-CB 3.79Å; F712-H716 AromaticContact CE1-CG 3.95Å; F712-H716 AromaticContact CE1-ND1 3.98Å; F712-H716 HydrophobicContact CE2-CB 4.5Å; F712-H716 HydrophobicContact CZ-CB 3.87Å; F712-H716 AromaticContact CZ-CG 3.87Å; F712-H716 AromaticContact CZ-ND1 3.47Å; F712-H716 WeakPolarHBondContact CZ-ND1 3.42Å; F712-H716 WeakPolarHBondContact O-CB 3.39Å; F712-H716 PolarHBondContact O-N 3.5Å; W713-H716 PolarHBondContact O-N 3.23Å; Q714-H716 VanDerWaalsContact C-N 3.32Å; Q714-H716 PolarHBondContact O-N 3.43Å; H716-K720 PolarHBondContact CE1-NZ 3.42Å; H716-K720 PolarHBondContact NE2-NZ 3.31Å; H716-K720 WeakPolarHBondContact O-CD 3.41Å; H716-K720 WeakPolarHBondContact O-CG 3.38Å
717	Y	88.8	Confident	86.7	Confident	13 Å²	13	49.2 Å²	49.2	5%	0.051	24%	0.242	C	C	.	.	H	α-helix	trans	-96.8	-25.5	-171.3	-75.8	-83.2	0	0	0	114.7	V663 N667 W713 N719 K720 D723 L727	V663-Y717 HydrophobicContact CG2-CE2 4.43Å; N667-Y717 PolarHBondContact ND2-OH 3.21Å; W713-Y717 AromaticContact CD1-CD2 3.43Å; W713-Y717 VanDerWaalsContact CD1-CD2 3.43Å; W713-Y717 AromaticContact CD1-CE2 3.55Å; W713-Y717 AromaticContact CD2-CD2 3.92Å; W713-Y717 HydrophobicContact CD2-CD2 3.92Å; W713-Y717 HydrophobicContact CD2-CG 4.48Å; W713-Y717 AromaticContact CE2-CD2 3.63Å; W713-Y717 AromaticContact CG-CD2 3.8Å; W713-Y717 HydrophobicContact CG-CD2 3.8Å; W713-Y717 HydrophobicContact CG-CE2 4.31Å; W713-Y717 HydrophobicContact CZ2-CD2 4.33Å; W713-Y717 HydrophobicContact CZ2-CG 4.25Å; W713-Y717 AromaticContact NE1-CD2 3.3Å; W713-Y717 VanDerWaalsContact NE1-CD2 3.3Å; W713-Y717 AromaticContact NE1-CE2 3.52Å; W713-Y717 PolarHBondContact O-N 3.25Å; Y717-N719 PolarHBondContact O-N 3.38Å; Y717-K720 PolarHBondContact O-N 3.33Å; Y717-D723 HydrophobicContact CD1-CB 3.91Å; Y717-D723 HydrophobicContact CE1-CB 3.84Å; Y717-L727 HydrophobicContact CD1-CD1 3.6Å; Y717-L727 HydrophobicContact CD1-CG 4.44Å; Y717-L727 HydrophobicContact CE1-CD1 3.55Å; Y717-L727 HydrophobicContact CE1-CG 4.08Å; Y717-L727 HydrophobicContact CG-CD1 4.2Å
718	L	81.5	Confident	86.5	Confident	78 Å²	78	52.2 Å²	52.2	41%	0.408	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-18.8	-175.7	-69.5	176.5	0	0	0	114.1	Q714 F735 K739	Q714-L718 HydrophobicContact CB-CD1 3.94Å; Q714-L718 HydrophobicContact CG-CD1 4.39Å; Q714-L718 WeakPolarHBondContact O-CB 3.41Å; Q714-L718 WeakPolarHBondContact O-CD1 3.45Å; Q714-L718 WeakPolarHBondContact O-CG 3.38Å; Q714-L718 PolarHBondContact O-N 3.46Å; Q714-L718 VanDerWaalsContact O-N 3.14Å; L718-F735 HydrophobicContact CD2-CE1 4.45Å; L718-K739 HydrophobicContact CD2-CD 3.38Å; L718-K739 HydrophobicContact CD2-CG 3.59Å
719	N	72.3	Confident	86.2	Confident	133 Å²	133	53.6 Å²	53.6	71%	0.711	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	11.6	-178.8	-60.3	-39.3	0	0	0	113.2	Y717	Y717-N719 PolarHBondContact O-N 3.38Å
720	K	75.2	Confident	85.8	Confident	40 Å²	40	54.7 Å²	54.7	17%	0.174	27%	0.271	C	S	.	.			trans	-126	94.9	-175.8	-64.7	-169.8	-172.6	176.3	0	111.2	N256 H716 Y717 K722 D723 S724	N256-K720 PolarHBondContact OD1-NZ 2.88Å; H716-K720 PolarHBondContact CE1-NZ 3.42Å; H716-K720 PolarHBondContact NE2-NZ 3.31Å; H716-K720 WeakPolarHBondContact O-CD 3.41Å; H716-K720 WeakPolarHBondContact O-CG 3.38Å; Y717-K720 PolarHBondContact O-N 3.33Å; K720-K722 VanDerWaalsContact C-N 3.32Å; K720-K722 PolarHBondContact O-N 2.71Å; K720-D723 HydrophobicContact CB-CB 4.13Å; K720-D723 WeakPolarHBondContact CD-OD2 3.46Å; K720-D723 PolarHBondContact O-N 3.44Å; K720-S724 WeakPolarHBondContact O-CB 3.46Å; K720-S724 PolarHBondContact O-N 3.28Å; K720-S724 VanDerWaalsContact O-N 3.11Å; K720-S724 PolarHBondContact O-OG 3.45Å
721	D	72.2	Confident	85.6	Confident	133 Å²	133	54.9 Å²	54.9	71%	0.711	27%	0.272	S	S	*	.	H	α-helix	trans	-62.5	-36.9	-176.7	-64.5	-24.9	0	0	0	112.8	S724 T725	D721-S724 WeakPolarHBondContact CA-OG 3.12Å; D721-S724 PolarHBondContact O-OG 2.99Å; D721-T725 WeakPolarHBondContact O-CB 3.38Å; D721-T725 PolarHBondContact O-N 3.46Å; D721-T725 VanDerWaalsContact O-N 3.1Å; D721-T725 PolarHBondContact O-OG1 3.1Å
722	K	77.3	Confident	85.6	Confident	139 Å²	139	53.7 Å²	53.7	60%	0.604	28%	0.278	S	S	*	.	H	α-helix	trans	-65.8	-50.3	178.6	-171.5	-178.4	178.2	-173.7	0	111.7	K720 S724 T725 C726	K720-K722 VanDerWaalsContact C-N 3.32Å; K720-K722 PolarHBondContact O-N 2.71Å; K722-S724 PolarHBondContact O-N 2.75Å; K722-T725 PolarHBondContact O-N 3.42Å; K722-C726 PolarHBondContact O-N 3.45Å; K722-C726 PolarHBondContact O-SG 2.92Å
723	D	82.4	Confident	85.7	Confident	54 Å²	54	53.6 Å²	53.6	29%	0.289	28%	0.277	S	S	.	.	H	α-helix	trans	-68.8	-37.8	-174.8	-62.1	-25.7	0	0	0	111.6	Y717 K720 C726 L727	Y717-D723 HydrophobicContact CD1-CB 3.91Å; Y717-D723 HydrophobicContact CE1-CB 3.84Å; K720-D723 HydrophobicContact CB-CB 4.13Å; K720-D723 WeakPolarHBondContact CD-OD2 3.46Å; K720-D723 PolarHBondContact O-N 3.44Å; D723-C726 PolarHBondContact O-N 3Å; D723-L727 PolarHBondContact O-N 3.35Å
