A0A077Z9E9_TRITR Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A077Z9E9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 467 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	32	Very low	28.7	Very low	239 Å²	239	153.5 Å²	153.5	100%	1.177	81%	0.808	S	S	*	*				0	65.7	0	-68.5	-169.7	-89.4	0	0	107
2	L	27.2	Very low	29.2	Very low	158 Å²	158	154.8 Å²	154.8	83%	0.827	80%	0.803	S	S	*	*				51.5	85.3	73.7	-78.1	170.2	0	0	0	113.7
3	F	28.7	Very low	29.1	Very low	204 Å²	204	155 Å²	155	90%	0.895	81%	0.805	S	S	*	*			trans	-130.5	91.8	145.9	-99.4	-86.6	0	0	0	107.7
4	S	26.5	Very low	29.2	Very low	90 Å²	90	154.2 Å²	154.2	63%	0.629	80%	0.802	S	S	*	*			trans	-88.4	108.7	163.9	171.7	0	0	0	0	106.4	T6	S4-T6 PolarHBondContact OG-OG1 2.83Å
5	L	28.6	Very low	29.2	Very low	146 Å²	146	151.6 Å²	151.6	76%	0.764	80%	0.795	S	S	*	*			trans	-95	93	167.2	-131.4	89.2	0	0	0	107.9	I7	L5-I7 PolarHBondContact O-N 2.8Å
6	T	28.6	Very low	29.2	Very low	107 Å²	107	146.9 Å²	146.9	66%	0.656	78%	0.778	S	S	*	*			trans	-75.6	104.6	168.4	-48.4	0	0	0	0	107.4	S4 Q8	S4-T6 PolarHBondContact OG-OG1 2.83Å; T6-Q8 PolarHBondContact O-N 3.01Å; T6-Q8 VanDerWaalsContact O-N 3.09Å
7	I	29.1	Very low	29.3	Very low	150 Å²	150	149.9 Å²	149.9	77%	0.769	78%	0.784	S	S	*	*			trans	-73.5	99.5	168.7	-65.9	177.4	0	0	0	107	L5 L9	L5-I7 PolarHBondContact O-N 2.8Å; I7-L9 PolarHBondContact O-N 3.16Å
8	Q	29.9	Very low	30	Very low	167 Å²	167	145.5 Å²	145.5	78%	0.78	76%	0.76	S	S	*	*			trans	-60.3	119.7	166.8	-100.9	161	-63	0	0	109.5	T6 L10	T6-Q8 PolarHBondContact O-N 3.01Å; T6-Q8 VanDerWaalsContact O-N 3.09Å; Q8-L10 PolarHBondContact O-N 2.63Å; Q8-L10 VanDerWaalsContact O-N 3.16Å
9	L	29.1	Very low	30.6	Very low	172 Å²	172	141.6 Å²	141.6	90%	0.901	75%	0.746	S	S	*	*			trans	-52.2	111.4	162.9	-71.8	154.7	0	0	0	109.3	I7	I7-L9 PolarHBondContact O-N 3.16Å
10	L	27.5	Very low	31.7	Very low	136 Å²	136	141.7 Å²	141.7	71%	0.712	75%	0.747	S	S	*	*			trans	-87	128.6	164.5	-72.3	174.4	0	0	0	108.6	Q8 F12	Q8-L10 PolarHBondContact O-N 2.63Å; Q8-L10 VanDerWaalsContact O-N 3.16Å; L10-F12 PolarHBondContact O-N 3.37Å; L10-F12 VanDerWaalsContact O-N 3.13Å
11	P	28.9	Very low	33.4	Very low	119 Å²	119	140.9 Å²	140.9	77%	0.773	74%	0.743	S	S	*	*			trans	-74.6	104	171.9	30.6	-28.4	0	0	0	107.7	N13	P11-N13 VanDerWaalsContact C-N 3.35Å; P11-N13 PolarHBondContact O-N 3.24Å
12	F	34.7	Very low	35.8	Very low	170 Å²	170	130.2 Å²	130.2	75%	0.746	69%	0.69	S	S	*	*			trans	-73.7	91.3	172	-93.7	-86.4	0	0	0	109.6	L10 L14	L10-F12 PolarHBondContact O-N 3.37Å; L10-F12 VanDerWaalsContact O-N 3.13Å; F12-L14 HydrophobicContact CD1-CD1 3.83Å; F12-L14 HydrophobicContact CE1-CD1 4.33Å; F12-L14 PolarHBondContact O-N 3.49Å
13	N	27.1	Very low	38.4	Very low	157 Å²	157	131 Å²	131	84%	0.84	69%	0.687	S	S	*	*			trans	-65.3	84	148.3	-93.9	-18.1	0	0	0	107.5	P11 V15	P11-N13 VanDerWaalsContact C-N 3.35Å; P11-N13 PolarHBondContact O-N 3.24Å; N13-V15 PolarHBondContact O-N 3.31Å
14	L	30.4	Very low	41.2	Very low	144 Å²	144	122.1 Å²	122.1	75%	0.754	65%	0.648	S	S	*	*			trans	-82.1	92.3	169.1	-147.1	86	0	0	0	107.6	F12 S16	F12-L14 HydrophobicContact CD1-CD1 3.83Å; F12-L14 HydrophobicContact CE1-CD1 4.33Å; F12-L14 PolarHBondContact O-N 3.49Å; L14-S16 PolarHBondContact O-N 3.34Å
15	V	29.9	Very low	44	Very low	115 Å²	115	119.7 Å²	119.7	70%	0.697	63%	0.629	S	S	*	*			trans	-54.1	124.7	164.1	176.8	0	0	0	0	107.7	N13 F17	N13-V15 PolarHBondContact O-N 3.31Å; V15-F17 PolarHBondContact O-N 2.89Å
16	S	29.4	Very low	46.7	Very low	76 Å²	76	117.4 Å²	117.4	53%	0.531	62%	0.622	S	S	.	*			trans	-53.9	111	176.6	39.5	0	0	0	0	111.9	L14	L14-S16 PolarHBondContact O-N 3.34Å
17	F	30.2	Very low	49.5	Very low	198 Å²	198	117.9 Å²	117.9	87%	0.868	62%	0.621	S	S	*	*			trans	-96.2	77.4	147.2	-86.1	-84.9	0	0	0	107.2	V15 S19	V15-F17 PolarHBondContact O-N 2.89Å; F17-S19 PolarHBondContact O-N 3.33Å
18	I	42.2	Very low	52.4	Low	71 Å²	71	111 Å²	111	36%	0.364	59%	0.586	S	S	.	*			trans	-73.5	103.9	162.4	-64.5	170.1	0	0	0	105.1	L20	I18-L20 PolarHBondContact O-N 3.08Å
19	S	41.4	Very low	55.1	Low	71 Å²	71	105.4 Å²	105.4	50%	0.497	56%	0.561	S	S	.	*			trans	-66.1	106.3	165	174.7	0	0	0	0	106.8	F17 D21 F22	F17-S19 PolarHBondContact O-N 3.33Å; S19-D21 PolarHBondContact O-N 3.42Å; S19-F22 PolarHBondContact O-N 3.01Å; S19-F22 VanDerWaalsContact O-N 3.12Å
20	L	52.7	Low	57.9	Low	144 Å²	144	101.4 Å²	101.4	75%	0.754	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-22.6	179.7	-85.5	150.3	0	0	0	113.1	I18 K94	I18-L20 PolarHBondContact O-N 3.08Å; L20-K94 PolarHBondContact O-NZ 3.08Å
21	D	67.9	Low	60.9	Low	125 Å²	125	99.7 Å²	99.7	67%	0.668	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	45.7	179.9	-64	-37.4	0	0	0	113.7	S19 K23	S19-D21 PolarHBondContact O-N 3.42Å; D21-K23 PolarHBondContact O-N 3.39Å
22	F	82.2	Confident	63.9	Low	15 Å²	15	97 Å²	97	7%	0.066	50%	0.504	C	S	.	.			trans	-57.9	127.1	167.6	179.9	-99.9	0	0	0	110.6	S19 L24 H56 S59 Q61 L63 Y96	S19-F22 PolarHBondContact O-N 3.01Å; S19-F22 VanDerWaalsContact O-N 3.12Å; F22-L24 HydrophobicContact CZ-CD1 4.48Å; F22-H56 HydrophobicContact CE2-CB 4.27Å; F22-H56 AromaticContact CE2-CE1 3.95Å; F22-H56 AromaticContact CE2-CG 3.94Å; F22-H56 AromaticContact CE2-ND1 3.42Å; F22-H56 WeakPolarHBondContact CE2-ND1 3.47Å; F22-H56 HydrophobicContact CZ-CB 4.17Å; F22-H56 AromaticContact CZ-CG 3.9Å; F22-H56 AromaticContact CZ-ND1 3.81Å; F22-S59 WeakPolarHBondContact CE2-OG 3.33Å; F22-Q61 HydrophobicContact CB-CG 4.33Å; F22-Q61 HydrophobicContact CD2-CB 3.98Å; F22-Q61 HydrophobicContact CD2-CG 3.98Å; F22-Q61 HydrophobicContact CE2-CB 4.19Å; F22-Q61 HydrophobicContact CE2-CG 4.48Å; F22-Q61 HydrophobicContact CG-CG 4.01Å; F22-L63 HydrophobicContact CD1-CD2 4.01Å; F22-L63 HydrophobicContact CE1-CD1 3.96Å; F22-L63 HydrophobicContact CE1-CD2 3.84Å; F22-L63 HydrophobicContact CZ-CD1 4.02Å; F22-Y96 HydrophobicContact CB-CE1 4.45Å; F22-Y96 AromaticContact CD1-CD1 3.75Å; F22-Y96 HydrophobicContact CD1-CD1 3.75Å; F22-Y96 AromaticContact CD1-CD2 3.97Å; F22-Y96 HydrophobicContact CD1-CD2 3.97Å; F22-Y96 AromaticContact CD1-CE1 3.7Å; F22-Y96 HydrophobicContact CD1-CE1 3.7Å; F22-Y96 AromaticContact CD1-CE2 3.89Å; F22-Y96 HydrophobicContact CD1-CE2 3.89Å; F22-Y96 AromaticContact CD1-CG 3.89Å; F22-Y96 HydrophobicContact CD1-CG 3.89Å; F22-Y96 AromaticContact CD1-CZ 3.76Å; F22-Y96 HydrophobicContact CE1-CD1 4.2Å; F22-Y96 HydrophobicContact CE1-CD2 4.05Å; F22-Y96 HydrophobicContact CE1-CE2 4.38Å; F22-Y96 AromaticContact CE1-CG 3.94Å; F22-Y96 HydrophobicContact CE1-CG 3.94Å; F22-Y96 VanDerWaalsContact O-CE1 3.29Å; F22-Y96 WeakPolarHBondContact O-CE1 3.3Å
23	K	82.2	Confident	66.6	Low	174 Å²	174	89 Å²	89	76%	0.757	47%	0.47	S	S	*	.			trans	-134.2	137.6	168.9	-68.2	-173.5	178.8	-179.4	0	108.3	D21	D21-K23 PolarHBondContact O-N 3.39Å
24	L	86.2	Confident	69.7	Low	17 Å²	17	84.6 Å²	84.6	9%	0.089	44%	0.444	C	S	.	.			trans	-75.1	125.1	171.5	-168.4	61.7	0	0	0	108.1	F22 L29 V36 F37 Y99	F22-L24 HydrophobicContact CZ-CD1 4.48Å; L24-L29 HydrophobicContact CD2-CD2 3.5Å; L24-L29 VanDerWaalsContact CD2-CD2 3.5Å; L24-L29 HydrophobicContact CD2-CG 3.94Å; L24-L29 HydrophobicContact CG-CD2 4.4Å; L24-L29 HydrophobicContact CG-CG 4.32Å; L24-V36 HydrophobicContact CD1-CG1 4.07Å; L24-F37 HydrophobicContact CD1-CE1 4.39Å; L24-F37 HydrophobicContact CD1-CZ 3.95Å; L24-F37 HydrophobicContact CD2-CZ 4.25Å; L24-Y99 HydrophobicContact CD2-CE2 3.97Å; L24-Y99 WeakPolarHBondContact CD2-OH 3.43Å
25	D	85.5	Confident	72.6	Confident	40 Å²	40	83.5 Å²	83.5	21%	0.214	44%	0.435	C	S	.	.			trans	-70.1	146.4	179.5	61.6	66.4	0	0	0	110.9	D27 S28 L29 K58	D25-D27 PolarHBondContact O-N 3.42Å; D25-D27 VanDerWaalsContact O-N 3.16Å; D25-S28 WeakPolarHBondContact O-CB 3.41Å; D25-S28 PolarHBondContact O-N 2.95Å; D25-S28 VanDerWaalsContact OD1-CB 3.3Å; D25-S28 WeakPolarHBondContact OD1-CB 3.33Å; D25-S28 PolarHBondContact OD1-N 2.69Å; D25-S28 PolarHBondContact OD1-OG 3.16Å; D25-S28 PolarHBondContact OD2-OG 3.23Å; D25-L29 PolarHBondContact O-N 2.84Å; D25-K58 IonicContact OD2-NZ 2.8Å; D25-K58 PolarHBondContact OD2-NZ 2.81Å
26	P	85.7	Confident	75.7	Confident	98 Å²	98	78.3 Å²	78.3	64%	0.636	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-30.7	-178.1	-28	35.3	0	0	0	114.1	S28 L29 N30	P26-S28 VanDerWaalsContact C-N 3.32Å; P26-L29 PolarHBondContact O-N 3.2Å; P26-N30 PolarHBondContact O-ND2 3.33Å
27	D	88.1	Confident	78.9	Confident	117 Å²	117	74.9 Å²	74.9	63%	0.626	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-34.1	177.8	-64.3	-28.2	0	0	0	111.5	D25 L29 N30	D25-D27 PolarHBondContact O-N 3.42Å; D25-D27 VanDerWaalsContact O-N 3.16Å; D27-L29 VanDerWaalsContact C-N 3.31Å; D27-L29 PolarHBondContact O-N 3.09Å; D27-N30 PolarHBondContact O-N 3.35Å
28	S	89	Confident	82	Confident	6 Å²	6	69.2 Å²	69.2	4%	0.042	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-67.5	-30.3	175.5	-62.3	0	0	0	0	112.4	D25 P26 N30 K31 V36 Y99	D25-S28 WeakPolarHBondContact O-CB 3.41Å; D25-S28 PolarHBondContact O-N 2.95Å; D25-S28 VanDerWaalsContact OD1-CB 3.3Å; D25-S28 WeakPolarHBondContact OD1-CB 3.33Å; D25-S28 PolarHBondContact OD1-N 2.69Å; D25-S28 PolarHBondContact OD1-OG 3.16Å; D25-S28 PolarHBondContact OD2-OG 3.23Å; P26-S28 VanDerWaalsContact C-N 3.32Å; S28-N30 PolarHBondContact O-N 2.72Å; S28-K31 PolarHBondContact O-N 3.15Å; S28-V36 WeakPolarHBondContact O-CG2 3.45Å; S28-Y99 VanDerWaalsContact C-OH 3.27Å; S28-Y99 WeakPolarHBondContact O-CE1 3.46Å; S28-Y99 PolarHBondContact O-OH 3.16Å
29	L	87.9	Confident	84.4	Confident	49 Å²	49	68.8 Å²	68.8	26%	0.257	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-67.8	-19	174.7	-73.4	169.2	0	0	0	113.2	L24 D25 P26 D27 Y99	L24-L29 HydrophobicContact CD2-CD2 3.5Å; L24-L29 VanDerWaalsContact CD2-CD2 3.5Å; L24-L29 HydrophobicContact CD2-CG 3.94Å; L24-L29 HydrophobicContact CG-CD2 4.4Å; L24-L29 HydrophobicContact CG-CG 4.32Å; D25-L29 PolarHBondContact O-N 2.84Å; P26-L29 PolarHBondContact O-N 3.2Å; D27-L29 VanDerWaalsContact C-N 3.31Å; D27-L29 PolarHBondContact O-N 3.09Å; L29-Y99 HydrophobicContact CD2-CE2 4.18Å
30	N	87.2	Confident	86.8	Confident	87 Å²	87	70 Å²	70	47%	0.465	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-91.3	-0.3	178.9	-63.6	-39.8	0	0	0	113.9	P26 D27 S28 I373	P26-N30 PolarHBondContact O-ND2 3.33Å; D27-N30 PolarHBondContact O-N 3.35Å; S28-N30 PolarHBondContact O-N 2.72Å; N30-I373 HydrophobicContact CB-CD1 4.11Å; N30-I373 WeakPolarHBondContact OD1-CD1 3.4Å
31	K	91.1	Very high	88.5	Confident	100 Å²	100	66.2 Å²	66.2	44%	0.435	34%	0.341	S	S	.	.	S	Bend	trans	-98.8	162.9	178.3	-64.7	-178.1	-177.1	178.7	0	111	S28 E35 V36 Y99	S28-K31 PolarHBondContact O-N 3.15Å; K31-E35 HydrophobicContact CB-CB 4.3Å; K31-V36 HydrophobicContact CB-CG2 3.71Å; K31-V36 HydrophobicContact CD-CG2 4.2Å; K31-Y99 WeakPolarHBondContact O-CD1 3.36Å; K31-Y99 VanDerWaalsContact O-CE1 3.24Å; K31-Y99 WeakPolarHBondContact O-CE1 3.41Å
32	Q	91.2	Very high	89.5	Confident	62 Å²	62	64.3 Å²	64.3	29%	0.29	33%	0.327	S	S	.	.			trans	-64.1	142.7	168.3	-66	-60.7	-35.6	0	0	110	E34 E35	Q32-E34 PolarHBondContact O-N 2.67Å; Q32-E34 VanDerWaalsContact O-N 3.15Å; Q32-E35 HydrophobicContact CB-CG 4.27Å; Q32-E35 WeakPolarHBondContact O-CB 3.24Å; Q32-E35 PolarHBondContact O-N 2.79Å
33	P	91.3	Very high	89.8	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.013	34%	0.343	C	S	.	.	H	α-helix	trans	-58.3	-32	-175.6	20.1	-29.9	0	0	0	112.7	E35 V36 F37 Y99 K101 W106	P33-E35 VanDerWaalsContact C-N 3.27Å; P33-E35 PolarHBondContact O-N 3.31Å; P33-V36 PolarHBondContact O-N 3.39Å; P33-V36 VanDerWaalsContact O-N 3.09Å; P33-F37 HydrophobicContact CB-CD2 4.35Å; P33-F37 WeakPolarHBondContact O-CD2 3.37Å; P33-F37 PolarHBondContact O-N 3.25Å; P33-Y99 HydrophobicContact CB-CD1 4.23Å; P33-Y99 HydrophobicContact CB-CD2 4.48Å; P33-Y99 HydrophobicContact CB-CG 4.07Å; P33-Y99 HydrophobicContact CG-CG 4.49Å; P33-K101 HydrophobicContact CG-CB 4.2Å; P33-K101 HydrophobicContact CG-CD 3.79Å; P33-W106 HydrophobicContact CB-CD2 4.44Å; P33-W106 HydrophobicContact CB-CE3 3.69Å; P33-W106 HydrophobicContact CB-CZ3 3.78Å; P33-W106 HydrophobicContact CG-CD2 4.29Å; P33-W106 HydrophobicContact CG-CE3 3.96Å; P33-W106 HydrophobicContact CG-CH2 4.38Å; P33-W106 HydrophobicContact CG-CZ3 4.01Å
34	E	91.1	Very high	89.8	Confident	65 Å²	65	60.5 Å²	60.5	30%	0.304	32%	0.323	S	S	.	.	H	α-helix	trans	-70.5	-20.7	177.6	-62.8	69.9	-153.1	0	0	113.2	Q32 V36 K57 K101 W106	Q32-E34 PolarHBondContact O-N 2.67Å; Q32-E34 VanDerWaalsContact O-N 3.15Å; E34-V36 VanDerWaalsContact C-N 3.27Å; E34-K57 PolarHBondContact O-NZ 3.38Å; E34-K101 WeakPolarHBondContact OE1-CD 3.47Å; E34-K101 WeakPolarHBondContact OE1-CE 3.39Å; E34-K101 IonicContact OE1-NZ 3.13Å; E34-K101 PolarHBondContact OE1-NZ 3.4Å; E34-K101 WeakPolarHBondContact OE2-CD 3.38Å; E34-K101 IonicContact OE2-NZ 3.57Å; E34-K101 PolarHBondContact OE2-NZ 3.3Å; E34-W106 VanDerWaalsContact OE1-CH2 3.23Å; E34-W106 WeakPolarHBondContact OE1-CH2 3.48Å
35	E	93	Very high	89.5	Confident	122 Å²	122	64.5 Å²	64.5	57%	0.57	34%	0.341	S	S	*	.	H	α-helix	trans	-77.2	-20.5	173.2	-64.4	178.9	-156.6	0	0	111.7	K31 Q32 P33 K57	K31-E35 HydrophobicContact CB-CB 4.3Å; Q32-E35 HydrophobicContact CB-CG 4.27Å; Q32-E35 WeakPolarHBondContact O-CB 3.24Å; Q32-E35 PolarHBondContact O-N 2.79Å; P33-E35 VanDerWaalsContact C-N 3.27Å; P33-E35 PolarHBondContact O-N 3.31Å; E35-K57 WeakPolarHBondContact O-CD 3.23Å
36	V	95	Very high	88.8	Confident	6 Å²	6	64.5 Å²	64.5	4%	0.036	35%	0.35	C	S	.	.	H	α-helix	trans	-105.2	-35.2	-171.4	-177.7	0	0	0	0	111.7	L24 S28 K31 P33 E34 K57	L24-V36 HydrophobicContact CD1-CG1 4.07Å; S28-V36 WeakPolarHBondContact O-CG2 3.45Å; K31-V36 HydrophobicContact CB-CG2 3.71Å; K31-V36 HydrophobicContact CD-CG2 4.2Å; P33-V36 PolarHBondContact O-N 3.39Å; P33-V36 VanDerWaalsContact O-N 3.09Å; E34-V36 VanDerWaalsContact C-N 3.27Å; V36-K57 WeakPolarHBondContact O-CB 3.33Å; V36-K57 WeakPolarHBondContact O-CG 3.39Å; V36-K57 PolarHBondContact O-N 2.95Å
37	F	95.8	Very high	87.9	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.018	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	145.7	-174.7	-50.8	-74.2	0	0	0	112.2	L24 P33 I39 A54 V55 H56 K57 L63 I65 Y99 V108	L24-F37 HydrophobicContact CD1-CE1 4.39Å; L24-F37 HydrophobicContact CD1-CZ 3.95Å; L24-F37 HydrophobicContact CD2-CZ 4.25Å; P33-F37 HydrophobicContact CB-CD2 4.35Å; P33-F37 WeakPolarHBondContact O-CD2 3.37Å; P33-F37 PolarHBondContact O-N 3.25Å; F37-I39 HydrophobicContact CB-CD1 4.42Å; F37-A54 HydrophobicContact CB-CB 4.33Å; F37-V55 CarbonylContact C-O 3.59Å; F37-V55 VanDerWaalsContact CA-O 3.31Å; F37-V55 WeakPolarHBondContact CA-O 3.43Å; F37-H56 HydrophobicContact CD1-CB 4.17Å; F37-H56 HydrophobicContact CE1-CB 4.19Å; F37-H56 AromaticContact CE1-CD2 3.81Å; F37-K57 WeakPolarHBondContact O-CE 3.38Å; F37-L63 HydrophobicContact CD1-CD1 3.94Å; F37-L63 HydrophobicContact CE1-CD1 3.48Å; F37-L63 VanDerWaalsContact CE1-CD1 3.48Å; F37-I65 HydrophobicContact CB-CD1 4.19Å; F37-I65 HydrophobicContact CD1-CD1 4.43Å; F37-I65 HydrophobicContact CD2-CD1 3.94Å; F37-I65 HydrophobicContact CE2-CD1 4.48Å; F37-I65 HydrophobicContact CG-CD1 3.92Å; F37-Y99 HydrophobicContact CE2-CD2 4.19Å; F37-Y99 AromaticContact CE2-CE2 3.47Å; F37-Y99 HydrophobicContact CE2-CE2 3.47Å; F37-Y99 VanDerWaalsContact CE2-CE2 3.47Å; F37-Y99 AromaticContact CE2-CZ 3.81Å; F37-Y99 AromaticContact CZ-CE2 3.99Å; F37-Y99 HydrophobicContact CZ-CE2 3.99Å; F37-V108 HydrophobicContact CE1-CG1 4.22Å; F37-V108 HydrophobicContact CE2-CG2 4.09Å; F37-V108 HydrophobicContact CZ-CG1 4.05Å; F37-V108 HydrophobicContact CZ-CG2 4.03Å
38	D	95.3	Very high	87.1	Confident	78 Å²	78	59.5 Å²	59.5	42%	0.417	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	115.2	159.9	-71	-48.9	0	0	0	108.5	A54 V55 K57	D38-A54 CarbonylContact O-C 3.41Å; D38-A54 VanDerWaalsContact O-CA 3.25Å; D38-A54 WeakPolarHBondContact O-CA 3.44Å; D38-V55 PolarHBondContact N-O 2.87Å; D38-V55 PolarHBondContact O-N 3.14Å; D38-K57 WeakPolarHBondContact OD1-CE 3.15Å; D38-K57 IonicContact OD1-NZ 3.43Å; D38-K57 PolarHBondContact OD1-NZ 2.83Å; D38-K57 WeakPolarHBondContact OD2-CE 3.48Å; D38-K57 WeakPolarHBondContact OD2-CG 3.49Å
39	I	93.5	Very high	86.7	Confident	62 Å²	62	60 Å²	60	32%	0.318	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	123.3	174	-52.9	-56.4	0	0	0	108.4	F37 F52 A54 I65 W106	F37-I39 HydrophobicContact CB-CD1 4.42Å; I39-F52 HydrophobicContact CG2-CB 3.96Å; I39-F52 HydrophobicContact CG2-CD1 3.94Å; I39-F52 HydrophobicContact CG2-CG 4.16Å; I39-A54 HydrophobicContact CD1-CB 3.82Å; I39-I65 HydrophobicContact CD1-CD1 3.67Å; I39-W106 HydrophobicContact CD1-CZ3 3.89Å; I39-W106 HydrophobicContact CG1-CH2 4.43Å; I39-W106 HydrophobicContact CG1-CZ3 4.17Å
40	L	90.3	Very high	86.7	Confident	96 Å²	96	58.4 Å²	58.4	50%	0.503	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-63.6	-173.3	-60.2	-173.3	0	0	0	112.4	K53 V55	L40-K53 HydrophobicContact CB-CB 4.47Å; L40-K53 WeakPolarHBondContact CB-O 3.37Å; L40-K53 HydrophobicContact CD1-CD 4.21Å; L40-K53 HydrophobicContact CD1-CG 4.24Å; L40-K53 PolarHBondContact N-O 3.2Å; L40-V55 HydrophobicContact CD1-CG2 3.64Å; L40-V55 HydrophobicContact CD2-CG2 4.48Å; L40-V55 HydrophobicContact CG-CG2 4.18Å
41	C	89	Confident	86.9	Confident	66 Å²	66	56.1 Å²	56.1	45%	0.446	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	156.6	-177	63.7	0	0	0	0	111.4	F52 K53	C41-F52 CarbonylContact O-C 3.54Å; C41-F52 WeakPolarHBondContact O-CA 3.29Å; C41-K53 PolarHBondContact O-N 3.09Å
42	K	89.6	Confident	87	Confident	84 Å²	84	53.1 Å²	53.1	37%	0.365	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	124.9	171.3	-174.3	165.9	169.4	168	0	109.5	G44 E45 S50 F52 R406	K42-G44 WeakPolarHBondContact CE-O 3.42Å; K42-E45 IonicContact NZ-OE1 3.7Å; K42-E45 IonicContact NZ-OE2 3.62Å; K42-E45 PolarHBondContact NZ-OE2 3.3Å; K42-S50 WeakPolarHBondContact CE-OG 3.44Å; K42-S50 PolarHBondContact NZ-OG 3.2Å; K42-F52 HydrophobicContact CB-CD1 3.9Å; K42-F52 HydrophobicContact CB-CE1 3.75Å; K42-F52 HydrophobicContact CB-CZ 4.5Å; K42-F52 HydrophobicContact CD-CE1 4.28Å; K42-F52 HydrophobicContact CD-CZ 4.27Å; K42-F52 HydrophobicContact CG-CD1 4.42Å; K42-F52 HydrophobicContact CG-CE1 4.12Å; K42-F52 HydrophobicContact CG-CZ 4.41Å; K42-R406 VanDerWaalsContact NZ-NH1 3.13Å
43	L	87	Confident	87.2	Confident	79 Å²	79	52.6 Å²	52.6	41%	0.414	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-36.2	176.6	-67.3	173	0	0	0	111.5	V51 K53 A64 Y111	L43-V51 HydrophobicContact CB-CG1 4.43Å; L43-V51 WeakPolarHBondContact CB-O 3.26Å; L43-V51 HydrophobicContact CD1-CG1 4.2Å; L43-V51 PolarHBondContact N-O 2.93Å; L43-K53 HydrophobicContact CD1-CB 3.99Å; L43-K53 HydrophobicContact CD2-CB 3.94Å; L43-K53 HydrophobicContact CG-CB 3.91Å; L43-A64 HydrophobicContact CD1-CB 4.47Å; L43-Y111 HydrophobicContact CD1-CD2 3.98Å; L43-Y111 HydrophobicContact CD1-CE2 3.69Å; L43-Y111 HydrophobicContact CD2-CE2 4.04Å
44	G	82.6	Confident	87.4	Confident	31 Å²	31	52.5 Å²	52.5	32%	0.32	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.3	178.7	-178.3	0	0	0	0	0	112.8	K42 V51	K42-G44 WeakPolarHBondContact CE-O 3.42Å; G44-V51 PolarHBondContact N-O 2.61Å; G44-V51 PolarHBondContact O-N 2.83Å
45	E	80.4	Confident	87.6	Confident	101 Å²	101	50.9 Å²	50.9	47%	0.472	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	130.7	175.9	-173.7	166.5	-157.3	0	0	108.3	K42 G49 R406	K42-E45 IonicContact NZ-OE1 3.7Å; K42-E45 IonicContact NZ-OE2 3.62Å; K42-E45 PolarHBondContact NZ-OE2 3.3Å; E45-G49 WeakPolarHBondContact CA-O 2.77Å; E45-R406 VanDerWaalsContact CD-NH1 3.29Å; E45-R406 IonicContact OE1-CZ 3.42Å; E45-R406 IonicContact OE1-NH1 2.98Å; E45-R406 PolarHBondContact OE1-NH1 2.9Å; E45-R406 IonicContact OE1-NH2 3.66Å; E45-R406 IonicContact OE2-CZ 3.32Å; E45-R406 VanDerWaalsContact OE2-CZ 3.32Å; E45-R406 IonicContact OE2-NH1 2.88Å; E45-R406 PolarHBondContact OE2-NH1 3.14Å; E45-R406 IonicContact OE2-NH2 2.81Å; E45-R406 PolarHBondContact OE2-NH2 2.91Å
46	G	70.6	Confident	87.7	Confident	39 Å²	39	45.4 Å²	45.4	40%	0.402	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	-170.9	175.9	0	0	0	0	0	111.2	Y48 G49	G46-Y48 PolarHBondContact O-N 3.25Å; G46-G49 PolarHBondContact N-O 3.18Å; G46-G49 PolarHBondContact O-N 2.85Å
47	S	66.4	Low	87.6	Confident	52 Å²	52	49.8 Å²	49.8	36%	0.364	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-26	177.2	43.7	0	0	0	0	114
48	Y	72.2	Confident	87.5	Confident	59 Å²	59	57.2 Å²	57.2	23%	0.231	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	3.5	-176.5	-54.6	-87.4	0	0	0	113.3	G46 V68 A178 V349	G46-Y48 PolarHBondContact O-N 3.25Å; Y48-V68 WeakPolarHBondContact O-CA 3.46Å; Y48-V68 WeakPolarHBondContact O-CB 3.25Å; Y48-V68 VanDerWaalsContact O-CG1 3.22Å; Y48-V68 WeakPolarHBondContact O-CG1 3.38Å; Y48-V68 WeakPolarHBondContact O-CG2 3.45Å; Y48-A178 WeakPolarHBondContact OH-CB 3.31Å; Y48-V349 HydrophobicContact CE1-CG2 3.31Å; Y48-V349 VanDerWaalsContact CZ-CG2 3.45Å; Y48-V349 WeakPolarHBondContact OH-CG2 3.34Å
49	G	79.3	Confident	87.4	Confident	15 Å²	15	56.7 Å²	56.7	16%	0.155	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	125	-160.4	179.2	0	0	0	0	0	113.9	E45 G46 Q67	E45-G49 WeakPolarHBondContact CA-O 2.77Å; G46-G49 PolarHBondContact N-O 3.18Å; G46-G49 PolarHBondContact O-N 2.85Å; G49-Q67 WeakPolarHBondContact CA-O 3.45Å
50	S	88.8	Confident	87.3	Confident	17 Å²	17	56 Å²	56	12%	0.119	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	140.2	-166.8	-67.9	0	0	0	0	111.8	K42 F52 K66 Q67	K42-S50 WeakPolarHBondContact CE-OG 3.44Å; K42-S50 PolarHBondContact NZ-OG 3.2Å; S50-F52 VanDerWaalsContact CB-CE2 3.42Å; S50-K66 CarbonylContact O-C 3.48Å; S50-K66 WeakPolarHBondContact O-CA 3.43Å; S50-Q67 PolarHBondContact N-O 3.09Å; S50-Q67 VanDerWaalsContact N-O 3.08Å; S50-Q67 PolarHBondContact O-N 3.3Å
51	V	91.8	Very high	87.4	Confident	38 Å²	38	52.9 Å²	52.9	23%	0.23	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	130.7	176.2	-172.7	0	0	0	0	109	L43 G44 A64 I65 K66	L43-V51 HydrophobicContact CB-CG1 4.43Å; L43-V51 WeakPolarHBondContact CB-O 3.26Å; L43-V51 HydrophobicContact CD1-CG1 4.2Å; L43-V51 PolarHBondContact N-O 2.93Å; G44-V51 PolarHBondContact N-O 2.61Å; G44-V51 PolarHBondContact O-N 2.83Å; V51-A64 HydrophobicContact CG1-CB 4.24Å; V51-I65 CarbonylContact C-O 3.52Å; V51-I65 WeakPolarHBondContact CA-O 3.41Å; V51-K66 HydrophobicContact CG2-CB 4.17Å; V51-K66 HydrophobicContact CG2-CG 4.05Å
52	F	93.4	Very high	87.7	Confident	38 Å²	38	51.8 Å²	51.8	17%	0.167	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146.6	-179	-63.1	-96.2	0	0	0	111.2	I39 C41 K42 S50 A64 I65 Q67	I39-F52 HydrophobicContact CG2-CB 3.96Å; I39-F52 HydrophobicContact CG2-CD1 3.94Å; I39-F52 HydrophobicContact CG2-CG 4.16Å; C41-F52 CarbonylContact O-C 3.54Å; C41-F52 WeakPolarHBondContact O-CA 3.29Å; K42-F52 HydrophobicContact CB-CD1 3.9Å; K42-F52 HydrophobicContact CB-CE1 3.75Å; K42-F52 HydrophobicContact CB-CZ 4.5Å; K42-F52 HydrophobicContact CD-CE1 4.28Å; K42-F52 HydrophobicContact CD-CZ 4.27Å; K42-F52 HydrophobicContact CG-CD1 4.42Å; K42-F52 HydrophobicContact CG-CE1 4.12Å; K42-F52 HydrophobicContact CG-CZ 4.41Å; S50-F52 VanDerWaalsContact CB-CE2 3.42Å; F52-A64 CarbonylContact O-C 3.39Å; F52-A64 WeakPolarHBondContact O-CA 3.38Å; F52-I65 PolarHBondContact N-O 2.89Å; F52-I65 PolarHBondContact O-N 3.16Å; F52-Q67 HydrophobicContact CD2-CG 4.12Å; F52-Q67 HydrophobicContact CE2-CB 4.37Å; F52-Q67 VanDerWaalsContact CE2-CD 3.45Å; F52-Q67 HydrophobicContact CE2-CG 4.08Å
53	K	94	Very high	87.9	Confident	51 Å²	51	47.8 Å²	47.8	22%	0.222	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	131.9	165.3	-171.9	176.4	-179.6	169.1	0	108.3	L40 C41 L43 Y111	L40-K53 HydrophobicContact CB-CB 4.47Å; L40-K53 WeakPolarHBondContact CB-O 3.37Å; L40-K53 HydrophobicContact CD1-CD 4.21Å; L40-K53 HydrophobicContact CD1-CG 4.24Å; L40-K53 PolarHBondContact N-O 3.2Å; C41-K53 PolarHBondContact O-N 3.09Å; L43-K53 HydrophobicContact CD1-CB 3.99Å; L43-K53 HydrophobicContact CD2-CB 3.94Å; L43-K53 HydrophobicContact CG-CB 3.91Å; K53-Y111 HydrophobicContact CD-CE1 4.35Å; K53-Y111 HydrophobicContact CD-CE2 4.23Å; K53-Y111 HydrophobicContact CG-CE2 4.19Å; K53-Y111 PolarHBondContact NZ-OH 2.81Å
54	A	95.4	Very high	88.3	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	159.3	177.6	0	0	0	0	0	111.1	F37 D38 I39 C62 L63 I65	F37-A54 HydrophobicContact CB-CB 4.33Å; D38-A54 CarbonylContact O-C 3.41Å; D38-A54 VanDerWaalsContact O-CA 3.25Å; D38-A54 WeakPolarHBondContact O-CA 3.44Å; I39-A54 HydrophobicContact CD1-CB 3.82Å; A54-C62 WeakPolarHBondContact O-CA 3.35Å; A54-L63 PolarHBondContact N-O 3.04Å; A54-L63 PolarHBondContact O-N 3.45Å; A54-I65 HydrophobicContact CB-CD1 3.55Å; A54-I65 HydrophobicContact CB-CG1 3.87Å