724	S	84.9	Confident	85.8	Confident	12 Å²	12	56.5 Å²	56.5	8%	0.084	30%	0.297	C	S	.	.	H	α-helix	trans	-64.4	-42.1	174	53.7	0	0	0	0	112.5	K720 D721 K722 C726 L727 E728 F735	K720-S724 WeakPolarHBondContact O-CB 3.46Å; K720-S724 PolarHBondContact O-N 3.28Å; K720-S724 VanDerWaalsContact O-N 3.11Å; K720-S724 PolarHBondContact O-OG 3.45Å; D721-S724 WeakPolarHBondContact CA-OG 3.12Å; D721-S724 PolarHBondContact O-OG 2.99Å; K722-S724 PolarHBondContact O-N 2.75Å; S724-C726 VanDerWaalsContact C-N 3.33Å; S724-C726 PolarHBondContact O-N 3.29Å; S724-L727 PolarHBondContact O-N 2.98Å; S724-E728 PolarHBondContact O-N 3.34Å; S724-F735 VanDerWaalsContact CB-CZ 3.48Å
725	T	85.1	Confident	86	Confident	73 Å²	73	55 Å²	55	45%	0.448	29%	0.289	S	S	.	.	H	α-helix	trans	-61.9	-40.2	173.9	-57.2	0	0	0	0	111.5	D721 K722 E728 N729	D721-T725 WeakPolarHBondContact O-CB 3.38Å; D721-T725 PolarHBondContact O-N 3.46Å; D721-T725 VanDerWaalsContact O-N 3.1Å; D721-T725 PolarHBondContact O-OG1 3.1Å; K722-T725 PolarHBondContact O-N 3.42Å; T725-E728 PolarHBondContact O-N 3.26Å; T725-N729 WeakPolarHBondContact O-CB 3.32Å; T725-N729 PolarHBondContact O-N 2.86Å; T725-N729 PolarHBondContact O-ND2 3.03Å
726	C	85.9	Confident	86.4	Confident	39 Å²	39	53.6 Å²	53.6	26%	0.264	30%	0.296	S	S	.	.	H	α-helix	trans	-63	-39.6	174.4	-73.7	0	0	0	0	112.7	K722 D723 S724 S730	K722-C726 PolarHBondContact O-N 3.45Å; K722-C726 PolarHBondContact O-SG 2.92Å; D723-C726 PolarHBondContact O-N 3Å; S724-C726 VanDerWaalsContact C-N 3.33Å; S724-C726 PolarHBondContact O-N 3.29Å; C726-S730 WeakPolarHBondContact O-CB 3.36Å; C726-S730 PolarHBondContact O-N 3.19Å; C726-S730 PolarHBondContact O-OG 3.5Å
727	L	89.8	Confident	86.9	Confident	8 Å²	8	55.3 Å²	55.3	4%	0.042	30%	0.302	C	S	.	.	H	α-helix	trans	-63.1	-43.6	174.5	-73.2	179.7	0	0	0	112.1	N667 W713 Y717 D723 S724 S730 S731 F735 W738	N667-L727 HydrophobicContact CB-CD2 4.13Å; W713-L727 HydrophobicContact CZ2-CD1 4.06Å; Y717-L727 HydrophobicContact CD1-CD1 3.6Å; Y717-L727 HydrophobicContact CD1-CG 4.44Å; Y717-L727 HydrophobicContact CE1-CD1 3.55Å; Y717-L727 HydrophobicContact CE1-CG 4.08Å; Y717-L727 HydrophobicContact CG-CD1 4.2Å; D723-L727 PolarHBondContact O-N 3.35Å; S724-L727 PolarHBondContact O-N 2.98Å; L727-S730 PolarHBondContact O-OG 3.02Å; L727-S731 WeakPolarHBondContact O-CB 3.45Å; L727-S731 PolarHBondContact O-N 3.09Å; L727-S731 VanDerWaalsContact O-N 3.1Å; L727-S731 PolarHBondContact O-OG 3.4Å; L727-F735 HydrophobicContact CD1-CE2 4.21Å; L727-W738 HydrophobicContact CB-CZ2 4.38Å; L727-W738 HydrophobicContact CD2-CH2 4.18Å; L727-W738 HydrophobicContact CD2-CZ2 4.44Å
728	E	91.3	Very high	87.3	Confident	80 Å²	80	54.7 Å²	54.7	37%	0.374	30%	0.3	S	S	.	.	H	α-helix	trans	-62.5	-52.3	177.8	-176.6	165.8	121.7	0	0	111.2	S724 T725 S730 S731 C732 P734 F735	S724-E728 PolarHBondContact O-N 3.34Å; T725-E728 PolarHBondContact O-N 3.26Å; E728-S730 PolarHBondContact O-N 3.27Å; E728-S731 PolarHBondContact O-N 3.16Å; E728-C732 WeakPolarHBondContact O-CA 3.44Å; E728-C732 PolarHBondContact O-N 2.76Å; E728-P734 WeakPolarHBondContact OE2-CA 3.49Å; E728-F735 PolarHBondContact OE2-N 3.35Å
729	N	87.4	Confident	87.9	Confident	59 Å²	59	55.3 Å²	55.3	32%	0.316	30%	0.299	S	S	.	.	H	α-helix	trans	-62.1	-41.1	-179.8	-72.5	-22.3	0	0	0	112.8	T725	T725-N729 WeakPolarHBondContact O-CB 3.32Å; T725-N729 PolarHBondContact O-N 2.86Å; T725-N729 PolarHBondContact O-ND2 3.03Å
730	S	88.5	Confident	89.1	Confident	23 Å²	23	53.2 Å²	53.2	16%	0.161	29%	0.285	C	S	.	.	H	α-helix	trans	-72.6	-28.6	-178.4	62	0	0	0	0	113.3	C726 L727 E728	C726-S730 WeakPolarHBondContact O-CB 3.36Å; C726-S730 PolarHBondContact O-N 3.19Å; C726-S730 PolarHBondContact O-OG 3.5Å; L727-S730 PolarHBondContact O-OG 3.02Å; E728-S730 PolarHBondContact O-N 3.27Å
731	S	92.5	Very high	90.1	Very high	3 Å²	3	51.3 Å²	51.3	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-101.8	-18.3	-177.3	65.6	0	0	0	0	114.6	L727 E728 I733 W738	L727-S731 WeakPolarHBondContact O-CB 3.45Å; L727-S731 PolarHBondContact O-N 3.09Å; L727-S731 VanDerWaalsContact O-N 3.1Å; L727-S731 PolarHBondContact O-OG 3.4Å; E728-S731 PolarHBondContact O-N 3.16Å; S731-I733 PolarHBondContact O-N 3.37Å; S731-I733 WeakPolarHBondContact OG-CB 3.37Å; S731-I733 PolarHBondContact OG-N 3.01Å; S731-I733 VanDerWaalsContact OG-N 3.16Å; S731-W738 PolarHBondContact OG-NE1 3.28Å
732	C	92.7	Very high	91.3	Very high	72 Å²	72	45 Å²	45	49%	0.486	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	29.4	-163.5	-63	0	0	0	0	112.7	F568 E728	F568-C732 HydrophobicContact CE2-CB 4.15Å; F568-C732 VanDerWaalsContact CE2-SG 3.6Å; F568-C732 HydrophobicContact CZ-CB 4.23Å; E728-C732 WeakPolarHBondContact O-CA 3.44Å; E728-C732 PolarHBondContact O-N 2.76Å
733	I	94.8	Very high	92.2	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	24%	0.236	C	C	.	.			trans	-113	121.5	174.6	-55.5	-179.1	0	0	0	108.3	L609 M674 L675 R678 S731 F735 Y737 W738	L609-I733 HydrophobicContact CD2-CD1 3.98Å; L609-I733 HydrophobicContact CD2-CG1 4.44Å; M674-I733 HydrophobicContact CE-CB 4.16Å; M674-I733 HydrophobicContact CE-CD1 3.93Å; M674-I733 HydrophobicContact CE-CG2 3.34Å; L675-I733 HydrophobicContact CD2-CD1 4.3Å; R678-I733 VanDerWaalsContact NH2-CG2 3.29Å; S731-I733 PolarHBondContact O-N 3.37Å; S731-I733 WeakPolarHBondContact OG-CB 3.37Å; S731-I733 PolarHBondContact OG-N 3.01Å; S731-I733 VanDerWaalsContact OG-N 3.16Å; I733-F735 PolarHBondContact O-N 3.45Å; I733-Y737 HydrophobicContact CG2-CD1 3.62Å; I733-Y737 HydrophobicContact CG2-CG 4.26Å; I733-W738 PolarHBondContact O-NE1 3.07Å
734	P	94.9	Very high	92.9	Very high	63 Å²	63	40.8 Å²	40.8	41%	0.409	23%	0.234	S	C	.	.			trans	-52.3	134	178.6	-28.3	35.3	0	0	0	111.8	E728 S736 Y737 W738	E728-P734 WeakPolarHBondContact OE2-CA 3.49Å; P734-S736 WeakPolarHBondContact CB-OG 2.87Å; P734-S736 PolarHBondContact O-N 3.04Å; P734-S736 VanDerWaalsContact O-N 3.12Å; P734-Y737 WeakPolarHBondContact O-CB 3.38Å; P734-Y737 PolarHBondContact O-N 2.84Å; P734-W738 PolarHBondContact O-N 3.43Å
735	F	94.9	Very high	93.5	Very high	24 Å²	24	40.2 Å²	40.2	11%	0.105	23%	0.23	C	C	.	.	H	α-helix	trans	-59.8	-26	-179.9	-170.8	-112.5	0	0	0	111.9	W713 L718 S724 L727 E728 I733 Y737 W738 K739	W713-F735 AromaticContact CH2-CE2 3.63Å; W713-F735 HydrophobicContact CH2-CE2 3.63Å; W713-F735 AromaticContact CH2-CZ 3.86Å; W713-F735 HydrophobicContact CH2-CZ 3.86Å; W713-F735 AromaticContact CZ2-CE2 3.85Å; W713-F735 HydrophobicContact CZ2-CE2 3.85Å; W713-F735 HydrophobicContact CZ2-CZ 4.42Å; L718-F735 HydrophobicContact CD2-CE1 4.45Å; S724-F735 VanDerWaalsContact CB-CZ 3.48Å; L727-F735 HydrophobicContact CD1-CE2 4.21Å; E728-F735 PolarHBondContact OE2-N 3.35Å; I733-F735 PolarHBondContact O-N 3.45Å; F735-Y737 VanDerWaalsContact C-N 3.29Å; F735-Y737 PolarHBondContact O-N 3.31Å; F735-W738 HydrophobicContact CD2-CB 4.05Å; F735-W738 HydrophobicContact CD2-CG 4.27Å; F735-W738 HydrophobicContact CE2-CB 4.36Å; F735-W738 WeakPolarHBondContact O-CB 3.48Å; F735-W738 PolarHBondContact O-N 3.18Å; F735-K739 HydrophobicContact CD1-CD 4.02Å; F735-K739 HydrophobicContact CD1-CG 4.09Å; F735-K739 HydrophobicContact CE1-CD 3.75Å; F735-K739 HydrophobicContact CE1-CG 3.8Å; F735-K739 HydrophobicContact CZ-CG 4.19Å; F735-K739 WeakPolarHBondContact O-CG 3.43Å; F735-K739 PolarHBondContact O-N 2.94Å
736	S	95.1	Very high	94	Very high	77 Å²	77	38 Å²	38	54%	0.538	22%	0.215	S	C	.	.	H	α-helix	trans	-55.2	-41.6	169.1	56.2	0	0	0	0	112.9	P734 K739 E740	P734-S736 WeakPolarHBondContact CB-OG 2.87Å; P734-S736 PolarHBondContact O-N 3.04Å; P734-S736 VanDerWaalsContact O-N 3.12Å; S736-K739 PolarHBondContact O-N 2.78Å; S736-E740 WeakPolarHBondContact O-CB 3.29Å; S736-E740 PolarHBondContact O-N 3.44Å
737	Y	97.1	Very high	94.3	Very high	37 Å²	37	37.3 Å²	37.3	15%	0.145	21%	0.214	C	C	.	.	H	α-helix	trans	-74.6	-30.2	179.2	-171.7	-107.1	0	0	0	112.5	M674 R677 R678 I733 P734 F735 E740 T741	M674-Y737 HydrophobicContact CB-CD1 4.49Å; M674-Y737 HydrophobicContact CB-CE1 3.88Å; M674-Y737 HydrophobicContact CE-CD1 3.49Å; M674-Y737 VanDerWaalsContact CE-CD1 3.49Å; M674-Y737 HydrophobicContact CE-CE1 4.04Å; M674-Y737 HydrophobicContact CG-CD1 4.48Å; M674-Y737 HydrophobicContact CG-CE1 4.19Å; M674-Y737 PolarHBondContact O-OH 2.85Å; M674-Y737 VanDerWaalsContact O-OH 3.05Å; R677-Y737 WeakPolarHBondContact CG-OH 3.38Å; R678-Y737 HydrophobicContact CG-CE1 4.11Å; R678-Y737 WeakPolarHBondContact CG-OH 3.45Å; R678-Y737 PolarHBondContact N-OH 2.85Å; I733-Y737 HydrophobicContact CG2-CD1 3.62Å; I733-Y737 HydrophobicContact CG2-CG 4.26Å; P734-Y737 WeakPolarHBondContact O-CB 3.38Å; P734-Y737 PolarHBondContact O-N 2.84Å; F735-Y737 VanDerWaalsContact C-N 3.29Å; F735-Y737 PolarHBondContact O-N 3.31Å; Y737-E740 VanDerWaalsContact CD2-OE2 3.3Å; Y737-E740 WeakPolarHBondContact CD2-OE2 3.4Å; Y737-T741 VanDerWaalsContact O-CB 3.3Å; Y737-T741 WeakPolarHBondContact O-CB 3.45Å; Y737-T741 PolarHBondContact O-N 2.99Å; Y737-T741 PolarHBondContact O-OG1 3.36Å