55	V	95.4	Very high	88.9	Confident	30 Å²	30	42.9 Å²	42.9	18%	0.182	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.5	170.6	174.4	0	0	0	0	108.5	F37 D38 L40 K57 Q61	F37-V55 CarbonylContact C-O 3.59Å; F37-V55 VanDerWaalsContact CA-O 3.31Å; F37-V55 WeakPolarHBondContact CA-O 3.43Å; D38-V55 PolarHBondContact N-O 2.87Å; D38-V55 PolarHBondContact O-N 3.14Å; L40-V55 HydrophobicContact CD1-CG2 3.64Å; L40-V55 HydrophobicContact CD2-CG2 4.48Å; L40-V55 HydrophobicContact CG-CG2 4.18Å; V55-K57 PolarHBondContact O-N 2.93Å; V55-Q61 WeakPolarHBondContact CA-O 3.07Å
56	H	95.5	Very high	89.4	Confident	8 Å²	8	38.7 Å²	38.7	4%	0.037	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	116.1	171	179.1	-124.5	0	0	0	110	F22 F37 K58 S59 G60 Q61 L63	F22-H56 HydrophobicContact CE2-CB 4.27Å; F22-H56 AromaticContact CE2-CE1 3.95Å; F22-H56 AromaticContact CE2-CG 3.94Å; F22-H56 AromaticContact CE2-ND1 3.42Å; F22-H56 WeakPolarHBondContact CE2-ND1 3.47Å; F22-H56 HydrophobicContact CZ-CB 4.17Å; F22-H56 AromaticContact CZ-CG 3.9Å; F22-H56 AromaticContact CZ-ND1 3.81Å; F37-H56 HydrophobicContact CD1-CB 4.17Å; F37-H56 HydrophobicContact CE1-CB 4.19Å; F37-H56 AromaticContact CE1-CD2 3.81Å; H56-K58 VanDerWaalsContact C-N 3.29Å; H56-K58 PolarHBondContact O-N 3.13Å; H56-S59 PolarHBondContact ND1-N 3.22Å; H56-S59 PolarHBondContact ND1-OG 3.06Å; H56-S59 PolarHBondContact O-N 3.33Å; H56-G60 WeakPolarHBondContact O-CA 3.42Å; H56-G60 PolarHBondContact O-N 3.12Å; H56-Q61 HydrophobicContact CB-CB 4.5Å; H56-Q61 PolarHBondContact N-O 2.78Å; H56-L63 HydrophobicContact CB-CD1 3.85Å
57	K	94.2	Very high	90.4	Very high	97 Å²	97	38.4 Å²	38.4	42%	0.422	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-41.6	-170.6	-74.8	176.6	168.5	179.6	0	113.6	E34 E35 V36 F37 D38 V55	E34-K57 PolarHBondContact O-NZ 3.38Å; E35-K57 WeakPolarHBondContact O-CD 3.23Å; V36-K57 WeakPolarHBondContact O-CB 3.33Å; V36-K57 WeakPolarHBondContact O-CG 3.39Å; V36-K57 PolarHBondContact O-N 2.95Å; F37-K57 WeakPolarHBondContact O-CE 3.38Å; D38-K57 WeakPolarHBondContact OD1-CE 3.15Å; D38-K57 IonicContact OD1-NZ 3.43Å; D38-K57 PolarHBondContact OD1-NZ 2.83Å; D38-K57 WeakPolarHBondContact OD2-CE 3.48Å; D38-K57 WeakPolarHBondContact OD2-CG 3.49Å; V55-K57 PolarHBondContact O-N 2.93Å
58	K	93.2	Very high	91.3	Very high	160 Å²	160	36 Å²	36	70%	0.696	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-36.8	-174.3	178.3	178.8	171.6	-172.9	0	113.3	D25 H56	D25-K58 IonicContact OD2-NZ 2.8Å; D25-K58 PolarHBondContact OD2-NZ 2.81Å; H56-K58 VanDerWaalsContact C-N 3.29Å; H56-K58 PolarHBondContact O-N 3.13Å
59	S	92.8	Very high	91.9	Very high	67 Å²	67	35.3 Å²	35.3	47%	0.469	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-14.5	-176.4	67.8	0	0	0	0	114.5	F22 H56 Q61	F22-S59 WeakPolarHBondContact CE2-OG 3.33Å; H56-S59 PolarHBondContact ND1-N 3.22Å; H56-S59 PolarHBondContact ND1-OG 3.06Å; H56-S59 PolarHBondContact O-N 3.33Å; S59-Q61 PolarHBondContact O-N 2.92Å; S59-Q61 VanDerWaalsContact OG-CB 3.26Å; S59-Q61 WeakPolarHBondContact OG-CB 3.45Å; S59-Q61 PolarHBondContact OG-N 3.3Å
60	G	92.1	Very high	91.9	Very high	48 Å²	48	36.2 Å²	36.2	50%	0.495	20%	0.202	S	C	.	.			trans	71.1	5.6	-171	0	0	0	0	0	114.2	H56 C62	H56-G60 WeakPolarHBondContact O-CA 3.42Å; H56-G60 PolarHBondContact O-N 3.12Å; G60-C62 PolarHBondContact O-N 3.18Å
61	Q	92.3	Very high	91.2	Very high	31 Å²	31	42.1 Å²	42.1	15%	0.145	23%	0.232	C	C	.	.			trans	-68.5	129.1	-177.8	-179.7	61.2	56.2	0	0	110.6	F22 V55 H56 S59 L63	F22-Q61 HydrophobicContact CB-CG 4.33Å; F22-Q61 HydrophobicContact CD2-CB 3.98Å; F22-Q61 HydrophobicContact CD2-CG 3.98Å; F22-Q61 HydrophobicContact CE2-CB 4.19Å; F22-Q61 HydrophobicContact CE2-CG 4.48Å; F22-Q61 HydrophobicContact CG-CG 4.01Å; V55-Q61 WeakPolarHBondContact CA-O 3.07Å; H56-Q61 HydrophobicContact CB-CB 4.5Å; H56-Q61 PolarHBondContact N-O 2.78Å; S59-Q61 PolarHBondContact O-N 2.92Å; S59-Q61 VanDerWaalsContact OG-CB 3.26Å; S59-Q61 WeakPolarHBondContact OG-CB 3.45Å; S59-Q61 PolarHBondContact OG-N 3.3Å; Q61-L63 HydrophobicContact CG-CD2 4.04Å; Q61-L63 HydrophobicContact CG-CG 4.41Å
62	C	94	Very high	89.9	Confident	42 Å²	42	42.2 Å²	42.2	28%	0.284	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	136.2	170	-69.1	0	0	0	0	110.6	A54 G60 Y111	A54-C62 WeakPolarHBondContact O-CA 3.35Å; G60-C62 PolarHBondContact O-N 3.18Å; C62-Y111 HydrophobicContact CB-CD1 3.85Å; C62-Y111 HydrophobicContact CB-CG 4.44Å
63	L	95.1	Very high	88.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	162.6	-176.9	-60.5	171.7	0	0	0	110.2	F22 F37 A54 H56 Q61 Y96 V108	F22-L63 HydrophobicContact CD1-CD2 4.01Å; F22-L63 HydrophobicContact CE1-CD1 3.96Å; F22-L63 HydrophobicContact CE1-CD2 3.84Å; F22-L63 HydrophobicContact CZ-CD1 4.02Å; F37-L63 HydrophobicContact CD1-CD1 3.94Å; F37-L63 HydrophobicContact CE1-CD1 3.48Å; F37-L63 VanDerWaalsContact CE1-CD1 3.48Å; A54-L63 PolarHBondContact N-O 3.04Å; A54-L63 PolarHBondContact O-N 3.45Å; H56-L63 HydrophobicContact CB-CD1 3.85Å; Q61-L63 HydrophobicContact CG-CD2 4.04Å; Q61-L63 HydrophobicContact CG-CG 4.41Å; L63-Y96 HydrophobicContact CD2-CD2 3.6Å; L63-Y96 HydrophobicContact CD2-CE2 3.43Å; L63-Y96 VanDerWaalsContact CD2-CE2 3.43Å; L63-V108 HydrophobicContact CB-CG1 4.43Å; L63-V108 HydrophobicContact CD1-CG1 3.89Å
64	A	94.7	Very high	88.1	Confident	7 Å²	7	42.5 Å²	42.5	6%	0.058	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	140	167.3	0	0	0	0	0	109.4	L43 V51 F52 M109 Y111	L43-A64 HydrophobicContact CD1-CB 4.47Å; V51-A64 HydrophobicContact CG1-CB 4.24Å; F52-A64 CarbonylContact O-C 3.39Å; F52-A64 WeakPolarHBondContact O-CA 3.38Å; A64-M109 HydrophobicContact CB-CG 3.71Å; A64-M109 HydrophobicContact CB-SD 4.46Å; A64-M109 PolarHBondContact N-O 3.26Å; A64-M109 PolarHBondContact O-N 2.83Å; A64-Y111 HydrophobicContact CB-CD2 4.46Å
65	I	94.5	Very high	87.3	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	115.1	176.3	-61.6	-177.1	0	0	0	108.2	F37 I39 V51 F52 A54 Q67 W106 I107 V108	F37-I65 HydrophobicContact CB-CD1 4.19Å; F37-I65 HydrophobicContact CD1-CD1 4.43Å; F37-I65 HydrophobicContact CD2-CD1 3.94Å; F37-I65 HydrophobicContact CE2-CD1 4.48Å; F37-I65 HydrophobicContact CG-CD1 3.92Å; I39-I65 HydrophobicContact CD1-CD1 3.67Å; V51-I65 CarbonylContact C-O 3.52Å; V51-I65 WeakPolarHBondContact CA-O 3.41Å; F52-I65 PolarHBondContact N-O 2.89Å; F52-I65 PolarHBondContact O-N 3.16Å; A54-I65 HydrophobicContact CB-CD1 3.55Å; A54-I65 HydrophobicContact CB-CG1 3.87Å; I65-Q67 HydrophobicContact CG2-CG 4.35Å; I65-W106 HydrophobicContact CD1-CE3 4.45Å; I65-W106 HydrophobicContact CG2-CB 3.98Å; I65-W106 HydrophobicContact CG2-CD2 4.15Å; I65-W106 HydrophobicContact CG2-CE3 3.72Å; I65-W106 HydrophobicContact CG2-CG 4.3Å; I65-I107 WeakPolarHBondContact CA-O 3.48Å; I65-V108 HydrophobicContact CD1-CG2 4.4Å; I65-V108 HydrophobicContact CG1-CG1 4.45Å; I65-V108 HydrophobicContact CG1-CG2 4.26Å
66	K	91.4	Very high	86.3	Confident	14 Å²	14	49.4 Å²	49.4	6%	0.061	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	115.3	174.5	-177.6	177.6	-176.1	-178.4	0	108.2	S50 V51 V68 E80 W106 I107 M109 D174	S50-K66 CarbonylContact O-C 3.48Å; S50-K66 WeakPolarHBondContact O-CA 3.43Å; V51-K66 HydrophobicContact CG2-CB 4.17Å; V51-K66 HydrophobicContact CG2-CG 4.05Å; K66-V68 HydrophobicContact CD-CG2 4.42Å; K66-V68 HydrophobicContact CG-CG2 3.91Å; K66-E80 IonicContact NZ-OE1 3.79Å; K66-W106 CarbonylContact O-C 3.57Å; K66-W106 WeakPolarHBondContact O-CA 3.22Å; K66-I107 HydrophobicContact CB-CB 4.34Å; K66-I107 PolarHBondContact N-O 3.42Å; K66-I107 PolarHBondContact O-N 2.83Å; K66-M109 HydrophobicContact CB-CE 3.29Å; K66-M109 HydrophobicContact CD-CE 4.06Å; K66-M109 HydrophobicContact CG-CE 4.34Å; K66-D174 IonicContact NZ-OD1 3.28Å; K66-D174 PolarHBondContact NZ-OD1 3.13Å
67	Q	90.9	Very high	85.5	Confident	32 Å²	32	49.2 Å²	49.2	15%	0.15	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.1	176.1	-65.6	177	-8.7	0	0	108.3	G49 S50 F52 I65 W106	G49-Q67 WeakPolarHBondContact CA-O 3.45Å; S50-Q67 PolarHBondContact N-O 3.09Å; S50-Q67 VanDerWaalsContact N-O 3.08Å; S50-Q67 PolarHBondContact O-N 3.3Å; F52-Q67 HydrophobicContact CD2-CG 4.12Å; F52-Q67 HydrophobicContact CE2-CB 4.37Å; F52-Q67 VanDerWaalsContact CE2-CD 3.45Å; F52-Q67 HydrophobicContact CE2-CG 4.08Å; I65-Q67 HydrophobicContact CG2-CG 4.35Å; Q67-W106 HydrophobicContact CG-CD2 3.93Å; Q67-W106 HydrophobicContact CG-CG 3.99Å; Q67-W106 HydrophobicContact CG-CZ2 4.42Å; Q67-W106 VanDerWaalsContact NE2-CE2 3.26Å; Q67-W106 VanDerWaalsContact NE2-CH2 3.26Å
68	V	86.4	Confident	84.9	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.012	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	118.5	-176.3	-177.4	0	0	0	0	109.3	Y48 K66 V70 I77 D104 L105 I107	Y48-V68 WeakPolarHBondContact O-CA 3.46Å; Y48-V68 WeakPolarHBondContact O-CB 3.25Å; Y48-V68 VanDerWaalsContact O-CG1 3.22Å; Y48-V68 WeakPolarHBondContact O-CG1 3.38Å; Y48-V68 WeakPolarHBondContact O-CG2 3.45Å; K66-V68 HydrophobicContact CD-CG2 4.42Å; K66-V68 HydrophobicContact CG-CG2 3.91Å; V68-V70 PolarHBondContact O-N 3.08Å; V68-I77 HydrophobicContact CB-CD1 4.43Å; V68-I77 HydrophobicContact CG1-CD1 3.31Å; V68-I77 HydrophobicContact CG1-CG1 4.16Å; V68-D104 CarbonylContact O-C 3.26Å; V68-D104 WeakPolarHBondContact O-CA 3.26Å; V68-L105 PolarHBondContact N-O 2.79Å; V68-L105 PolarHBondContact O-N 2.84Å; V68-I107 HydrophobicContact CG2-CD1 4.13Å
69	P	84.9	Confident	84.2	Confident	45 Å²	45	44.7 Å²	44.7	29%	0.292	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	130.2	174.5	-26.5	36.9	0	0	0	111.6	D71 T72 D104	P69-D71 WeakPolarHBondContact CB-OD1 3.41Å; P69-D71 PolarHBondContact O-N 3.46Å; P69-T72 HydrophobicContact CB-CG2 4.44Å; P69-T72 WeakPolarHBondContact O-CB 3.34Å; P69-T72 WeakPolarHBondContact O-CG2 3.21Å; P69-T72 PolarHBondContact O-N 3.06Å; P69-T72 PolarHBondContact O-OG1 3.36Å; P69-D104 WeakPolarHBondContact CA-OD1 3.37Å
70	V	78.2	Confident	83.6	Confident	33 Å²	33	42 Å²	42	20%	0.2	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-13.7	-172.4	172.1	0	0	0	0	112.9	V68 T72 L74 F100 S103 L105	V68-V70 PolarHBondContact O-N 3.08Å; V70-T72 PolarHBondContact O-N 3.23Å; V70-T72 VanDerWaalsContact O-O 3.09Å; V70-L74 HydrophobicContact CG1-CD1 4.2Å; V70-L74 HydrophobicContact CG1-CD2 4Å; V70-F100 HydrophobicContact CB-CE2 4.12Å; V70-F100 HydrophobicContact CG1-CE2 4.09Å; V70-F100 HydrophobicContact CG2-CD2 3.98Å; V70-F100 HydrophobicContact CG2-CE2 3.42Å; V70-F100 VanDerWaalsContact CG2-CE2 3.42Å; V70-F100 HydrophobicContact CG2-CZ 4.38Å; V70-S103 VanDerWaalsContact CB-O 3.22Å; V70-S103 WeakPolarHBondContact CB-O 3.42Å; V70-S103 WeakPolarHBondContact CG2-O 3.37Å; V70-S103 PolarHBondContact N-O 3.28Å; V70-L105 HydrophobicContact CG2-CB 4.05Å
71	D	74.6	Confident	83.2	Confident	142 Å²	142	39.9 Å²	39.9	76%	0.759	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-10.1	170	65.1	-22.3	0	0	0	113.4	P69	P69-D71 WeakPolarHBondContact CB-OD1 3.41Å; P69-D71 PolarHBondContact O-N 3.46Å
72	T	65.6	Low	82.8	Confident	40 Å²	40	40.5 Å²	40.5	25%	0.245	22%	0.216	C	C	.	.	S	Bend	trans	-78.3	175.7	167.3	67.7	0	0	0	0	111.8	P69 V70 L74 I77	P69-T72 HydrophobicContact CB-CG2 4.44Å; P69-T72 WeakPolarHBondContact O-CB 3.34Å; P69-T72 WeakPolarHBondContact O-CG2 3.21Å; P69-T72 PolarHBondContact O-N 3.06Å; P69-T72 PolarHBondContact O-OG1 3.36Å; V70-T72 PolarHBondContact O-N 3.23Å; V70-T72 VanDerWaalsContact O-O 3.09Å; T72-L74 VanDerWaalsContact C-N 3.27Å; T72-L74 PolarHBondContact O-N 2.94Å; T72-I77 VanDerWaalsContact OG1-CD1 3.26Å; T72-I77 WeakPolarHBondContact OG1-CD1 3.46Å
73	D	71.8	Confident	82.3	Confident	30 Å²	30	40.3 Å²	40.3	16%	0.16	21%	0.211	C	C	.	.			trans	-67	84.7	-176.5	-88.5	0.6	0	0	0	112.4	Q75 E76 I77 N350 G351	D73-Q75 PolarHBondContact O-N 2.94Å; D73-Q75 VanDerWaalsContact O-N 3.08Å; D73-E76 HydrophobicContact CB-CB 4.15Å; D73-E76 HydrophobicContact CB-CG 3.94Å; D73-E76 PolarHBondContact O-N 3.34Å; D73-I77 PolarHBondContact O-N 3.23Å; D73-N350 HydrophobicContact CB-CB 4.26Å; D73-N350 VanDerWaalsContact CB-CG 3.41Å; D73-N350 WeakPolarHBondContact CB-OD1 3.28Å; D73-N350 PolarHBondContact N-ND2 3.1Å; D73-N350 PolarHBondContact N-OD1 2.79Å; D73-N350 VanDerWaalsContact OD1-CB 3.31Å; D73-N350 WeakPolarHBondContact OD1-CB 3.26Å; D73-N350 PolarHBondContact OD1-ND2 3.31Å; D73-N350 WeakPolarHBondContact OD2-CA 3.42Å; D73-N350 WeakPolarHBondContact OD2-CB 3.33Å; D73-N350 PolarHBondContact OD2-OD1 3.35Å; D73-G351 WeakPolarHBondContact OD2-CA 3.46Å; D73-G351 PolarHBondContact OD2-N 3.29Å
74	L	76.5	Confident	81.8	Confident	65 Å²	65	40.7 Å²	40.7	34%	0.34	21%	0.213	S	C	.	.	H	α-helix	trans	-54.8	-32.8	179.9	-176.1	64	0	0	0	112	V70 T72 I77 I78 L105	V70-L74 HydrophobicContact CG1-CD1 4.2Å; V70-L74 HydrophobicContact CG1-CD2 4Å; T72-L74 VanDerWaalsContact C-N 3.27Å; T72-L74 PolarHBondContact O-N 2.94Å; L74-I77 PolarHBondContact O-N 3.48Å; L74-I78 HydrophobicContact CD1-CD1 4.23Å; L74-I78 HydrophobicContact CD1-CG1 4.26Å; L74-I78 HydrophobicContact CD2-CD1 4.27Å; L74-I78 HydrophobicContact CG-CD1 3.77Å; L74-I78 HydrophobicContact CG-CG1 4.26Å; L74-I78 WeakPolarHBondContact O-CB 3.35Å; L74-I78 WeakPolarHBondContact O-CG1 3.43Å; L74-I78 PolarHBondContact O-N 2.9Å; L74-L105 HydrophobicContact CD1-CD2 4.37Å
75	Q	78.7	Confident	81.5	Confident	136 Å²	136	44.2 Å²	44.2	64%	0.636	23%	0.229	S	C	*	.	H	α-helix	trans	-64.4	-39.8	177	-69.4	-170.5	-19.2	0	0	112.7	D73 K79	D73-Q75 PolarHBondContact O-N 2.94Å; D73-Q75 VanDerWaalsContact O-N 3.08Å; Q75-K79 WeakPolarHBondContact O-CB 3.17Å; Q75-K79 PolarHBondContact O-N 2.94Å; Q75-K79 VanDerWaalsContact O-N 3.12Å
76	E	75	Confident	81.2	Confident	38 Å²	38	49.8 Å²	49.8	18%	0.178	26%	0.255	C	S	.	.	H	α-helix	trans	-68.1	-43.4	176.5	-65.3	-172.3	177.9	0	0	110.1	D73 I78 K79 E80 V177 V349	D73-E76 HydrophobicContact CB-CB 4.15Å; D73-E76 HydrophobicContact CB-CG 3.94Å; D73-E76 PolarHBondContact O-N 3.34Å; E76-I78 PolarHBondContact O-N 2.83Å; E76-K79 WeakPolarHBondContact O-CB 3.28Å; E76-K79 PolarHBondContact O-N 3.18Å; E76-K79 VanDerWaalsContact O-N 3.15Å; E76-E80 PolarHBondContact O-N 3.37Å; E76-V177 HydrophobicContact CB-CG2 4.27Å; E76-V349 VanDerWaalsContact OE2-CB 3.23Å; E76-V349 WeakPolarHBondContact OE2-CB 3.33Å; E76-V349 WeakPolarHBondContact OE2-CG1 3.36Å; E76-V349 WeakPolarHBondContact OE2-CG2 3.45Å
77	I	78.7	Confident	81.1	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-44	178.7	-61.6	156.8	0	0	0	111.6	V68 T72 D73 L74 K79 E80 I81 L105 I107	V68-I77 HydrophobicContact CB-CD1 4.43Å; V68-I77 HydrophobicContact CG1-CD1 3.31Å; V68-I77 HydrophobicContact CG1-CG1 4.16Å; T72-I77 VanDerWaalsContact OG1-CD1 3.26Å; T72-I77 WeakPolarHBondContact OG1-CD1 3.46Å; D73-I77 PolarHBondContact O-N 3.23Å; L74-I77 PolarHBondContact O-N 3.48Å; I77-K79 VanDerWaalsContact C-N 3.27Å; I77-K79 PolarHBondContact O-N 3.02Å; I77-E80 WeakPolarHBondContact O-CB 3.22Å; I77-E80 PolarHBondContact O-N 2.89Å; I77-I81 HydrophobicContact CG2-CD1 3.97Å; I77-I81 WeakPolarHBondContact O-CG1 3.33Å; I77-I81 PolarHBondContact O-N 3.49Å; I77-L105 HydrophobicContact CG2-CD2 3.57Å; I77-I107 HydrophobicContact CG2-CD1 4.01Å
78	I	81.5	Confident	81.1	Confident	66 Å²	66	54.2 Å²	54.2	34%	0.338	28%	0.281	S	S	.	.	H	α-helix	trans	-61.2	-39.1	175.6	-72.5	169.2	0	0	0	110.8	L74 E76 I81 S82	L74-I78 HydrophobicContact CD1-CD1 4.23Å; L74-I78 HydrophobicContact CD1-CG1 4.26Å; L74-I78 HydrophobicContact CD2-CD1 4.27Å; L74-I78 HydrophobicContact CG-CD1 3.77Å; L74-I78 HydrophobicContact CG-CG1 4.26Å; L74-I78 WeakPolarHBondContact O-CB 3.35Å; L74-I78 WeakPolarHBondContact O-CG1 3.43Å; L74-I78 PolarHBondContact O-N 2.9Å; E76-I78 PolarHBondContact O-N 2.83Å; I78-I81 PolarHBondContact O-N 3.5Å; I78-S82 WeakPolarHBondContact O-CB 3.18Å; I78-S82 PolarHBondContact O-N 3.15Å
79	K	79.1	Confident	81.4	Confident	95 Å²	95	54.4 Å²	54.4	41%	0.413	28%	0.282	S	S	.	.	H	α-helix	trans	-65	-41.3	176.2	-173.8	-178.3	179.5	-178.2	0	111.4	Q75 E76 I77 S82 I83 V177	Q75-K79 WeakPolarHBondContact O-CB 3.17Å; Q75-K79 PolarHBondContact O-N 2.94Å; Q75-K79 VanDerWaalsContact O-N 3.12Å; E76-K79 WeakPolarHBondContact O-CB 3.28Å; E76-K79 PolarHBondContact O-N 3.18Å; E76-K79 VanDerWaalsContact O-N 3.15Å; I77-K79 VanDerWaalsContact C-N 3.27Å; I77-K79 PolarHBondContact O-N 3.02Å; K79-S82 PolarHBondContact O-N 3.32Å; K79-I83 HydrophobicContact CG-CD1 4.39Å; K79-I83 WeakPolarHBondContact O-CG1 3.21Å; K79-I83 PolarHBondContact O-N 3.37Å; K79-V177 HydrophobicContact CB-CG1 4.32Å; K79-V177 HydrophobicContact CD-CB 4.48Å; K79-V177 HydrophobicContact CD-CG1 4.18Å; K79-V177 HydrophobicContact CG-CG1 4.02Å
80	E	78.6	Confident	81.9	Confident	11 Å²	11	56.2 Å²	56.2	5%	0.051	29%	0.294	C	S	.	.	H	α-helix	trans	-60	-50.9	175.1	-165.3	-176.7	168.2	0	0	110.8	K66 E76 I77 S82 I83 M84 F175 V177	K66-E80 IonicContact NZ-OE1 3.79Å; E76-E80 PolarHBondContact O-N 3.37Å; I77-E80 WeakPolarHBondContact O-CB 3.22Å; I77-E80 PolarHBondContact O-N 2.89Å; E80-S82 VanDerWaalsContact C-N 3.32Å; E80-S82 PolarHBondContact O-N 3.13Å; E80-I83 PolarHBondContact O-N 2.82Å; E80-I83 VanDerWaalsContact O-N 3.13Å; E80-M84 HydrophobicContact CG-SD 4.4Å; E80-M84 WeakPolarHBondContact O-CG 3.03Å; E80-M84 PolarHBondContact O-N 3.27Å; E80-F175 HydrophobicContact CG-CB 4.24Å; E80-V177 HydrophobicContact CB-CG1 4.09Å; E80-V177 HydrophobicContact CB-CG2 3.89Å; E80-V177 HydrophobicContact CG-CG2 4.37Å
81	I	84.2	Confident	82.8	Confident	3 Å²	3	56 Å²	56	2%	0.015	29%	0.291	C	S	.	.	H	α-helix	trans	-57.8	-44.5	177.4	-69.1	167.4	0	0	0	111.1	I77 I78 I83 M84 Q85 Y95 L105 I107 M370	I77-I81 HydrophobicContact CG2-CD1 3.97Å; I77-I81 WeakPolarHBondContact O-CG1 3.33Å; I77-I81 PolarHBondContact O-N 3.49Å; I78-I81 PolarHBondContact O-N 3.5Å; I81-I83 VanDerWaalsContact C-N 3.32Å; I81-I83 PolarHBondContact O-N 3.07Å; I81-M84 PolarHBondContact O-N 3.2Å; I81-Q85 VanDerWaalsContact O-CB 3.28Å; I81-Q85 WeakPolarHBondContact O-CB 3.5Å; I81-Q85 PolarHBondContact O-N 2.79Å; I81-Y95 HydrophobicContact CG2-CE1 4.17Å; I81-Y95 HydrophobicContact CG2-CE2 3.81Å; I81-L105 HydrophobicContact CD1-CD2 3.56Å; I81-I107 HydrophobicContact CD1-CD1 3.88Å; I81-I107 HydrophobicContact CD1-CG1 4Å; I81-I107 HydrophobicContact CG1-CD1 4.04Å; I81-I107 HydrophobicContact CG1-CG1 4.41Å; I81-M370 HydrophobicContact CG2-CE 4.37Å
82	S	84.4	Confident	83.7	Confident	45 Å²	45	49.3 Å²	49.3	32%	0.315	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-40.5	178.1	-179.5	0	0	0	0	112.2	I78 K79 E80 Q86	I78-S82 WeakPolarHBondContact O-CB 3.18Å; I78-S82 PolarHBondContact O-N 3.15Å; K79-S82 PolarHBondContact O-N 3.32Å; E80-S82 VanDerWaalsContact C-N 3.32Å; E80-S82 PolarHBondContact O-N 3.13Å; S82-Q86 VanDerWaalsContact O-CG 3.26Å; S82-Q86 WeakPolarHBondContact O-CG 3.32Å; S82-Q86 PolarHBondContact O-N 2.88Å; S82-Q86 PolarHBondContact O-NE2 3.39Å; S82-Q86 VanDerWaalsContact O-NE2 3.15Å; S82-Q86 PolarHBondContact OG-NE2 3.38Å
83	I	83.1	Confident	85.1	Confident	37 Å²	37	47.6 Å²	47.6	19%	0.19	24%	0.244	C	C	.	.	H	α-helix	trans	-65.1	-48.2	176	-69.4	167.5	0	0	0	110.5	K79 E80 I81 Q86 C87 K152 F175 V177	K79-I83 HydrophobicContact CG-CD1 4.39Å; K79-I83 WeakPolarHBondContact O-CG1 3.21Å; K79-I83 PolarHBondContact O-N 3.37Å; E80-I83 PolarHBondContact O-N 2.82Å; E80-I83 VanDerWaalsContact O-N 3.13Å; I81-I83 VanDerWaalsContact C-N 3.32Å; I81-I83 PolarHBondContact O-N 3.07Å; I83-Q86 PolarHBondContact O-N 3.27Å; I83-C87 PolarHBondContact O-N 3.15Å; I83-C87 PolarHBondContact O-SG 3.48Å; I83-K152 HydrophobicContact CG2-CD 4.12Å; I83-K152 PolarHBondContact O-NZ 3.02Å; I83-F175 HydrophobicContact CG2-CB 4.49Å; I83-F175 HydrophobicContact CG2-CD1 3.86Å; I83-F175 HydrophobicContact CG2-CD2 4.2Å; I83-F175 HydrophobicContact CG2-CE1 4.09Å; I83-F175 HydrophobicContact CG2-CE2 4.42Å; I83-F175 HydrophobicContact CG2-CG 3.91Å; I83-F175 HydrophobicContact CG2-CZ 4.36Å; I83-V177 HydrophobicContact CD1-CG1 3.8Å
84	M	85.8	Confident	86.1	Confident	8 Å²	8	48.2 Å²	48.2	4%	0.039	25%	0.246	C	C	.	.	H	α-helix	trans	-62	-43.8	179.8	-68.3	179.2	75.3	0	0	112.1	E80 I81 Q86 C87 Y95 F175	E80-M84 HydrophobicContact CG-SD 4.4Å; E80-M84 WeakPolarHBondContact O-CG 3.03Å; E80-M84 PolarHBondContact O-N 3.27Å; I81-M84 PolarHBondContact O-N 3.2Å; M84-Q86 PolarHBondContact O-N 3.4Å; M84-C87 WeakPolarHBondContact O-CB 3.38Å; M84-C87 PolarHBondContact O-N 3.12Å; M84-Y95 HydrophobicContact CB-CG 4.46Å; M84-F175 HydrophobicContact CG-CD2 3.53Å; M84-F175 HydrophobicContact CG-CE2 3.7Å
85	Q	87.7	Confident	86.9	Confident	82 Å²	82	47 Å²	47	38%	0.383	24%	0.237	S	C	.	.	H	α-helix	trans	-60.5	-31.5	179.9	-172.2	-176.4	17.2	0	0	112.3	I81 C87 Y95	I81-Q85 VanDerWaalsContact O-CB 3.28Å; I81-Q85 WeakPolarHBondContact O-CB 3.5Å; I81-Q85 PolarHBondContact O-N 2.79Å; Q85-C87 VanDerWaalsContact C-N 3.29Å; Q85-Y95 HydrophobicContact CB-CD1 3.86Å; Q85-Y95 HydrophobicContact CB-CE1 4.13Å; Q85-Y95 HydrophobicContact CG-CD1 4.07Å; Q85-Y95 HydrophobicContact CG-CE1 4.12Å
86	Q	87.3	Confident	87.5	Confident	116 Å²	116	42.3 Å²	42.3	54%	0.542	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	3.3	177.2	-66.6	169.7	38	0	0	113.1	S82 I83 M84 K152	S82-Q86 VanDerWaalsContact O-CG 3.26Å; S82-Q86 WeakPolarHBondContact O-CG 3.32Å; S82-Q86 PolarHBondContact O-N 2.88Å; S82-Q86 PolarHBondContact O-NE2 3.39Å; S82-Q86 VanDerWaalsContact O-NE2 3.15Å; S82-Q86 PolarHBondContact OG-NE2 3.38Å; I83-Q86 PolarHBondContact O-N 3.27Å; M84-Q86 PolarHBondContact O-N 3.4Å; Q86-K152 PolarHBondContact O-NZ 2.91Å
87	C	89.3	Confident	88.3	Confident	13 Å²	13	40.7 Å²	40.7	9%	0.088	21%	0.207	C	C	.	.			trans	-102.2	119.8	178	-71.2	0	0	0	0	110.3	I83 M84 Q85 V92 Y146 K152	I83-C87 PolarHBondContact O-N 3.15Å; I83-C87 PolarHBondContact O-SG 3.48Å; M84-C87 WeakPolarHBondContact O-CB 3.38Å; M84-C87 PolarHBondContact O-N 3.12Å; Q85-C87 VanDerWaalsContact C-N 3.29Å; C87-V92 HydrophobicContact CB-CB 4.49Å; C87-V92 HydrophobicContact CB-CG1 3.88Å; C87-Y146 WeakPolarHBondContact CA-OH 3.46Å; C87-Y146 HydrophobicContact CB-CE1 4.19Å; C87-K152 PolarHBondContact SG-NZ 2.85Å
88	D	91.5	Very high	88.9	Confident	126 Å²	126	41.4 Å²	41.4	67%	0.674	21%	0.212	S	C	*	.			trans	-127.9	86.4	172	-172.5	21.1	0	0	0	108.3	Y146	D88-Y146 PolarHBondContact N-OH 2.8Å; D88-Y146 VanDerWaalsContact O-CE2 3.32Å; D88-Y146 WeakPolarHBondContact O-CE2 3.44Å
89	S	93.5	Very high	89.4	Confident	6 Å²	6	38.9 Å²	38.9	4%	0.042	20%	0.199	C	C	.	.			trans	-145.2	139.7	-179	176.3	0	0	0	0	109.7	F91 V92	S89-F91 PolarHBondContact O-N 2.89Å; S89-F91 VanDerWaalsContact O-N 3.15Å; S89-F91 PolarHBondContact OG-N 3.44Å; S89-V92 PolarHBondContact O-N 3.4Å
90	P	94.9	Very high	89.9	Confident	83 Å²	83	37.3 Å²	37.3	54%	0.539	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.8	173.7	25.9	-31.9	0	0	0	113.2	K171	P90-K171 WeakPolarHBondContact O-CE 3.35Å; P90-K171 WeakPolarHBondContact O-CG 3.28Å; P90-K171 PolarHBondContact O-NZ 3.07Å
91	F	96.1	Very high	90.3	Very high	29 Å²	29	38.2 Å²	38.2	13%	0.127	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	8	-179.2	-55.6	-85.2	0	0	0	113.8	S89 D139 T142 K171 L172	S89-F91 PolarHBondContact O-N 2.89Å; S89-F91 VanDerWaalsContact O-N 3.15Å; S89-F91 PolarHBondContact OG-N 3.44Å; F91-D139 HydrophobicContact CD1-CB 3.8Å; F91-D139 WeakPolarHBondContact CD1-O 3.32Å; F91-D139 HydrophobicContact CE1-CB 3.88Å; F91-T142 HydrophobicContact CD1-CG2 4.44Å; F91-T142 HydrophobicContact CD2-CG2 3.52Å; F91-T142 HydrophobicContact CE1-CG2 4.12Å; F91-T142 HydrophobicContact CE2-CG2 3.21Å; F91-T142 HydrophobicContact CG-CG2 4.14Å; F91-T142 HydrophobicContact CZ-CG2 3.53Å; F91-K171 WeakPolarHBondContact O-CA 3.19Å; F91-L172 PolarHBondContact O-N 3Å
92	V	95	Very high	90.3	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.012	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-126.8	137.2	173.9	177.1	0	0	0	0	107.5	C87 S89 K94 Y146 L147 F175	C87-V92 HydrophobicContact CB-CB 4.49Å; C87-V92 HydrophobicContact CB-CG1 3.88Å; S89-V92 PolarHBondContact O-N 3.4Å; V92-K94 PolarHBondContact O-N 3.2Å; V92-Y146 HydrophobicContact CG2-CD1 4.15Å; V92-L147 HydrophobicContact CG2-CD2 4.27Å; V92-L147 HydrophobicContact CG2-CG 4.39Å; V92-F175 HydrophobicContact CG1-CE2 3.86Å; V92-F175 HydrophobicContact CG1-CZ 3.56Å