738	W	96.7	Very high	94.3	Very high	1 Å²	1	42.5 Å²	42.5	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-59.7	-53.1	167.9	-72.3	84.3	0	0	0	110.5	N667 L670 V671 M674 W713 L727 S731 I733 P734 F735 E740 T741 V742	N667-W738 HydrophobicContact CB-CH2 4.33Å; N667-W738 HydrophobicContact CB-CZ3 4.38Å; L670-W738 HydrophobicContact CB-CE3 4.23Å; L670-W738 HydrophobicContact CB-CZ3 3.74Å; L670-W738 HydrophobicContact CD1-CE3 4.29Å; L670-W738 HydrophobicContact CD1-CZ3 4.22Å; V671-W738 HydrophobicContact CG2-CH2 3.37Å; V671-W738 HydrophobicContact CG2-CZ2 3.65Å; V671-W738 HydrophobicContact CG2-CZ3 4.3Å; M674-W738 HydrophobicContact CE-CB 4.22Å; M674-W738 HydrophobicContact CE-CD2 3.57Å; M674-W738 HydrophobicContact CE-CE3 4.2Å; M674-W738 HydrophobicContact CE-CG 3.54Å; M674-W738 HydrophobicContact SD-CD2 3.56Å; M674-W738 VanDerWaalsContact SD-CD2 3.56Å; M674-W738 HydrophobicContact SD-CE3 3.53Å; M674-W738 VanDerWaalsContact SD-CE3 3.53Å; M674-W738 HydrophobicContact SD-CG 4.04Å; M674-W738 HydrophobicContact SD-CH2 4.4Å; M674-W738 HydrophobicContact SD-CZ2 4.39Å; M674-W738 HydrophobicContact SD-CZ3 3.97Å; W713-W738 HydrophobicContact CH2-CB 3.9Å; W713-W738 HydrophobicContact CZ2-CB 4.14Å; W713-W738 AromaticContact CZ2-CE3 3.92Å; W713-W738 HydrophobicContact CZ2-CE3 3.92Å; L727-W738 HydrophobicContact CB-CZ2 4.38Å; L727-W738 HydrophobicContact CD2-CH2 4.18Å; L727-W738 HydrophobicContact CD2-CZ2 4.44Å; S731-W738 PolarHBondContact OG-NE1 3.28Å; I733-W738 PolarHBondContact O-NE1 3.07Å; P734-W738 PolarHBondContact O-N 3.43Å; F735-W738 HydrophobicContact CD2-CB 4.05Å; F735-W738 HydrophobicContact CD2-CG 4.27Å; F735-W738 HydrophobicContact CE2-CB 4.36Å; F735-W738 WeakPolarHBondContact O-CB 3.48Å; F735-W738 PolarHBondContact O-N 3.18Å; W738-E740 VanDerWaalsContact C-N 3.35Å; W738-E740 PolarHBondContact O-N 3.34Å; W738-T741 PolarHBondContact O-N 3.21Å; W738-V742 WeakPolarHBondContact O-CG2 3.37Å; W738-V742 PolarHBondContact O-N 3.27Å
739	K	95.7	Very high	94.2	Very high	90 Å²	90	42.6 Å²	42.6	39%	0.391	25%	0.254	S	S	.	.	H	α-helix	trans	-57.5	-46.3	178.4	-67.9	-172.3	-67	-174.8	0	112.4	L718 F735 S736 S743	L718-K739 HydrophobicContact CD2-CD 3.38Å; L718-K739 HydrophobicContact CD2-CG 3.59Å; F735-K739 HydrophobicContact CD1-CD 4.02Å; F735-K739 HydrophobicContact CD1-CG 4.09Å; F735-K739 HydrophobicContact CE1-CD 3.75Å; F735-K739 HydrophobicContact CE1-CG 3.8Å; F735-K739 HydrophobicContact CZ-CG 4.19Å; F735-K739 WeakPolarHBondContact O-CG 3.43Å; F735-K739 PolarHBondContact O-N 2.94Å; S736-K739 PolarHBondContact O-N 2.78Å; K739-S743 WeakPolarHBondContact O-CB 3.06Å; K739-S743 PolarHBondContact O-N 3.47Å; K739-S743 PolarHBondContact O-OG 3.31Å
740	E	96.6	Very high	94.2	Very high	89 Å²	89	45 Å²	45	42%	0.416	26%	0.259	S	S	.	.	H	α-helix	trans	-62.7	-46.6	179	-169.3	-157.4	177.7	0	0	111.2	R677 S736 Y737 W738 V742 S743 V744	R677-E740 IonicContact CZ-OE1 3.56Å; R677-E740 IonicContact CZ-OE2 3.89Å; R677-E740 VanDerWaalsContact NH1-CD 3.26Å; R677-E740 IonicContact NH1-OE1 3.77Å; R677-E740 IonicContact NH1-OE2 4Å; R677-E740 PolarHBondContact NH1-OE2 2.81Å; R677-E740 IonicContact NH2-OE1 2.74Å; R677-E740 PolarHBondContact NH2-OE1 3.43Å; R677-E740 IonicContact NH2-OE2 3.39Å; R677-E740 PolarHBondContact NH2-OE2 3.14Å; S736-E740 WeakPolarHBondContact O-CB 3.29Å; S736-E740 PolarHBondContact O-N 3.44Å; Y737-E740 VanDerWaalsContact CD2-OE2 3.3Å; Y737-E740 WeakPolarHBondContact CD2-OE2 3.4Å; W738-E740 VanDerWaalsContact C-N 3.35Å; W738-E740 PolarHBondContact O-N 3.34Å; E740-V742 PolarHBondContact O-N 2.87Å; E740-S743 WeakPolarHBondContact O-CB 3.11Å; E740-S743 PolarHBondContact O-N 3.41Å; E740-S743 VanDerWaalsContact O-N 3.17Å; E740-V744 WeakPolarHBondContact O-CG2 3.39Å; E740-V744 PolarHBondContact O-N 3.15Å
741	T	97.4	Very high	94.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.9	-42	-179.3	-58.2	0	0	0	0	111.8	M674 R677 Y737 W738 S743 V744 L745	M674-T741 HydrophobicContact CG-CG2 3.61Å; R677-T741 PolarHBondContact NH1-OG1 3.08Å; Y737-T741 VanDerWaalsContact O-CB 3.3Å; Y737-T741 WeakPolarHBondContact O-CB 3.45Å; Y737-T741 PolarHBondContact O-N 2.99Å; Y737-T741 PolarHBondContact O-OG1 3.36Å; W738-T741 PolarHBondContact O-N 3.21Å; T741-S743 VanDerWaalsContact C-N 3.32Å; T741-S743 PolarHBondContact O-N 2.88Å; T741-V744 PolarHBondContact O-N 2.89Å; T741-L745 HydrophobicContact CG2-CD1 4.03Å; T741-L745 HydrophobicContact CG2-CG 4.48Å; T741-L745 VanDerWaalsContact O-CG 3.32Å; T741-L745 WeakPolarHBondContact O-CG 3.39Å; T741-L745 PolarHBondContact O-N 3.12Å