93	V	94.2	Very high	90.4	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.024	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-59.8	123.3	177.1	172.4	0	0	0	0	110	M109 E110 L163 K171 L172 A173	V93-M109 HydrophobicContact CG1-CB 4.13Å; V93-M109 HydrophobicContact CG1-CG 4.37Å; V93-E110 HydrophobicContact CG1-CB 4.07Å; V93-L163 HydrophobicContact CG2-CD1 3.96Å; V93-L163 HydrophobicContact CG2-CG 4.48Å; V93-K171 HydrophobicContact CG2-CB 3.88Å; V93-L172 WeakPolarHBondContact CG2-O 3.36Å; V93-L172 PolarHBondContact N-O 3.38Å; V93-A173 HydrophobicContact CB-CB 4.4Å; V93-A173 HydrophobicContact CG2-CB 3.7Å
94	K	93.2	Very high	90.6	Very high	43 Å²	43	45.3 Å²	45.3	19%	0.187	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-70.3	136.2	-179.2	-63.1	-175.9	176.8	-175	0	111.4	L20 V92 Y96 M109 E110	L20-K94 PolarHBondContact O-NZ 3.08Å; V92-K94 PolarHBondContact O-N 3.2Å; K94-Y96 HydrophobicContact CB-CE1 3.92Å; K94-Y96 HydrophobicContact CD-CE1 4.26Å; K94-M109 CarbonylContact O-C 3.45Å; K94-M109 VanDerWaalsContact O-CA 3.28Å; K94-M109 WeakPolarHBondContact O-CA 3.49Å; K94-E110 HydrophobicContact CB-CB 4.12Å; K94-E110 PolarHBondContact N-OE2 3.26Å; K94-E110 PolarHBondContact O-N 3.15Å
95	Y	92.3	Very high	90.8	Very high	40 Å²	40	45.9 Å²	45.9	16%	0.157	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	134.6	167.1	169.5	-99.3	0	0	0	110.2	I81 M84 Q85 G97 S98 I107	I81-Y95 HydrophobicContact CG2-CE1 4.17Å; I81-Y95 HydrophobicContact CG2-CE2 3.81Å; M84-Y95 HydrophobicContact CB-CG 4.46Å; Q85-Y95 HydrophobicContact CB-CD1 3.86Å; Q85-Y95 HydrophobicContact CB-CE1 4.13Å; Q85-Y95 HydrophobicContact CG-CD1 4.07Å; Q85-Y95 HydrophobicContact CG-CE1 4.12Å; Y95-G97 VanDerWaalsContact CE2-C 3.49Å; Y95-G97 WeakPolarHBondContact CE2-O 3.33Å; Y95-G97 VanDerWaalsContact CZ-CA 3.4Å; Y95-G97 WeakPolarHBondContact OH-CA 3.33Å; Y95-S98 WeakPolarHBondContact CE2-OG 3.42Å; Y95-S98 WeakPolarHBondContact OH-CB 3.45Å; Y95-S98 PolarHBondContact OH-N 3.39Å; Y95-S98 VanDerWaalsContact OH-N 3.14Å; Y95-S98 PolarHBondContact OH-OG 3.29Å; Y95-I107 HydrophobicContact CD2-CG2 3.95Å; Y95-I107 HydrophobicContact CE2-CG2 3.9Å
96	Y	92.6	Very high	91	Very high	37 Å²	37	42.8 Å²	42.8	15%	0.145	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-24.8	-178.9	-61.5	-54.7	0	0	0	114.2	F22 L63 K94 V108 E110	F22-Y96 HydrophobicContact CB-CE1 4.45Å; F22-Y96 AromaticContact CD1-CD1 3.75Å; F22-Y96 HydrophobicContact CD1-CD1 3.75Å; F22-Y96 AromaticContact CD1-CD2 3.97Å; F22-Y96 HydrophobicContact CD1-CD2 3.97Å; F22-Y96 AromaticContact CD1-CE1 3.7Å; F22-Y96 HydrophobicContact CD1-CE1 3.7Å; F22-Y96 AromaticContact CD1-CE2 3.89Å; F22-Y96 HydrophobicContact CD1-CE2 3.89Å; F22-Y96 AromaticContact CD1-CG 3.89Å; F22-Y96 HydrophobicContact CD1-CG 3.89Å; F22-Y96 AromaticContact CD1-CZ 3.76Å; F22-Y96 HydrophobicContact CE1-CD1 4.2Å; F22-Y96 HydrophobicContact CE1-CD2 4.05Å; F22-Y96 HydrophobicContact CE1-CE2 4.38Å; F22-Y96 AromaticContact CE1-CG 3.94Å; F22-Y96 HydrophobicContact CE1-CG 3.94Å; F22-Y96 VanDerWaalsContact O-CE1 3.29Å; F22-Y96 WeakPolarHBondContact O-CE1 3.3Å; L63-Y96 HydrophobicContact CD2-CD2 3.6Å; L63-Y96 HydrophobicContact CD2-CE2 3.43Å; L63-Y96 VanDerWaalsContact CD2-CE2 3.43Å; K94-Y96 HydrophobicContact CB-CE1 3.92Å; K94-Y96 HydrophobicContact CD-CE1 4.26Å; Y96-V108 HydrophobicContact CD2-CG1 4.43Å; Y96-V108 PolarHBondContact N-O 3.18Å; Y96-E110 HydrophobicContact CE2-CB 4.16Å
97	G	91.7	Very high	91.2	Very high	3 Å²	3	37.5 Å²	37.5	3%	0.031	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.6	174.8	-177.7	0	0	0	0	0	112.4	Y95 V108	Y95-G97 VanDerWaalsContact CE2-C 3.49Å; Y95-G97 WeakPolarHBondContact CE2-O 3.33Å; Y95-G97 VanDerWaalsContact CZ-CA 3.4Å; Y95-G97 WeakPolarHBondContact OH-CA 3.33Å; G97-V108 WeakPolarHBondContact O-CB 3.04Å; G97-V108 PolarHBondContact O-N 3.24Å
98	S	91.7	Very high	91.4	Very high	21 Å²	21	36.9 Å²	36.9	15%	0.147	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	150	175.5	-62.1	0	0	0	0	111	Y95 W106	Y95-S98 WeakPolarHBondContact CE2-OG 3.42Å; Y95-S98 WeakPolarHBondContact OH-CB 3.45Å; Y95-S98 PolarHBondContact OH-N 3.39Å; Y95-S98 VanDerWaalsContact OH-N 3.14Å; Y95-S98 PolarHBondContact OH-OG 3.29Å; S98-W106 CarbonylContact C-O 3.58Å; S98-W106 WeakPolarHBondContact CA-O 3.43Å; S98-W106 WeakPolarHBondContact CB-O 3.39Å
99	Y	92.2	Very high	91.5	Very high	12 Å²	12	31.8 Å²	31.8	5%	0.047	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	148.7	173.8	-64.5	-99.5	0	0	0	108.9	L24 S28 L29 K31 P33 F37 W106 V108	L24-Y99 HydrophobicContact CD2-CE2 3.97Å; L24-Y99 WeakPolarHBondContact CD2-OH 3.43Å; S28-Y99 VanDerWaalsContact C-OH 3.27Å; S28-Y99 WeakPolarHBondContact O-CE1 3.46Å; S28-Y99 PolarHBondContact O-OH 3.16Å; L29-Y99 HydrophobicContact CD2-CE2 4.18Å; K31-Y99 WeakPolarHBondContact O-CD1 3.36Å; K31-Y99 VanDerWaalsContact O-CE1 3.24Å; K31-Y99 WeakPolarHBondContact O-CE1 3.41Å; P33-Y99 HydrophobicContact CB-CD1 4.23Å; P33-Y99 HydrophobicContact CB-CD2 4.48Å; P33-Y99 HydrophobicContact CB-CG 4.07Å; P33-Y99 HydrophobicContact CG-CG 4.49Å; F37-Y99 HydrophobicContact CE2-CD2 4.19Å; F37-Y99 AromaticContact CE2-CE2 3.47Å; F37-Y99 HydrophobicContact CE2-CE2 3.47Å; F37-Y99 VanDerWaalsContact CE2-CE2 3.47Å; F37-Y99 AromaticContact CE2-CZ 3.81Å; F37-Y99 AromaticContact CZ-CE2 3.99Å; F37-Y99 HydrophobicContact CZ-CE2 3.99Å; Y99-W106 PolarHBondContact N-O 2.99Å; Y99-W106 PolarHBondContact O-N 3.13Å; Y99-V108 HydrophobicContact CD2-CG2 3.91Å; Y99-V108 HydrophobicContact CE2-CG2 3.91Å
100	F	88.7	Confident	91.5	Very high	62 Å²	62	32.9 Å²	32.9	27%	0.272	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.3	170.6	-174.9	-89.5	0	0	0	108.3	V70 I372 D374	V70-F100 HydrophobicContact CB-CE2 4.12Å; V70-F100 HydrophobicContact CG1-CE2 4.09Å; V70-F100 HydrophobicContact CG2-CD2 3.98Å; V70-F100 HydrophobicContact CG2-CE2 3.42Å; V70-F100 VanDerWaalsContact CG2-CE2 3.42Å; V70-F100 HydrophobicContact CG2-CZ 4.38Å; F100-I372 HydrophobicContact CB-CG2 4.39Å; F100-D374 HydrophobicContact CD1-CB 4.44Å
101	K	86.9	Confident	91.5	Very high	30 Å²	30	31.6 Å²	31.6	13%	0.13	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	133.8	-179.9	176.8	171.9	176.2	177	0	110.5	P33 E34 S103 D104 W106	P33-K101 HydrophobicContact CG-CB 4.2Å; P33-K101 HydrophobicContact CG-CD 3.79Å; E34-K101 WeakPolarHBondContact OE1-CD 3.47Å; E34-K101 WeakPolarHBondContact OE1-CE 3.39Å; E34-K101 IonicContact OE1-NZ 3.13Å; E34-K101 PolarHBondContact OE1-NZ 3.4Å; E34-K101 WeakPolarHBondContact OE2-CD 3.38Å; E34-K101 IonicContact OE2-NZ 3.57Å; E34-K101 PolarHBondContact OE2-NZ 3.3Å; K101-S103 PolarHBondContact O-N 3.46Å; K101-S103 VanDerWaalsContact O-N 3.13Å; K101-D104 PolarHBondContact N-O 3.34Å; K101-D104 WeakPolarHBondContact O-CA 3.36Å; K101-D104 WeakPolarHBondContact O-CB 3.34Å; K101-D104 PolarHBondContact O-N 3.09Å; K101-W106 HydrophobicContact CD-CZ2 4.13Å
102	N	85.3	Confident	91.4	Very high	110 Å²	110	30.6 Å²	30.6	59%	0.588	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	35.2	172.7	-61.4	-9.2	0	0	0	114.8	D104	N102-D104 PolarHBondContact O-N 3.01Å
103	S	85	Confident	91.1	Very high	83 Å²	83	30.9 Å²	30.9	58%	0.58	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	72	9.7	-174.1	-39.5	0	0	0	0	115.5	V70 K101	V70-S103 VanDerWaalsContact CB-O 3.22Å; V70-S103 WeakPolarHBondContact CB-O 3.42Å; V70-S103 WeakPolarHBondContact CG2-O 3.37Å; V70-S103 PolarHBondContact N-O 3.28Å; K101-S103 PolarHBondContact O-N 3.46Å; K101-S103 VanDerWaalsContact O-N 3.13Å
104	D	87.5	Confident	91	Very high	41 Å²	41	30.7 Å²	30.7	22%	0.219	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	142.2	170.3	-64.7	-37.1	0	0	0	111.2	V68 P69 K101 N102	V68-D104 CarbonylContact O-C 3.26Å; V68-D104 WeakPolarHBondContact O-CA 3.26Å; P69-D104 WeakPolarHBondContact CA-OD1 3.37Å; K101-D104 PolarHBondContact N-O 3.34Å; K101-D104 WeakPolarHBondContact O-CA 3.36Å; K101-D104 WeakPolarHBondContact O-CB 3.34Å; K101-D104 PolarHBondContact O-N 3.09Å; N102-D104 PolarHBondContact O-N 3.01Å
105	L	89.8	Confident	90.9	Very high	21 Å²	21	29.5 Å²	29.5	11%	0.11	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	117.3	164.1	-173.7	67.6	0	0	0	109.1	V68 V70 L74 I77 I81 I107	V68-L105 PolarHBondContact N-O 2.79Å; V68-L105 PolarHBondContact O-N 2.84Å; V70-L105 HydrophobicContact CG2-CB 4.05Å; L74-L105 HydrophobicContact CD1-CD2 4.37Å; I77-L105 HydrophobicContact CG2-CD2 3.57Å; I81-L105 HydrophobicContact CD1-CD2 3.56Å; L105-I107 HydrophobicContact CD2-CD1 4.49Å; L105-I107 HydrophobicContact CD2-CG1 4.35Å; L105-I107 HydrophobicContact CG-CG1 4.25Å
106	W	92.3	Very high	91.1	Very high	17 Å²	17	27.9 Å²	27.9	6%	0.064	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	116.4	177.5	-68.9	38.4	0	0	0	108.5	P33 E34 I39 I65 K66 Q67 S98 Y99 K101	P33-W106 HydrophobicContact CB-CD2 4.44Å; P33-W106 HydrophobicContact CB-CE3 3.69Å; P33-W106 HydrophobicContact CB-CZ3 3.78Å; P33-W106 HydrophobicContact CG-CD2 4.29Å; P33-W106 HydrophobicContact CG-CE3 3.96Å; P33-W106 HydrophobicContact CG-CH2 4.38Å; P33-W106 HydrophobicContact CG-CZ3 4.01Å; E34-W106 VanDerWaalsContact OE1-CH2 3.23Å; E34-W106 WeakPolarHBondContact OE1-CH2 3.48Å; I39-W106 HydrophobicContact CD1-CZ3 3.89Å; I39-W106 HydrophobicContact CG1-CH2 4.43Å; I39-W106 HydrophobicContact CG1-CZ3 4.17Å; I65-W106 HydrophobicContact CD1-CE3 4.45Å; I65-W106 HydrophobicContact CG2-CB 3.98Å; I65-W106 HydrophobicContact CG2-CD2 4.15Å; I65-W106 HydrophobicContact CG2-CE3 3.72Å; I65-W106 HydrophobicContact CG2-CG 4.3Å; K66-W106 CarbonylContact O-C 3.57Å; K66-W106 WeakPolarHBondContact O-CA 3.22Å; Q67-W106 HydrophobicContact CG-CD2 3.93Å; Q67-W106 HydrophobicContact CG-CG 3.99Å; Q67-W106 HydrophobicContact CG-CZ2 4.42Å; Q67-W106 VanDerWaalsContact NE2-CE2 3.26Å; Q67-W106 VanDerWaalsContact NE2-CH2 3.26Å; S98-W106 CarbonylContact C-O 3.58Å; S98-W106 WeakPolarHBondContact CA-O 3.43Å; S98-W106 WeakPolarHBondContact CB-O 3.39Å; Y99-W106 PolarHBondContact N-O 2.99Å; Y99-W106 PolarHBondContact O-N 3.13Å; K101-W106 HydrophobicContact CD-CZ2 4.13Å
107	I	90.9	Very high	91.4	Very high	5 Å²	5	26.1 Å²	26.1	3%	0.026	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	113.1	-178.7	-54	174.5	0	0	0	108.2	I65 K66 V68 I77 I81 Y95 L105 M109	I65-I107 WeakPolarHBondContact CA-O 3.48Å; K66-I107 HydrophobicContact CB-CB 4.34Å; K66-I107 PolarHBondContact N-O 3.42Å; K66-I107 PolarHBondContact O-N 2.83Å; V68-I107 HydrophobicContact CG2-CD1 4.13Å; I77-I107 HydrophobicContact CG2-CD1 4.01Å; I81-I107 HydrophobicContact CD1-CD1 3.88Å; I81-I107 HydrophobicContact CD1-CG1 4Å; I81-I107 HydrophobicContact CG1-CD1 4.04Å; I81-I107 HydrophobicContact CG1-CG1 4.41Å; Y95-I107 HydrophobicContact CD2-CG2 3.95Å; Y95-I107 HydrophobicContact CE2-CG2 3.9Å; L105-I107 HydrophobicContact CD2-CD1 4.49Å; L105-I107 HydrophobicContact CD2-CG1 4.35Å; L105-I107 HydrophobicContact CG-CG1 4.25Å; I107-M109 HydrophobicContact CB-CE 4.18Å; I107-M109 HydrophobicContact CG2-CE 3.97Å; I107-M109 WeakPolarHBondContact O-CE 3.42Å
108	V	94.4	Very high	91.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.2	-178.8	-170.7	0	0	0	0	109.7	F37 L63 I65 Y96 G97 Y99	F37-V108 HydrophobicContact CE1-CG1 4.22Å; F37-V108 HydrophobicContact CE2-CG2 4.09Å; F37-V108 HydrophobicContact CZ-CG1 4.05Å; F37-V108 HydrophobicContact CZ-CG2 4.03Å; L63-V108 HydrophobicContact CB-CG1 4.43Å; L63-V108 HydrophobicContact CD1-CG1 3.89Å; I65-V108 HydrophobicContact CD1-CG2 4.4Å; I65-V108 HydrophobicContact CG1-CG1 4.45Å; I65-V108 HydrophobicContact CG1-CG2 4.26Å; Y96-V108 HydrophobicContact CD2-CG1 4.43Å; Y96-V108 PolarHBondContact N-O 3.18Å; G97-V108 WeakPolarHBondContact O-CB 3.04Å; G97-V108 PolarHBondContact O-N 3.24Å; Y99-V108 HydrophobicContact CD2-CG2 3.91Å; Y99-V108 HydrophobicContact CE2-CG2 3.91Å
109	M	93.6	Very high	91.6	Very high	18 Å²	18	28.6 Å²	28.6	9%	0.089	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	169	-173.7	70.7	-168.7	79.8	0	0	112.9	A64 K66 V93 K94 I107 Y111	A64-M109 HydrophobicContact CB-CG 3.71Å; A64-M109 HydrophobicContact CB-SD 4.46Å; A64-M109 PolarHBondContact N-O 3.26Å; A64-M109 PolarHBondContact O-N 2.83Å; K66-M109 HydrophobicContact CB-CE 3.29Å; K66-M109 HydrophobicContact CD-CE 4.06Å; K66-M109 HydrophobicContact CG-CE 4.34Å; V93-M109 HydrophobicContact CG1-CB 4.13Å; V93-M109 HydrophobicContact CG1-CG 4.37Å; K94-M109 CarbonylContact O-C 3.45Å; K94-M109 VanDerWaalsContact O-CA 3.28Å; K94-M109 WeakPolarHBondContact O-CA 3.49Å; I107-M109 HydrophobicContact CB-CE 4.18Å; I107-M109 HydrophobicContact CG2-CE 3.97Å; I107-M109 WeakPolarHBondContact O-CE 3.42Å; M109-Y111 PolarHBondContact O-N 2.88Å
110	E	93.7	Very high	91.8	Very high	29 Å²	29	28 Å²	28	14%	0.136	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	132.4	174.2	-179.8	178	-162.1	0	0	112.1	V93 K94 Y96 K171	V93-E110 HydrophobicContact CG1-CB 4.07Å; K94-E110 HydrophobicContact CB-CB 4.12Å; K94-E110 PolarHBondContact N-OE2 3.26Å; K94-E110 PolarHBondContact O-N 3.15Å; Y96-E110 HydrophobicContact CE2-CB 4.16Å; E110-K171 VanDerWaalsContact CD-CE 3.49Å; E110-K171 WeakPolarHBondContact OE1-CE 3.44Å; E110-K171 IonicContact OE1-NZ 2.83Å; E110-K171 PolarHBondContact OE1-NZ 3.12Å; E110-K171 WeakPolarHBondContact OE2-CE 2.91Å; E110-K171 IonicContact OE2-NZ 3.25Å; E110-K171 PolarHBondContact OE2-NZ 2.86Å
111	Y	94.4	Very high	92.2	Very high	56 Å²	56	25.8 Å²	25.8	22%	0.22	15%	0.146	C	C	.	.			trans	-85.7	116.8	175	177.7	-118.5	0	0	0	111.1	L43 K53 C62 A64 M109	L43-Y111 HydrophobicContact CD1-CD2 3.98Å; L43-Y111 HydrophobicContact CD1-CE2 3.69Å; L43-Y111 HydrophobicContact CD2-CE2 4.04Å; K53-Y111 HydrophobicContact CD-CE1 4.35Å; K53-Y111 HydrophobicContact CD-CE2 4.23Å; K53-Y111 HydrophobicContact CG-CE2 4.19Å; K53-Y111 PolarHBondContact NZ-OH 2.81Å; C62-Y111 HydrophobicContact CB-CD1 3.85Å; C62-Y111 HydrophobicContact CB-CG 4.44Å; A64-Y111 HydrophobicContact CB-CD2 4.46Å; M109-Y111 PolarHBondContact O-N 2.88Å
112	C	93.9	Very high	92.6	Very high	9 Å²	9	30.3 Å²	30.3	6%	0.061	16%	0.162	C	C	.	.			trans	-98.5	96.2	173.2	-66	0	0	0	0	109.6	A114 G115 L163 L164	C112-A114 PolarHBondContact O-N 3.49Å; C112-A114 VanDerWaalsContact O-N 3.11Å; C112-G115 PolarHBondContact O-N 2.96Å; C112-L163 HydrophobicContact CB-CB 3.52Å; C112-L163 HydrophobicContact CB-CD1 4.04Å; C112-L163 HydrophobicContact CB-CG 4.4Å; C112-L164 CarbonylContact C-O 3.57Å; C112-L164 VanDerWaalsContact C-O 3.26Å; C112-L164 WeakPolarHBondContact CB-O 3.48Å
113	G	89.3	Confident	93	Very high	7 Å²	7	26.7 Å²	26.7	7%	0.072	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-21	-165.7	0	0	0	0	0	116.7	L305	G113-L305 WeakPolarHBondContact O-CD2 3.45Å
114	A	90.8	Very high	93.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-2.4	178.4	0	0	0	0	0	113.4	C112 L164 I301	C112-A114 PolarHBondContact O-N 3.49Å; C112-A114 VanDerWaalsContact O-N 3.11Å; A114-L164 HydrophobicContact CB-CB 3.8Å; A114-L164 WeakPolarHBondContact CB-O 3.42Å; A114-L164 PolarHBondContact N-O 3.39Å; A114-I301 HydrophobicContact CB-CB 4.45Å; A114-I301 HydrophobicContact CB-CD1 4.44Å; A114-I301 HydrophobicContact CB-CG1 4.03Å; A114-I301 HydrophobicContact CB-CG2 3.76Å
115	G	92.8	Very high	93.9	Very high	19 Å²	19	31.3 Å²	31.3	20%	0.196	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	75.8	-160.3	-177.4	0	0	0	0	0	112.7	C112 L163 L164	C112-G115 PolarHBondContact O-N 2.96Å; G115-L163 WeakPolarHBondContact O-CA 3.3Å; G115-L164 PolarHBondContact O-N 2.64Å
116	S	95.7	Very high	94.2	Very high	5 Å²	5	35.5 Å²	35.5	4%	0.035	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	161.9	175.8	70.2	0	0	0	0	112.4	S118 D119 L120 G160 I162	S116-S118 PolarHBondContact O-N 2.84Å; S116-D119 WeakPolarHBondContact CB-OD2 3.41Å; S116-D119 PolarHBondContact N-OD2 2.97Å; S116-D119 WeakPolarHBondContact O-CA 3.48Å; S116-D119 WeakPolarHBondContact O-CB 3.47Å; S116-D119 PolarHBondContact O-N 3.43Å; S116-D119 PolarHBondContact OG-N 3.26Å; S116-D119 PolarHBondContact OG-OD1 2.85Å; S116-D119 PolarHBondContact OG-OD2 2.96Å; S116-L120 PolarHBondContact O-N 3.4Å; S116-G160 VanDerWaalsContact CB-O 3.22Å; S116-G160 WeakPolarHBondContact CB-O 3.06Å; S116-I162 CarbonylContact C-O 3.54Å; S116-I162 VanDerWaalsContact CA-O 3.23Å; S116-I162 WeakPolarHBondContact CA-O 3.22Å
117	V	98	Very high	94.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.8	-33.8	171.8	176.9	0	0	0	0	111.3	L120 M121 L128 I136 A159 I162 L164 M224	V117-L120 WeakPolarHBondContact O-CB 3.4Å; V117-L120 PolarHBondContact O-N 3.35Å; V117-M121 PolarHBondContact O-N 2.82Å; V117-M121 VanDerWaalsContact O-N 3.12Å; V117-L128 HydrophobicContact CG1-CD1 3.8Å; V117-I136 HydrophobicContact CG1-CD1 4.18Å; V117-I136 HydrophobicContact CG2-CD1 3.94Å; V117-I136 HydrophobicContact CG2-CG2 4.11Å; V117-A159 HydrophobicContact CB-CB 4.06Å; V117-A159 WeakPolarHBondContact CB-O 3.41Å; V117-A159 HydrophobicContact CG1-CB 4.09Å; V117-A159 PolarHBondContact N-O 2.88Å; V117-A159 VanDerWaalsContact N-O 3.16Å; V117-I162 HydrophobicContact CG2-CB 3.94Å; V117-I162 HydrophobicContact CG2-CG2 3.69Å; V117-I162 PolarHBondContact N-O 3.22Å; V117-L164 HydrophobicContact CG2-CD1 3.98Å; V117-L164 HydrophobicContact CG2-CG 4.17Å; V117-M224 HydrophobicContact CG1-CG 3.75Å; V117-M224 HydrophobicContact CG1-SD 3.73Å
118	S	96.3	Very high	94.8	Very high	36 Å²	36	37.7 Å²	37.7	25%	0.252	18%	0.182	S	C	.	.	H	α-helix	trans	-63.1	-40.8	172	-170.4	0	0	0	0	112	S116 M121 R122 A159	S116-S118 PolarHBondContact O-N 2.84Å; S118-M121 PolarHBondContact O-N 3Å; S118-R122 VanDerWaalsContact O-CB 3.3Å; S118-R122 WeakPolarHBondContact O-CB 3.31Å; S118-R122 PolarHBondContact O-N 2.87Å; S118-A159 PolarHBondContact N-O 2.83Å; S118-A159 VanDerWaalsContact N-O 3.11Å
119	D	93.4	Very high	94.9	Very high	41 Å²	41	40.9 Å²	40.9	22%	0.219	20%	0.199	C	C	.	.	H	α-helix	trans	-64.5	-42.5	175.1	-55.6	-35.1	0	0	0	111.5	S116 M121 R122 I123	S116-D119 WeakPolarHBondContact CB-OD2 3.41Å; S116-D119 PolarHBondContact N-OD2 2.97Å; S116-D119 WeakPolarHBondContact O-CA 3.48Å; S116-D119 WeakPolarHBondContact O-CB 3.47Å; S116-D119 PolarHBondContact O-N 3.43Å; S116-D119 PolarHBondContact OG-N 3.26Å; S116-D119 PolarHBondContact OG-OD1 2.85Å; S116-D119 PolarHBondContact OG-OD2 2.96Å; D119-M121 PolarHBondContact O-N 3.23Å; D119-R122 PolarHBondContact O-N 3.27Å; D119-R122 IonicContact OD1-CZ 3.68Å; D119-R122 IonicContact OD1-NH1 3.94Å; D119-R122 PolarHBondContact OD1-NH1 2.81Å; D119-R122 IonicContact OD1-NH2 3.57Å; D119-R122 PolarHBondContact OD1-NH2 3.12Å; D119-I123 HydrophobicContact CB-CD1 4.18Å; D119-I123 WeakPolarHBondContact O-CB 3.42Å; D119-I123 WeakPolarHBondContact O-CD1 3.42Å; D119-I123 WeakPolarHBondContact O-CG1 3.34Å; D119-I123 PolarHBondContact O-N 3.23Å
120	L	95.9	Very high	95.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-54.1	-51.4	176.4	-170.5	79.3	0	0	0	110.9	S116 V117 R124 L128 L164 L297 I301 T304	S116-L120 PolarHBondContact O-N 3.4Å; V117-L120 WeakPolarHBondContact O-CB 3.4Å; V117-L120 PolarHBondContact O-N 3.35Å; L120-R124 WeakPolarHBondContact O-CB 3.18Å; L120-R124 VanDerWaalsContact O-CG 3.28Å; L120-R124 WeakPolarHBondContact O-CG 3.35Å; L120-R124 PolarHBondContact O-N 3.22Å; L120-L128 HydrophobicContact CD2-CD1 4.43Å; L120-L128 HydrophobicContact CD2-CD2 3.83Å; L120-L164 HydrophobicContact CD2-CD1 3.82Å; L120-L297 HydrophobicContact CD2-CD1 4.14Å; L120-I301 HydrophobicContact CD1-CG1 4.18Å; L120-T304 HydrophobicContact CD1-CG2 4.06Å; L120-T304 WeakPolarHBondContact CD1-OG1 3.41Å
121	M	97.5	Very high	95.1	Very high	14 Å²	14	46 Å²	46	7%	0.069	23%	0.227	C	C	.	.	H	α-helix	trans	-64.5	-44	177.8	-69.7	-170.8	-71	0	0	112.5	V117 S118 D119 K125 K126 L128 A159 E223	V117-M121 PolarHBondContact O-N 2.82Å; V117-M121 VanDerWaalsContact O-N 3.12Å; S118-M121 PolarHBondContact O-N 3Å; D119-M121 PolarHBondContact O-N 3.23Å; M121-K125 WeakPolarHBondContact O-CA 3.43Å; M121-K125 PolarHBondContact O-N 3Å; M121-K126 VanDerWaalsContact CA-O 3.24Å; M121-K126 WeakPolarHBondContact CA-O 3.41Å; M121-K126 WeakPolarHBondContact CB-O 3.5Å; M121-K126 PolarHBondContact O-N 3.06Å; M121-L128 HydrophobicContact CG-CD2 4.06Å; M121-L128 HydrophobicContact CG-CG 4Å; M121-L128 HydrophobicContact SD-CG 4.35Å; M121-A159 HydrophobicContact CE-CB 4.16Å; M121-E223 HydrophobicContact CE-CG 4.45Å
122	R	95.1	Very high	95.3	Very high	126 Å²	126	43.7 Å²	43.7	48%	0.475	22%	0.218	S	C	.	.	H	α-helix	trans	-64.1	-44.8	-178.1	-174.8	176.7	68.4	-106.4	2.1	112.4	S118 D119 K125	S118-R122 VanDerWaalsContact O-CB 3.3Å; S118-R122 WeakPolarHBondContact O-CB 3.31Å; S118-R122 PolarHBondContact O-N 2.87Å; D119-R122 PolarHBondContact O-N 3.27Å; D119-R122 IonicContact OD1-CZ 3.68Å; D119-R122 IonicContact OD1-NH1 3.94Å; D119-R122 PolarHBondContact OD1-NH1 2.81Å; D119-R122 IonicContact OD1-NH2 3.57Å; D119-R122 PolarHBondContact OD1-NH2 3.12Å; R122-K125 PolarHBondContact O-N 2.96Å
123	I	93	Very high	95.5	Very high	34 Å²	34	43.2 Å²	43.2	17%	0.174	22%	0.215	C	C	.	.	H	α-helix	trans	-68.7	-44.1	-178	-68.3	162.5	0	0	0	110.5	D119 K125 T304 L307 Q308	D119-I123 HydrophobicContact CB-CD1 4.18Å; D119-I123 WeakPolarHBondContact O-CB 3.42Å; D119-I123 WeakPolarHBondContact O-CD1 3.42Å; D119-I123 WeakPolarHBondContact O-CG1 3.34Å; D119-I123 PolarHBondContact O-N 3.23Å; I123-K125 PolarHBondContact O-N 3.13Å; I123-T304 HydrophobicContact CB-CG2 4.05Å; I123-T304 HydrophobicContact CD1-CG2 3.78Å; I123-T304 HydrophobicContact CG2-CG2 3.89Å; I123-L307 HydrophobicContact CG2-CB 3.74Å; I123-L307 HydrophobicContact CG2-CD1 4.17Å; I123-Q308 HydrophobicContact CD1-CG 3.82Å; I123-Q308 VanDerWaalsContact CD1-NE2 3.26Å; I123-Q308 HydrophobicContact CG2-CG 4.37Å
124	R	95.6	Very high	95.9	Very high	31 Å²	31	43.1 Å²	43.1	12%	0.117	21%	0.214	C	C	.	.	H	α-helix	trans	-73.1	-17.7	177.2	-64.6	172.4	72.4	-160.5	10.9	113.1	L120 K126 E132 A300 E303 T304	L120-R124 WeakPolarHBondContact O-CB 3.18Å; L120-R124 VanDerWaalsContact O-CG 3.28Å; L120-R124 WeakPolarHBondContact O-CG 3.35Å; L120-R124 PolarHBondContact O-N 3.22Å; R124-K126 HydrophobicContact CB-CB 4.23Å; R124-K126 WeakPolarHBondContact O-CG 3.5Å; R124-K126 PolarHBondContact O-N 3.36Å; R124-E132 IonicContact CZ-OE1 2.7Å; R124-E132 IonicContact NH1-OE1 2.88Å; R124-E132 PolarHBondContact NH1-OE1 3.19Å; R124-E132 IonicContact NH1-OE2 3.8Å; R124-E132 IonicContact NH2-OE1 2.77Å; R124-E132 PolarHBondContact NH2-OE1 2.92Å; R124-A300 VanDerWaalsContact CZ-CB 3.43Å; R124-E303 HydrophobicContact CG-CG 4.49Å; R124-E303 IonicContact CZ-OE2 3.15Å; R124-E303 IonicContact NE-OE2 3.12Å; R124-E303 PolarHBondContact NE-OE2 3.24Å; R124-E303 IonicContact NH2-OE2 3.81Å; R124-E303 PolarHBondContact NH2-OE2 3.4Å; R124-T304 WeakPolarHBondContact CD-OG1 3.3Å; R124-T304 VanDerWaalsContact CG-OG1 3.29Å; R124-T304 WeakPolarHBondContact CG-OG1 3.29Å
125	K	95.8	Very high	96.2	Very high	190 Å²	190	43.2 Å²	43.2	83%	0.826	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	38	-169.3	-57	-178.9	179.6	-179	0	112	M121 R122 I123	M121-K125 WeakPolarHBondContact O-CA 3.43Å; M121-K125 PolarHBondContact O-N 3Å; R122-K125 PolarHBondContact O-N 2.96Å; I123-K125 PolarHBondContact O-N 3.13Å
126	K	96.4	Very high	96.4	Very high	108 Å²	108	42.3 Å²	42.3	47%	0.47	21%	0.205	S	C	.	.			trans	-142	142.9	-176.6	-68.7	172	-170.7	164.8	0	109.3	M121 R124 E303	M121-K126 VanDerWaalsContact CA-O 3.24Å; M121-K126 WeakPolarHBondContact CA-O 3.41Å; M121-K126 WeakPolarHBondContact CB-O 3.5Å; M121-K126 PolarHBondContact O-N 3.06Å; R124-K126 HydrophobicContact CB-CB 4.23Å; R124-K126 WeakPolarHBondContact O-CG 3.5Å; R124-K126 PolarHBondContact O-N 3.36Å; K126-E303 IonicContact NZ-OE1 3.89Å; K126-E303 PolarHBondContact NZ-OE1 2.68Å; K126-E303 IonicContact NZ-OE2 3.07Å
127	T	97.7	Very high	96.5	Very high	66 Å²	66	42.1 Å²	42.1	41%	0.405	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-74.9	171.9	166.3	57.1	0	0	0	0	110.1	M224 A225 G227	T127-M224 WeakPolarHBondContact CB-O 3.33Å; T127-A225 VanDerWaalsContact CB-O 3.29Å; T127-A225 WeakPolarHBondContact CB-O 3.41Å; T127-A225 WeakPolarHBondContact CG2-O 3.45Å; T127-A225 PolarHBondContact OG1-O 2.93Å; T127-G227 VanDerWaalsContact CG2-N 3.32Å
128	L	97.9	Very high	96.5	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-91.2	148.8	-180	-56.4	-171.2	0	0	0	111.8	V117 L120 M121 E132 I133 I136 M224	V117-L128 HydrophobicContact CG1-CD1 3.8Å; L120-L128 HydrophobicContact CD2-CD1 4.43Å; L120-L128 HydrophobicContact CD2-CD2 3.83Å; M121-L128 HydrophobicContact CG-CD2 4.06Å; M121-L128 HydrophobicContact CG-CG 4Å; M121-L128 HydrophobicContact SD-CG 4.35Å; L128-E132 WeakPolarHBondContact CA-OE2 3.32Å; L128-E132 HydrophobicContact CB-CB 4.12Å; L128-E132 WeakPolarHBondContact CB-OE2 3.48Å; L128-E132 WeakPolarHBondContact CD2-OE2 3.45Å; L128-I133 HydrophobicContact CB-CD1 4.09Å; L128-I133 HydrophobicContact CB-CG1 3.64Å; L128-I133 HydrophobicContact CD1-CG1 4.41Å; L128-I136 HydrophobicContact CD1-CD1 3.48Å; L128-I136 VanDerWaalsContact CD1-CD1 3.48Å; L128-M224 HydrophobicContact CD1-CB 4.26Å; L128-M224 HydrophobicContact CD1-CG 4.26Å; L128-M224 HydrophobicContact CD1-SD 4.11Å; L128-M224 PolarHBondContact N-O 3.47Å