742	V	97.2	Very high	94.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63	-40.3	174.9	174	0	0	0	0	111.1	L670 L710 W713 Q714 W738 E740 V744 L745 L746	L670-V742 HydrophobicContact CD1-CG2 3.91Å; L670-V742 HydrophobicContact CD2-CG2 3.81Å; L710-V742 HydrophobicContact CB-CG1 4.38Å; L710-V742 HydrophobicContact CD2-CG2 4.42Å; W713-V742 HydrophobicContact CD2-CG2 4.12Å; W713-V742 HydrophobicContact CE3-CB 4.19Å; W713-V742 HydrophobicContact CE3-CG1 4Å; W713-V742 HydrophobicContact CE3-CG2 3.67Å; W713-V742 HydrophobicContact CH2-CG2 4.3Å; W713-V742 HydrophobicContact CZ3-CB 4.2Å; W713-V742 HydrophobicContact CZ3-CG1 4.41Å; W713-V742 HydrophobicContact CZ3-CG2 3.78Å; Q714-V742 HydrophobicContact CG-CG1 3.49Å; Q714-V742 VanDerWaalsContact CG-CG1 3.49Å; W738-V742 WeakPolarHBondContact O-CG2 3.37Å; W738-V742 PolarHBondContact O-N 3.27Å; E740-V742 PolarHBondContact O-N 2.87Å; V742-V744 PolarHBondContact O-N 3.46Å; V742-L745 PolarHBondContact O-N 3.2Å; V742-L746 HydrophobicContact CG1-CD1 3.8Å; V742-L746 HydrophobicContact CG1-CG 4.42Å; V742-L746 WeakPolarHBondContact O-CB 3.5Å; V742-L746 WeakPolarHBondContact O-CG 3.46Å; V742-L746 PolarHBondContact O-N 3.27Å
743	S	96.1	Very high	94.4	Very high	65 Å²	65	56.7 Å²	56.7	46%	0.455	31%	0.308	S	S	.	.	H	α-helix	trans	-64.8	-38.9	176.6	-55.1	0	0	0	0	112.4	K739 E740 T741 L746 G747	K739-S743 WeakPolarHBondContact O-CB 3.06Å; K739-S743 PolarHBondContact O-N 3.47Å; K739-S743 PolarHBondContact O-OG 3.31Å; E740-S743 WeakPolarHBondContact O-CB 3.11Å; E740-S743 PolarHBondContact O-N 3.41Å; E740-S743 VanDerWaalsContact O-N 3.17Å; T741-S743 VanDerWaalsContact C-N 3.32Å; T741-S743 PolarHBondContact O-N 2.88Å; S743-L746 CarbonylContact O-C 3.48Å; S743-L746 PolarHBondContact O-N 3.15Å; S743-G747 PolarHBondContact O-N 2.75Å
744	V	96.6	Very high	94.4	Very high	40 Å²	40	58.5 Å²	58.5	24%	0.242	32%	0.32	C	S	.	.	H	α-helix	trans	-64	-45.4	174.5	167.4	0	0	0	0	111.4	L682 E740 T741 V742 L746 G747 C754	L682-V744 HydrophobicContact CD2-CG1 4.38Å; E740-V744 WeakPolarHBondContact O-CG2 3.39Å; E740-V744 PolarHBondContact O-N 3.15Å; T741-V744 PolarHBondContact O-N 2.89Å; V742-V744 PolarHBondContact O-N 3.46Å; V744-L746 VanDerWaalsContact C-N 3.29Å; V744-L746 PolarHBondContact O-N 2.63Å; V744-G747 PolarHBondContact O-N 2.84Å; V744-C754 HydrophobicContact CG1-CB 3.49Å; V744-C754 VanDerWaalsContact CG1-CB 3.49Å
745	L	97.1	Very high	94.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65.1	-32.7	179.2	-73.2	168.2	0	0	0	112.7	L670 L673 L682 L686 L710 T741 V742 I756	L670-L745 HydrophobicContact CD2-CD1 3.88Å; L673-L745 HydrophobicContact CD1-CD1 4.27Å; L673-L745 HydrophobicContact CD1-CD2 4.47Å; L682-L745 HydrophobicContact CD1-CD2 4.04Å; L682-L745 HydrophobicContact CD2-CD2 4.22Å; L686-L745 HydrophobicContact CD1-CD2 4.34Å; L686-L745 HydrophobicContact CD2-CD2 4.16Å; L710-L745 HydrophobicContact CD1-CB 3.6Å; L710-L745 HydrophobicContact CD1-CD1 3.77Å; L710-L745 HydrophobicContact CD1-CG 4.28Å; T741-L745 HydrophobicContact CG2-CD1 4.03Å; T741-L745 HydrophobicContact CG2-CG 4.48Å; T741-L745 VanDerWaalsContact O-CG 3.32Å; T741-L745 WeakPolarHBondContact O-CG 3.39Å; T741-L745 PolarHBondContact O-N 3.12Å; V742-L745 PolarHBondContact O-N 3.2Å; L745-I756 HydrophobicContact CB-CD1 4.14Å; L745-I756 HydrophobicContact CB-CG1 4.34Å; L745-I756 HydrophobicContact CD2-CD1 4.34Å; L745-I756 HydrophobicContact CD2-CG1 4.07Å; L745-I756 PolarHBondContact O-N 2.78Å
746	L	95.8	Very high	94.5	Very high	28 Å²	28	54.4 Å²	54.4	15%	0.147	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	9.3	178.1	-68.6	177.3	0	0	0	114	H707 L710 R711 Q714 V742 S743 V744 S748	H707-L746 VanDerWaalsContact CD2-CD2 3.45Å; H707-L746 WeakPolarHBondContact CD2-CD2 3.3Å; L710-L746 HydrophobicContact CB-CD1 4.07Å; L710-L746 HydrophobicContact CB-CD2 3.8Å; L710-L746 HydrophobicContact CB-CG 3.99Å; R711-L746 HydrophobicContact CG-CD1 4.27Å; R711-L746 HydrophobicContact CG-CD2 4.01Å; Q714-L746 HydrophobicContact CG-CD1 4.05Å; Q714-L746 VanDerWaalsContact OE1-CD1 3.22Å; V742-L746 HydrophobicContact CG1-CD1 3.8Å; V742-L746 HydrophobicContact CG1-CG 4.42Å; V742-L746 WeakPolarHBondContact O-CB 3.5Å; V742-L746 WeakPolarHBondContact O-CG 3.46Å; V742-L746 PolarHBondContact O-N 3.27Å; S743-L746 CarbonylContact O-C 3.48Å; S743-L746 PolarHBondContact O-N 3.15Å; V744-L746 VanDerWaalsContact C-N 3.29Å; V744-L746 PolarHBondContact O-N 2.63Å; L746-S748 PolarHBondContact O-N 3.29Å
747	G	92.8	Very high	94.4	Very high	23 Å²	23	51.4 Å²	51.4	24%	0.237	28%	0.275	C	S	.	.			trans	-56.7	138.9	178.5	0	0	0	0	0	112.1	S743 V744 A755 V757	S743-G747 PolarHBondContact O-N 2.75Å; V744-G747 PolarHBondContact O-N 2.84Å; G747-A755 WeakPolarHBondContact O-CB 3.37Å; G747-V757 WeakPolarHBondContact O-CG2 3.42Å
748	S	89.1	Confident	94.3	Very high	117 Å²	117	51.3 Å²	51.3	82%	0.818	28%	0.279	S	S	*	.	S	Bend	trans	-82	-13.6	-179.3	56.6	0	0	0	0	113.8	L746 R750	L746-S748 PolarHBondContact O-N 3.29Å; S748-R750 PolarHBondContact O-N 3.3Å
749	D	89.4	Confident	94.2	Very high	83 Å²	83	52.4 Å²	52.4	44%	0.444	28%	0.283	S	S	.	.			trans	-75.1	107.4	178.6	175.2	15.1	0	0	0	111.2	T751 S752 S758	D749-T751 VanDerWaalsContact CG-OG1 3.23Å; D749-T751 PolarHBondContact O-N 3.4Å; D749-T751 WeakPolarHBondContact OD1-CB 3.34Å; D749-T751 PolarHBondContact OD1-N 3.13Å; D749-T751 PolarHBondContact OD1-OG1 3.41Å; D749-T751 PolarHBondContact OD2-OG1 2.77Å; D749-T751 VanDerWaalsContact OD2-OG1 3.06Å; D749-S752 VanDerWaalsContact O-CB 3.24Å; D749-S752 WeakPolarHBondContact O-CB 3.4Å; D749-S752 PolarHBondContact O-N 3.01Å; D749-S758 PolarHBondContact O-OG 3.21Å
750	R	86.4	Confident	94	Very high	108 Å²	108	48.3 Å²	48.3	41%	0.408	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-8.8	178.9	-62.3	-175.9	73.5	-159.5	2.3	114.1	S748 V757 S758 I760 E762	S748-R750 PolarHBondContact O-N 3.3Å; R750-V757 HydrophobicContact CG-CG2 4.19Å; R750-S758 VanDerWaalsContact C-OG 3.31Å; R750-S758 WeakPolarHBondContact CA-OG 3.41Å; R750-S758 WeakPolarHBondContact O-CB 3.46Å; R750-S758 PolarHBondContact O-OG 3.48Å; R750-S758 VanDerWaalsContact O-OG 3.08Å; R750-I760 PolarHBondContact NH2-O 3.07Å; R750-E762 IonicContact CZ-OE1 3.77Å; R750-E762 VanDerWaalsContact NH1-CG 3.33Å; R750-E762 IonicContact NH1-OE1 2.74Å; R750-E762 PolarHBondContact NH1-OE1 3.25Å; R750-E762 VanDerWaalsContact NH2-CG 3.28Å; R750-E762 IonicContact NH2-OE1 3.94Å
751	T	89.8	Confident	93.7	Very high	119 Å²	119	46.2 Å²	46.2	73%	0.73	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-16	172	74.6	0	0	0	0	112.1	D749 R753	D749-T751 VanDerWaalsContact CG-OG1 3.23Å; D749-T751 PolarHBondContact O-N 3.4Å; D749-T751 WeakPolarHBondContact OD1-CB 3.34Å; D749-T751 PolarHBondContact OD1-N 3.13Å; D749-T751 PolarHBondContact OD1-OG1 3.41Å; D749-T751 PolarHBondContact OD2-OG1 2.77Å; D749-T751 VanDerWaalsContact OD2-OG1 3.06Å; T751-R753 PolarHBondContact O-N 3.23Å
752	S	93.4	Very high	93.2	Very high	38 Å²	38	52.9 Å²	52.9	27%	0.266	29%	0.289	S	S	.	.			trans	-72	115	178.3	178.6	0	0	0	0	111.3	D749 C754 A755 S758	D749-S752 VanDerWaalsContact O-CB 3.24Å; D749-S752 WeakPolarHBondContact O-CB 3.4Å; D749-S752 PolarHBondContact O-N 3.01Å; S752-C754 PolarHBondContact O-N 2.81Å; S752-C754 PolarHBondContact OG-N 3.49Å; S752-A755 PolarHBondContact O-N 3.3Å; S752-S758 VanDerWaalsContact O-CB 3.26Å; S752-S758 WeakPolarHBondContact O-CB 3.16Å; S752-S758 PolarHBondContact O-OG 3.2Å
753	R	94.9	Very high	92.7	Very high	188 Å²	188	58 Å²	58	71%	0.709	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-2.2	175.8	-62.5	-174.6	179.8	179.1	-0.4	114.3	P683 T751 Y759	P683-R753 HydrophobicContact CB-CB 4.11Å; P683-R753 WeakPolarHBondContact CB-O 3.28Å; P683-R753 HydrophobicContact CG-CB 4.05Å; P683-R753 WeakPolarHBondContact CG-O 3.5Å; T751-R753 PolarHBondContact O-N 3.23Å; R753-Y759 WeakPolarHBondContact O-CE2 3.4Å; R753-Y759 PolarHBondContact O-OH 2.94Å; R753-Y759 VanDerWaalsContact O-OH 3.04Å
754	C	95.3	Very high	92.2	Very high	39 Å²	39	58.8 Å²	58.8	26%	0.264	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-6.6	178.4	-64.8	0	0	0	0	113.2	L682 V744 S752	L682-C754 HydrophobicContact CD2-CB 3.91Å; V744-C754 HydrophobicContact CG1-CB 3.49Å; V744-C754 VanDerWaalsContact CG1-CB 3.49Å; S752-C754 PolarHBondContact O-N 2.81Å; S752-C754 PolarHBondContact OG-N 3.49Å
755	A	95.9	Very high	91.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.318	C	S	.	.	S	Bend	trans	-91.2	140.4	175.7	0	0	0	0	0	110.7	G747 S752 V757 S758 Y759	G747-A755 WeakPolarHBondContact O-CB 3.37Å; S752-A755 PolarHBondContact O-N 3.3Å; A755-V757 VanDerWaalsContact C-N 3.3Å; A755-V757 HydrophobicContact CB-CG2 4.02Å; A755-V757 PolarHBondContact O-N 3.36Å; A755-S758 WeakPolarHBondContact O-CB 3.29Å; A755-S758 PolarHBondContact O-N 3.35Å; A755-Y759 WeakPolarHBondContact O-CD2 3.24Å
756	I	95.6	Very high	90.8	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-63.3	-38.6	-179.6	-68.8	170.4	0	0	0	111.1	L686 L703 F706 H707 L710 L745 S758 Y759 I760	L686-I756 HydrophobicContact CD2-CG1 4.11Å; L703-I756 HydrophobicContact CB-CG2 4.09Å; L703-I756 HydrophobicContact CD2-CG2 4.22Å; F706-I756 HydrophobicContact CD1-CD1 3.45Å; F706-I756 VanDerWaalsContact CD1-CD1 3.45Å; F706-I756 HydrophobicContact CD1-CG1 4.38Å; F706-I756 HydrophobicContact CE1-CD1 3.76Å; F706-I756 HydrophobicContact CG-CD1 4.19Å; H707-I756 HydrophobicContact CB-CG2 4.19Å; L710-I756 HydrophobicContact CD1-CD1 3.52Å; L745-I756 HydrophobicContact CB-CD1 4.14Å; L745-I756 HydrophobicContact CB-CG1 4.34Å; L745-I756 HydrophobicContact CD2-CD1 4.34Å; L745-I756 HydrophobicContact CD2-CG1 4.07Å; L745-I756 PolarHBondContact O-N 2.78Å; I756-S758 PolarHBondContact O-N 3.41Å; I756-S758 VanDerWaalsContact O-N 3.08Å; I756-Y759 PolarHBondContact O-N 3.39Å; I756-I760 HydrophobicContact CG2-CD1 4.03Å; I756-I760 HydrophobicContact CG2-CG1 4.47Å