129	N	96.3	Very high	96.6	Very high	68 Å²	68	42.6 Å²	42.6	36%	0.364	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-83.6	169.5	169.3	67.3	53.8	0	0	0	111.3	D131 E132 I133	N129-D131 VanDerWaalsContact C-N 3.35Å; N129-D131 PolarHBondContact O-N 2.81Å; N129-D131 PolarHBondContact OD1-N 3.27Å; N129-D131 VanDerWaalsContact OD1-N 3.11Å; N129-E132 PolarHBondContact N-OE2 3.31Å; N129-E132 PolarHBondContact ND2-OE2 3.16Å; N129-E132 PolarHBondContact O-N 3.43Å; N129-E132 WeakPolarHBondContact OD1-CG 3.34Å; N129-E132 PolarHBondContact OD1-N 3.42Å; N129-I133 WeakPolarHBondContact O-CB 3.39Å; N129-I133 VanDerWaalsContact O-CG1 3.26Å; N129-I133 WeakPolarHBondContact O-CG1 3.43Å; N129-I133 PolarHBondContact O-N 3.46Å
130	E	96.7	Very high	96.8	Very high	39 Å²	39	40.7 Å²	40.7	18%	0.182	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-38.8	-176.5	-71	-169.7	-150.9	0	0	114	I133 A134 W257 S258 F261 F287	E130-I133 PolarHBondContact O-N 3.18Å; E130-A134 VanDerWaalsContact O-CB 3.25Å; E130-A134 WeakPolarHBondContact O-CB 3.23Å; E130-A134 PolarHBondContact O-N 2.95Å; E130-W257 HydrophobicContact CG-CE3 3.78Å; E130-W257 HydrophobicContact CG-CZ3 4.11Å; E130-W257 VanDerWaalsContact OE1-CA 3.23Å; E130-W257 WeakPolarHBondContact OE1-CA 3.38Å; E130-S258 PolarHBondContact OE1-N 3.26Å; E130-S258 WeakPolarHBondContact OE2-CB 3.32Å; E130-S258 PolarHBondContact OE2-OG 3.08Å; E130-F261 HydrophobicContact CG-CD1 3.78Å; E130-F261 HydrophobicContact CG-CE1 4.36Å; E130-F261 HydrophobicContact CG-CG 4.39Å; E130-F287 HydrophobicContact CB-CE2 4.06Å; E130-F287 HydrophobicContact CB-CZ 4.28Å; E130-F287 HydrophobicContact CG-CE2 4.3Å
131	D	95.2	Very high	96.9	Very high	116 Å²	116	40.7 Å²	40.7	62%	0.62	19%	0.189	S	C	*	.	H	α-helix	trans	-64.8	-43.5	179	-67.7	-26.4	0	0	0	111.1	N129 V135 A296	N129-D131 VanDerWaalsContact C-N 3.35Å; N129-D131 PolarHBondContact O-N 2.81Å; N129-D131 PolarHBondContact OD1-N 3.27Å; N129-D131 VanDerWaalsContact OD1-N 3.11Å; D131-V135 VanDerWaalsContact O-CG2 3.28Å; D131-V135 WeakPolarHBondContact O-CG2 3.18Å; D131-V135 PolarHBondContact O-N 3.1Å; D131-A296 HydrophobicContact CB-CB 4.24Å
132	E	97.3	Very high	96.9	Very high	6 Å²	6	41.4 Å²	41.4	3%	0.028	19%	0.194	C	C	.	.	H	α-helix	trans	-61	-46.6	174.1	-69.4	167.5	158	0	0	110.8	R124 L128 N129 I136 A296 L297 A300	R124-E132 IonicContact CZ-OE1 2.7Å; R124-E132 IonicContact NH1-OE1 2.88Å; R124-E132 PolarHBondContact NH1-OE1 3.19Å; R124-E132 IonicContact NH1-OE2 3.8Å; R124-E132 IonicContact NH2-OE1 2.77Å; R124-E132 PolarHBondContact NH2-OE1 2.92Å; L128-E132 WeakPolarHBondContact CA-OE2 3.32Å; L128-E132 HydrophobicContact CB-CB 4.12Å; L128-E132 WeakPolarHBondContact CB-OE2 3.48Å; L128-E132 WeakPolarHBondContact CD2-OE2 3.45Å; N129-E132 PolarHBondContact N-OE2 3.31Å; N129-E132 PolarHBondContact ND2-OE2 3.16Å; N129-E132 PolarHBondContact O-N 3.43Å; N129-E132 WeakPolarHBondContact OD1-CG 3.34Å; N129-E132 PolarHBondContact OD1-N 3.42Å; E132-I136 WeakPolarHBondContact O-CG1 2.85Å; E132-I136 PolarHBondContact O-N 3.42Å; E132-A296 HydrophobicContact CG-CB 4.08Å; E132-L297 HydrophobicContact CB-CD1 4.48Å; E132-A300 WeakPolarHBondContact OE1-CB 3.4Å
133	I	98.1	Very high	97	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.8	-46.6	-179.3	-70.3	169.3	0	0	0	111.1	L128 N129 E130 V135 I136 L137 M224 A225 F261 F287	L128-I133 HydrophobicContact CB-CD1 4.09Å; L128-I133 HydrophobicContact CB-CG1 3.64Å; L128-I133 HydrophobicContact CD1-CG1 4.41Å; N129-I133 WeakPolarHBondContact O-CB 3.39Å; N129-I133 VanDerWaalsContact O-CG1 3.26Å; N129-I133 WeakPolarHBondContact O-CG1 3.43Å; N129-I133 PolarHBondContact O-N 3.46Å; E130-I133 PolarHBondContact O-N 3.18Å; I133-V135 VanDerWaalsContact C-N 3.32Å; I133-V135 PolarHBondContact O-N 2.69Å; I133-I136 PolarHBondContact O-N 3.21Å; I133-I136 VanDerWaalsContact O-N 3.16Å; I133-L137 HydrophobicContact CG2-CD1 3.47Å; I133-L137 VanDerWaalsContact CG2-CD1 3.47Å; I133-L137 HydrophobicContact CG2-CG 3.95Å; I133-L137 WeakPolarHBondContact O-CB 3.45Å; I133-L137 WeakPolarHBondContact O-CG 3.2Å; I133-L137 PolarHBondContact O-N 3.22Å; I133-M224 HydrophobicContact CD1-CB 4Å; I133-M224 HydrophobicContact CG1-CB 3.86Å; I133-M224 HydrophobicContact CG1-SD 4.47Å; I133-M224 HydrophobicContact CG2-CE 3.85Å; I133-A225 HydrophobicContact CD1-CB 4.1Å; I133-F261 HydrophobicContact CD1-CE1 3.99Å; I133-F261 HydrophobicContact CD1-CZ 3.92Å; I133-F261 HydrophobicContact CG2-CE2 3.94Å; I133-F261 HydrophobicContact CG2-CZ 3.79Å; I133-F287 HydrophobicContact CG2-CE1 4.12Å; I133-F287 HydrophobicContact CG2-CZ 4.24Å
134	A	97.6	Very high	97.2	Very high	5 Å²	5	33.8 Å²	33.8	4%	0.041	16%	0.163	C	C	.	.	H	α-helix	trans	-63.3	-38.4	-176.1	0	0	0	0	0	111.8	E130 R138 F287 V291	E130-A134 VanDerWaalsContact O-CB 3.25Å; E130-A134 WeakPolarHBondContact O-CB 3.23Å; E130-A134 PolarHBondContact O-N 2.95Å; A134-R138 WeakPolarHBondContact O-CB 3.32Å; A134-R138 PolarHBondContact O-N 3.36Å; A134-F287 HydrophobicContact CB-CD1 4.43Å; A134-F287 HydrophobicContact CB-CE1 3.96Å; A134-F287 HydrophobicContact CB-CE2 4.32Å; A134-F287 HydrophobicContact CB-CZ 3.89Å; A134-V291 HydrophobicContact CB-CG2 3.41Å; A134-V291 VanDerWaalsContact CB-CG2 3.41Å
135	V	97.2	Very high	97.3	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-61.2	-46.9	173.1	175.5	0	0	0	0	111.4	D131 I133 D139 V291 N293 S294 L297	D131-V135 VanDerWaalsContact O-CG2 3.28Å; D131-V135 WeakPolarHBondContact O-CG2 3.18Å; D131-V135 PolarHBondContact O-N 3.1Å; I133-V135 VanDerWaalsContact C-N 3.32Å; I133-V135 PolarHBondContact O-N 2.69Å; V135-D139 PolarHBondContact O-N 2.98Å; V135-V291 HydrophobicContact CB-CG1 4.22Å; V135-V291 HydrophobicContact CG2-CG1 3.38Å; V135-N293 WeakPolarHBondContact CG2-O 3.45Å; V135-S294 WeakPolarHBondContact CG1-OG 3.49Å; V135-L297 HydrophobicContact CB-CD2 4.08Å; V135-L297 HydrophobicContact CG1-CD2 3.57Å
136	I	98.2	Very high	97.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.4	-48.9	179.4	-66.5	166.4	0	0	0	110.2	V117 L128 E132 I133 R138 D139 V140 I162 L164 A170 M224 L297	V117-I136 HydrophobicContact CG1-CD1 4.18Å; V117-I136 HydrophobicContact CG2-CD1 3.94Å; V117-I136 HydrophobicContact CG2-CG2 4.11Å; L128-I136 HydrophobicContact CD1-CD1 3.48Å; L128-I136 VanDerWaalsContact CD1-CD1 3.48Å; E132-I136 WeakPolarHBondContact O-CG1 2.85Å; E132-I136 PolarHBondContact O-N 3.42Å; I133-I136 PolarHBondContact O-N 3.21Å; I133-I136 VanDerWaalsContact O-N 3.16Å; I136-R138 PolarHBondContact O-N 2.86Å; I136-D139 PolarHBondContact O-N 3.17Å; I136-V140 HydrophobicContact CG2-CG2 4.15Å; I136-V140 VanDerWaalsContact O-CG2 3.28Å; I136-V140 WeakPolarHBondContact O-CG2 2.96Å; I136-V140 PolarHBondContact O-N 2.61Å; I136-I162 HydrophobicContact CG2-CG2 3.97Å; I136-L164 HydrophobicContact CG1-CD2 4.34Å; I136-A170 HydrophobicContact CG2-CB 4.2Å; I136-M224 HydrophobicContact CB-SD 4.4Å; I136-M224 HydrophobicContact CD1-SD 4.08Å; I136-M224 HydrophobicContact CG2-CE 4.49Å; I136-M224 HydrophobicContact CG2-SD 3.98Å; I136-L297 HydrophobicContact CD1-CD1 4.03Å; I136-L297 HydrophobicContact CD1-CD2 4.46Å; I136-L297 HydrophobicContact CG1-CD1 4.29Å; I136-L297 HydrophobicContact CG1-CD2 3.81Å
137	L	98.3	Very high	97.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.5	-37.8	-177.2	-69.7	177.5	0	0	0	112.5	I133 D139 V140 L141 L217 A221 M224 F261 F264 F287 V288	I133-L137 HydrophobicContact CG2-CD1 3.47Å; I133-L137 VanDerWaalsContact CG2-CD1 3.47Å; I133-L137 HydrophobicContact CG2-CG 3.95Å; I133-L137 WeakPolarHBondContact O-CB 3.45Å; I133-L137 WeakPolarHBondContact O-CG 3.2Å; I133-L137 PolarHBondContact O-N 3.22Å; L137-D139 PolarHBondContact O-N 3.25Å; L137-V140 PolarHBondContact O-N 2.91Å; L137-L141 VanDerWaalsContact O-CB 3.28Å; L137-L141 WeakPolarHBondContact O-CB 3.48Å; L137-L141 VanDerWaalsContact O-CG 3.28Å; L137-L141 WeakPolarHBondContact O-CG 3.33Å; L137-L141 PolarHBondContact O-N 3.5Å; L137-L217 HydrophobicContact CD2-CD1 3.47Å; L137-L217 VanDerWaalsContact CD2-CD1 3.47Å; L137-L217 HydrophobicContact CD2-CG 3.97Å; L137-A221 HydrophobicContact CD1-CB 4.05Å; L137-A221 HydrophobicContact CD2-CB 4.47Å; L137-M224 HydrophobicContact CD1-CE 4.41Å; L137-M224 HydrophobicContact CD2-CE 3.63Å; L137-M224 HydrophobicContact CG-CE 3.88Å; L137-F261 HydrophobicContact CD1-CE2 4.46Å; L137-F264 HydrophobicContact CD1-CD1 4.19Å; L137-F264 HydrophobicContact CD1-CE1 3.63Å; L137-F264 HydrophobicContact CD1-CZ 4.15Å; L137-F287 HydrophobicContact CD1-CE1 3.96Å; L137-V288 HydrophobicContact CB-CG1 4.05Å
138	R	97.4	Very high	97	Very high	46 Å²	46	20.6 Å²	20.6	17%	0.174	10%	0.102	C	C	.	.	H	α-helix	trans	-58.4	-47.4	173.5	-177.2	-159.3	66.6	-157.5	-6.1	111.6	A134 I136 T142 M283 V288 V291	A134-R138 WeakPolarHBondContact O-CB 3.32Å; A134-R138 PolarHBondContact O-N 3.36Å; I136-R138 PolarHBondContact O-N 2.86Å; R138-T142 PolarHBondContact O-N 2.88Å; R138-T142 PolarHBondContact O-OG1 2.75Å; R138-M283 HydrophobicContact CG-CE 4.06Å; R138-M283 HydrophobicContact CG-SD 4.4Å; R138-V288 HydrophobicContact CB-CB 4.38Å; R138-V291 PolarHBondContact NH1-O 3.26Å
139	D	97.5	Very high	96.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.1	-40.9	179.3	-83.4	22.8	0	0	0	111.3	F91 V135 I136 L137 T142 G143 R169 A170	F91-D139 HydrophobicContact CD1-CB 3.8Å; F91-D139 WeakPolarHBondContact CD1-O 3.32Å; F91-D139 HydrophobicContact CE1-CB 3.88Å; V135-D139 PolarHBondContact O-N 2.98Å; I136-D139 PolarHBondContact O-N 3.17Å; L137-D139 PolarHBondContact O-N 3.25Å; D139-T142 PolarHBondContact O-N 3.24Å; D139-G143 PolarHBondContact O-N 2.95Å; D139-R169 IonicContact OD1-CZ 2.61Å; D139-R169 IonicContact OD1-NE 3.61Å; D139-R169 IonicContact OD1-NH2 2.87Å; D139-R169 PolarHBondContact OD1-NH2 2.8Å; D139-R169 WeakPolarHBondContact OD2-CA 3.47Å; D139-R169 IonicContact OD2-CZ 2.79Å; D139-R169 IonicContact OD2-NE 2.83Å; D139-R169 PolarHBondContact OD2-NE 3.18Å; D139-R169 IonicContact OD2-NH2 3.43Å; D139-R169 PolarHBondContact OD2-NH2 3.3Å; D139-A170 HydrophobicContact CB-CB 3.72Å; D139-A170 PolarHBondContact OD2-N 3.49Å
140	V	98.2	Very high	96.5	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-64.6	-44.6	176.1	171.5	0	0	0	0	111.8	I136 L137 T142 G143 L144 I162 A170 L172 L217	I136-V140 HydrophobicContact CG2-CG2 4.15Å; I136-V140 VanDerWaalsContact O-CG2 3.28Å; I136-V140 WeakPolarHBondContact O-CG2 2.96Å; I136-V140 PolarHBondContact O-N 2.61Å; L137-V140 PolarHBondContact O-N 2.91Å; V140-T142 VanDerWaalsContact C-N 3.3Å; V140-T142 PolarHBondContact O-N 2.9Å; V140-G143 CarbonylContact O-C 3.6Å; V140-G143 WeakPolarHBondContact O-CA 3.35Å; V140-G143 PolarHBondContact O-N 2.91Å; V140-G143 VanDerWaalsContact O-N 3.1Å; V140-L144 HydrophobicContact CG1-CD1 4.15Å; V140-L144 HydrophobicContact CG1-CG 4.32Å; V140-L144 WeakPolarHBondContact O-CG 3.21Å; V140-L144 PolarHBondContact O-N 3.46Å; V140-I162 HydrophobicContact CG2-CD1 3.79Å; V140-I162 HydrophobicContact CG2-CG1 3.91Å; V140-I162 HydrophobicContact CG2-CG2 3.74Å; V140-A170 HydrophobicContact CG2-CB 4.38Å; V140-L172 HydrophobicContact CG1-CD2 4.02Å; V140-L217 HydrophobicContact CB-CD1 4.22Å; V140-L217 HydrophobicContact CG1-CD1 3.42Å; V140-L217 VanDerWaalsContact CG1-CD1 3.42Å
141	L	98.4	Very high	96.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.6	-41.4	175.4	-80.5	169.1	0	0	0	111.4	L137 G143 L144 Q145 I214 L217 F264 A279 L282 M283 V288	L137-L141 VanDerWaalsContact O-CB 3.28Å; L137-L141 WeakPolarHBondContact O-CB 3.48Å; L137-L141 VanDerWaalsContact O-CG 3.28Å; L137-L141 WeakPolarHBondContact O-CG 3.33Å; L137-L141 PolarHBondContact O-N 3.5Å; L141-G143 VanDerWaalsContact C-N 3.31Å; L141-G143 PolarHBondContact O-N 3.04Å; L141-L144 PolarHBondContact O-N 3.11Å; L141-Q145 WeakPolarHBondContact O-CB 3.41Å; L141-Q145 PolarHBondContact O-N 3.11Å; L141-I214 HydrophobicContact CD2-CD1 4.5Å; L141-L217 HydrophobicContact CD2-CD2 3.42Å; L141-L217 VanDerWaalsContact CD2-CD2 3.42Å; L141-L217 HydrophobicContact CG-CD2 3.79Å; L141-F264 HydrophobicContact CD1-CE2 4.03Å; L141-F264 HydrophobicContact CD1-CZ 4.05Å; L141-A279 HydrophobicContact CD2-CB 4.22Å; L141-L282 HydrophobicContact CD1-CB 3.97Å; L141-L282 HydrophobicContact CD2-CB 3.65Å; L141-L282 HydrophobicContact CD2-CD1 3.94Å; L141-L282 HydrophobicContact CD2-CG 4.48Å; L141-L282 HydrophobicContact CG-CB 4.48Å; L141-M283 HydrophobicContact CB-CG 3.98Å; L141-M283 HydrophobicContact CB-SD 3.42Å; L141-M283 WeakPolarHBondContact CB-SD 3.14Å; L141-M283 HydrophobicContact CD1-SD 4.17Å; L141-M283 HydrophobicContact CG-SD 4.44Å; L141-V288 HydrophobicContact CD1-CB 4.49Å; L141-V288 HydrophobicContact CD1-CG1 4.21Å; L141-V288 HydrophobicContact CD1-CG2 3.97Å
142	T	97.5	Very high	95.8	Very high	29 Å²	29	32.5 Å²	32.5	18%	0.178	15%	0.145	C	C	.	.	H	α-helix	trans	-63.1	-39.4	175.1	-48.9	0	0	0	0	111.2	F91 R138 D139 V140 Y146 M283	F91-T142 HydrophobicContact CD1-CG2 4.44Å; F91-T142 HydrophobicContact CD2-CG2 3.52Å; F91-T142 HydrophobicContact CE1-CG2 4.12Å; F91-T142 HydrophobicContact CE2-CG2 3.21Å; F91-T142 HydrophobicContact CG-CG2 4.14Å; F91-T142 HydrophobicContact CZ-CG2 3.53Å; R138-T142 PolarHBondContact O-N 2.88Å; R138-T142 PolarHBondContact O-OG1 2.75Å; D139-T142 PolarHBondContact O-N 3.24Å; V140-T142 VanDerWaalsContact C-N 3.3Å; V140-T142 PolarHBondContact O-N 2.9Å; T142-Y146 PolarHBondContact O-N 2.93Å; T142-Y146 VanDerWaalsContact O-N 3.11Å; T142-M283 WeakPolarHBondContact OG1-CE 3.39Å
143	G	97	Very high	95.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.7	-44.8	172	0	0	0	0	0	113.2	D139 V140 L141 Y146 L147	D139-G143 PolarHBondContact O-N 2.95Å; V140-G143 CarbonylContact O-C 3.6Å; V140-G143 WeakPolarHBondContact O-CA 3.35Å; V140-G143 PolarHBondContact O-N 2.91Å; V140-G143 VanDerWaalsContact O-N 3.1Å; L141-G143 VanDerWaalsContact C-N 3.31Å; L141-G143 PolarHBondContact O-N 3.04Å; G143-Y146 WeakPolarHBondContact O-CB 3.37Å; G143-Y146 PolarHBondContact O-N 3.46Å; G143-L147 WeakPolarHBondContact O-CG 3.39Å; G143-L147 PolarHBondContact O-N 3.44Å; G143-L147 VanDerWaalsContact O-N 3.08Å
144	L	97.3	Very high	95.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-65.5	-44.1	177.8	-70.8	178	0	0	0	111.6	V140 L141 Y146 L147 H148 H154 V157 L172 D213 I214 L217 A279	V140-L144 HydrophobicContact CG1-CD1 4.15Å; V140-L144 HydrophobicContact CG1-CG 4.32Å; V140-L144 WeakPolarHBondContact O-CG 3.21Å; V140-L144 PolarHBondContact O-N 3.46Å; L141-L144 PolarHBondContact O-N 3.11Å; L144-Y146 VanDerWaalsContact C-N 3.28Å; L144-Y146 PolarHBondContact O-N 2.8Å; L144-L147 PolarHBondContact O-N 3.08Å; L144-L147 VanDerWaalsContact O-N 3.08Å; L144-H148 VanDerWaalsContact O-CB 3.3Å; L144-H148 WeakPolarHBondContact O-CB 3.42Å; L144-H148 PolarHBondContact O-CD2 2.99Å; L144-H148 VanDerWaalsContact O-CD2 3.31Å; L144-H148 PolarHBondContact O-N 3.33Å; L144-H154 HydrophobicContact CD2-CB 4.08Å; L144-V157 HydrophobicContact CD2-CG2 4.02Å; L144-L172 HydrophobicContact CD2-CD1 3.82Å; L144-L172 HydrophobicContact CG-CD1 4.06Å; L144-D213 HydrophobicContact CD1-CB 4.27Å; L144-D213 HydrophobicContact CD2-CB 3.87Å; L144-I214 HydrophobicContact CD1-CD1 4.21Å; L144-L217 HydrophobicContact CD1-CD2 4.32Å; L144-A279 HydrophobicContact CB-CB 3.96Å
145	Q	97	Very high	94.7	Very high	63 Å²	63	37.2 Å²	37.2	29%	0.294	16%	0.164	S	C	.	.	H	α-helix	trans	-55.8	-44.2	173.8	-173.3	-169.7	31.5	0	0	111.4	L141 L147 S149 A279 E280	L141-Q145 WeakPolarHBondContact O-CB 3.41Å; L141-Q145 PolarHBondContact O-N 3.11Å; Q145-L147 VanDerWaalsContact C-N 3.34Å; Q145-L147 PolarHBondContact O-N 3.08Å; Q145-S149 WeakPolarHBondContact O-CB 3.46Å; Q145-S149 PolarHBondContact O-N 3.29Å; Q145-S149 PolarHBondContact O-OG 2.91Å; Q145-A279 HydrophobicContact CB-CB 4.08Å; Q145-E280 HydrophobicContact CG-CB 4.34Å
146	Y	95.9	Very high	94.3	Very high	28 Å²	28	39.5 Å²	39.5	11%	0.11	18%	0.176	C	C	.	.	H	α-helix	trans	-59.8	-41.9	175.8	169	-85.7	0	0	0	112.7	C87 D88 V92 T142 G143 L144 S149 R150	C87-Y146 WeakPolarHBondContact CA-OH 3.46Å; C87-Y146 HydrophobicContact CB-CE1 4.19Å; D88-Y146 PolarHBondContact N-OH 2.8Å; D88-Y146 VanDerWaalsContact O-CE2 3.32Å; D88-Y146 WeakPolarHBondContact O-CE2 3.44Å; V92-Y146 HydrophobicContact CG2-CD1 4.15Å; T142-Y146 PolarHBondContact O-N 2.93Å; T142-Y146 VanDerWaalsContact O-N 3.11Å; G143-Y146 WeakPolarHBondContact O-CB 3.37Å; G143-Y146 PolarHBondContact O-N 3.46Å; L144-Y146 VanDerWaalsContact C-N 3.28Å; L144-Y146 PolarHBondContact O-N 2.8Å; Y146-S149 PolarHBondContact O-OG 3.4Å; Y146-R150 VanDerWaalsContact CE2-NH2 3.35Å; Y146-R150 VanDerWaalsContact CZ-CZ 3.46Å; Y146-R150 PolarHBondContact O-NH1 2.87Å; Y146-R150 PolarHBondContact OH-NE 2.87Å
147	L	93.6	Very high	94.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-72.2	-47.3	179.6	-67.8	172.4	0	0	0	111.7	V92 G143 L144 Q145 S149 R150 R151 K152 H154 L172 F175	V92-L147 HydrophobicContact CG2-CD2 4.27Å; V92-L147 HydrophobicContact CG2-CG 4.39Å; G143-L147 WeakPolarHBondContact O-CG 3.39Å; G143-L147 PolarHBondContact O-N 3.44Å; G143-L147 VanDerWaalsContact O-N 3.08Å; L144-L147 PolarHBondContact O-N 3.08Å; L144-L147 VanDerWaalsContact O-N 3.08Å; Q145-L147 VanDerWaalsContact C-N 3.34Å; Q145-L147 PolarHBondContact O-N 3.08Å; L147-S149 PolarHBondContact O-N 2.88Å; L147-R150 CarbonylContact O-C 3.55Å; L147-R150 WeakPolarHBondContact O-CA 3.45Å; L147-R150 PolarHBondContact O-N 2.97Å; L147-R151 PolarHBondContact O-N 2.85Å; L147-K152 CarbonylContact C-O 3.57Å; L147-K152 HydrophobicContact CB-CB 4.21Å; L147-K152 HydrophobicContact CD2-CB 4.29Å; L147-K152 HydrophobicContact CD2-CD 4.19Å; L147-K152 WeakPolarHBondContact O-CB 3.34Å; L147-K152 PolarHBondContact O-N 2.73Å; L147-H154 HydrophobicContact CD1-CB 4.32Å; L147-L172 HydrophobicContact CD1-CD1 3.67Å; L147-F175 HydrophobicContact CD1-CE1 3.65Å; L147-F175 HydrophobicContact CD1-CZ 4.32Å; L147-F175 HydrophobicContact CD2-CE1 3.57Å; L147-F175 HydrophobicContact CD2-CZ 3.87Å; L147-F175 HydrophobicContact CG-CE1 4.26Å
148	H	94	Very high	94	Very high	27 Å²	27	41.9 Å²	41.9	13%	0.125	19%	0.187	C	C	.	.	H	α-helix	trans	-64	-40.9	-176.7	-64.2	179.7	0	0	0	111.3	L144 R150 R151 K152 C210 D213	L144-H148 VanDerWaalsContact O-CB 3.3Å; L144-H148 WeakPolarHBondContact O-CB 3.42Å; L144-H148 PolarHBondContact O-CD2 2.99Å; L144-H148 VanDerWaalsContact O-CD2 3.31Å; L144-H148 PolarHBondContact O-N 3.33Å; H148-R150 PolarHBondContact O-N 3.32Å; H148-R150 VanDerWaalsContact O-N 3.12Å; H148-R151 PolarHBondContact O-N 3.32Å; H148-K152 PolarHBondContact CD2-O 2.9Å; H148-C210 HydrophobicContact CB-CB 4.06Å; H148-C210 PolarHBondContact CE1-O 2.79Å; H148-C210 PolarHBondContact NE2-O 2.65Å; H148-D213 IonicContact CD2-OD2 3.99Å; H148-D213 IonicContact CE1-OD2 3.5Å; H148-D213 IonicContact NE2-OD2 3.46Å; H148-D213 PolarHBondContact NE2-OD2 2.92Å
149	S	93.5	Very high	94	Very high	85 Å²	85	39.7 Å²	39.7	59%	0.594	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.2	173.4	59.7	0	0	0	0	113.9	Q145 Y146 L147	Q145-S149 WeakPolarHBondContact O-CB 3.46Å; Q145-S149 PolarHBondContact O-N 3.29Å; Q145-S149 PolarHBondContact O-OG 2.91Å; Y146-S149 PolarHBondContact O-OG 3.4Å; L147-S149 PolarHBondContact O-N 2.88Å
150	R	91	Very high	93.9	Very high	125 Å²	125	40.9 Å²	40.9	47%	0.472	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	16	174.5	-69.5	175.6	174.3	69.8	-1.7	113.1	Y146 L147 H148 K152	Y146-R150 VanDerWaalsContact CE2-NH2 3.35Å; Y146-R150 VanDerWaalsContact CZ-CZ 3.46Å; Y146-R150 PolarHBondContact O-NH1 2.87Å; Y146-R150 PolarHBondContact OH-NE 2.87Å; L147-R150 CarbonylContact O-C 3.55Å; L147-R150 WeakPolarHBondContact O-CA 3.45Å; L147-R150 PolarHBondContact O-N 2.97Å; H148-R150 PolarHBondContact O-N 3.32Å; H148-R150 VanDerWaalsContact O-N 3.12Å; R150-K152 PolarHBondContact O-N 2.76Å
151	R	88.9	Confident	93.7	Very high	240 Å²	240	41.4 Å²	41.4	91%	0.906	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.9	30.3	-179	-52.9	-179.9	-177.7	177.6	0.5	113.2	L147 H148	L147-R151 PolarHBondContact O-N 2.85Å; H148-R151 PolarHBondContact O-N 3.32Å
152	K	87.8	Confident	93.6	Very high	25 Å²	25	41.4 Å²	41.4	11%	0.109	19%	0.194	C	C	.	.			trans	-101.8	138.7	173	-65.6	175.7	175	-177.4	0	109.1	I83 Q86 C87 L147 H148 R150	I83-K152 HydrophobicContact CG2-CD 4.12Å; I83-K152 PolarHBondContact O-NZ 3.02Å; Q86-K152 PolarHBondContact O-NZ 2.91Å; C87-K152 PolarHBondContact SG-NZ 2.85Å; L147-K152 CarbonylContact C-O 3.57Å; L147-K152 HydrophobicContact CB-CB 4.21Å; L147-K152 HydrophobicContact CD2-CB 4.29Å; L147-K152 HydrophobicContact CD2-CD 4.19Å; L147-K152 WeakPolarHBondContact O-CB 3.34Å; L147-K152 PolarHBondContact O-N 2.73Å; H148-K152 PolarHBondContact CD2-O 2.9Å; R150-K152 PolarHBondContact O-N 2.76Å
153	I	88.5	Confident	93.6	Very high	36 Å²	36	41.7 Å²	41.7	19%	0.185	19%	0.194	C	C	.	.			trans	-113.8	131.8	175.3	-49.5	173.6	0	0	0	106.6	R155 Y208 C210 D213	I153-R155 HydrophobicContact CB-CG 3.97Å; I153-R155 HydrophobicContact CG2-CG 3.65Å; I153-Y208 HydrophobicContact CD1-CD2 4.08Å; I153-Y208 HydrophobicContact CD1-CE2 3.93Å; I153-Y208 HydrophobicContact CG2-CE2 4.29Å; I153-C210 HydrophobicContact CG1-CB 4.48Å; I153-D213 WeakPolarHBondContact CG2-OD2 3.44Å
154	H	91.1	Very high	93.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	19%	0.194	C	C	.	.			trans	-70.8	-43.1	-177.8	-170.4	-79.9	0	0	0	112	L144 L147 D156 V157 A173 F175 G176 D213	L144-H154 HydrophobicContact CD2-CB 4.08Å; L147-H154 HydrophobicContact CD1-CB 4.32Å; H154-D156 PolarHBondContact CE1-O 3.23Å; H154-D156 VanDerWaalsContact ND1-C 3.34Å; H154-D156 PolarHBondContact ND1-N 2.74Å; H154-D156 PolarHBondContact ND1-O 3.29Å; H154-D156 PolarHBondContact O-N 3.2Å; H154-V157 HydrophobicContact CB-CG2 3.79Å; H154-V157 PolarHBondContact ND1-N 2.69Å; H154-A173 PolarHBondContact CE1-O 2.91Å; H154-A173 VanDerWaalsContact CE1-O 3.28Å; H154-A173 PolarHBondContact NE2-O 3.45Å; H154-A173 VanDerWaalsContact NE2-O 3.09Å; H154-F175 AromaticContact CD2-CD1 3.95Å; H154-F175 AromaticContact CD2-CE1 4Å; H154-G176 WeakPolarHBondContact O-CA 3.26Å; H154-G176 PolarHBondContact O-N 3.24Å; H154-D213 PolarHBondContact N-OD1 2.85Å; H154-D213 PolarHBondContact N-OD2 3.35Å
155	R	89.3	Confident	93.3	Very high	74 Å²	74	42.4 Å²	42.4	28%	0.279	20%	0.198	S	C	.	.			trans	68.7	-13.5	174.4	-55.4	171.8	178.8	-164.4	-4.9	116.9	I153 G176 Y208 D213	I153-R155 HydrophobicContact CB-CG 3.97Å; I153-R155 HydrophobicContact CG2-CG 3.65Å; R155-G176 WeakPolarHBondContact CB-O 3.13Å; R155-G176 WeakPolarHBondContact CD-O 3.5Å; R155-Y208 WeakPolarHBondContact CD-OH 3.39Å; R155-Y208 HydrophobicContact CG-CE2 4.17Å; R155-Y208 PolarHBondContact NE-OH 3.09Å; R155-Y208 PolarHBondContact NH1-OH 3.36Å; R155-D213 PolarHBondContact N-OD1 2.8Å
156	D	90.1	Very high	92.9	Very high	50 Å²	50	43.1 Å²	43.1	27%	0.267	21%	0.206	S	C	.	.			trans	-136.5	48.9	178.4	-163.4	23.7	0	0	0	111.9	H154 K158 N161	H154-D156 PolarHBondContact CE1-O 3.23Å; H154-D156 VanDerWaalsContact ND1-C 3.34Å; H154-D156 PolarHBondContact ND1-N 2.74Å; H154-D156 PolarHBondContact ND1-O 3.29Å; H154-D156 PolarHBondContact O-N 3.2Å; D156-K158 PolarHBondContact O-N 3.46Å; D156-K158 WeakPolarHBondContact OD1-CE 3.41Å; D156-K158 IonicContact OD1-NZ 3.64Å; D156-K158 PolarHBondContact OD1-NZ 2.88Å; D156-K158 WeakPolarHBondContact OD2-CE 3.41Å; D156-K158 IonicContact OD2-NZ 2.95Å; D156-K158 PolarHBondContact OD2-NZ 3.4Å; D156-N161 PolarHBondContact O-ND2 2.92Å; D156-N161 PolarHBondContact OD2-ND2 2.84Å
157	V	95.1	Very high	92.6	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	23%	0.225	C	C	.	.			trans	-74.2	117.7	175.8	-178.5	0	0	0	0	109.2	L144 H154 D213 L217 T220	L144-V157 HydrophobicContact CD2-CG2 4.02Å; H154-V157 HydrophobicContact CB-CG2 3.79Å; H154-V157 PolarHBondContact ND1-N 2.69Å; V157-D213 HydrophobicContact CG2-CB 4.09Å; V157-L217 HydrophobicContact CG1-CD1 4.38Å; V157-T220 PolarHBondContact O-OG1 2.92Å