757	V	93.8	Very high	88.7	Confident	15 Å²	15	70.1 Å²	70.1	9%	0.091	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-60.7	-19.7	-177.9	-63.1	0	0	0	0	114.1	G747 R750 A755 Y759 M765	G747-V757 WeakPolarHBondContact O-CG2 3.42Å; R750-V757 HydrophobicContact CG-CG2 4.19Å; A755-V757 VanDerWaalsContact C-N 3.3Å; A755-V757 HydrophobicContact CB-CG2 4.02Å; A755-V757 PolarHBondContact O-N 3.36Å; V757-Y759 PolarHBondContact O-N 3.41Å; V757-M765 HydrophobicContact CB-CE 3.81Å; V757-M765 HydrophobicContact CG1-CE 4.02Å
758	S	94.2	Very high	86.7	Confident	35 Å²	35	75.8 Å²	75.8	25%	0.245	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-74.3	-13.4	175.3	-51.1	0	0	0	0	113	D749 R750 S752 A755 I756	D749-S758 PolarHBondContact O-OG 3.21Å; R750-S758 VanDerWaalsContact C-OG 3.31Å; R750-S758 WeakPolarHBondContact CA-OG 3.41Å; R750-S758 WeakPolarHBondContact O-CB 3.46Å; R750-S758 PolarHBondContact O-OG 3.48Å; R750-S758 VanDerWaalsContact O-OG 3.08Å; S752-S758 VanDerWaalsContact O-CB 3.26Å; S752-S758 WeakPolarHBondContact O-CB 3.16Å; S752-S758 PolarHBondContact O-OG 3.2Å; A755-S758 WeakPolarHBondContact O-CB 3.29Å; A755-S758 PolarHBondContact O-N 3.35Å; I756-S758 PolarHBondContact O-N 3.41Å; I756-S758 VanDerWaalsContact O-N 3.08Å
759	Y	94.8	Very high	84.8	Confident	23 Å²	23	79 Å²	79	9%	0.09	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-111.2	2.5	-177.3	-65.1	-87.5	0	0	0	113.3	P683 L686 N687 R690 L703 R753 A755 I756 V757	P683-Y759 WeakPolarHBondContact CA-OH 3.43Å; P683-Y759 WeakPolarHBondContact CB-OH 3.23Å; P683-Y759 PolarHBondContact O-OH 3.49Å; L686-Y759 HydrophobicContact CB-CD1 4.25Å; L686-Y759 HydrophobicContact CB-CD2 3.62Å; L686-Y759 HydrophobicContact CB-CE1 4.16Å; L686-Y759 HydrophobicContact CB-CE2 3.51Å; L686-Y759 HydrophobicContact CB-CG 4Å; L686-Y759 HydrophobicContact CD1-CD2 3.93Å; L686-Y759 HydrophobicContact CD1-CE2 3.61Å; L686-Y759 HydrophobicContact CG-CD2 4.39Å; L686-Y759 HydrophobicContact CG-CE2 4.22Å; N687-Y759 HydrophobicContact CB-CD1 4.32Å; N687-Y759 HydrophobicContact CB-CE1 3.79Å; R690-Y759 WeakPolarHBondContact CD-O 3.34Å; R690-Y759 WeakPolarHBondContact CG-O 3.47Å; R690-Y759 PolarHBondContact NE-O 3.28Å; L703-Y759 WeakPolarHBondContact CD1-O 3.4Å; R753-Y759 WeakPolarHBondContact O-CE2 3.4Å; R753-Y759 PolarHBondContact O-OH 2.94Å; R753-Y759 VanDerWaalsContact O-OH 3.04Å; A755-Y759 WeakPolarHBondContact O-CD2 3.24Å; I756-Y759 PolarHBondContact O-N 3.39Å; V757-Y759 PolarHBondContact O-N 3.41Å
760	I	92.9	Very high	82.9	Confident	4 Å²	4	78.9 Å²	78.9	2%	0.021	39%	0.393	C	S	.	.	S	Bend	trans	-105.4	122.4	174.5	-52.6	172	0	0	0	108	L703 R750 I756 F764 M765	L703-I760 HydrophobicContact CB-CD1 3.91Å; L703-I760 HydrophobicContact CB-CG1 3.62Å; L703-I760 HydrophobicContact CD1-CG1 4.19Å; R750-I760 PolarHBondContact NH2-O 3.07Å; I756-I760 HydrophobicContact CG2-CD1 4.03Å; I756-I760 HydrophobicContact CG2-CG1 4.47Å; I760-F764 HydrophobicContact CG2-CB 4.4Å; I760-M765 HydrophobicContact CB-CG 4.24Å; I760-M765 HydrophobicContact CB-SD 3.5Å; I760-M765 WeakPolarHBondContact CB-SD 3.45Å; I760-M765 HydrophobicContact CD1-SD 3.95Å; I760-M765 HydrophobicContact CG1-SD 4.3Å; I760-M765 HydrophobicContact CG2-CG 3.76Å; I760-M765 HydrophobicContact CG2-SD 3.44Å; I760-M765 WeakPolarHBondContact CG2-SD 3.18Å
761	D	88.9	Confident	81.2	Confident	45 Å²	45	77.7 Å²	77.7	24%	0.241	39%	0.394	C	S	.	.			trans	-69.3	147.7	177.2	-55.2	-22.7	0	0	0	110.4	R690 Y694 P763 F764 M765	R690-D761 IonicContact CZ-OD1 3.85Å; R690-D761 IonicContact NE-OD1 3.59Å; R690-D761 IonicContact NH2-OD1 2.67Å; R690-D761 PolarHBondContact NH2-OD1 3.14Å; R690-D761 IonicContact NH2-OD2 2.73Å; Y694-D761 VanDerWaalsContact OH-CG 3.25Å; Y694-D761 PolarHBondContact OH-OD1 2.89Å; Y694-D761 PolarHBondContact OH-OD2 3.35Å; D761-P763 VanDerWaalsContact C-N 3.33Å; D761-F764 HydrophobicContact CB-CD2 3.82Å; D761-F764 HydrophobicContact CB-CE2 4.23Å; D761-F764 PolarHBondContact O-N 2.84Å; D761-M765 PolarHBondContact O-N 2.89Å
762	E	86.6	Confident	79.3	Confident	140 Å²	140	73.2 Å²	73.2	65%	0.654	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-50.8	-41	-178.8	-64.3	-176.5	168.3	0	0	114.9	R750 F764 M765	R750-E762 IonicContact CZ-OE1 3.77Å; R750-E762 VanDerWaalsContact NH1-CG 3.33Å; R750-E762 IonicContact NH1-OE1 2.74Å; R750-E762 PolarHBondContact NH1-OE1 3.25Å; R750-E762 VanDerWaalsContact NH2-CG 3.28Å; R750-E762 IonicContact NH2-OE1 3.94Å; E762-F764 PolarHBondContact O-N 3.27Å; E762-M765 PolarHBondContact O-N 3.05Å