158	K	95.7	Very high	92.5	Very high	49 Å²	49	46.8 Å²	46.8	21%	0.213	23%	0.225	C	C	.	.	S	Bend	trans	-160.8	163.5	177.1	61.4	-169.4	177.6	-144.7	0	110.2	D156 G160 N161 I162 W197 T220	D156-K158 PolarHBondContact O-N 3.46Å; D156-K158 WeakPolarHBondContact OD1-CE 3.41Å; D156-K158 IonicContact OD1-NZ 3.64Å; D156-K158 PolarHBondContact OD1-NZ 2.88Å; D156-K158 WeakPolarHBondContact OD2-CE 3.41Å; D156-K158 IonicContact OD2-NZ 2.95Å; D156-K158 PolarHBondContact OD2-NZ 3.4Å; K158-G160 PolarHBondContact O-N 3.45Å; K158-G160 VanDerWaalsContact O-N 3.1Å; K158-N161 WeakPolarHBondContact CE-ND2 3.23Å; K158-N161 WeakPolarHBondContact CE-OD1 3.47Å; K158-N161 HydrophobicContact CG-CB 4.14Å; K158-N161 PolarHBondContact O-N 3.4Å; K158-I162 PolarHBondContact O-N 3.24Å; K158-W197 HydrophobicContact CB-CD2 3.93Å; K158-W197 HydrophobicContact CB-CG 4.05Å; K158-W197 HydrophobicContact CB-CZ2 4.1Å; K158-T220 WeakPolarHBondContact CA-OG1 3.45Å
159	A	97.2	Very high	92.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-59.9	-27.6	-178	0	0	0	0	0	113.2	V117 S118 M121 N161 T220 E223	V117-A159 HydrophobicContact CB-CB 4.06Å; V117-A159 WeakPolarHBondContact CB-O 3.41Å; V117-A159 HydrophobicContact CG1-CB 4.09Å; V117-A159 PolarHBondContact N-O 2.88Å; V117-A159 VanDerWaalsContact N-O 3.16Å; S118-A159 PolarHBondContact N-O 2.83Å; S118-A159 VanDerWaalsContact N-O 3.11Å; M121-A159 HydrophobicContact CE-CB 4.16Å; A159-N161 VanDerWaalsContact C-N 3.3Å; A159-N161 PolarHBondContact O-N 3.22Å; A159-T220 HydrophobicContact CB-CG2 4.33Å; A159-E223 HydrophobicContact CB-CG 4.17Å; A159-E223 WeakPolarHBondContact CB-OE1 3.29Å; A159-E223 WeakPolarHBondContact CB-OE2 3.39Å; A159-E223 PolarHBondContact N-OE2 3.39Å
160	G	93.7	Very high	92.8	Very high	26 Å²	26	45.5 Å²	45.5	27%	0.268	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-68.1	-23.6	174.8	0	0	0	0	0	114.8	S116 K158	S116-G160 VanDerWaalsContact CB-O 3.22Å; S116-G160 WeakPolarHBondContact CB-O 3.06Å; K158-G160 PolarHBondContact O-N 3.45Å; K158-G160 VanDerWaalsContact O-N 3.1Å
161	N	94.5	Very high	93.1	Very high	11 Å²	11	40 Å²	40	6%	0.059	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-107.6	9.4	-177.2	-69.2	6.6	0	0	0	112.6	D156 K158 A159 A173	D156-N161 PolarHBondContact O-ND2 2.92Å; D156-N161 PolarHBondContact OD2-ND2 2.84Å; K158-N161 WeakPolarHBondContact CE-ND2 3.23Å; K158-N161 WeakPolarHBondContact CE-OD1 3.47Å; K158-N161 HydrophobicContact CG-CB 4.14Å; K158-N161 PolarHBondContact O-N 3.4Å; A159-N161 VanDerWaalsContact C-N 3.3Å; A159-N161 PolarHBondContact O-N 3.22Å; N161-A173 PolarHBondContact O-N 3.18Å
162	I	97.6	Very high	93.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	109.8	171.7	-61.7	161.4	0	0	0	106.8	S116 V117 I136 V140 K158 A170 L172 T220	S116-I162 CarbonylContact C-O 3.54Å; S116-I162 VanDerWaalsContact CA-O 3.23Å; S116-I162 WeakPolarHBondContact CA-O 3.22Å; V117-I162 HydrophobicContact CG2-CB 3.94Å; V117-I162 HydrophobicContact CG2-CG2 3.69Å; V117-I162 PolarHBondContact N-O 3.22Å; I136-I162 HydrophobicContact CG2-CG2 3.97Å; V140-I162 HydrophobicContact CG2-CD1 3.79Å; V140-I162 HydrophobicContact CG2-CG1 3.91Å; V140-I162 HydrophobicContact CG2-CG2 3.74Å; K158-I162 PolarHBondContact O-N 3.24Å; I162-A170 HydrophobicContact CG2-CB 3.88Å; I162-L172 HydrophobicContact CG1-CD2 4.47Å; I162-T220 HydrophobicContact CD1-CG2 3.7Å
163	L	96.9	Very high	93.6	Very high	35 Å²	35	27.7 Å²	27.7	18%	0.183	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	145.6	-179.4	-55.4	-171.9	0	0	0	111.5	V93 C112 G115 A170 K171 A173	V93-L163 HydrophobicContact CG2-CD1 3.96Å; V93-L163 HydrophobicContact CG2-CG 4.48Å; C112-L163 HydrophobicContact CB-CB 3.52Å; C112-L163 HydrophobicContact CB-CD1 4.04Å; C112-L163 HydrophobicContact CB-CG 4.4Å; G115-L163 WeakPolarHBondContact O-CA 3.3Å; L163-A170 CarbonylContact O-C 3.36Å; L163-A170 WeakPolarHBondContact O-CA 3.48Å; L163-K171 PolarHBondContact N-O 3.06Å; L163-K171 PolarHBondContact O-N 3.23Å; L163-A173 HydrophobicContact CD1-CB 3.76Å; L163-A173 HydrophobicContact CG-CB 3.7Å
164	L	96.1	Very high	93.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.3	178.4	-71.2	169.2	0	0	0	110.4	C112 A114 G115 V117 L120 I136 R169 A170 L297 I301	C112-L164 CarbonylContact C-O 3.57Å; C112-L164 VanDerWaalsContact C-O 3.26Å; C112-L164 WeakPolarHBondContact CB-O 3.48Å; A114-L164 HydrophobicContact CB-CB 3.8Å; A114-L164 WeakPolarHBondContact CB-O 3.42Å; A114-L164 PolarHBondContact N-O 3.39Å; G115-L164 PolarHBondContact O-N 2.64Å; V117-L164 HydrophobicContact CG2-CD1 3.98Å; V117-L164 HydrophobicContact CG2-CG 4.17Å; L120-L164 HydrophobicContact CD2-CD1 3.82Å; I136-L164 HydrophobicContact CG1-CD2 4.34Å; L164-R169 WeakPolarHBondContact CA-O 3.44Å; L164-A170 HydrophobicContact CD2-CB 3.87Å; L164-L297 HydrophobicContact CD1-CD1 4.19Å; L164-L297 HydrophobicContact CD2-CD2 4.14Å; L164-I301 HydrophobicContact CB-CD1 4.33Å; L164-I301 HydrophobicContact CD1-CD1 4.39Å; L164-I301 HydrophobicContact CD1-CG1 4.45Å
165	N	90.9	Very high	92.7	Very high	16 Å²	16	29.1 Å²	29.1	9%	0.086	15%	0.147	C	C	.	.			trans	-83.8	174.8	167.6	78.7	-0.6	0	0	0	110.9	E167 A168 R169	N165-E167 PolarHBondContact O-N 3.36Å; N165-E167 VanDerWaalsContact O-N 3.17Å; N165-E167 WeakPolarHBondContact OD1-CA 3.33Å; N165-E167 WeakPolarHBondContact OD1-CB 3.45Å; N165-E167 PolarHBondContact OD1-N 3.43Å; N165-A168 PolarHBondContact O-N 3.02Å; N165-A168 PolarHBondContact OD1-N 3.28Å; N165-R169 PolarHBondContact N-O 3.46Å; N165-R169 VanDerWaalsContact N-O 3.12Å; N165-R169 WeakPolarHBondContact OD1-CB 3.47Å; N165-R169 PolarHBondContact OD1-N 3.05Å
166	T	88.9	Confident	91.4	Very high	77 Å²	77	26 Å²	26	47%	0.472	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-9	179.9	50.6	0	0	0	0	114	L305	T166-L305 HydrophobicContact CG2-CD1 4.31Å
167	E	89.1	Confident	89.7	Confident	105 Å²	105	24.3 Å²	24.3	49%	0.491	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	14.3	-180	-60.7	168.9	179.8	0	0	111.8	N165 R169	N165-E167 PolarHBondContact O-N 3.36Å; N165-E167 VanDerWaalsContact O-N 3.17Å; N165-E167 WeakPolarHBondContact OD1-CA 3.33Å; N165-E167 WeakPolarHBondContact OD1-CB 3.45Å; N165-E167 PolarHBondContact OD1-N 3.43Å; E167-R169 VanDerWaalsContact C-N 3.31Å; E167-R169 HydrophobicContact CB-CG 4.46Å; E167-R169 PolarHBondContact O-N 3.3Å
168	A	93.2	Very high	87.3	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.141	C	C	.	.	S	Bend	trans	60.1	35.2	-178.7	0	0	0	0	0	114.3	N165 L297 I298 I301	N165-A168 PolarHBondContact O-N 3.02Å; N165-A168 PolarHBondContact OD1-N 3.28Å; A168-L297 HydrophobicContact CB-CB 4.3Å; A168-L297 HydrophobicContact CB-CD2 4.01Å; A168-L297 HydrophobicContact CB-CG 3.96Å; A168-I298 HydrophobicContact CB-CG1 3.56Å; A168-I301 HydrophobicContact CB-CD1 3.7Å
169	R	94.6	Very high	84.7	Confident	84 Å²	84	24.8 Å²	24.8	32%	0.317	15%	0.146	S	C	.	.			trans	-98.2	128.4	170.6	-57.5	-55.1	-55.5	-145.4	-11.6	110.7	D139 L164 N165 E167	D139-R169 IonicContact OD1-CZ 2.61Å; D139-R169 IonicContact OD1-NE 3.61Å; D139-R169 IonicContact OD1-NH2 2.87Å; D139-R169 PolarHBondContact OD1-NH2 2.8Å; D139-R169 WeakPolarHBondContact OD2-CA 3.47Å; D139-R169 IonicContact OD2-CZ 2.79Å; D139-R169 IonicContact OD2-NE 2.83Å; D139-R169 PolarHBondContact OD2-NE 3.18Å; D139-R169 IonicContact OD2-NH2 3.43Å; D139-R169 PolarHBondContact OD2-NH2 3.3Å; L164-R169 WeakPolarHBondContact CA-O 3.44Å; N165-R169 PolarHBondContact N-O 3.46Å; N165-R169 VanDerWaalsContact N-O 3.12Å; N165-R169 WeakPolarHBondContact OD1-CB 3.47Å; N165-R169 PolarHBondContact OD1-N 3.05Å; E167-R169 VanDerWaalsContact C-N 3.31Å; E167-R169 HydrophobicContact CB-CG 4.46Å; E167-R169 PolarHBondContact O-N 3.3Å
170	A	97.5	Very high	82.2	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.008	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	138.8	175.4	0	0	0	0	0	111	I136 D139 V140 I162 L163 L164	I136-A170 HydrophobicContact CG2-CB 4.2Å; D139-A170 HydrophobicContact CB-CB 3.72Å; D139-A170 PolarHBondContact OD2-N 3.49Å; V140-A170 HydrophobicContact CG2-CB 4.38Å; I162-A170 HydrophobicContact CG2-CB 3.88Å; L163-A170 CarbonylContact O-C 3.36Å; L163-A170 WeakPolarHBondContact O-CA 3.48Å; L164-A170 HydrophobicContact CD2-CB 3.87Å
171	K	97.6	Very high	79.8	Confident	10 Å²	10	28.3 Å²	28.3	4%	0.043	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	133.7	-178.7	-72.4	162.5	176.6	-80.9	0	110	P90 F91 V93 E110 L163	P90-K171 WeakPolarHBondContact O-CE 3.35Å; P90-K171 WeakPolarHBondContact O-CG 3.28Å; P90-K171 PolarHBondContact O-NZ 3.07Å; F91-K171 WeakPolarHBondContact O-CA 3.19Å; V93-K171 HydrophobicContact CG2-CB 3.88Å; E110-K171 VanDerWaalsContact CD-CE 3.49Å; E110-K171 WeakPolarHBondContact OE1-CE 3.44Å; E110-K171 IonicContact OE1-NZ 2.83Å; E110-K171 PolarHBondContact OE1-NZ 3.12Å; E110-K171 WeakPolarHBondContact OE2-CE 2.91Å; E110-K171 IonicContact OE2-NZ 3.25Å; E110-K171 PolarHBondContact OE2-NZ 2.86Å; L163-K171 PolarHBondContact N-O 3.06Å; L163-K171 PolarHBondContact O-N 3.23Å
172	L	96.3	Very high	77.2	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	132.2	169.8	-70.4	170.6	0	0	0	110.2	F91 V93 V140 L144 L147 I162	F91-L172 PolarHBondContact O-N 3Å; V93-L172 WeakPolarHBondContact CG2-O 3.36Å; V93-L172 PolarHBondContact N-O 3.38Å; V140-L172 HydrophobicContact CG1-CD2 4.02Å; L144-L172 HydrophobicContact CD2-CD1 3.82Å; L144-L172 HydrophobicContact CG-CD1 4.06Å; L147-L172 HydrophobicContact CD1-CD1 3.67Å; I162-L172 HydrophobicContact CG1-CD2 4.47Å
173	A	92.3	Very high	74.5	Confident	5 Å²	5	34.5 Å²	34.5	4%	0.041	19%	0.192	C	C	.	.			trans	-131.6	168.3	178.9	0	0	0	0	0	111.1	V93 H154 N161 L163	V93-A173 HydrophobicContact CB-CB 4.4Å; V93-A173 HydrophobicContact CG2-CB 3.7Å; H154-A173 PolarHBondContact CE1-O 2.91Å; H154-A173 VanDerWaalsContact CE1-O 3.28Å; H154-A173 PolarHBondContact NE2-O 3.45Å; H154-A173 VanDerWaalsContact NE2-O 3.09Å; N161-A173 PolarHBondContact O-N 3.18Å; L163-A173 HydrophobicContact CD1-CB 3.76Å; L163-A173 HydrophobicContact CG-CB 3.7Å
174	D	82.7	Confident	71.6	Confident	57 Å²	57	34.4 Å²	34.4	31%	0.305	19%	0.193	S	C	.	.	S	Bend	trans	48.4	77.3	175	-68.2	-39.5	0	0	0	113.2	K66 G176	K66-D174 IonicContact NZ-OD1 3.28Å; K66-D174 PolarHBondContact NZ-OD1 3.13Å; D174-G176 PolarHBondContact O-N 3.4Å
175	F	76.4	Confident	68.8	Low	8 Å²	8	40.4 Å²	40.4	4%	0.035	22%	0.222	C	C	.	.			trans	-63.4	125.9	178.7	-70.8	-87.7	0	0	0	110.1	E80 I83 M84 V92 L147 H154 V177	E80-F175 HydrophobicContact CG-CB 4.24Å; I83-F175 HydrophobicContact CG2-CB 4.49Å; I83-F175 HydrophobicContact CG2-CD1 3.86Å; I83-F175 HydrophobicContact CG2-CD2 4.2Å; I83-F175 HydrophobicContact CG2-CE1 4.09Å; I83-F175 HydrophobicContact CG2-CE2 4.42Å; I83-F175 HydrophobicContact CG2-CG 3.91Å; I83-F175 HydrophobicContact CG2-CZ 4.36Å; M84-F175 HydrophobicContact CG-CD2 3.53Å; M84-F175 HydrophobicContact CG-CE2 3.7Å; V92-F175 HydrophobicContact CG1-CE2 3.86Å; V92-F175 HydrophobicContact CG1-CZ 3.56Å; L147-F175 HydrophobicContact CD1-CE1 3.65Å; L147-F175 HydrophobicContact CD1-CZ 4.32Å; L147-F175 HydrophobicContact CD2-CE1 3.57Å; L147-F175 HydrophobicContact CD2-CZ 3.87Å; L147-F175 HydrophobicContact CG-CE1 4.26Å; H154-F175 AromaticContact CD2-CD1 3.95Å; H154-F175 AromaticContact CD2-CE1 4Å; F175-V177 PolarHBondContact O-N 3.05Å
176	G	63.1	Low	66.4	Low	9 Å²	9	43.9 Å²	43.9	9%	0.093	25%	0.253	C	S	.	.			trans	-70.5	67.1	-178.9	0	0	0	0	0	113.2	H154 R155 D174 A178	H154-G176 WeakPolarHBondContact O-CA 3.26Å; H154-G176 PolarHBondContact O-N 3.24Å; R155-G176 WeakPolarHBondContact CB-O 3.13Å; R155-G176 WeakPolarHBondContact CD-O 3.5Å; D174-G176 PolarHBondContact O-N 3.4Å; G176-A178 PolarHBondContact O-N 3.4Å
177	V	54.2	Low	64.1	Low	15 Å²	15	44.7 Å²	44.7	9%	0.091	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-24.8	169.6	-71.3	0	0	0	0	111.8	E76 K79 E80 I83 F175 G179	E76-V177 HydrophobicContact CB-CG2 4.27Å; K79-V177 HydrophobicContact CB-CG1 4.32Å; K79-V177 HydrophobicContact CD-CB 4.48Å; K79-V177 HydrophobicContact CD-CG1 4.18Å; K79-V177 HydrophobicContact CG-CG1 4.02Å; E80-V177 HydrophobicContact CB-CG1 4.09Å; E80-V177 HydrophobicContact CB-CG2 3.89Å; E80-V177 HydrophobicContact CG-CG2 4.37Å; I83-V177 HydrophobicContact CD1-CG1 3.8Å; F175-V177 PolarHBondContact O-N 3.05Å; V177-G179 VanDerWaalsContact C-N 3.35Å; V177-G179 PolarHBondContact O-N 3.42Å
178	A	45	Very low	61.7	Low	30 Å²	30	51 Å²	51	25%	0.248	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-5.1	-175.7	0	0	0	0	0	116.3	Y48 G176 V349	Y48-A178 WeakPolarHBondContact OH-CB 3.31Å; G176-A178 PolarHBondContact O-N 3.4Å; A178-V349 HydrophobicContact CB-CB 4.12Å; A178-V349 HydrophobicContact CB-CG1 3.55Å; A178-V349 HydrophobicContact CB-CG2 3.39Å
179	G	40.2	Very low	59	Low	30 Å²	30	58.7 Å²	58.7	31%	0.309	31%	0.311	S	S	.	.			trans	-96.1	15.8	-164.4	0	0	0	0	0	117.7	V177 L181	V177-G179 VanDerWaalsContact C-N 3.35Å; V177-G179 PolarHBondContact O-N 3.42Å; G179-L181 PolarHBondContact O-N 3.24Å
180	Q	46.4	Very low	56.4	Low	83 Å²	83	57.8 Å²	57.8	39%	0.388	31%	0.314	S	S	.	.			trans	-77.6	104.4	177.2	-80.5	-178.5	-13.8	0	0	110.7	T182	Q180-T182 PolarHBondContact O-N 3.04Å; Q180-T182 VanDerWaalsContact O-N 3.13Å
181	L	41.6	Very low	53.8	Low	16 Å²	16	62.3 Å²	62.3	8%	0.084	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-56.4	-26.1	178.7	-88.1	160.5	0	0	0	114.8	G179 D183 T184 M198 V202 E205	G179-L181 PolarHBondContact O-N 3.24Å; L181-D183 PolarHBondContact O-N 3.4Å; L181-T184 WeakPolarHBondContact O-CB 3.32Å; L181-T184 PolarHBondContact O-N 2.92Å; L181-T184 PolarHBondContact O-OG1 3.43Å; L181-M198 HydrophobicContact CD1-CE 3.32Å; L181-M198 HydrophobicContact CD2-CE 3.97Å; L181-M198 HydrophobicContact CG-CE 3.58Å; L181-V202 HydrophobicContact CD1-CG1 3.76Å; L181-V202 WeakPolarHBondContact CD1-O 3.4Å; L181-E205 VanDerWaalsContact C-OE1 3.25Å; L181-E205 HydrophobicContact CB-CG 3.86Å
182	T	39.6	Very low	51.6	Low	80 Å²	80	62.9 Å²	62.9	49%	0.491	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-52.7	-26.3	-174	50.6	0	0	0	0	113.7	Q180	Q180-T182 PolarHBondContact O-N 3.04Å; Q180-T182 VanDerWaalsContact O-N 3.13Å
183	D	41.6	Very low	49.7	Very low	62 Å²	62	64.4 Å²	64.4	33%	0.332	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-91.4	-12.8	178.2	-69.3	-18.2	0	0	0	114	L181	L181-D183 PolarHBondContact O-N 3.4Å
184	T	37.1	Very low	48.8	Very low	33 Å²	33	66.3 Å²	66.3	20%	0.202	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-33.6	-167.8	-34.7	0	0	0	0	112.9	L181 I192	L181-T184 WeakPolarHBondContact O-CB 3.32Å; L181-T184 PolarHBondContact O-N 2.92Å; L181-T184 PolarHBondContact O-OG1 3.43Å; T184-I192 HydrophobicContact CG2-CB 4.44Å; T184-I192 HydrophobicContact CG2-CG1 3.97Å; T184-I192 HydrophobicContact CG2-CG2 4.43Å
185	M	37.2	Very low	49.1	Very low	126 Å²	126	63.6 Å²	63.6	62%	0.621	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-27.4	177.4	-70.1	-154.7	91.6	0	0	113.1
186	A	40.2	Very low	50	Low	89 Å²	89	64 Å²	64	74%	0.736	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-34.6	175.6	0	0	0	0	0	112.1	R188	A186-R188 PolarHBondContact O-N 3.49Å
187	K	39.7	Very low	51.6	Low	93 Å²	93	65 Å²	65	40%	0.404	36%	0.36	S	S	.	.	S	Bend	trans	-87.7	81.6	172.9	-67.5	175.8	-174.8	169.4	0	109.1	N189 T190 N350 G351	K187-N189 PolarHBondContact O-N 3.48Å; K187-T190 HydrophobicContact CB-CG2 4.07Å; K187-T190 WeakPolarHBondContact CB-OG1 3.45Å; K187-T190 HydrophobicContact CD-CG2 4.12Å; K187-T190 PolarHBondContact O-N 2.76Å; K187-T190 VanDerWaalsContact O-N 3.11Å; K187-T190 PolarHBondContact O-OG1 3.1Å; K187-N350 PolarHBondContact NZ-O 3.26Å; K187-G351 PolarHBondContact NZ-O 3.02Å
188	R	38.9	Very low	53.4	Low	237 Å²	237	66 Å²	66	89%	0.894	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	-4.1	179.4	-77.1	-173.2	-169.8	168.2	4.6	117	A186	A186-R188 PolarHBondContact O-N 3.49Å
189	N	36.7	Very low	55.8	Low	163 Å²	163	64.7 Å²	64.7	87%	0.872	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.2	2.3	-175.7	-66.7	-29	0	0	0	115.1	K187	K187-N189 PolarHBondContact O-N 3.48Å
190	T	40.7	Very low	58.4	Low	64 Å²	64	63.4 Å²	63.4	39%	0.393	34%	0.34	S	S	.	.	S	Bend	trans	-81.7	129.1	175.8	36.2	0	0	0	0	110.9	K187 I192	K187-T190 HydrophobicContact CB-CG2 4.07Å; K187-T190 WeakPolarHBondContact CB-OG1 3.45Å; K187-T190 HydrophobicContact CD-CG2 4.12Å; K187-T190 PolarHBondContact O-N 2.76Å; K187-T190 VanDerWaalsContact O-N 3.11Å; K187-T190 PolarHBondContact O-OG1 3.1Å; T190-I192 PolarHBondContact O-N 3.38Å
191	V	42.4	Very low	60.6	Low	96 Å²	96	59.8 Å²	59.8	58%	0.582	32%	0.323	S	S	*	.			trans	-56.2	108.2	172.4	175.8	0	0	0	0	106.9	G193	V191-G193 PolarHBondContact O-N 3.1Å
192	I	51.7	Low	62.9	Low	23 Å²	23	59.7 Å²	59.7	12%	0.118	32%	0.323	C	S	.	.			trans	-59.7	129.4	176.2	-52.3	-178.8	0	0	0	106.7	T184 T190 M237 I240	T184-I192 HydrophobicContact CG2-CB 4.44Å; T184-I192 HydrophobicContact CG2-CG1 3.97Å; T184-I192 HydrophobicContact CG2-CG2 4.43Å; T190-I192 PolarHBondContact O-N 3.38Å; I192-M237 HydrophobicContact CD1-CE 4.1Å; I192-M237 HydrophobicContact CD1-SD 3.41Å; I192-M237 WeakPolarHBondContact CD1-SD 3.44Å; I192-M237 HydrophobicContact CG1-SD 3.86Å; I192-I240 HydrophobicContact CB-CD1 3.57Å; I192-I240 HydrophobicContact CD1-CD1 3.32Å; I192-I240 HydrophobicContact CG1-CD1 3.97Å; I192-I240 HydrophobicContact CG2-CD1 3.3Å; I192-I240 HydrophobicContact CG2-CG1 4.4Å
193	G	56.9	Low	65.2	Low	33 Å²	33	56.7 Å²	56.7	34%	0.34	30%	0.303	S	S	.	.			trans	-51.5	163.3	177.3	0	0	0	0	0	111.3	V191 P195	V191-G193 PolarHBondContact O-N 3.1Å; G193-P195 WeakPolarHBondContact O-CD 3.27Å
194	T	72.3	Confident	67.3	Low	46 Å²	46	58.6 Å²	58.6	28%	0.282	31%	0.31	S	S	.	.			trans	-61.9	102.4	-172.7	-52.9	0	0	0	0	111.1	F196 W197	T194-F196 HydrophobicContact CG2-CD2 3.13Å; T194-F196 HydrophobicContact CG2-CE2 3.24Å; T194-F196 HydrophobicContact CG2-CG 4.11Å; T194-F196 HydrophobicContact CG2-CZ 4.28Å; T194-F196 PolarHBondContact O-N 2.97Å; T194-W197 HydrophobicContact CG2-CE3 4.38Å; T194-W197 HydrophobicContact CG2-CZ3 3.6Å
195	P	90.2	Very high	69.3	Low	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-84.2	-0.8	-159.3	35.1	-36.8	0	0	0	113.2	G193 W197 M198 P236 A239 I240 I243	G193-P195 WeakPolarHBondContact O-CD 3.27Å; P195-W197 VanDerWaalsContact C-N 3.26Å; P195-W197 PolarHBondContact O-N 3.39Å; P195-M198 VanDerWaalsContact CA-SD 3.56Å; P195-M198 HydrophobicContact CB-SD 3.9Å; P195-M198 VanDerWaalsContact O-CB 3.3Å; P195-M198 WeakPolarHBondContact O-CB 3.23Å; P195-M198 WeakPolarHBondContact O-CG 3.38Å; P195-M198 PolarHBondContact O-N 3.05Å; P195-P236 HydrophobicContact CG-CB 4.21Å; P195-A239 HydrophobicContact CG-CB 3.94Å; P195-I240 HydrophobicContact CB-CD1 4.29Å; P195-I240 HydrophobicContact CB-CG1 3.64Å; P195-I240 HydrophobicContact CG-CD1 4.36Å; P195-I240 HydrophobicContact CG-CG1 3.85Å; P195-I243 HydrophobicContact CB-CD1 4.46Å; P195-I243 VanDerWaalsContact O-CD1 3.25Å; P195-I243 WeakPolarHBondContact O-CD1 3.33Å
196	F	95.2	Very high	70.9	Confident	15 Å²	15	60.6 Å²	60.6	7%	0.066	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-66.5	-26.8	-161.7	-50.6	-49.9	0	0	0	113.5	T194 P229 Y231 I234 P236 A239	T194-F196 HydrophobicContact CG2-CD2 3.13Å; T194-F196 HydrophobicContact CG2-CE2 3.24Å; T194-F196 HydrophobicContact CG2-CG 4.11Å; T194-F196 HydrophobicContact CG2-CZ 4.28Å; T194-F196 PolarHBondContact O-N 2.97Å; F196-P229 HydrophobicContact CB-CB 4.04Å; F196-P229 HydrophobicContact CB-CG 3.85Å; F196-P229 HydrophobicContact CD2-CG 4.22Å; F196-P229 HydrophobicContact CG-CG 4.36Å; F196-Y231 VanDerWaalsContact CE1-O 3.31Å; F196-Y231 WeakPolarHBondContact CE1-O 3.28Å; F196-I234 WeakPolarHBondContact CZ-O 3.39Å; F196-P236 HydrophobicContact CZ-CG 4.3Å; F196-A239 HydrophobicContact CD1-CB 3.81Å; F196-A239 HydrophobicContact CE1-CB 3.58Å
197	W	95.9	Very high	72.4	Confident	31 Å²	31	58.6 Å²	58.6	12%	0.117	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-93.6	-5.6	175.1	-61.6	-100.6	0	0	0	113.5	K158 T194 P195 S216 I219 E223 P229	K158-W197 HydrophobicContact CB-CD2 3.93Å; K158-W197 HydrophobicContact CB-CG 4.05Å; K158-W197 HydrophobicContact CB-CZ2 4.1Å; T194-W197 HydrophobicContact CG2-CE3 4.38Å; T194-W197 HydrophobicContact CG2-CZ3 3.6Å; P195-W197 VanDerWaalsContact C-N 3.26Å; P195-W197 PolarHBondContact O-N 3.39Å; W197-S216 WeakPolarHBondContact O-CA 3.37Å; W197-S216 WeakPolarHBondContact O-CB 3.28Å; W197-S216 PolarHBondContact O-OG 3.49Å; W197-I219 HydrophobicContact CB-CG2 4.37Å; W197-I219 VanDerWaalsContact CD1-CG2 3.48Å; W197-I219 HydrophobicContact CG-CB 4.44Å; W197-I219 HydrophobicContact CG-CG2 3.87Å; W197-E223 HydrophobicContact CZ2-CG 4.48Å; W197-E223 WeakPolarHBondContact CZ2-OE1 3.39Å; W197-E223 WeakPolarHBondContact CZ2-OE2 3.2Å; W197-E223 PolarHBondContact NE1-OE2 2.86Å; W197-P229 HydrophobicContact CH2-CG 3.7Å; W197-P229 HydrophobicContact CZ2-CB 3.99Å; W197-P229 HydrophobicContact CZ2-CG 3.52Å; W197-P229 HydrophobicContact CZ3-CG 4.32Å
198	M	93.1	Very high	74.2	Confident	37 Å²	37	57 Å²	57	18%	0.182	30%	0.299	C	S	.	.			trans	-74.8	137.7	-174	-59.1	178.4	75.5	0	0	110.9	L181 P195 V202 I203 W215	L181-M198 HydrophobicContact CD1-CE 3.32Å; L181-M198 HydrophobicContact CD2-CE 3.97Å; L181-M198 HydrophobicContact CG-CE 3.58Å; P195-M198 VanDerWaalsContact CA-SD 3.56Å; P195-M198 HydrophobicContact CB-SD 3.9Å; P195-M198 VanDerWaalsContact O-CB 3.3Å; P195-M198 WeakPolarHBondContact O-CB 3.23Å; P195-M198 WeakPolarHBondContact O-CG 3.38Å; P195-M198 PolarHBondContact O-N 3.05Å; M198-V202 HydrophobicContact CE-CG1 3.63Å; M198-I203 HydrophobicContact CB-CD1 4.08Å; M198-I203 HydrophobicContact CB-CG1 3.9Å; M198-W215 PolarHBondContact O-NE1 3.39Å
199	A	94.3	Very high	76.2	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.008	27%	0.272	C	S	.	.			trans	-70.9	152.7	175.7	0	0	0	0	0	111.7	E201 V202 I203 A212 W215	A199-E201 VanDerWaalsContact C-N 3.3Å; A199-E201 VanDerWaalsContact CB-CD 3.42Å; A199-E201 WeakPolarHBondContact CB-OE1 3.48Å; A199-E201 WeakPolarHBondContact CB-OE2 3.3Å; A199-E201 PolarHBondContact O-N 3.34Å; A199-V202 HydrophobicContact CB-CB 4.45Å; A199-V202 HydrophobicContact CB-CG2 3.9Å; A199-V202 WeakPolarHBondContact O-CB 3.44Å; A199-V202 PolarHBondContact O-N 3.44Å; A199-V202 VanDerWaalsContact O-N 3.14Å; A199-I203 PolarHBondContact O-N 2.81Å; A199-I203 VanDerWaalsContact O-N 3.09Å; A199-A212 HydrophobicContact CB-CB 4.36Å; A199-W215 VanDerWaalsContact CA-CD1 3.42Å; A199-W215 HydrophobicContact CB-CB 3.66Å; A199-W215 HydrophobicContact CB-CD2 4.29Å; A199-W215 HydrophobicContact CB-CG 3.66Å
200	P	94.3	Very high	78.8	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.019	24%	0.243	C	C	.	.	H	α-helix	trans	-54.2	-44.3	178.8	-27.4	35.8	0	0	0	113.3	V202 I203 Q204 W215 I243 P244 K271	P200-V202 VanDerWaalsContact C-N 3.3Å; P200-V202 PolarHBondContact O-N 3.1Å; P200-I203 PolarHBondContact O-N 3.36Å; P200-Q204 WeakPolarHBondContact O-CB 3.42Å; P200-Q204 VanDerWaalsContact O-CG 3.29Å; P200-Q204 WeakPolarHBondContact O-CG 3.35Å; P200-Q204 PolarHBondContact O-N 3.42Å; P200-W215 HydrophobicContact CG-CE3 4.25Å; P200-W215 HydrophobicContact CG-CH2 3.67Å; P200-W215 HydrophobicContact CG-CZ2 3.94Å; P200-W215 HydrophobicContact CG-CZ3 3.83Å; P200-I243 HydrophobicContact CG-CG2 4.22Å; P200-P244 HydrophobicContact CB-CB 4.39Å; P200-K271 HydrophobicContact CG-CB 4.41Å; P200-K271 HydrophobicContact CG-CG 4.33Å
201	E	92.4	Very high	81.4	Confident	8 Å²	8	41.1 Å²	41.1	4%	0.037	23%	0.231	C	C	.	.	H	α-helix	trans	-67.6	-30.8	-179.3	68.7	-79.8	-173.5	0	0	112.8	A199 E205 I206 P273 R276	A199-E201 VanDerWaalsContact C-N 3.3Å; A199-E201 VanDerWaalsContact CB-CD 3.42Å; A199-E201 WeakPolarHBondContact CB-OE1 3.48Å; A199-E201 WeakPolarHBondContact CB-OE2 3.3Å; A199-E201 PolarHBondContact O-N 3.34Å; E201-E205 PolarHBondContact O-N 2.83Å; E201-I206 PolarHBondContact O-N 3.23Å; E201-P273 HydrophobicContact CB-CG 4.33Å; E201-P273 HydrophobicContact CG-CB 4.32Å; E201-P273 HydrophobicContact CG-CG 4.14Å; E201-R276 IonicContact OE1-CZ 2.85Å; E201-R276 IonicContact OE1-NH1 2.83Å; E201-R276 PolarHBondContact OE1-NH1 3.05Å; E201-R276 IonicContact OE1-NH2 3.75Å; E201-R276 PolarHBondContact OE1-NH2 3.05Å; E201-R276 IonicContact OE2-CZ 2.65Å; E201-R276 IonicContact OE2-NH1 2.7Å; E201-R276 IonicContact OE2-NH2 3.86Å; E201-R276 PolarHBondContact OE2-NH2 3.34Å
202	V	90	Very high	83.8	Confident	14 Å²	14	36.8 Å²	36.8	9%	0.085	21%	0.205	C	C	.	.	H	α-helix	trans	-64.8	-54.9	172.9	-179.8	0	0	0	0	107.6	L181 M198 A199 P200 Q204 E205 Y208 A212	L181-V202 HydrophobicContact CD1-CG1 3.76Å; L181-V202 WeakPolarHBondContact CD1-O 3.4Å; M198-V202 HydrophobicContact CE-CG1 3.63Å; A199-V202 HydrophobicContact CB-CB 4.45Å; A199-V202 HydrophobicContact CB-CG2 3.9Å; A199-V202 WeakPolarHBondContact O-CB 3.44Å; A199-V202 PolarHBondContact O-N 3.44Å; A199-V202 VanDerWaalsContact O-N 3.14Å; P200-V202 VanDerWaalsContact C-N 3.3Å; P200-V202 PolarHBondContact O-N 3.1Å; V202-Q204 VanDerWaalsContact C-N 3.28Å; V202-Q204 PolarHBondContact O-N 2.99Å; V202-E205 PolarHBondContact O-N 2.79Å; V202-Y208 HydrophobicContact CB-CD1 4.47Å; V202-Y208 HydrophobicContact CG1-CD1 4.32Å; V202-Y208 HydrophobicContact CG1-CE1 4.45Å; V202-Y208 HydrophobicContact CG2-CD1 4.02Å; V202-Y208 HydrophobicContact CG2-CD2 4.22Å; V202-Y208 HydrophobicContact CG2-CG 3.73Å; V202-A212 HydrophobicContact CG2-CB 3.61Å