763	P	87.4	Confident	76.8	Confident	109 Å²	109	77.9 Å²	77.9	71%	0.708	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-65.8	-19.5	179.3	-21.4	34.9	0	0	0	114.1	D761	D761-P763 VanDerWaalsContact C-N 3.33Å
764	F	86.3	Confident	74	Confident	81 Å²	81	79.4 Å²	79.4	36%	0.355	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-109.5	2.5	-176.8	-49	-56.9	0	0	0	112.6	P699 N704 I760 D761 E762 D766	P699-F764 HydrophobicContact CB-CD2 3.66Å; P699-F764 HydrophobicContact CB-CE2 3.53Å; P699-F764 HydrophobicContact CB-CG 4.25Å; P699-F764 HydrophobicContact CB-CZ 3.99Å; P699-F764 HydrophobicContact CG-CD1 4.17Å; P699-F764 HydrophobicContact CG-CD2 3.94Å; P699-F764 HydrophobicContact CG-CE1 3.73Å; P699-F764 HydrophobicContact CG-CE2 3.49Å; P699-F764 VanDerWaalsContact CG-CE2 3.49Å; P699-F764 HydrophobicContact CG-CG 4.28Å; P699-F764 HydrophobicContact CG-CZ 3.38Å; N704-F764 PolarHBondContact ND2-O 3.46Å; I760-F764 HydrophobicContact CG2-CB 4.4Å; D761-F764 HydrophobicContact CB-CD2 3.82Å; D761-F764 HydrophobicContact CB-CE2 4.23Å; D761-F764 PolarHBondContact O-N 2.84Å; E762-F764 PolarHBondContact O-N 3.27Å; F764-D766 PolarHBondContact O-N 3.01Å
765	M	83.8	Confident	73	Confident	50 Å²	50	81.4 Å²	81.4	25%	0.246	41%	0.413	C	S	.	.	S	Bend	trans	-69.4	129.2	175.8	-79.5	-72.3	-112.4	0	0	110.1	V757 I760 D761 E762 L767	V757-M765 HydrophobicContact CB-CE 3.81Å; V757-M765 HydrophobicContact CG1-CE 4.02Å; I760-M765 HydrophobicContact CB-CG 4.24Å; I760-M765 HydrophobicContact CB-SD 3.5Å; I760-M765 WeakPolarHBondContact CB-SD 3.45Å; I760-M765 HydrophobicContact CD1-SD 3.95Å; I760-M765 HydrophobicContact CG1-SD 4.3Å; I760-M765 HydrophobicContact CG2-CG 3.76Å; I760-M765 HydrophobicContact CG2-SD 3.44Å; I760-M765 WeakPolarHBondContact CG2-SD 3.18Å; D761-M765 PolarHBondContact O-N 2.89Å; E762-M765 PolarHBondContact O-N 3.05Å; M765-L767 VanDerWaalsContact C-N 3.32Å; M765-L767 PolarHBondContact O-N 3.28Å
766	D	80.4	Confident	71.7	Confident	96 Å²	96	85.7 Å²	85.7	51%	0.513	44%	0.435	S	S	.	.			trans	-67.9	93.9	168.3	-80.5	-22.7	0	0	0	108.5	N704 F764 D768	N704-D766 PolarHBondContact OD1-N 3.17Å; F764-D766 PolarHBondContact O-N 3.01Å; D766-D768 PolarHBondContact O-N 3.15Å; D766-D768 VanDerWaalsContact O-N 3.16Å
767	L	51.3	Low	70.4	Confident	159 Å²	159	90.4 Å²	90.4	83%	0.832	46%	0.459	S	S	*	.			trans	-62.9	110	169.6	-70.5	163.1	0	0	0	108	M765 R769	M765-L767 VanDerWaalsContact C-N 3.32Å; M765-L767 PolarHBondContact O-N 3.28Å; L767-R769 PolarHBondContact O-N 3.38Å
768	D	49.9	Very low	69	Low	142 Å²	142	94.9 Å²	94.9	76%	0.759	48%	0.48	S	S	*	.			trans	37.2	72.1	166.5	-68.2	-26.2	0	0	0	115.5	D766	D766-D768 PolarHBondContact O-N 3.15Å; D766-D768 VanDerWaalsContact O-N 3.16Å
769	R	49.8	Very low	67.5	Low	186 Å²	186	98.6 Å²	98.6	70%	0.702	50%	0.495	S	S	*	.			trans	-106.4	88.7	149.4	-121.1	-174	-85.3	-142.3	-0.5	108	L767 L771	L767-R769 PolarHBondContact O-N 3.38Å; R769-L771 HydrophobicContact CB-CD1 4.23Å; R769-L771 HydrophobicContact CB-CG 4.11Å; R769-L771 HydrophobicContact CG-CG 4.31Å; R769-L771 PolarHBondContact O-N 2.85Å
770	D	50.3	Low	65.6	Low	79 Å²	79	103.7 Å²	103.7	42%	0.422	52%	0.522	S	S	.	.			trans	-60.4	69.5	157.8	-74.8	-45.6	0	0	0	109.3	L772 E773	D770-L772 PolarHBondContact O-N 3.31Å; D770-E773 HydrophobicContact CB-CB 3.99Å; D770-E773 HydrophobicContact CB-CG 3.97Å; D770-E773 PolarHBondContact O-N 3.27Å
771	L	49.3	Very low	63.7	Low	83 Å²	83	110.8 Å²	110.8	44%	0.435	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.6	14.1	170.5	-80.7	158.9	0	0	0	112.4	R769	R769-L771 HydrophobicContact CB-CD1 4.23Å; R769-L771 HydrophobicContact CB-CG 4.11Å; R769-L771 HydrophobicContact CG-CG 4.31Å; R769-L771 PolarHBondContact O-N 2.85Å
772	L	50.3	Low	61.8	Low	26 Å²	26	115.8 Å²	115.8	14%	0.136	58%	0.582	C	S	.	*	T	Hydrogen-bonded Turn	trans	-151.7	-10.2	-153.6	-87.7	-175.9	0	0	0	111	L253 R711 R715 D770 D774	L253-L772 HydrophobicContact CD1-CD2 3.54Å; R711-L772 HydrophobicContact CB-CD1 4.08Å; R715-L772 VanDerWaalsContact NH1-CB 3.29Å; R715-L772 PolarHBondContact NH1-O 3.39Å; D770-L772 PolarHBondContact O-N 3.31Å; L772-D774 PolarHBondContact O-N 3.44Å
773	E	41.2	Very low	59.7	Low	135 Å²	135	113.8 Å²	113.8	63%	0.631	58%	0.576	S	S	*	*			trans	-92.1	81.5	164.3	-68.7	-162.1	159.7	0	0	109.6	D770	D770-E773 HydrophobicContact CB-CB 3.99Å; D770-E773 HydrophobicContact CB-CG 3.97Å; D770-E773 PolarHBondContact O-N 3.27Å
774	D	36.6	Very low	57.2	Low	220 Å²	220	114.3 Å²	114.3	100%	1.176	56%	0.564	S	S	*	*			trans	-163	0	149.2	-91.8	-29.1	0	0	0	109.6	L772	L772-D774 PolarHBondContact O-N 3.44Å

Retrieved 774 of 774 residues in 538 ms (Link to these results)

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