203	I	88.3	Confident	86	Confident	16 Å²	16	35.7 Å²	35.7	8%	0.082	20%	0.199	C	C	.	.	H	α-helix	trans	-55.6	-39.5	178.8	-67.9	172.1	0	0	0	113.2	M198 A199 P200 E205 I240 I243 P244	M198-I203 HydrophobicContact CB-CD1 4.08Å; M198-I203 HydrophobicContact CB-CG1 3.9Å; A199-I203 PolarHBondContact O-N 2.81Å; A199-I203 VanDerWaalsContact O-N 3.09Å; P200-I203 PolarHBondContact O-N 3.36Å; I203-E205 PolarHBondContact O-N 2.86Å; I203-I240 HydrophobicContact CG2-CG2 3.85Å; I203-I243 HydrophobicContact CD1-CB 3.64Å; I203-I243 HydrophobicContact CD1-CD1 3.63Å; I203-I243 HydrophobicContact CD1-CG1 4.25Å; I203-I243 HydrophobicContact CD1-CG2 3.6Å; I203-P244 HydrophobicContact CB-CG 3.97Å; I203-P244 HydrophobicContact CD1-CG 4.4Å; I203-P244 HydrophobicContact CG2-CG 3.56Å
204	Q	85.6	Confident	87.9	Confident	102 Å²	102	34.1 Å²	34.1	48%	0.477	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-3.6	-178.4	-67.6	175	-47.9	0	0	113.6	P200 V202 I206 P244	P200-Q204 WeakPolarHBondContact O-CB 3.42Å; P200-Q204 VanDerWaalsContact O-CG 3.29Å; P200-Q204 WeakPolarHBondContact O-CG 3.35Å; P200-Q204 PolarHBondContact O-N 3.42Å; V202-Q204 VanDerWaalsContact C-N 3.28Å; V202-Q204 PolarHBondContact O-N 2.99Å; Q204-I206 HydrophobicContact CB-CD1 3.54Å; Q204-I206 HydrophobicContact CB-CG1 3.7Å; Q204-I206 HydrophobicContact CG-CD1 4.34Å; Q204-I206 PolarHBondContact O-N 2.82Å; Q204-P244 HydrophobicContact CG-CB 3.85Å; Q204-P244 HydrophobicContact CG-CG 4.07Å
205	E	79.2	Confident	89.2	Confident	74 Å²	74	32.2 Å²	32.2	35%	0.346	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	29.5	-178.3	-59.4	-179.1	-178.1	0	0	113.6	L181 E201 V202 I203 G207	L181-E205 VanDerWaalsContact C-OE1 3.25Å; L181-E205 HydrophobicContact CB-CG 3.86Å; E201-E205 PolarHBondContact O-N 2.83Å; V202-E205 PolarHBondContact O-N 2.79Å; I203-E205 PolarHBondContact O-N 2.86Å; E205-G207 PolarHBondContact O-N 2.9Å; E205-G207 VanDerWaalsContact O-N 3.08Å
206	I	70.4	Confident	89.5	Confident	127 Å²	127	32.6 Å²	32.6	65%	0.651	17%	0.173	S	C	*	.	S	Bend	trans	-77.3	6.4	-178	-61.2	171	0	0	0	111.4	E201 Q204	E201-I206 PolarHBondContact O-N 3.23Å; Q204-I206 HydrophobicContact CB-CD1 3.54Å; Q204-I206 HydrophobicContact CB-CG1 3.7Å; Q204-I206 HydrophobicContact CG-CD1 4.34Å; Q204-I206 PolarHBondContact O-N 2.82Å
207	G	72	Confident	89.7	Confident	48 Å²	48	31.9 Å²	31.9	50%	0.495	17%	0.17	S	C	.	.			trans	81	150.7	-159	0	0	0	0	0	110	E205	E205-G207 PolarHBondContact O-N 2.9Å; E205-G207 VanDerWaalsContact O-N 3.08Å
208	Y	77.7	Confident	89.8	Confident	59 Å²	59	30.4 Å²	30.4	23%	0.231	16%	0.164	C	C	.	.			trans	-143.5	151	177.1	64.4	-92.5	0	0	0	109.5	I153 R155 V202 A212	I153-Y208 HydrophobicContact CD1-CD2 4.08Å; I153-Y208 HydrophobicContact CD1-CE2 3.93Å; I153-Y208 HydrophobicContact CG2-CE2 4.29Å; R155-Y208 WeakPolarHBondContact CD-OH 3.39Å; R155-Y208 HydrophobicContact CG-CE2 4.17Å; R155-Y208 PolarHBondContact NE-OH 3.09Å; R155-Y208 PolarHBondContact NH1-OH 3.36Å; V202-Y208 HydrophobicContact CB-CD1 4.47Å; V202-Y208 HydrophobicContact CG1-CD1 4.32Å; V202-Y208 HydrophobicContact CG1-CE1 4.45Å; V202-Y208 HydrophobicContact CG2-CD1 4.02Å; V202-Y208 HydrophobicContact CG2-CD2 4.22Å; V202-Y208 HydrophobicContact CG2-CG 3.73Å; Y208-A212 HydrophobicContact CD2-CB 4Å; Y208-A212 HydrophobicContact CG-CB 4.47Å
209	D	82.1	Confident	90.1	Very high	62 Å²	62	28.8 Å²	28.8	33%	0.332	16%	0.157	S	C	.	.			trans	-111.9	-165.5	177	72.6	-4.6	0	0	0	110.5	K211 A212	D209-K211 PolarHBondContact O-N 3.28Å; D209-K211 VanDerWaalsContact OD1-CB 3.26Å; D209-K211 WeakPolarHBondContact OD1-CB 3.48Å; D209-K211 PolarHBondContact OD1-N 3.35Å; D209-A212 WeakPolarHBondContact O-CB 3.31Å; D209-A212 PolarHBondContact O-N 2.9Å
210	C	89.7	Confident	90.3	Very high	38 Å²	38	28.7 Å²	28.7	26%	0.257	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-21.1	177	51	0	0	0	0	114.5	H148 I153 A212 D213	H148-C210 HydrophobicContact CB-CB 4.06Å; H148-C210 PolarHBondContact CE1-O 2.79Å; H148-C210 PolarHBondContact NE2-O 2.65Å; I153-C210 HydrophobicContact CG1-CB 4.48Å; C210-A212 PolarHBondContact O-N 3.32Å; C210-D213 WeakPolarHBondContact O-CB 3.27Å; C210-D213 PolarHBondContact O-N 3.02Å
211	K	95.1	Very high	90.5	Very high	31 Å²	31	28.6 Å²	28.6	14%	0.135	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-13	-178.9	-65.1	176.8	174.8	176	0	112.6	D209 D213 I214 W215 P273 D274 R276	D209-K211 PolarHBondContact O-N 3.28Å; D209-K211 VanDerWaalsContact OD1-CB 3.26Å; D209-K211 WeakPolarHBondContact OD1-CB 3.48Å; D209-K211 PolarHBondContact OD1-N 3.35Å; K211-D213 PolarHBondContact O-N 3.32Å; K211-I214 WeakPolarHBondContact O-CB 3.44Å; K211-I214 PolarHBondContact O-N 3.31Å; K211-W215 PolarHBondContact O-N 3.09Å; K211-P273 WeakPolarHBondContact CD-O 3.47Å; K211-P273 PolarHBondContact NZ-O 3.4Å; K211-D274 PolarHBondContact NZ-O 3.46Å; K211-R276 VanDerWaalsContact C-NH1 3.33Å; K211-R276 HydrophobicContact CD-CB 4.34Å; K211-R276 VanDerWaalsContact CD-O 3.27Å; K211-R276 WeakPolarHBondContact CD-O 3.26Å; K211-R276 WeakPolarHBondContact CE-O 3.47Å; K211-R276 PolarHBondContact NZ-O 2.94Å; K211-R276 WeakPolarHBondContact O-CD 3.28Å; K211-R276 PolarHBondContact O-NH1 3.28Å
212	A	94.6	Very high	90.8	Very high	5 Å²	5	28.2 Å²	28.2	4%	0.041	15%	0.153	C	C	.	.	H	α-helix	trans	-54.1	-40.2	167.2	0	0	0	0	0	111.7	A199 V202 Y208 D209 C210 I214 W215 S216	A199-A212 HydrophobicContact CB-CB 4.36Å; V202-A212 HydrophobicContact CG2-CB 3.61Å; Y208-A212 HydrophobicContact CD2-CB 4Å; Y208-A212 HydrophobicContact CG-CB 4.47Å; D209-A212 WeakPolarHBondContact O-CB 3.31Å; D209-A212 PolarHBondContact O-N 2.9Å; C210-A212 PolarHBondContact O-N 3.32Å; A212-I214 PolarHBondContact O-N 2.76Å; A212-W215 PolarHBondContact O-N 3.28Å; A212-S216 PolarHBondContact O-N 3.08Å; A212-S216 VanDerWaalsContact O-N 3.15Å; A212-S216 PolarHBondContact O-OG 3.3Å
213	D	95.9	Very high	91.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-64.4	-29.6	177	-66.3	-29.4	0	0	0	112.2	L144 H148 I153 H154 R155 V157 C210 K211 S216 L217	L144-D213 HydrophobicContact CD1-CB 4.27Å; L144-D213 HydrophobicContact CD2-CB 3.87Å; H148-D213 IonicContact CD2-OD2 3.99Å; H148-D213 IonicContact CE1-OD2 3.5Å; H148-D213 IonicContact NE2-OD2 3.46Å; H148-D213 PolarHBondContact NE2-OD2 2.92Å; I153-D213 WeakPolarHBondContact CG2-OD2 3.44Å; H154-D213 PolarHBondContact N-OD1 2.85Å; H154-D213 PolarHBondContact N-OD2 3.35Å; R155-D213 PolarHBondContact N-OD1 2.8Å; V157-D213 HydrophobicContact CG2-CB 4.09Å; C210-D213 WeakPolarHBondContact O-CB 3.27Å; C210-D213 PolarHBondContact O-N 3.02Å; K211-D213 PolarHBondContact O-N 3.32Å; D213-S216 PolarHBondContact O-N 3.19Å; D213-L217 WeakPolarHBondContact O-CB 3.5Å; D213-L217 PolarHBondContact O-N 2.85Å
214	I	98.4	Very high	91.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-71.1	-37.3	178.8	-57.8	-54.1	0	0	0	111.3	L141 L144 K211 A212 L217 G218 C268 R276 A279 L282	L141-I214 HydrophobicContact CD2-CD1 4.5Å; L144-I214 HydrophobicContact CD1-CD1 4.21Å; K211-I214 WeakPolarHBondContact O-CB 3.44Å; K211-I214 PolarHBondContact O-N 3.31Å; A212-I214 PolarHBondContact O-N 2.76Å; I214-L217 WeakPolarHBondContact O-CB 3.4Å; I214-L217 PolarHBondContact O-N 3.41Å; I214-G218 PolarHBondContact O-N 2.82Å; I214-C268 HydrophobicContact CG2-CB 4.29Å; I214-R276 HydrophobicContact CB-CG 4.28Å; I214-R276 HydrophobicContact CG2-CG 3.86Å; I214-A279 HydrophobicContact CD1-CB 4.04Å; I214-L282 HydrophobicContact CD1-CD1 4.12Å; I214-L282 HydrophobicContact CG2-CD1 3.45Å; I214-L282 VanDerWaalsContact CG2-CD1 3.45Å
215	W	98.2	Very high	92.3	Very high	5 Å²	5	22.7 Å²	22.7	2%	0.019	13%	0.127	C	C	.	.	H	α-helix	trans	-62.5	-48.7	169.9	175.6	-79.9	0	0	0	110.8	M198 A199 P200 K211 A212 L217 G218 I219 I243 L269 K271	M198-W215 PolarHBondContact O-NE1 3.39Å; A199-W215 VanDerWaalsContact CA-CD1 3.42Å; A199-W215 HydrophobicContact CB-CB 3.66Å; A199-W215 HydrophobicContact CB-CD2 4.29Å; A199-W215 HydrophobicContact CB-CG 3.66Å; P200-W215 HydrophobicContact CG-CE3 4.25Å; P200-W215 HydrophobicContact CG-CH2 3.67Å; P200-W215 HydrophobicContact CG-CZ2 3.94Å; P200-W215 HydrophobicContact CG-CZ3 3.83Å; K211-W215 PolarHBondContact O-N 3.09Å; A212-W215 PolarHBondContact O-N 3.28Å; W215-L217 PolarHBondContact O-N 3.04Å; W215-G218 PolarHBondContact O-N 2.7Å; W215-I219 PolarHBondContact O-N 3.36Å; W215-I243 HydrophobicContact CZ2-CG2 4.12Å; W215-L269 HydrophobicContact CD2-CD2 3.91Å; W215-L269 HydrophobicContact CE3-CB 4.49Å; W215-L269 HydrophobicContact CE3-CD2 4.12Å; W215-L269 HydrophobicContact CG-CD2 4.29Å; W215-L269 HydrophobicContact CZ2-CD2 4.45Å; W215-L269 HydrophobicContact CZ3-CB 4.3Å; W215-L269 HydrophobicContact CZ3-CD2 4.47Å; W215-K271 HydrophobicContact CH2-CG 4.27Å; W215-K271 HydrophobicContact CZ3-CG 4.08Å
216	S	97.5	Very high	93.2	Very high	8 Å²	8	20.8 Å²	20.8	6%	0.056	12%	0.118	C	C	.	.	H	α-helix	trans	-58.9	-36.1	177.9	-57.9	0	0	0	0	111.9	W197 A212 D213 I219 T220	W197-S216 WeakPolarHBondContact O-CA 3.37Å; W197-S216 WeakPolarHBondContact O-CB 3.28Å; W197-S216 PolarHBondContact O-OG 3.49Å; A212-S216 PolarHBondContact O-N 3.08Å; A212-S216 VanDerWaalsContact O-N 3.15Å; A212-S216 PolarHBondContact O-OG 3.3Å; D213-S216 PolarHBondContact O-N 3.19Å; S216-I219 PolarHBondContact O-N 3.25Å; S216-T220 WeakPolarHBondContact O-CB 3.36Å; S216-T220 PolarHBondContact O-N 3.37Å; S216-T220 PolarHBondContact O-OG1 3.35Å
217	L	98.6	Very high	94.5	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61.9	-45.9	172.1	-173.6	69.9	0	0	0	112.1	L137 V140 L141 L144 V157 D213 I214 W215 I219 T220 A221 F264	L137-L217 HydrophobicContact CD2-CD1 3.47Å; L137-L217 VanDerWaalsContact CD2-CD1 3.47Å; L137-L217 HydrophobicContact CD2-CG 3.97Å; V140-L217 HydrophobicContact CB-CD1 4.22Å; V140-L217 HydrophobicContact CG1-CD1 3.42Å; V140-L217 VanDerWaalsContact CG1-CD1 3.42Å; L141-L217 HydrophobicContact CD2-CD2 3.42Å; L141-L217 VanDerWaalsContact CD2-CD2 3.42Å; L141-L217 HydrophobicContact CG-CD2 3.79Å; L144-L217 HydrophobicContact CD1-CD2 4.32Å; V157-L217 HydrophobicContact CG1-CD1 4.38Å; D213-L217 WeakPolarHBondContact O-CB 3.5Å; D213-L217 PolarHBondContact O-N 2.85Å; I214-L217 WeakPolarHBondContact O-CB 3.4Å; I214-L217 PolarHBondContact O-N 3.41Å; W215-L217 PolarHBondContact O-N 3.04Å; L217-I219 VanDerWaalsContact C-N 3.33Å; L217-I219 PolarHBondContact O-N 3.43Å; L217-T220 CarbonylContact O-C 3.54Å; L217-T220 WeakPolarHBondContact O-CA 3.49Å; L217-T220 WeakPolarHBondContact O-CB 3.49Å; L217-T220 PolarHBondContact O-N 2.87Å; L217-T220 VanDerWaalsContact O-N 3.11Å; L217-A221 PolarHBondContact O-N 3.27Å; L217-F264 HydrophobicContact CD2-CZ 4.32Å
218	G	98.7	Very high	95.7	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.4	-40.3	175.6	0	0	0	0	0	112.8	I214 W215 A221 L222	I214-G218 PolarHBondContact O-N 2.82Å; W215-G218 PolarHBondContact O-N 2.7Å; G218-A221 WeakPolarHBondContact O-CB 3.28Å; G218-A221 PolarHBondContact O-N 2.93Å; G218-L222 PolarHBondContact O-N 2.83Å
219	I	98.7	Very high	96.6	Very high	3 Å²	3	15 Å²	15	2%	0.015	9%	0.088	C	C	.	.	H	α-helix	trans	-66.3	-39.5	172.8	-61.7	-59.8	0	0	0	111.3	W197 W215 S216 L217 A221 L222 E223 P229 P230 P249 L269	W197-I219 HydrophobicContact CB-CG2 4.37Å; W197-I219 VanDerWaalsContact CD1-CG2 3.48Å; W197-I219 HydrophobicContact CG-CB 4.44Å; W197-I219 HydrophobicContact CG-CG2 3.87Å; W215-I219 PolarHBondContact O-N 3.36Å; S216-I219 PolarHBondContact O-N 3.25Å; L217-I219 VanDerWaalsContact C-N 3.33Å; L217-I219 PolarHBondContact O-N 3.43Å; I219-A221 VanDerWaalsContact C-N 3.3Å; I219-A221 PolarHBondContact O-N 3.13Å; I219-L222 WeakPolarHBondContact O-CB 3.42Å; I219-L222 PolarHBondContact O-N 3.06Å; I219-E223 PolarHBondContact O-N 3.29Å; I219-P229 HydrophobicContact CG2-CB 3.69Å; I219-P230 HydrophobicContact CD1-CG 4.18Å; I219-P249 HydrophobicContact CD1-CG 3.71Å; I219-L269 HydrophobicContact CD1-CD1 4.32Å; I219-L269 HydrophobicContact CD1-CD2 3.73Å; I219-L269 HydrophobicContact CG1-CD2 3.94Å
220	T	98.7	Very high	97.3	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-64.6	-35.4	177.2	-55.5	0	0	0	0	111.7	V157 K158 A159 I162 S216 L217 E223 M224	V157-T220 PolarHBondContact O-OG1 2.92Å; K158-T220 WeakPolarHBondContact CA-OG1 3.45Å; A159-T220 HydrophobicContact CB-CG2 4.33Å; I162-T220 HydrophobicContact CD1-CG2 3.7Å; S216-T220 WeakPolarHBondContact O-CB 3.36Å; S216-T220 PolarHBondContact O-N 3.37Å; S216-T220 PolarHBondContact O-OG1 3.35Å; L217-T220 CarbonylContact O-C 3.54Å; L217-T220 WeakPolarHBondContact O-CA 3.49Å; L217-T220 WeakPolarHBondContact O-CB 3.49Å; L217-T220 PolarHBondContact O-N 2.87Å; L217-T220 VanDerWaalsContact O-N 3.11Å; T220-E223 WeakPolarHBondContact O-CB 3.35Å; T220-E223 PolarHBondContact O-N 3.28Å; T220-M224 HydrophobicContact CG2-CE 4.32Å; T220-M224 WeakPolarHBondContact O-CG 3.38Å; T220-M224 PolarHBondContact O-N 2.87Å
221	A	98.8	Very high	97.6	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-61.8	-45.4	172.9	0	0	0	0	0	111.8	L137 L217 G218 I219 E223 M224 A225 F261 V265	L137-A221 HydrophobicContact CD1-CB 4.05Å; L137-A221 HydrophobicContact CD2-CB 4.47Å; L217-A221 PolarHBondContact O-N 3.27Å; G218-A221 WeakPolarHBondContact O-CB 3.28Å; G218-A221 PolarHBondContact O-N 2.93Å; I219-A221 VanDerWaalsContact C-N 3.3Å; I219-A221 PolarHBondContact O-N 3.13Å; A221-E223 VanDerWaalsContact C-N 3.34Å; A221-E223 PolarHBondContact O-N 3.27Å; A221-M224 PolarHBondContact O-N 3.36Å; A221-A225 WeakPolarHBondContact O-CB 3.29Å; A221-A225 PolarHBondContact O-N 3.4Å; A221-A225 VanDerWaalsContact O-N 3.11Å; A221-F261 HydrophobicContact CB-CE2 4.01Å; A221-F261 HydrophobicContact CB-CZ 4.23Å; A221-V265 HydrophobicContact CB-CG2 3.89Å
222	L	98.7	Very high	97.5	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-63.2	-39.2	172.8	-68	175.7	0	0	0	112.1	G218 I219 A225 E226 P230 P249 F251 V265 L269	G218-L222 PolarHBondContact O-N 2.83Å; I219-L222 WeakPolarHBondContact O-CB 3.42Å; I219-L222 PolarHBondContact O-N 3.06Å; L222-A225 PolarHBondContact O-N 3.48Å; L222-E226 WeakPolarHBondContact O-CB 3.07Å; L222-E226 PolarHBondContact O-N 2.94Å; L222-P230 HydrophobicContact CB-CG 4.43Å; L222-P230 HydrophobicContact CD1-CG 3.62Å; L222-P249 HydrophobicContact CD1-CB 4.34Å; L222-P249 HydrophobicContact CD1-CG 4.34Å; L222-F251 HydrophobicContact CD2-CD1 3.61Å; L222-F251 HydrophobicContact CD2-CD2 4.01Å; L222-F251 HydrophobicContact CD2-CE1 3.66Å; L222-F251 HydrophobicContact CD2-CE2 3.99Å; L222-F251 HydrophobicContact CD2-CG 3.82Å; L222-F251 HydrophobicContact CD2-CZ 3.86Å; L222-V265 HydrophobicContact CD1-CG1 4.2Å; L222-V265 HydrophobicContact CD2-CG1 3.99Å; L222-V265 HydrophobicContact CG-CG1 3.93Å; L222-L269 HydrophobicContact CD1-CD1 3.85Å
223	E	98.6	Very high	97.4	Very high	13 Å²	13	20.5 Å²	20.5	6%	0.061	11%	0.112	C	C	.	.	H	α-helix	trans	-60.2	-44.3	175.7	178.6	-171.4	-167.6	0	0	111.9	M121 A159 W197 I219 T220 A221 G227 K228	M121-E223 HydrophobicContact CE-CG 4.45Å; A159-E223 HydrophobicContact CB-CG 4.17Å; A159-E223 WeakPolarHBondContact CB-OE1 3.29Å; A159-E223 WeakPolarHBondContact CB-OE2 3.39Å; A159-E223 PolarHBondContact N-OE2 3.39Å; W197-E223 HydrophobicContact CZ2-CG 4.48Å; W197-E223 WeakPolarHBondContact CZ2-OE1 3.39Å; W197-E223 WeakPolarHBondContact CZ2-OE2 3.2Å; W197-E223 PolarHBondContact NE1-OE2 2.86Å; I219-E223 PolarHBondContact O-N 3.29Å; T220-E223 WeakPolarHBondContact O-CB 3.35Å; T220-E223 PolarHBondContact O-N 3.28Å; A221-E223 VanDerWaalsContact C-N 3.34Å; A221-E223 PolarHBondContact O-N 3.27Å; E223-G227 CarbonylContact O-C 3.56Å; E223-G227 WeakPolarHBondContact O-CA 3.35Å; E223-G227 PolarHBondContact O-N 2.84Å; E223-K228 PolarHBondContact O-N 3.18Å
224	M	98.7	Very high	97.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.9	-37.3	178	-69.8	-175.7	-71	0	0	112.7	V117 T127 L128 I133 I136 L137 T220 A221	V117-M224 HydrophobicContact CG1-CG 3.75Å; V117-M224 HydrophobicContact CG1-SD 3.73Å; T127-M224 WeakPolarHBondContact CB-O 3.33Å; L128-M224 HydrophobicContact CD1-CB 4.26Å; L128-M224 HydrophobicContact CD1-CG 4.26Å; L128-M224 HydrophobicContact CD1-SD 4.11Å; L128-M224 PolarHBondContact N-O 3.47Å; I133-M224 HydrophobicContact CD1-CB 4Å; I133-M224 HydrophobicContact CG1-CB 3.86Å; I133-M224 HydrophobicContact CG1-SD 4.47Å; I133-M224 HydrophobicContact CG2-CE 3.85Å; I136-M224 HydrophobicContact CB-SD 4.4Å; I136-M224 HydrophobicContact CD1-SD 4.08Å; I136-M224 HydrophobicContact CG2-CE 4.49Å; I136-M224 HydrophobicContact CG2-SD 3.98Å; L137-M224 HydrophobicContact CD1-CE 4.41Å; L137-M224 HydrophobicContact CD2-CE 3.63Å; L137-M224 HydrophobicContact CG-CE 3.88Å; T220-M224 HydrophobicContact CG2-CE 4.32Å; T220-M224 WeakPolarHBondContact O-CG 3.38Å; T220-M224 PolarHBondContact O-N 2.87Å; A221-M224 PolarHBondContact O-N 3.36Å
225	A	98.6	Very high	96.8	Very high	4 Å²	4	28.7 Å²	28.7	3%	0.033	15%	0.151	C	C	.	.	H	α-helix	trans	-72.1	-41.7	179.8	0	0	0	0	0	112.7	T127 I133 A221 L222 F251 W257 F261	T127-A225 VanDerWaalsContact CB-O 3.29Å; T127-A225 WeakPolarHBondContact CB-O 3.41Å; T127-A225 WeakPolarHBondContact CG2-O 3.45Å; T127-A225 PolarHBondContact OG1-O 2.93Å; I133-A225 HydrophobicContact CD1-CB 4.1Å; A221-A225 WeakPolarHBondContact O-CB 3.29Å; A221-A225 PolarHBondContact O-N 3.4Å; A221-A225 VanDerWaalsContact O-N 3.11Å; L222-A225 PolarHBondContact O-N 3.48Å; A225-F251 HydrophobicContact CB-CD1 4.39Å; A225-F251 HydrophobicContact CB-CE1 3.82Å; A225-W257 HydrophobicContact CB-CH2 3.52Å; A225-W257 HydrophobicContact CB-CZ2 3.59Å; A225-W257 HydrophobicContact CB-CZ3 4.09Å; A225-F261 HydrophobicContact CB-CE1 4.07Å; A225-F261 HydrophobicContact CB-CZ 4.34Å
226	E	97.9	Very high	96.4	Very high	34 Å²	34	29.7 Å²	29.7	16%	0.159	16%	0.159	C	C	.	.	H	α-helix	trans	-111.1	-0.1	-170.9	-56.2	-169.1	158.8	0	0	114.3	L222 K228 F251 R252	L222-E226 WeakPolarHBondContact O-CB 3.07Å; L222-E226 PolarHBondContact O-N 2.94Å; E226-K228 PolarHBondContact O-N 2.94Å; E226-F251 WeakPolarHBondContact OE1-CA 3.44Å; E226-R252 WeakPolarHBondContact OE1-CG 3.36Å; E226-R252 PolarHBondContact OE1-N 3.36Å; E226-R252 IonicContact OE2-CZ 2.74Å; E226-R252 IonicContact OE2-NE 3.94Å; E226-R252 PolarHBondContact OE2-NE 2.92Å; E226-R252 IonicContact OE2-NH1 2.68Å; E226-R252 IonicContact OE2-NH2 2.77Å; E226-R252 PolarHBondContact OE2-NH2 3.19Å
227	G	97.3	Very high	95.9	Very high	40 Å²	40	33.5 Å²	33.5	41%	0.412	18%	0.177	S	C	.	.	S	Bend	trans	78.6	-8.4	179	0	0	0	0	0	115.2	T127 E223	T127-G227 VanDerWaalsContact CG2-N 3.32Å; E223-G227 CarbonylContact O-C 3.56Å; E223-G227 WeakPolarHBondContact O-CA 3.35Å; E223-G227 PolarHBondContact O-N 2.84Å
228	K	96.5	Very high	95.6	Very high	66 Å²	66	41.4 Å²	41.4	29%	0.287	21%	0.206	S	C	.	.	S	Bend	trans	-155.6	148.6	178.6	65.5	-169.3	-179	-174.9	0	110.8	E223 E226 A232 E233	E223-K228 PolarHBondContact O-N 3.18Å; E226-K228 PolarHBondContact O-N 2.94Å; K228-A232 HydrophobicContact CB-CB 3.92Å; K228-A232 HydrophobicContact CD-CB 4.11Å; K228-A232 HydrophobicContact CG-CB 4.11Å; K228-E233 WeakPolarHBondContact CD-OE1 3.19Å; K228-E233 IonicContact NZ-OE1 2.67Å; K228-E233 PolarHBondContact NZ-OE1 3.35Å
229	P	97.5	Very high	95.3	Very high	7 Å²	7	41.4 Å²	41.4	5%	0.045	21%	0.206	C	C	.	.			trans	-66.7	162.3	178.1	31.9	-39	0	0	0	111.3	F196 W197 I219 Y231 A232	F196-P229 HydrophobicContact CB-CB 4.04Å; F196-P229 HydrophobicContact CB-CG 3.85Å; F196-P229 HydrophobicContact CD2-CG 4.22Å; F196-P229 HydrophobicContact CG-CG 4.36Å; W197-P229 HydrophobicContact CH2-CG 3.7Å; W197-P229 HydrophobicContact CZ2-CB 3.99Å; W197-P229 HydrophobicContact CZ2-CG 3.52Å; W197-P229 HydrophobicContact CZ3-CG 4.32Å; I219-P229 HydrophobicContact CG2-CB 3.69Å; P229-Y231 PolarHBondContact O-N 3.13Å; P229-A232 HydrophobicContact CG-CB 4.08Å; P229-A232 WeakPolarHBondContact O-CB 3.28Å; P229-A232 PolarHBondContact O-N 3.02Å
230	P	97.3	Very high	94.9	Very high	14 Å²	14	42.3 Å²	42.3	9%	0.091	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	142.3	167.3	-24.5	36.1	0	0	0	111.1	I219 L222 A232 P249	I219-P230 HydrophobicContact CD1-CG 4.18Å; L222-P230 HydrophobicContact CB-CG 4.43Å; L222-P230 HydrophobicContact CD1-CG 3.62Å; P230-A232 PolarHBondContact O-N 2.82Å; P230-P249 HydrophobicContact CB-CB 3.7Å; P230-P249 HydrophobicContact CB-CG 4.05Å; P230-P249 HydrophobicContact CG-CB 3.61Å; P230-P249 HydrophobicContact CG-CG 3.79Å
231	Y	95.6	Very high	94.6	Very high	56 Å²	56	49 Å²	49	22%	0.22	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	65	11.2	-179.8	-45.3	-43.7	0	0	0	116.3	F196 P229 E233 I234 M242 I243	F196-Y231 VanDerWaalsContact CE1-O 3.31Å; F196-Y231 WeakPolarHBondContact CE1-O 3.28Å; P229-Y231 PolarHBondContact O-N 3.13Å; Y231-E233 PolarHBondContact O-N 2.87Å; Y231-E233 VanDerWaalsContact O-N 3.08Å; Y231-I234 HydrophobicContact CD1-CD1 3.56Å; Y231-I234 HydrophobicContact CE1-CD1 4.44Å; Y231-I234 HydrophobicContact CG-CD1 4.08Å; Y231-I234 WeakPolarHBondContact O-CA 3.49Å; Y231-I234 VanDerWaalsContact O-CB 3.32Å; Y231-I234 WeakPolarHBondContact O-CB 3.5Å; Y231-I234 PolarHBondContact O-N 3.25Å; Y231-M242 HydrophobicContact CD1-CE 3.76Å; Y231-M242 HydrophobicContact CE1-CE 3.45Å; Y231-M242 VanDerWaalsContact CE1-CE 3.45Å; Y231-M242 HydrophobicContact CE2-CB 4.42Å; Y231-M242 HydrophobicContact CE2-CE 4.49Å; Y231-M242 HydrophobicContact CG-CE 4.42Å; Y231-I243 HydrophobicContact CD2-CG1 4.1Å; Y231-I243 HydrophobicContact CE2-CG1 4.14Å
232	A	93.5	Very high	94.4	Very high	33 Å²	33	50.4 Å²	50.4	27%	0.273	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-31.8	177.2	0	0	0	0	0	114.4	K228 P229 P230 I234	K228-A232 HydrophobicContact CB-CB 3.92Å; K228-A232 HydrophobicContact CD-CB 4.11Å; K228-A232 HydrophobicContact CG-CB 4.11Å; P229-A232 HydrophobicContact CG-CB 4.08Å; P229-A232 WeakPolarHBondContact O-CB 3.28Å; P229-A232 PolarHBondContact O-N 3.02Å; P230-A232 PolarHBondContact O-N 2.82Å; A232-I234 VanDerWaalsContact C-N 3.3Å
233	E	92.5	Very high	94.3	Very high	147 Å²	147	50.9 Å²	50.9	69%	0.687	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-1.5	177.8	-54.5	-55.8	150.6	0	0	113.6	K228 Y231	K228-E233 WeakPolarHBondContact CD-OE1 3.19Å; K228-E233 IonicContact NZ-OE1 2.67Å; K228-E233 PolarHBondContact NZ-OE1 3.35Å; Y231-E233 PolarHBondContact O-N 2.87Å; Y231-E233 VanDerWaalsContact O-N 3.08Å
234	I	92.4	Very high	94.1	Very high	42 Å²	42	51.2 Å²	51.2	22%	0.215	25%	0.253	C	S	.	.	S	Bend	trans	-100.1	136	-178	-57.8	-174.5	0	0	0	108.6	F196 Y231 A232 R238 M242	F196-I234 WeakPolarHBondContact CZ-O 3.39Å; Y231-I234 HydrophobicContact CD1-CD1 3.56Å; Y231-I234 HydrophobicContact CE1-CD1 4.44Å; Y231-I234 HydrophobicContact CG-CD1 4.08Å; Y231-I234 WeakPolarHBondContact O-CA 3.49Å; Y231-I234 VanDerWaalsContact O-CB 3.32Å; Y231-I234 WeakPolarHBondContact O-CB 3.5Å; Y231-I234 PolarHBondContact O-N 3.25Å; A232-I234 VanDerWaalsContact C-N 3.3Å; I234-R238 HydrophobicContact CG2-CB 3.74Å; I234-R238 HydrophobicContact CG2-CG 3.7Å; I234-M242 HydrophobicContact CD1-CE 3.66Å; I234-M242 HydrophobicContact CD1-SD 3.87Å; I234-M242 HydrophobicContact CG2-SD 4.34Å
235	H	89.6	Confident	93.9	Very high	131 Å²	131	56.1 Å²	56.1	61%	0.606	28%	0.283	S	S	*	.			trans	-51.6	132.1	175.7	-170.9	-78.9	0	0	0	111.5	M237 R238 A239	H235-M237 VanDerWaalsContact C-N 3.32Å; H235-M237 PolarHBondContact ND1-N 2.91Å; H235-M237 PolarHBondContact O-N 3.42Å; H235-M237 VanDerWaalsContact O-N 3.14Å; H235-R238 WeakPolarHBondContact O-CA 3.37Å; H235-R238 WeakPolarHBondContact O-CB 3.45Å; H235-R238 PolarHBondContact O-N 2.86Å; H235-A239 PolarHBondContact O-N 3.21Å
236	P	89.3	Confident	93.8	Very high	26 Å²	26	60.9 Å²	60.9	17%	0.169	30%	0.303	C	S	.	.	H	α-helix	trans	-47.1	-47.7	-175.3	-34.4	37.6	0	0	0	114.7	P195 F196 R238 A239 I240	P195-P236 HydrophobicContact CG-CB 4.21Å; F196-P236 HydrophobicContact CZ-CG 4.3Å; P236-R238 PolarHBondContact O-N 3.12Å; P236-A239 WeakPolarHBondContact O-CB 3.42Å; P236-A239 PolarHBondContact O-N 3.4Å; P236-I240 WeakPolarHBondContact O-CG1 3.38Å; P236-I240 PolarHBondContact O-N 2.9Å
237	M	86.8	Confident	93.8	Very high	88 Å²	88	64.1 Å²	64.1	43%	0.433	33%	0.327	S	S	.	.	H	α-helix	trans	-54	-37.7	176.2	-67.9	-63.3	-63.7	0	0	113.8	I192 H235 F241	I192-M237 HydrophobicContact CD1-CE 4.1Å; I192-M237 HydrophobicContact CD1-SD 3.41Å; I192-M237 WeakPolarHBondContact CD1-SD 3.44Å; I192-M237 HydrophobicContact CG1-SD 3.86Å; H235-M237 VanDerWaalsContact C-N 3.32Å; H235-M237 PolarHBondContact ND1-N 2.91Å; H235-M237 PolarHBondContact O-N 3.42Å; H235-M237 VanDerWaalsContact O-N 3.14Å; M237-F241 WeakPolarHBondContact O-CD2 3.35Å
238	R	92.1	Very high	93.8	Very high	165 Å²	165	65 Å²	65	62%	0.623	33%	0.326	S	S	*	.	H	α-helix	trans	-76.3	-36.7	178.7	177.8	173.6	174.2	178	2.5	111.1	I234 H235 P236 I240 F241 M242	I234-R238 HydrophobicContact CG2-CB 3.74Å; I234-R238 HydrophobicContact CG2-CG 3.7Å; H235-R238 WeakPolarHBondContact O-CA 3.37Å; H235-R238 WeakPolarHBondContact O-CB 3.45Å; H235-R238 PolarHBondContact O-N 2.86Å; P236-R238 PolarHBondContact O-N 3.12Å; R238-I240 VanDerWaalsContact C-N 3.3Å; R238-I240 PolarHBondContact O-N 2.91Å; R238-F241 PolarHBondContact O-N 3.41Å; R238-M242 HydrophobicContact CG-CG 4.41Å; R238-M242 HydrophobicContact CG-SD 3.8Å; R238-M242 WeakPolarHBondContact O-CG 3.04Å; R238-M242 PolarHBondContact O-N 3.28Å; R238-M242 VanDerWaalsContact O-N 3.15Å
239	A	92.4	Very high	93.9	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-61.7	-38.1	176.3	0	0	0	0	0	112.1	P195 F196 H235 P236 F241 M242 I243	P195-A239 HydrophobicContact CG-CB 3.94Å; F196-A239 HydrophobicContact CD1-CB 3.81Å; F196-A239 HydrophobicContact CE1-CB 3.58Å; H235-A239 PolarHBondContact O-N 3.21Å; P236-A239 WeakPolarHBondContact O-CB 3.42Å; P236-A239 PolarHBondContact O-N 3.4Å; A239-F241 VanDerWaalsContact C-N 3.28Å; A239-F241 PolarHBondContact O-N 3.27Å; A239-M242 PolarHBondContact O-N 3.44Å; A239-I243 HydrophobicContact CB-CD1 4.48Å; A239-I243 WeakPolarHBondContact O-CG1 3.27Å; A239-I243 PolarHBondContact O-N 3.03Å
240	I	90.5	Very high	93.9	Very high	23 Å²	23	66 Å²	66	12%	0.118	34%	0.34	C	S	.	.	H	α-helix	trans	-56.9	-39.3	175.8	-72.1	162.3	0	0	0	112.6	I192 P195 I203 P236 R238 P244	I192-I240 HydrophobicContact CB-CD1 3.57Å; I192-I240 HydrophobicContact CD1-CD1 3.32Å; I192-I240 HydrophobicContact CG1-CD1 3.97Å; I192-I240 HydrophobicContact CG2-CD1 3.3Å; I192-I240 HydrophobicContact CG2-CG1 4.4Å; P195-I240 HydrophobicContact CB-CD1 4.29Å; P195-I240 HydrophobicContact CB-CG1 3.64Å; P195-I240 HydrophobicContact CG-CD1 4.36Å; P195-I240 HydrophobicContact CG-CG1 3.85Å; I203-I240 HydrophobicContact CG2-CG2 3.85Å; P236-I240 WeakPolarHBondContact O-CG1 3.38Å; P236-I240 PolarHBondContact O-N 2.9Å; R238-I240 VanDerWaalsContact C-N 3.3Å; R238-I240 PolarHBondContact O-N 2.91Å; I240-P244 WeakPolarHBondContact O-CD 3.03Å
241	F	91.5	Very high	93.9	Very high	141 Å²	141	65.8 Å²	65.8	62%	0.618	34%	0.338	S	S	*	.	H	α-helix	trans	-75.9	-30.7	174.3	-69.3	-71	0	0	0	112.6	M237 R238 A239 T245	M237-F241 WeakPolarHBondContact O-CD2 3.35Å; R238-F241 PolarHBondContact O-N 3.41Å; A239-F241 VanDerWaalsContact C-N 3.28Å; A239-F241 PolarHBondContact O-N 3.27Å; F241-T245 WeakPolarHBondContact O-CB 3.35Å; F241-T245 VanDerWaalsContact O-CG2 3.23Å; F241-T245 WeakPolarHBondContact O-CG2 3.38Å; F241-T245 PolarHBondContact O-OG1 3.45Å
242	M	95.4	Very high	93.9	Very high	28 Å²	28	69.5 Å²	69.5	14%	0.138	35%	0.351	C	S	.	.	H	α-helix	trans	-76.3	-42.8	-175.8	-73	177.3	54.7	0	0	112.6	Y231 I234 R238 A239 T245 K246	Y231-M242 HydrophobicContact CD1-CE 3.76Å; Y231-M242 HydrophobicContact CE1-CE 3.45Å; Y231-M242 VanDerWaalsContact CE1-CE 3.45Å; Y231-M242 HydrophobicContact CE2-CB 4.42Å; Y231-M242 HydrophobicContact CE2-CE 4.49Å; Y231-M242 HydrophobicContact CG-CE 4.42Å; I234-M242 HydrophobicContact CD1-CE 3.66Å; I234-M242 HydrophobicContact CD1-SD 3.87Å; I234-M242 HydrophobicContact CG2-SD 4.34Å; R238-M242 HydrophobicContact CG-CG 4.41Å; R238-M242 HydrophobicContact CG-SD 3.8Å; R238-M242 WeakPolarHBondContact O-CG 3.04Å; R238-M242 PolarHBondContact O-N 3.28Å; R238-M242 VanDerWaalsContact O-N 3.15Å; A239-M242 PolarHBondContact O-N 3.44Å; M242-T245 PolarHBondContact O-N 3.38Å; M242-T245 VanDerWaalsContact O-N 3.1Å; M242-T245 PolarHBondContact O-OG1 3.45Å; M242-K246 HydrophobicContact CB-CG 4.17Å; M242-K246 HydrophobicContact CG-CG 4.49Å; M242-K246 VanDerWaalsContact O-CB 3.32Å; M242-K246 WeakPolarHBondContact O-CB 3.26Å; M242-K246 WeakPolarHBondContact O-CG 3.41Å; M242-K246 PolarHBondContact O-N 2.94Å
243	I	95.4	Very high	94.1	Very high	11 Å²	11	72.5 Å²	72.5	6%	0.056	36%	0.363	C	S	.	.	H	α-helix	trans	-57.6	-48.5	-174	-67.8	159.4	0	0	0	111.9	P195 P200 I203 W215 Y231 A239 T245	P195-I243 HydrophobicContact CB-CD1 4.46Å; P195-I243 VanDerWaalsContact O-CD1 3.25Å; P195-I243 WeakPolarHBondContact O-CD1 3.33Å; P200-I243 HydrophobicContact CG-CG2 4.22Å; I203-I243 HydrophobicContact CD1-CB 3.64Å; I203-I243 HydrophobicContact CD1-CD1 3.63Å; I203-I243 HydrophobicContact CD1-CG1 4.25Å; I203-I243 HydrophobicContact CD1-CG2 3.6Å; W215-I243 HydrophobicContact CZ2-CG2 4.12Å; Y231-I243 HydrophobicContact CD2-CG1 4.1Å; Y231-I243 HydrophobicContact CE2-CG1 4.14Å; A239-I243 HydrophobicContact CB-CD1 4.48Å; A239-I243 WeakPolarHBondContact O-CG1 3.27Å; A239-I243 PolarHBondContact O-N 3.03Å; I243-T245 VanDerWaalsContact C-N 3.33Å; I243-T245 PolarHBondContact O-N 3.38Å
244	P	94.6	Very high	94.2	Very high	19 Å²	19	68.4 Å²	68.4	12%	0.123	35%	0.349	C	S	.	.	H	α-helix	trans	-77.6	-13.9	178.7	-14.6	31.2	0	0	0	114.2	P200 I203 Q204 I240 K271	P200-P244 HydrophobicContact CB-CB 4.39Å; I203-P244 HydrophobicContact CB-CG 3.97Å; I203-P244 HydrophobicContact CD1-CG 4.4Å; I203-P244 HydrophobicContact CG2-CG 3.56Å; Q204-P244 HydrophobicContact CG-CB 3.85Å; Q204-P244 HydrophobicContact CG-CG 4.07Å; I240-P244 WeakPolarHBondContact O-CD 3.03Å; P244-K271 PolarHBondContact O-NZ 3.37Å
245	T	95.3	Very high	94.5	Very high	103 Å²	103	74.2 Å²	74.2	63%	0.632	38%	0.381	S	S	*	.	H	α-helix	trans	-106.8	-31.7	-173.8	61.2	0	0	0	0	114.3	F241 M242 I243	F241-T245 WeakPolarHBondContact O-CB 3.35Å; F241-T245 VanDerWaalsContact O-CG2 3.23Å; F241-T245 WeakPolarHBondContact O-CG2 3.38Å; F241-T245 PolarHBondContact O-OG1 3.45Å; M242-T245 PolarHBondContact O-N 3.38Å; M242-T245 VanDerWaalsContact O-N 3.1Å; M242-T245 PolarHBondContact O-OG1 3.45Å; I243-T245 VanDerWaalsContact C-N 3.33Å; I243-T245 PolarHBondContact O-N 3.38Å
246	K	96.8	Very high	94.8	Very high	105 Å²	105	73 Å²	73	46%	0.457	38%	0.379	S	S	.	.	S	Bend	trans	-81.7	159.8	178.3	-63.7	-62.2	-178	-178.7	0	111.2	M242 K271	M242-K246 HydrophobicContact CB-CG 4.17Å; M242-K246 HydrophobicContact CG-CG 4.49Å; M242-K246 VanDerWaalsContact O-CB 3.32Å; M242-K246 WeakPolarHBondContact O-CB 3.26Å; M242-K246 WeakPolarHBondContact O-CG 3.41Å; M242-K246 PolarHBondContact O-N 2.94Å; K246-K271 PolarHBondContact O-NZ 3.37Å
247	P	97.4	Very high	95.2	Very high	101 Å²	101	74 Å²	74	66%	0.656	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-56.4	156.7	166	-22.2	33.9	0	0	0	110.9
248	P	97.8	Very high	95.7	Very high	60 Å²	60	71.3 Å²	71.3	39%	0.39	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-49.6	139.9	171.6	-27.8	36.4	0	0	0	112.1	L269 K271	P248-L269 HydrophobicContact CB-CB 4.08Å; P248-L269 WeakPolarHBondContact CB-O 3.41Å; P248-L269 WeakPolarHBondContact CG-O 3.34Å; P248-K271 HydrophobicContact CG-CD 4.29Å; P248-K271 HydrophobicContact CG-CG 3.89Å
249	P	97.7	Very high	96	Very high	24 Å²	24	66.8 Å²	66.8	16%	0.156	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-67.7	158.4	173.6	28.6	-30.6	0	0	0	110.6	I219 L222 P230 L269	I219-P249 HydrophobicContact CD1-CG 3.71Å; L222-P249 HydrophobicContact CD1-CB 4.34Å; L222-P249 HydrophobicContact CD1-CG 4.34Å; P230-P249 HydrophobicContact CB-CB 3.7Å; P230-P249 HydrophobicContact CB-CG 4.05Å; P230-P249 HydrophobicContact CG-CB 3.61Å; P230-P249 HydrophobicContact CG-CG 3.79Å; P249-L269 HydrophobicContact CG-CD1 3.99Å; P249-L269 WeakPolarHBondContact O-CD1 3.42Å
250	S	97.2	Very high	96.2	Very high	70 Å²	70	71.1 Å²	71.1	49%	0.49	39%	0.387	S	S	.	.			trans	-142.1	177.7	173.1	-169	0	0	0	0	108.6
251	F	97.9	Very high	96.6	Very high	9 Å²	9	70 Å²	70	4%	0.039	38%	0.382	C	S	.	.			trans	-56.8	138.9	176.2	-62	-87.4	0	0	0	111.1	L222 A225 E226 N253 W257 F261 I262 V265	L222-F251 HydrophobicContact CD2-CD1 3.61Å; L222-F251 HydrophobicContact CD2-CD2 4.01Å; L222-F251 HydrophobicContact CD2-CE1 3.66Å; L222-F251 HydrophobicContact CD2-CE2 3.99Å; L222-F251 HydrophobicContact CD2-CG 3.82Å; L222-F251 HydrophobicContact CD2-CZ 3.86Å; A225-F251 HydrophobicContact CB-CD1 4.39Å; A225-F251 HydrophobicContact CB-CE1 3.82Å; E226-F251 WeakPolarHBondContact OE1-CA 3.44Å; F251-N253 VanDerWaalsContact C-N 3.27Å; F251-N253 PolarHBondContact O-N 2.78Å; F251-W257 AromaticContact CD1-CD1 3.32Å; F251-W257 HydrophobicContact CD1-CD2 4.06Å; F251-W257 AromaticContact CD1-CE2 3.76Å; F251-W257 AromaticContact CD1-CG 3.81Å; F251-W257 HydrophobicContact CD1-CG 3.81Å; F251-W257 AromaticContact CD1-NE1 3.27Å; F251-W257 VanDerWaalsContact CD1-NE1 3.27Å; F251-W257 AromaticContact CE1-CD1 3.9Å; F251-W257 AromaticContact CE1-CD2 3.94Å; F251-W257 HydrophobicContact CE1-CD2 3.94Å; F251-W257 AromaticContact CE1-CE2 3.97Å; F251-W257 AromaticContact CE1-CG 3.9Å; F251-W257 HydrophobicContact CE1-CG 3.9Å; F251-W257 AromaticContact CE1-NE1 3.93Å; F251-W257 AromaticContact CG-CD1 3.56Å; F251-W257 HydrophobicContact CG-CG 4.21Å; F251-W257 AromaticContact CG-NE1 3.9Å; F251-W257 HydrophobicContact CZ-CG 4.43Å; F251-F261 AromaticContact CE1-CD1 3.96Å; F251-F261 HydrophobicContact CE1-CD1 3.96Å; F251-F261 AromaticContact CE1-CE1 3.53Å; F251-F261 HydrophobicContact CE1-CE1 3.53Å; F251-F261 HydrophobicContact CE1-CZ 4.02Å; F251-F261 AromaticContact CZ-CD1 3.59Å; F251-F261 HydrophobicContact CZ-CD1 3.59Å; F251-F261 HydrophobicContact CZ-CD2 4.25Å; F251-F261 AromaticContact CZ-CE1 3.47Å; F251-F261 HydrophobicContact CZ-CE1 3.47Å; F251-F261 VanDerWaalsContact CZ-CE1 3.47Å; F251-F261 HydrophobicContact CZ-CE2 4.14Å; F251-F261 AromaticContact CZ-CG 3.99Å; F251-F261 HydrophobicContact CZ-CG 3.99Å; F251-F261 AromaticContact CZ-CZ 3.75Å; F251-F261 HydrophobicContact CZ-CZ 3.75Å; F251-I262 HydrophobicContact CD2-CG1 3.93Å; F251-I262 HydrophobicContact CE2-CB 4.47Å; F251-I262 HydrophobicContact CE2-CG1 3.99Å; F251-V265 HydrophobicContact CE2-CB 3.94Å; F251-V265 HydrophobicContact CE2-CG1 4.28Å; F251-V265 HydrophobicContact CE2-CG2 3.8Å; F251-V265 HydrophobicContact CZ-CB 4.31Å; F251-V265 HydrophobicContact CZ-CG2 3.65Å
252	R	96.5	Very high	96.9	Very high	133 Å²	133	65.6 Å²	65.6	50%	0.502	36%	0.364	S	S	.	.	S	Bend	trans	-63.4	-37.1	176.1	-66.7	175.9	-162.4	145.6	20.5	111.6	E226	E226-R252 WeakPolarHBondContact OE1-CG 3.36Å; E226-R252 PolarHBondContact OE1-N 3.36Å; E226-R252 IonicContact OE2-CZ 2.74Å; E226-R252 IonicContact OE2-NE 3.94Å; E226-R252 PolarHBondContact OE2-NE 2.92Å; E226-R252 IonicContact OE2-NH1 2.68Å; E226-R252 IonicContact OE2-NH2 2.77Å; E226-R252 PolarHBondContact OE2-NH2 3.19Å
253	N	96.3	Very high	97.1	Very high	97 Å²	97	68 Å²	68	52%	0.519	38%	0.378	S	S	.	.	S	Bend	trans	-126.3	85.2	178.2	-60.7	-29	0	0	0	109.6	F251 N255 D256	F251-N253 VanDerWaalsContact C-N 3.27Å; F251-N253 PolarHBondContact O-N 2.78Å; N253-N255 PolarHBondContact O-N 3.02Å; N253-N255 VanDerWaalsContact O-N 3.13Å; N253-D256 HydrophobicContact CB-CB 4.45Å; N253-D256 WeakPolarHBondContact CB-OD2 3.41Å; N253-D256 PolarHBondContact ND2-OD2 3.41Å; N253-D256 WeakPolarHBondContact O-CB 2.86Å; N253-D256 PolarHBondContact O-N 3.03Å; N253-D256 VanDerWaalsContact O-N 3.12Å
254	P	96.4	Very high	97.2	Very high	61 Å²	61	67.5 Å²	67.5	40%	0.396	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-59.2	-26.3	-177.7	-27.1	36	0	0	0	114.4	D256 W257 I262	P254-D256 PolarHBondContact O-N 3.44Å; P254-W257 PolarHBondContact O-N 2.92Å; P254-I262 HydrophobicContact CB-CD1 4.16Å; P254-I262 WeakPolarHBondContact O-CD1 3.38Å
255	N	96.9	Very high	97.4	Very high	164 Å²	164	66.7 Å²	66.7	88%	0.877	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-69.3	-11.8	179.6	-62.9	-30.5	0	0	0	114	N253 W257	N253-N255 PolarHBondContact O-N 3.02Å; N253-N255 VanDerWaalsContact O-N 3.13Å; N255-W257 VanDerWaalsContact C-N 3.28Å
256	D	97.2	Very high	97.6	Very high	106 Å²	106	64.7 Å²	64.7	57%	0.567	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-83.5	-7.3	179.1	-62.4	-17.5	0	0	0	112	N253 P254	N253-D256 HydrophobicContact CB-CB 4.45Å; N253-D256 WeakPolarHBondContact CB-OD2 3.41Å; N253-D256 PolarHBondContact ND2-OD2 3.41Å; N253-D256 WeakPolarHBondContact O-CB 2.86Å; N253-D256 PolarHBondContact O-N 3.03Å; N253-D256 VanDerWaalsContact O-N 3.12Å; P254-D256 PolarHBondContact O-N 3.44Å
257	W	97.6	Very high	97.6	Very high	45 Å²	45	61.6 Å²	61.6	17%	0.17	35%	0.35	C	S	.	.	S	Bend	trans	-129.8	151.4	-169.6	-50.2	99.8	0	0	0	112.5	E130 A225 F251 P254 N255 F261 I262	E130-W257 HydrophobicContact CG-CE3 3.78Å; E130-W257 HydrophobicContact CG-CZ3 4.11Å; E130-W257 VanDerWaalsContact OE1-CA 3.23Å; E130-W257 WeakPolarHBondContact OE1-CA 3.38Å; A225-W257 HydrophobicContact CB-CH2 3.52Å; A225-W257 HydrophobicContact CB-CZ2 3.59Å; A225-W257 HydrophobicContact CB-CZ3 4.09Å; F251-W257 AromaticContact CD1-CD1 3.32Å; F251-W257 HydrophobicContact CD1-CD2 4.06Å; F251-W257 AromaticContact CD1-CE2 3.76Å; F251-W257 AromaticContact CD1-CG 3.81Å; F251-W257 HydrophobicContact CD1-CG 3.81Å; F251-W257 AromaticContact CD1-NE1 3.27Å; F251-W257 VanDerWaalsContact CD1-NE1 3.27Å; F251-W257 AromaticContact CE1-CD1 3.9Å; F251-W257 AromaticContact CE1-CD2 3.94Å; F251-W257 HydrophobicContact CE1-CD2 3.94Å; F251-W257 AromaticContact CE1-CE2 3.97Å; F251-W257 AromaticContact CE1-CG 3.9Å; F251-W257 HydrophobicContact CE1-CG 3.9Å; F251-W257 AromaticContact CE1-NE1 3.93Å; F251-W257 AromaticContact CG-CD1 3.56Å; F251-W257 HydrophobicContact CG-CG 4.21Å; F251-W257 AromaticContact CG-NE1 3.9Å; F251-W257 HydrophobicContact CZ-CG 4.43Å; P254-W257 PolarHBondContact O-N 2.92Å; N255-W257 VanDerWaalsContact C-N 3.28Å; W257-F261 HydrophobicContact CB-CD1 4.26Å; W257-F261 HydrophobicContact CD2-CD1 4.12Å; W257-F261 HydrophobicContact CD2-CE1 4.23Å; W257-F261 AromaticContact CE3-CD1 3.68Å; W257-F261 HydrophobicContact CE3-CD1 3.68Å; W257-F261 AromaticContact CE3-CE1 3.74Å; W257-F261 HydrophobicContact CE3-CE1 3.74Å; W257-F261 HydrophobicContact CG-CD1 4.38Å; W257-F261 HydrophobicContact CZ3-CD1 4.41Å; W257-F261 HydrophobicContact CZ3-CE1 4.08Å; W257-I262 HydrophobicContact CB-CD1 4.33Å; W257-I262 HydrophobicContact CB-CG1 4.12Å
258	S	97.5	Very high	97.7	Very high	32 Å²	32	56.8 Å²	56.8	22%	0.224	32%	0.319	C	S	.	.			trans	-64.7	153.7	176.4	72.2	0	0	0	0	111.8	E130 E260 F261 I262	E130-S258 PolarHBondContact OE1-N 3.26Å; E130-S258 WeakPolarHBondContact OE2-CB 3.32Å; E130-S258 PolarHBondContact OE2-OG 3.08Å; S258-E260 WeakPolarHBondContact CB-OE2 3.45Å; S258-E260 PolarHBondContact O-N 3.41Å; S258-F261 PolarHBondContact O-N 2.94Å; S258-F261 WeakPolarHBondContact OG-CB 3.43Å; S258-F261 PolarHBondContact OG-N 3.41Å; S258-I262 VanDerWaalsContact O-CG1 3.31Å; S258-I262 WeakPolarHBondContact O-CG1 3.49Å; S258-I262 PolarHBondContact O-N 2.98Å; S258-I262 VanDerWaalsContact O-N 3.07Å
259	A	97.6	Very high	97.7	Very high	71 Å²	71	54.1 Å²	54.1	59%	0.587	30%	0.301	S	S	*	.	H	α-helix	trans	-61.6	-35.2	176.1	0	0	0	0	0	110.8	I262 D263	A259-I262 PolarHBondContact O-N 3.27Å; A259-D263 VanDerWaalsContact O-CB 3.28Å; A259-D263 WeakPolarHBondContact O-CB 3.46Å; A259-D263 PolarHBondContact O-N 2.94Å
260	E	97.5	Very high	97.7	Very high	90 Å²	90	55 Å²	55	42%	0.421	31%	0.306	S	S	.	.	H	α-helix	trans	-63.6	-42.6	177.5	-65.3	78.7	-176.3	0	0	112	S258 F264 H285 V286 F287	S258-E260 WeakPolarHBondContact CB-OE2 3.45Å; S258-E260 PolarHBondContact O-N 3.41Å; E260-F264 WeakPolarHBondContact O-CB 3.37Å; E260-F264 PolarHBondContact O-N 2.99Å; E260-H285 PolarHBondContact O-CE1 3.25Å; E260-V286 HydrophobicContact CB-CG1 3.92Å; E260-V286 HydrophobicContact CG-CG1 3.64Å; E260-V286 HydrophobicContact CG-CG2 4.33Å; E260-F287 HydrophobicContact CB-CB 4.41Å; E260-F287 HydrophobicContact CB-CD2 4.4Å
261	F	98	Very high	97.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-71.5	-40.4	177.9	-171.4	-155.5	0	0	0	111.9	E130 I133 L137 A221 A225 F251 W257 S258 D263 F264 V265 F287	E130-F261 HydrophobicContact CG-CD1 3.78Å; E130-F261 HydrophobicContact CG-CE1 4.36Å; E130-F261 HydrophobicContact CG-CG 4.39Å; I133-F261 HydrophobicContact CD1-CE1 3.99Å; I133-F261 HydrophobicContact CD1-CZ 3.92Å; I133-F261 HydrophobicContact CG2-CE2 3.94Å; I133-F261 HydrophobicContact CG2-CZ 3.79Å; L137-F261 HydrophobicContact CD1-CE2 4.46Å; A221-F261 HydrophobicContact CB-CE2 4.01Å; A221-F261 HydrophobicContact CB-CZ 4.23Å; A225-F261 HydrophobicContact CB-CE1 4.07Å; A225-F261 HydrophobicContact CB-CZ 4.34Å; F251-F261 AromaticContact CE1-CD1 3.96Å; F251-F261 HydrophobicContact CE1-CD1 3.96Å; F251-F261 AromaticContact CE1-CE1 3.53Å; F251-F261 HydrophobicContact CE1-CE1 3.53Å; F251-F261 HydrophobicContact CE1-CZ 4.02Å; F251-F261 AromaticContact CZ-CD1 3.59Å; F251-F261 HydrophobicContact CZ-CD1 3.59Å; F251-F261 HydrophobicContact CZ-CD2 4.25Å; F251-F261 AromaticContact CZ-CE1 3.47Å; F251-F261 HydrophobicContact CZ-CE1 3.47Å; F251-F261 VanDerWaalsContact CZ-CE1 3.47Å; F251-F261 HydrophobicContact CZ-CE2 4.14Å; F251-F261 AromaticContact CZ-CG 3.99Å; F251-F261 HydrophobicContact CZ-CG 3.99Å; F251-F261 AromaticContact CZ-CZ 3.75Å; F251-F261 HydrophobicContact CZ-CZ 3.75Å; W257-F261 HydrophobicContact CB-CD1 4.26Å; W257-F261 HydrophobicContact CD2-CD1 4.12Å; W257-F261 HydrophobicContact CD2-CE1 4.23Å; W257-F261 AromaticContact CE3-CD1 3.68Å; W257-F261 HydrophobicContact CE3-CD1 3.68Å; W257-F261 AromaticContact CE3-CE1 3.74Å; W257-F261 HydrophobicContact CE3-CE1 3.74Å; W257-F261 HydrophobicContact CG-CD1 4.38Å; W257-F261 HydrophobicContact CZ3-CD1 4.41Å; W257-F261 HydrophobicContact CZ3-CE1 4.08Å; S258-F261 PolarHBondContact O-N 2.94Å; S258-F261 WeakPolarHBondContact OG-CB 3.43Å; S258-F261 PolarHBondContact OG-N 3.41Å; F261-D263 VanDerWaalsContact C-N 3.31Å; F261-D263 PolarHBondContact O-N 3.46Å; F261-F264 PolarHBondContact O-N 3.44Å; F261-V265 HydrophobicContact CD2-CG2 4.08Å; F261-V265 HydrophobicContact CE2-CG2 3.77Å; F261-V265 HydrophobicContact CZ-CG2 4.37Å; F261-V265 PolarHBondContact O-N 2.84Å; F261-F287 HydrophobicContact CB-CD2 3.74Å; F261-F287 HydrophobicContact CB-CE1 4.49Å; F261-F287 HydrophobicContact CB-CE2 3.45Å; F261-F287 VanDerWaalsContact CB-CE2 3.45Å; F261-F287 HydrophobicContact CB-CG 4.41Å; F261-F287 HydrophobicContact CB-CZ 3.88Å; F261-F287 HydrophobicContact CD1-CE2 4.45Å; F261-F287 HydrophobicContact CD1-CZ 4.18Å; F261-F287 AromaticContact CD2-CD1 3.8Å; F261-F287 HydrophobicContact CD2-CD1 3.8Å; F261-F287 HydrophobicContact CD2-CD2 4.24Å; F261-F287 AromaticContact CD2-CE1 3.24Å; F261-F287 HydrophobicContact CD2-CE1 3.24Å; F261-F287 AromaticContact CD2-CE2 3.77Å; F261-F287 HydrophobicContact CD2-CE2 3.77Å; F261-F287 HydrophobicContact CD2-CG 4.28Å; F261-F287 AromaticContact CD2-CZ 3.23Å; F261-F287 HydrophobicContact CD2-CZ 3.23Å; F261-F287 HydrophobicContact CE2-CD1 4.41Å; F261-F287 AromaticContact CE2-CE1 3.58Å; F261-F287 HydrophobicContact CE2-CE1 3.58Å; F261-F287 AromaticContact CE2-CZ 3.74Å; F261-F287 HydrophobicContact CE2-CZ 3.74Å; F261-F287 HydrophobicContact CG-CD2 4.27Å; F261-F287 HydrophobicContact CG-CE1 4.01Å; F261-F287 AromaticContact CG-CE2 3.65Å; F261-F287 HydrophobicContact CG-CE2 3.65Å; F261-F287 AromaticContact CG-CZ 3.5Å; F261-F287 HydrophobicContact CG-CZ 3.5Å; F261-F287 HydrophobicContact CZ-CZ 4.39Å
262	I	98.5	Very high	97.6	Very high	48 Å²	48	57.5 Å²	57.5	25%	0.246	31%	0.311	C	S	.	.	H	α-helix	trans	-59.1	-45.4	174.4	-66.1	167.1	0	0	0	110.7	F251 P254 W257 S258 A259 V265 S266	F251-I262 HydrophobicContact CD2-CG1 3.93Å; F251-I262 HydrophobicContact CE2-CB 4.47Å; F251-I262 HydrophobicContact CE2-CG1 3.99Å; P254-I262 HydrophobicContact CB-CD1 4.16Å; P254-I262 WeakPolarHBondContact O-CD1 3.38Å; W257-I262 HydrophobicContact CB-CD1 4.33Å; W257-I262 HydrophobicContact CB-CG1 4.12Å; S258-I262 VanDerWaalsContact O-CG1 3.31Å; S258-I262 WeakPolarHBondContact O-CG1 3.49Å; S258-I262 PolarHBondContact O-N 2.98Å; S258-I262 VanDerWaalsContact O-N 3.07Å; A259-I262 PolarHBondContact O-N 3.27Å; I262-V265 PolarHBondContact O-N 3.38Å; I262-S266 WeakPolarHBondContact O-CB 3.39Å; I262-S266 PolarHBondContact O-N 3.29Å
263	D	98.3	Very high	97.5	Very high	79 Å²	79	52.5 Å²	52.5	42%	0.422	30%	0.296	S	S	.	.	H	α-helix	trans	-62	-48	177.6	-167.3	51.6	0	0	0	111	A259 F261 V265 S266 V267 H285	A259-D263 VanDerWaalsContact O-CB 3.28Å; A259-D263 WeakPolarHBondContact O-CB 3.46Å; A259-D263 PolarHBondContact O-N 2.94Å; F261-D263 VanDerWaalsContact C-N 3.31Å; F261-D263 PolarHBondContact O-N 3.46Å; D263-V265 VanDerWaalsContact C-N 3.34Å; D263-V265 PolarHBondContact O-N 2.89Å; D263-S266 WeakPolarHBondContact O-CA 3.35Å; D263-S266 WeakPolarHBondContact O-CB 3.29Å; D263-S266 PolarHBondContact O-N 3.19Å; D263-S266 PolarHBondContact O-OG 3.3Å; D263-V267 PolarHBondContact O-N 2.98Å; D263-H285 IonicContact OD2-CE1 3.04Å; D263-H285 IonicContact OD2-NE2 2.63Å; D263-H285 PolarHBondContact OD2-NE2 3.25Å; D263-H285 VanDerWaalsContact OD2-NE2 3.15Å
264	F	98.6	Very high	97.4	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-53.9	-47.8	177.2	-179.5	-88.9	0	0	0	112.3	L137 L141 L217 E260 F261 S266 V267 C268 L282 H285 F287 V288	L137-F264 HydrophobicContact CD1-CD1 4.19Å; L137-F264 HydrophobicContact CD1-CE1 3.63Å; L137-F264 HydrophobicContact CD1-CZ 4.15Å; L141-F264 HydrophobicContact CD1-CE2 4.03Å; L141-F264 HydrophobicContact CD1-CZ 4.05Å; L217-F264 HydrophobicContact CD2-CZ 4.32Å; E260-F264 WeakPolarHBondContact O-CB 3.37Å; E260-F264 PolarHBondContact O-N 2.99Å; F261-F264 PolarHBondContact O-N 3.44Å; F264-S266 VanDerWaalsContact C-N 3.34Å; F264-V267 WeakPolarHBondContact O-CG2 3.34Å; F264-C268 PolarHBondContact O-N 2.95Å; F264-C268 PolarHBondContact O-SG 2.89Å; F264-L282 HydrophobicContact CD2-CD2 4.35Å; F264-L282 HydrophobicContact CE2-CB 4.44Å; F264-L282 HydrophobicContact CE2-CD2 4.03Å; F264-H285 VanDerWaalsContact CA-CE1 3.47Å; F264-H285 WeakPolarHBondContact CA-CE1 3.5Å; F264-H285 HydrophobicContact CD2-CB 4.02Å; F264-H285 AromaticContact CD2-CG 3.75Å; F264-H285 AromaticContact CD2-ND1 3.63Å; F264-H285 HydrophobicContact CE2-CB 4.46Å; F264-H285 PolarHBondContact N-CE1 3.01Å; F264-H285 PolarHBondContact N-NE2 3.25Å; F264-F287 HydrophobicContact CB-CB 3.94Å; F264-F287 HydrophobicContact CB-CD1 4.03Å; F264-F287 HydrophobicContact CB-CG 4.18Å; F264-F287 HydrophobicContact CD1-CD1 4.19Å; F264-F287 HydrophobicContact CD2-CB 4.29Å; F264-F287 HydrophobicContact CD2-CD1 4.23Å; F264-F287 HydrophobicContact CG-CB 4.3Å; F264-F287 AromaticContact CG-CD1 3.87Å; F264-F287 HydrophobicContact CG-CD1 3.87Å; F264-F287 HydrophobicContact CG-CG 4.44Å; F264-V288 HydrophobicContact CD2-CG1 4.29Å; F264-V288 HydrophobicContact CE2-CG1 3.82Å; F264-V288 HydrophobicContact CE2-CG2 4.32Å; F264-V288 HydrophobicContact CZ-CG1 4.27Å
265	V	98.7	Very high	97.4	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.012	31%	0.313	C	S	.	.	H	α-helix	trans	-66.3	-39.4	177.9	171.9	0	0	0	0	110.8	A221 L222 F251 F261 I262 D263 V267 C268 L269	A221-V265 HydrophobicContact CB-CG2 3.89Å; L222-V265 HydrophobicContact CD1-CG1 4.2Å; L222-V265 HydrophobicContact CD2-CG1 3.99Å; L222-V265 HydrophobicContact CG-CG1 3.93Å; F251-V265 HydrophobicContact CE2-CB 3.94Å; F251-V265 HydrophobicContact CE2-CG1 4.28Å; F251-V265 HydrophobicContact CE2-CG2 3.8Å; F251-V265 HydrophobicContact CZ-CB 4.31Å; F251-V265 HydrophobicContact CZ-CG2 3.65Å; F261-V265 HydrophobicContact CD2-CG2 4.08Å; F261-V265 HydrophobicContact CE2-CG2 3.77Å; F261-V265 HydrophobicContact CZ-CG2 4.37Å; F261-V265 PolarHBondContact O-N 2.84Å; I262-V265 PolarHBondContact O-N 3.38Å; D263-V265 VanDerWaalsContact C-N 3.34Å; D263-V265 PolarHBondContact O-N 2.89Å; V265-V267 PolarHBondContact O-N 2.91Å; V265-C268 PolarHBondContact O-N 2.94Å; V265-L269 HydrophobicContact CG1-CD1 3.58Å; V265-L269 HydrophobicContact CG1-CG 4.18Å; V265-L269 WeakPolarHBondContact O-CB 3.15Å; V265-L269 WeakPolarHBondContact O-CG 3.48Å; V265-L269 PolarHBondContact O-N 3.16Å
266	S	98.4	Very high	97.5	Very high	62 Å²	62	48.6 Å²	48.6	43%	0.434	27%	0.272	S	S	.	.	H	α-helix	trans	-64	-39	-179.1	83.6	0	0	0	0	112.9	I262 D263 F264 L269	I262-S266 WeakPolarHBondContact O-CB 3.39Å; I262-S266 PolarHBondContact O-N 3.29Å; D263-S266 WeakPolarHBondContact O-CA 3.35Å; D263-S266 WeakPolarHBondContact O-CB 3.29Å; D263-S266 PolarHBondContact O-N 3.19Å; D263-S266 PolarHBondContact O-OG 3.3Å; F264-S266 VanDerWaalsContact C-N 3.34Å; S266-L269 PolarHBondContact O-N 3.27Å
267	V	98.3	Very high	97.5	Very high	40 Å²	40	44.7 Å²	44.7	24%	0.242	25%	0.252	C	S	.	.	H	α-helix	trans	-73.2	-30.3	177.5	-61.7	0	0	0	0	112.1	D263 F264 V265 V270 P277 L282	D263-V267 PolarHBondContact O-N 2.98Å; F264-V267 WeakPolarHBondContact O-CG2 3.34Å; V265-V267 PolarHBondContact O-N 2.91Å; V267-V270 WeakPolarHBondContact O-CG2 3.43Å; V267-P277 HydrophobicContact CB-CG 4.41Å; V267-P277 WeakPolarHBondContact O-CD 3.47Å; V267-L282 HydrophobicContact CG2-CD2 3.66Å
268	C	98.6	Very high	97.5	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.5	-39	172.1	-67	0	0	0	0	112	I214 F264 V265 V270 R276	I214-C268 HydrophobicContact CG2-CB 4.29Å; F264-C268 PolarHBondContact O-N 2.95Å; F264-C268 PolarHBondContact O-SG 2.89Å; V265-C268 PolarHBondContact O-N 2.94Å; C268-V270 VanDerWaalsContact C-N 3.28Å; C268-V270 PolarHBondContact O-N 3.22Å; C268-R276 VanDerWaalsContact O-CD 3.29Å; C268-R276 WeakPolarHBondContact O-CD 3.34Å; C268-R276 PolarHBondContact O-NE 3.35Å
269	L	98.6	Very high	97.5	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.016	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	39.6	-172.6	-60.4	-178.8	0	0	0	113.6	W215 I219 L222 P248 P249 V265 S266	W215-L269 HydrophobicContact CD2-CD2 3.91Å; W215-L269 HydrophobicContact CE3-CB 4.49Å; W215-L269 HydrophobicContact CE3-CD2 4.12Å; W215-L269 HydrophobicContact CG-CD2 4.29Å; W215-L269 HydrophobicContact CZ2-CD2 4.45Å; W215-L269 HydrophobicContact CZ3-CB 4.3Å; W215-L269 HydrophobicContact CZ3-CD2 4.47Å; I219-L269 HydrophobicContact CD1-CD1 4.32Å; I219-L269 HydrophobicContact CD1-CD2 3.73Å; I219-L269 HydrophobicContact CG1-CD2 3.94Å; L222-L269 HydrophobicContact CD1-CD1 3.85Å; P248-L269 HydrophobicContact CB-CB 4.08Å; P248-L269 WeakPolarHBondContact CB-O 3.41Å; P248-L269 WeakPolarHBondContact CG-O 3.34Å; P249-L269 HydrophobicContact CG-CD1 3.99Å; P249-L269 WeakPolarHBondContact O-CD1 3.42Å; V265-L269 HydrophobicContact CG1-CD1 3.58Å; V265-L269 HydrophobicContact CG1-CG 4.18Å; V265-L269 WeakPolarHBondContact O-CB 3.15Å; V265-L269 WeakPolarHBondContact O-CG 3.48Å; V265-L269 PolarHBondContact O-N 3.16Å; S266-L269 PolarHBondContact O-N 3.27Å
270	V	98	Very high	97.5	Very high	44 Å²	44	45.8 Å²	45.8	27%	0.267	25%	0.247	S	C	.	.			trans	-82.8	125.9	171.5	-179.6	0	0	0	0	109.8	V267 C268 D275 R276	V267-V270 WeakPolarHBondContact O-CG2 3.43Å; C268-V270 VanDerWaalsContact C-N 3.28Å; C268-V270 PolarHBondContact O-N 3.22Å; V270-D275 HydrophobicContact CG1-CB 3.71Å; V270-R276 HydrophobicContact CB-CB 4.37Å; V270-R276 VanDerWaalsContact O-CZ 3.31Å; V270-R276 PolarHBondContact O-NE 2.93Å; V270-R276 PolarHBondContact O-NH2 3.11Å
271	K	96	Very high	97.5	Very high	61 Å²	61	46.7 Å²	46.7	27%	0.265	25%	0.251	S	S	.	.	S	Bend	trans	-70.5	-36.5	-173.9	-63	-171.8	68.8	170.3	0	113.5	P200 W215 P244 K246 P248 P273	P200-K271 HydrophobicContact CG-CB 4.41Å; P200-K271 HydrophobicContact CG-CG 4.33Å; W215-K271 HydrophobicContact CH2-CG 4.27Å; W215-K271 HydrophobicContact CZ3-CG 4.08Å; P244-K271 PolarHBondContact O-NZ 3.37Å; K246-K271 PolarHBondContact O-NZ 3.37Å; P248-K271 HydrophobicContact CG-CD 4.29Å; P248-K271 HydrophobicContact CG-CG 3.89Å; K271-P273 WeakPolarHBondContact O-CD 3.1Å
272	N	95.2	Very high	97.5	Very high	69 Å²	69	46.9 Å²	46.9	37%	0.369	25%	0.252	S	S	.	.	S	Bend	trans	-76.7	115.9	173.8	-176	12.1	0	0	0	108.4	D274 D275 R276	N272-D274 PolarHBondContact O-N 3.27Å; N272-D274 PolarHBondContact OD1-N 3.19Å; N272-D275 HydrophobicContact CB-CB 4.33Å; N272-D275 WeakPolarHBondContact CB-OD2 3.25Å; N272-D275 PolarHBondContact ND2-OD2 3.27Å; N272-D275 PolarHBondContact O-N 3.46Å; N272-R276 PolarHBondContact O-N 3.35Å
273	P	94.9	Very high	97.4	Very high	29 Å²	29	47 Å²	47	19%	0.188	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-62.1	-28.7	-180	25.3	-34.9	0	0	0	112.7	E201 K211 K271 D275 R276	E201-P273 HydrophobicContact CB-CG 4.33Å; E201-P273 HydrophobicContact CG-CB 4.32Å; E201-P273 HydrophobicContact CG-CG 4.14Å; K211-P273 WeakPolarHBondContact CD-O 3.47Å; K211-P273 PolarHBondContact NZ-O 3.4Å; K271-P273 WeakPolarHBondContact O-CD 3.1Å; P273-D275 VanDerWaalsContact C-N 3.28Å; P273-D275 PolarHBondContact O-N 3.07Å; P273-R276 WeakPolarHBondContact O-CB 3.26Å; P273-R276 PolarHBondContact O-N 3.16Å
274	D	94.8	Very high	97.4	Very high	124 Å²	124	50.9 Å²	50.9	66%	0.663	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-63	-36.9	179	-68.1	-29.9	0	0	0	112.2	K211 N272	K211-D274 PolarHBondContact NZ-O 3.46Å; N272-D274 PolarHBondContact O-N 3.27Å; N272-D274 PolarHBondContact OD1-N 3.19Å
275	D	97	Very high	97.3	Very high	113 Å²	113	52.1 Å²	52.1	60%	0.604	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-85	-9.5	-179.8	-59.9	-40.7	0	0	0	112.9	V270 N272 P273	V270-D275 HydrophobicContact CG1-CB 3.71Å; N272-D275 HydrophobicContact CB-CB 4.33Å; N272-D275 WeakPolarHBondContact CB-OD2 3.25Å; N272-D275 PolarHBondContact ND2-OD2 3.27Å; N272-D275 PolarHBondContact O-N 3.46Å; P273-D275 VanDerWaalsContact C-N 3.28Å; P273-D275 PolarHBondContact O-N 3.07Å
276	R	97.5	Very high	97.3	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.008	29%	0.292	C	S	.	.	S	Bend	trans	-78.2	135.1	179.2	-163.8	-178.2	-56.2	142.4	5.8	109.3	E201 K211 I214 C268 V270 N272 P273	E201-R276 IonicContact OE1-CZ 2.85Å; E201-R276 IonicContact OE1-NH1 2.83Å; E201-R276 PolarHBondContact OE1-NH1 3.05Å; E201-R276 IonicContact OE1-NH2 3.75Å; E201-R276 PolarHBondContact OE1-NH2 3.05Å; E201-R276 IonicContact OE2-CZ 2.65Å; E201-R276 IonicContact OE2-NH1 2.7Å; E201-R276 IonicContact OE2-NH2 3.86Å; E201-R276 PolarHBondContact OE2-NH2 3.34Å; K211-R276 VanDerWaalsContact C-NH1 3.33Å; K211-R276 HydrophobicContact CD-CB 4.34Å; K211-R276 VanDerWaalsContact CD-O 3.27Å; K211-R276 WeakPolarHBondContact CD-O 3.26Å; K211-R276 WeakPolarHBondContact CE-O 3.47Å; K211-R276 PolarHBondContact NZ-O 2.94Å; K211-R276 WeakPolarHBondContact O-CD 3.28Å; K211-R276 PolarHBondContact O-NH1 3.28Å; I214-R276 HydrophobicContact CB-CG 4.28Å; I214-R276 HydrophobicContact CG2-CG 3.86Å; C268-R276 VanDerWaalsContact O-CD 3.29Å; C268-R276 WeakPolarHBondContact O-CD 3.34Å; C268-R276 PolarHBondContact O-NE 3.35Å; V270-R276 HydrophobicContact CB-CB 4.37Å; V270-R276 VanDerWaalsContact O-CZ 3.31Å; V270-R276 PolarHBondContact O-NE 2.93Å; V270-R276 PolarHBondContact O-NH2 3.11Å; N272-R276 PolarHBondContact O-N 3.35Å; P273-R276 WeakPolarHBondContact O-CB 3.26Å; P273-R276 PolarHBondContact O-N 3.16Å
277	P	97.9	Very high	97.2	Very high	24 Å²	24	53.1 Å²	53.1	16%	0.156	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-68.2	158.7	179.1	29.9	-36.1	0	0	0	111.4	V267 E281 L282	V267-P277 HydrophobicContact CB-CG 4.41Å; V267-P277 WeakPolarHBondContact O-CD 3.47Å; P277-E281 WeakPolarHBondContact CA-OE2 3.28Å; P277-E281 HydrophobicContact CB-CB 4.09Å; P277-L282 HydrophobicContact CB-CD2 4.34Å; P277-L282 HydrophobicContact CB-CG 4.02Å; P277-L282 HydrophobicContact CG-CD1 4.01Å; P277-L282 HydrophobicContact CG-CD2 3.67Å; P277-L282 HydrophobicContact CG-CG 3.66Å
278	T	98	Very high	97.1	Very high	46 Å²	46	51.3 Å²	51.3	28%	0.282	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-78.2	165.6	169.2	62.2	0	0	0	0	111.2	E280 E281 L282	T278-E280 PolarHBondContact O-N 3.12Å; T278-E281 WeakPolarHBondContact CB-OE2 3.4Å; T278-E281 PolarHBondContact N-OE2 2.74Å; T278-E281 PolarHBondContact O-N 3.3Å; T278-E281 WeakPolarHBondContact OG1-CG 3.5Å; T278-E281 PolarHBondContact OG1-N 2.63Å; T278-E281 PolarHBondContact OG1-OE2 2.84Å; T278-L282 PolarHBondContact O-N 3.25Å
279	A	97.8	Very high	96.9	Very high	2 Å²	2	54 Å²	54	2%	0.017	29%	0.287	C	S	.	.	H	α-helix	trans	-59.4	-34.4	173.5	0	0	0	0	0	112.3	L141 L144 Q145 I214 M283	L141-A279 HydrophobicContact CD2-CB 4.22Å; L144-A279 HydrophobicContact CB-CB 3.96Å; Q145-A279 HydrophobicContact CB-CB 4.08Å; I214-A279 HydrophobicContact CD1-CB 4.04Å; A279-M283 WeakPolarHBondContact O-CG 3.3Å; A279-M283 PolarHBondContact O-N 3.15Å
280	E	96.9	Very high	96.4	Very high	124 Å²	124	59.2 Å²	59.2	58%	0.579	32%	0.315	S	S	*	.	H	α-helix	trans	-66.4	-46.4	178.1	-179.4	165.4	-150.8	0	0	111.8	Q145 T278 L282 M283	Q145-E280 HydrophobicContact CG-CB 4.34Å; T278-E280 PolarHBondContact O-N 3.12Å; E280-L282 VanDerWaalsContact C-N 3.34Å; E280-L282 PolarHBondContact O-N 3.44Å; E280-M283 WeakPolarHBondContact O-CB 3.39Å; E280-M283 PolarHBondContact O-N 2.82Å
281	E	97.9	Very high	95.8	Very high	109 Å²	109	58.5 Å²	58.5	51%	0.509	31%	0.31	S	S	.	.	H	α-helix	trans	-64.8	-38	176.5	-69.2	160.7	142.1	0	0	111.8	P277 T278 M283 E284	P277-E281 WeakPolarHBondContact CA-OE2 3.28Å; P277-E281 HydrophobicContact CB-CB 4.09Å; T278-E281 WeakPolarHBondContact CB-OE2 3.4Å; T278-E281 PolarHBondContact N-OE2 2.74Å; T278-E281 PolarHBondContact O-N 3.3Å; T278-E281 WeakPolarHBondContact OG1-CG 3.5Å; T278-E281 PolarHBondContact OG1-N 2.63Å; T278-E281 PolarHBondContact OG1-OE2 2.84Å; E281-M283 VanDerWaalsContact C-N 3.28Å; E281-M283 PolarHBondContact O-N 2.73Å; E281-E284 PolarHBondContact O-N 3.37Å
282	L	98.1	Very high	94.7	Very high	4 Å²	4	61.6 Å²	61.6	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-68.2	-24.5	177.7	-78.7	174.3	0	0	0	113.9	L141 I214 F264 V267 P277 T278 E280 E284 H285 V288	L141-L282 HydrophobicContact CD1-CB 3.97Å; L141-L282 HydrophobicContact CD2-CB 3.65Å; L141-L282 HydrophobicContact CD2-CD1 3.94Å; L141-L282 HydrophobicContact CD2-CG 4.48Å; L141-L282 HydrophobicContact CG-CB 4.48Å; I214-L282 HydrophobicContact CD1-CD1 4.12Å; I214-L282 HydrophobicContact CG2-CD1 3.45Å; I214-L282 VanDerWaalsContact CG2-CD1 3.45Å; F264-L282 HydrophobicContact CD2-CD2 4.35Å; F264-L282 HydrophobicContact CE2-CB 4.44Å; F264-L282 HydrophobicContact CE2-CD2 4.03Å; V267-L282 HydrophobicContact CG2-CD2 3.66Å; P277-L282 HydrophobicContact CB-CD2 4.34Å; P277-L282 HydrophobicContact CB-CG 4.02Å; P277-L282 HydrophobicContact CG-CD1 4.01Å; P277-L282 HydrophobicContact CG-CD2 3.67Å; P277-L282 HydrophobicContact CG-CG 3.66Å; T278-L282 PolarHBondContact O-N 3.25Å; E280-L282 VanDerWaalsContact C-N 3.34Å; E280-L282 PolarHBondContact O-N 3.44Å; L282-E284 PolarHBondContact O-N 3.1Å; L282-H285 WeakPolarHBondContact O-CB 3.49Å; L282-H285 PolarHBondContact O-N 2.96Å; L282-H285 VanDerWaalsContact O-N 3.11Å; L282-V288 WeakPolarHBondContact O-CG2 3.41Å
283	M	96.3	Very high	94.1	Very high	51 Å²	51	63.1 Å²	63.1	25%	0.251	35%	0.346	S	S	.	.	H	α-helix	trans	-64.2	-23.9	173.9	-76.4	-69.6	-65.4	0	0	112.5	R138 L141 T142 A279 E280 E281 H285	R138-M283 HydrophobicContact CG-CE 4.06Å; R138-M283 HydrophobicContact CG-SD 4.4Å; L141-M283 HydrophobicContact CB-CG 3.98Å; L141-M283 HydrophobicContact CB-SD 3.42Å; L141-M283 WeakPolarHBondContact CB-SD 3.14Å; L141-M283 HydrophobicContact CD1-SD 4.17Å; L141-M283 HydrophobicContact CG-SD 4.44Å; T142-M283 WeakPolarHBondContact OG1-CE 3.39Å; A279-M283 WeakPolarHBondContact O-CG 3.3Å; A279-M283 PolarHBondContact O-N 3.15Å; E280-M283 WeakPolarHBondContact O-CB 3.39Å; E280-M283 PolarHBondContact O-N 2.82Å; E281-M283 VanDerWaalsContact C-N 3.28Å; E281-M283 PolarHBondContact O-N 2.73Å; M283-H285 VanDerWaalsContact C-N 3.33Å
284	E	97.1	Very high	93.8	Very high	160 Å²	160	63 Å²	63	75%	0.748	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-8.7	176.4	-56.6	-172.7	164.9	0	0	112.8	E281 L282 V286	E281-E284 PolarHBondContact O-N 3.37Å; L282-E284 PolarHBondContact O-N 3.1Å; E284-V286 PolarHBondContact O-N 2.77Å
285	H	98.1	Very high	93.7	Very high	25 Å²	25	59.3 Å²	59.3	12%	0.116	33%	0.33	C	S	.	.	S	Bend	trans	-65.4	133.9	-178.5	-168.1	-78	0	0	0	111.3	E260 D263 F264 L282 M283 F287 V288 A289	E260-H285 PolarHBondContact O-CE1 3.25Å; D263-H285 IonicContact OD2-CE1 3.04Å; D263-H285 IonicContact OD2-NE2 2.63Å; D263-H285 PolarHBondContact OD2-NE2 3.25Å; D263-H285 VanDerWaalsContact OD2-NE2 3.15Å; F264-H285 VanDerWaalsContact CA-CE1 3.47Å; F264-H285 WeakPolarHBondContact CA-CE1 3.5Å; F264-H285 HydrophobicContact CD2-CB 4.02Å; F264-H285 AromaticContact CD2-CG 3.75Å; F264-H285 AromaticContact CD2-ND1 3.63Å; F264-H285 HydrophobicContact CE2-CB 4.46Å; F264-H285 PolarHBondContact N-CE1 3.01Å; F264-H285 PolarHBondContact N-NE2 3.25Å; L282-H285 WeakPolarHBondContact O-CB 3.49Å; L282-H285 PolarHBondContact O-N 2.96Å; L282-H285 VanDerWaalsContact O-N 3.11Å; M283-H285 VanDerWaalsContact C-N 3.33Å; H285-F287 PolarHBondContact ND1-N 3.33Å; H285-F287 PolarHBondContact O-N 3.02Å; H285-V288 HydrophobicContact CB-CG2 4.34Å; H285-V288 WeakPolarHBondContact O-CG2 3.38Å; H285-V288 PolarHBondContact O-N 2.85Å; H285-A289 WeakPolarHBondContact O-CB 3.49Å; H285-A289 PolarHBondContact O-N 3.2Å
286	V	96.9	Very high	93.4	Very high	67 Å²	67	55 Å²	55	41%	0.406	31%	0.31	S	S	.	.	H	α-helix	trans	-50.5	-37.2	-172.4	65	0	0	0	0	114	E260 E284 V288 N290	E260-V286 HydrophobicContact CB-CG1 3.92Å; E260-V286 HydrophobicContact CG-CG1 3.64Å; E260-V286 HydrophobicContact CG-CG2 4.33Å; E284-V286 PolarHBondContact O-N 2.77Å; V286-V288 PolarHBondContact O-N 3.29Å; V286-N290 WeakPolarHBondContact CG2-ND2 3.32Å; V286-N290 PolarHBondContact O-ND2 3.15Å
287	F	97.2	Very high	93.3	Very high	18 Å²	18	54.9 Å²	54.9	8%	0.079	31%	0.31	C	S	.	.	H	α-helix	trans	-60	-38.6	178.3	-174.2	-114.5	0	0	0	113.8	E130 I133 A134 L137 E260 F261 F264 H285	E130-F287 HydrophobicContact CB-CE2 4.06Å; E130-F287 HydrophobicContact CB-CZ 4.28Å; E130-F287 HydrophobicContact CG-CE2 4.3Å; I133-F287 HydrophobicContact CG2-CE1 4.12Å; I133-F287 HydrophobicContact CG2-CZ 4.24Å; A134-F287 HydrophobicContact CB-CD1 4.43Å; A134-F287 HydrophobicContact CB-CE1 3.96Å; A134-F287 HydrophobicContact CB-CE2 4.32Å; A134-F287 HydrophobicContact CB-CZ 3.89Å; L137-F287 HydrophobicContact CD1-CE1 3.96Å; E260-F287 HydrophobicContact CB-CB 4.41Å; E260-F287 HydrophobicContact CB-CD2 4.4Å; F261-F287 HydrophobicContact CB-CD2 3.74Å; F261-F287 HydrophobicContact CB-CE1 4.49Å; F261-F287 HydrophobicContact CB-CE2 3.45Å; F261-F287 VanDerWaalsContact CB-CE2 3.45Å; F261-F287 HydrophobicContact CB-CG 4.41Å; F261-F287 HydrophobicContact CB-CZ 3.88Å; F261-F287 HydrophobicContact CD1-CE2 4.45Å; F261-F287 HydrophobicContact CD1-CZ 4.18Å; F261-F287 AromaticContact CD2-CD1 3.8Å; F261-F287 HydrophobicContact CD2-CD1 3.8Å; F261-F287 HydrophobicContact CD2-CD2 4.24Å; F261-F287 AromaticContact CD2-CE1 3.24Å; F261-F287 HydrophobicContact CD2-CE1 3.24Å; F261-F287 AromaticContact CD2-CE2 3.77Å; F261-F287 HydrophobicContact CD2-CE2 3.77Å; F261-F287 HydrophobicContact CD2-CG 4.28Å; F261-F287 AromaticContact CD2-CZ 3.23Å; F261-F287 HydrophobicContact CD2-CZ 3.23Å; F261-F287 HydrophobicContact CE2-CD1 4.41Å; F261-F287 AromaticContact CE2-CE1 3.58Å; F261-F287 HydrophobicContact CE2-CE1 3.58Å; F261-F287 AromaticContact CE2-CZ 3.74Å; F261-F287 HydrophobicContact CE2-CZ 3.74Å; F261-F287 HydrophobicContact CG-CD2 4.27Å; F261-F287 HydrophobicContact CG-CE1 4.01Å; F261-F287 AromaticContact CG-CE2 3.65Å; F261-F287 HydrophobicContact CG-CE2 3.65Å; F261-F287 AromaticContact CG-CZ 3.5Å; F261-F287 HydrophobicContact CG-CZ 3.5Å; F261-F287 HydrophobicContact CZ-CZ 4.39Å; F264-F287 HydrophobicContact CB-CB 3.94Å; F264-F287 HydrophobicContact CB-CD1 4.03Å; F264-F287 HydrophobicContact CB-CG 4.18Å; F264-F287 HydrophobicContact CD1-CD1 4.19Å; F264-F287 HydrophobicContact CD2-CB 4.29Å; F264-F287 HydrophobicContact CD2-CD1 4.23Å; F264-F287 HydrophobicContact CG-CB 4.3Å; F264-F287 AromaticContact CG-CD1 3.87Å; F264-F287 HydrophobicContact CG-CD1 3.87Å; F264-F287 HydrophobicContact CG-CG 4.44Å; H285-F287 PolarHBondContact ND1-N 3.33Å; H285-F287 PolarHBondContact O-N 3.02Å
288	V	96.6	Very high	93.2	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.018	32%	0.317	C	S	.	.	H	α-helix	trans	-103.4	-27.5	-178.4	-62.5	0	0	0	0	113	L137 R138 L141 F264 L282 H285 V286 N290 V291	L137-V288 HydrophobicContact CB-CG1 4.05Å; R138-V288 HydrophobicContact CB-CB 4.38Å; L141-V288 HydrophobicContact CD1-CB 4.49Å; L141-V288 HydrophobicContact CD1-CG1 4.21Å; L141-V288 HydrophobicContact CD1-CG2 3.97Å; F264-V288 HydrophobicContact CD2-CG1 4.29Å; F264-V288 HydrophobicContact CE2-CG1 3.82Å; F264-V288 HydrophobicContact CE2-CG2 4.32Å; F264-V288 HydrophobicContact CZ-CG1 4.27Å; L282-V288 WeakPolarHBondContact O-CG2 3.41Å; H285-V288 HydrophobicContact CB-CG2 4.34Å; H285-V288 WeakPolarHBondContact O-CG2 3.38Å; H285-V288 PolarHBondContact O-N 2.85Å; V286-V288 PolarHBondContact O-N 3.29Å; V288-N290 VanDerWaalsContact C-N 3.32Å; V288-N290 PolarHBondContact O-N 3.36Å; V288-V291 VanDerWaalsContact O-CG2 3.29Å; V288-V291 WeakPolarHBondContact O-CG2 3.48Å; V288-V291 PolarHBondContact O-N 3.26Å
289	A	94.6	Very high	93.1	Very high	55 Å²	55	60.5 Å²	60.5	46%	0.455	33%	0.332	S	S	.	.	H	α-helix	trans	-66.4	-32.7	-178.2	0	0	0	0	0	112.6	H285 V291	H285-A289 WeakPolarHBondContact O-CB 3.49Å; H285-A289 PolarHBondContact O-N 3.2Å; A289-V291 VanDerWaalsContact C-N 3.32Å; A289-V291 PolarHBondContact O-N 3.31Å
290	N	86.9	Confident	92.9	Very high	114 Å²	114	60.5 Å²	60.5	61%	0.61	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	6	-177	-70.4	-28.7	0	0	0	114.4	V286 V288 C292	V286-N290 WeakPolarHBondContact CG2-ND2 3.32Å; V286-N290 PolarHBondContact O-ND2 3.15Å; V288-N290 VanDerWaalsContact C-N 3.32Å; V288-N290 PolarHBondContact O-N 3.36Å; N290-C292 PolarHBondContact O-N 2.68Å; N290-C292 PolarHBondContact O-SG 2.77Å
291	V	85.4	Confident	92.8	Very high	28 Å²	28	54.7 Å²	54.7	17%	0.17	31%	0.305	C	S	.	.			trans	-72.9	100.7	-176.8	-179.7	0	0	0	0	111	A134 V135 R138 V288 A289	A134-V291 HydrophobicContact CB-CG2 3.41Å; A134-V291 VanDerWaalsContact CB-CG2 3.41Å; V135-V291 HydrophobicContact CB-CG1 4.22Å; V135-V291 HydrophobicContact CG2-CG1 3.38Å; R138-V291 PolarHBondContact NH1-O 3.26Å; V288-V291 VanDerWaalsContact O-CG2 3.29Å; V288-V291 WeakPolarHBondContact O-CG2 3.48Å; V288-V291 PolarHBondContact O-N 3.26Å; A289-V291 VanDerWaalsContact C-N 3.32Å; A289-V291 PolarHBondContact O-N 3.31Å
292	C	73.2	Confident	92.7	Very high	126 Å²	126	54.6 Å²	54.6	85%	0.851	30%	0.304	S	S	*	.			trans	-99.7	-19.1	-176.1	-62.8	0	0	0	0	114.3	N290	N290-C292 PolarHBondContact O-N 2.68Å; N290-C292 PolarHBondContact O-SG 2.77Å
293	N	82.3	Confident	92.5	Very high	101 Å²	101	57.1 Å²	57.1	54%	0.54	32%	0.316	S	S	.	.			trans	-140.1	138.4	-170.5	-173.9	5.1	0	0	0	111.5	V135 S295	V135-N293 WeakPolarHBondContact CG2-O 3.45Å; N293-S295 WeakPolarHBondContact ND2-CB 3.43Å; N293-S295 PolarHBondContact ND2-OG 2.68Å; N293-S295 VanDerWaalsContact OD1-CB 3.3Å; N293-S295 WeakPolarHBondContact OD1-CB 3.29Å; N293-S295 PolarHBondContact OD1-N 3.25Å; N293-S295 PolarHBondContact OD1-OG 3.26Å
294	S	89	Confident	92.3	Very high	26 Å²	26	54.7 Å²	54.7	18%	0.182	30%	0.304	C	S	.	.			trans	-102.3	9.3	176.1	-59.5	0	0	0	0	112.9	V135 A296 L297 I298	V135-S294 WeakPolarHBondContact CG1-OG 3.49Å; S294-A296 PolarHBondContact O-N 3.01Å; S294-L297 PolarHBondContact O-N 3.28Å; S294-L297 VanDerWaalsContact O-N 3.12Å; S294-I298 VanDerWaalsContact O-CG1 3.32Å; S294-I298 WeakPolarHBondContact O-CG1 3.48Å; S294-I298 PolarHBondContact O-N 3.32Å
295	S	92.3	Very high	92.1	Very high	47 Å²	47	49.9 Å²	49.9	33%	0.329	28%	0.283	S	S	.	.	H	α-helix	trans	-57.6	-44	-173.3	62.5	0	0	0	0	113.2	N293 L297 I298 E299	N293-S295 WeakPolarHBondContact ND2-CB 3.43Å; N293-S295 PolarHBondContact ND2-OG 2.68Å; N293-S295 VanDerWaalsContact OD1-CB 3.3Å; N293-S295 WeakPolarHBondContact OD1-CB 3.29Å; N293-S295 PolarHBondContact OD1-N 3.25Å; N293-S295 PolarHBondContact OD1-OG 3.26Å; S295-L297 VanDerWaalsContact C-N 3.31Å; S295-L297 PolarHBondContact O-N 2.59Å; S295-I298 PolarHBondContact O-N 3.28Å; S295-E299 WeakPolarHBondContact O-CG 3.39Å; S295-E299 PolarHBondContact O-N 3.39Å
296	A	92.5	Very high	91.8	Very high	22 Å²	22	55 Å²	55	18%	0.182	31%	0.307	C	S	.	.	H	α-helix	trans	-59.6	-43.3	177.5	0	0	0	0	0	111.5	D131 E132 S294 E299 A300	D131-A296 HydrophobicContact CB-CB 4.24Å; E132-A296 HydrophobicContact CG-CB 4.08Å; S294-A296 PolarHBondContact O-N 3.01Å; A296-E299 PolarHBondContact O-N 3.08Å; A296-A300 PolarHBondContact O-N 3.27Å
297	L	95.2	Very high	91.5	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-69.7	-36.5	177.1	-174.2	59.4	0	0	0	112.5	L120 E132 V135 I136 L164 A168 S294 S295 A300 I301	L120-L297 HydrophobicContact CD2-CD1 4.14Å; E132-L297 HydrophobicContact CB-CD1 4.48Å; V135-L297 HydrophobicContact CB-CD2 4.08Å; V135-L297 HydrophobicContact CG1-CD2 3.57Å; I136-L297 HydrophobicContact CD1-CD1 4.03Å; I136-L297 HydrophobicContact CD1-CD2 4.46Å; I136-L297 HydrophobicContact CG1-CD1 4.29Å; I136-L297 HydrophobicContact CG1-CD2 3.81Å; L164-L297 HydrophobicContact CD1-CD1 4.19Å; L164-L297 HydrophobicContact CD2-CD2 4.14Å; A168-L297 HydrophobicContact CB-CB 4.3Å; A168-L297 HydrophobicContact CB-CD2 4.01Å; A168-L297 HydrophobicContact CB-CG 3.96Å; S294-L297 PolarHBondContact O-N 3.28Å; S294-L297 VanDerWaalsContact O-N 3.12Å; S295-L297 VanDerWaalsContact C-N 3.31Å; S295-L297 PolarHBondContact O-N 2.59Å; L297-A300 WeakPolarHBondContact O-CB 3.35Å; L297-A300 PolarHBondContact O-N 2.88Å; L297-I301 HydrophobicContact CD1-CD1 4.4Å; L297-I301 HydrophobicContact CG-CD1 4.03Å; L297-I301 WeakPolarHBondContact O-CB 3.34Å; L297-I301 VanDerWaalsContact O-CG1 3.26Å; L297-I301 WeakPolarHBondContact O-CG1 3.19Å; L297-I301 PolarHBondContact O-N 3.24Å
298	I	95.3	Very high	91	Very high	61 Å²	61	56.5 Å²	56.5	31%	0.313	31%	0.311	S	S	.	.	H	α-helix	trans	-62	-45.2	174.2	-68.8	166.5	0	0	0	110.3	A168 S294 S295 I301 Q302	A168-I298 HydrophobicContact CB-CG1 3.56Å; S294-I298 VanDerWaalsContact O-CG1 3.32Å; S294-I298 WeakPolarHBondContact O-CG1 3.48Å; S294-I298 PolarHBondContact O-N 3.32Å; S295-I298 PolarHBondContact O-N 3.28Å; I298-I301 PolarHBondContact O-N 3.48Å; I298-Q302 HydrophobicContact CG2-CG 4.46Å; I298-Q302 VanDerWaalsContact O-CG 3.31Å; I298-Q302 WeakPolarHBondContact O-CG 3.29Å; I298-Q302 PolarHBondContact O-N 2.88Å
299	E	94.8	Very high	90.5	Very high	127 Å²	127	61.5 Å²	61.5	59%	0.593	33%	0.334	S	S	*	.	H	α-helix	trans	-61.2	-43.9	176.5	-73.1	174.9	-161.7	0	0	111.5	S295 A296 I301 Q302 E303	S295-E299 WeakPolarHBondContact O-CG 3.39Å; S295-E299 PolarHBondContact O-N 3.39Å; A296-E299 PolarHBondContact O-N 3.08Å; E299-I301 VanDerWaalsContact C-N 3.35Å; E299-I301 PolarHBondContact O-N 3.21Å; E299-Q302 PolarHBondContact O-N 3.42Å; E299-E303 PolarHBondContact O-N 2.78Å
300	A	95.1	Very high	90.2	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.008	34%	0.339	C	S	.	.	H	α-helix	trans	-59.4	-42.6	174.5	0	0	0	0	0	113.3	R124 E132 A296 L297 T304	R124-A300 VanDerWaalsContact CZ-CB 3.43Å; E132-A300 WeakPolarHBondContact OE1-CB 3.4Å; A296-A300 PolarHBondContact O-N 3.27Å; L297-A300 WeakPolarHBondContact O-CB 3.35Å; L297-A300 PolarHBondContact O-N 2.88Å; A300-T304 WeakPolarHBondContact O-CB 3.3Å; A300-T304 PolarHBondContact O-N 2.95Å; A300-T304 PolarHBondContact O-OG1 3.29Å
301	I	94.7	Very high	90	Very high	3 Å²	3	62.2 Å²	62.2	2%	0.015	33%	0.33	C	S	.	.	H	α-helix	trans	-65.6	-44.1	177	-73.2	166	0	0	0	110.2	A114 L120 L164 A168 L297 I298 E299 T304 L305	A114-I301 HydrophobicContact CB-CB 4.45Å; A114-I301 HydrophobicContact CB-CD1 4.44Å; A114-I301 HydrophobicContact CB-CG1 4.03Å; A114-I301 HydrophobicContact CB-CG2 3.76Å; L120-I301 HydrophobicContact CD1-CG1 4.18Å; L164-I301 HydrophobicContact CB-CD1 4.33Å; L164-I301 HydrophobicContact CD1-CD1 4.39Å; L164-I301 HydrophobicContact CD1-CG1 4.45Å; A168-I301 HydrophobicContact CB-CD1 3.7Å; L297-I301 HydrophobicContact CD1-CD1 4.4Å; L297-I301 HydrophobicContact CG-CD1 4.03Å; L297-I301 WeakPolarHBondContact O-CB 3.34Å; L297-I301 VanDerWaalsContact O-CG1 3.26Å; L297-I301 WeakPolarHBondContact O-CG1 3.19Å; L297-I301 PolarHBondContact O-N 3.24Å; I298-I301 PolarHBondContact O-N 3.48Å; E299-I301 VanDerWaalsContact C-N 3.35Å; E299-I301 PolarHBondContact O-N 3.21Å; I301-T304 WeakPolarHBondContact O-CB 3.25Å; I301-T304 PolarHBondContact O-N 2.91Å; I301-L305 HydrophobicContact CG2-CD1 3.96Å; I301-L305 HydrophobicContact CG2-CG 4.35Å; I301-L305 WeakPolarHBondContact O-CG 3.46Å; I301-L305 PolarHBondContact O-N 3.42Å
302	Q	94.9	Very high	89.7	Confident	106 Å²	106	64.1 Å²	64.1	50%	0.495	35%	0.345	S	S	.	.	H	α-helix	trans	-62.4	-44.6	177.1	-72.2	175.3	-0.2	0	0	112.1	I298 E299 T304 L305 Q306	I298-Q302 HydrophobicContact CG2-CG 4.46Å; I298-Q302 VanDerWaalsContact O-CG 3.31Å; I298-Q302 WeakPolarHBondContact O-CG 3.29Å; I298-Q302 PolarHBondContact O-N 2.88Å; E299-Q302 PolarHBondContact O-N 3.42Å; Q302-T304 VanDerWaalsContact C-N 3.27Å; Q302-T304 PolarHBondContact O-N 2.85Å; Q302-L305 PolarHBondContact O-N 3.38Å; Q302-Q306 VanDerWaalsContact O-CG 3.27Å; Q302-Q306 WeakPolarHBondContact O-CG 3.18Å; Q302-Q306 PolarHBondContact O-N 3.03Å
303	E	94.2	Very high	90	Very high	57 Å²	57	63.3 Å²	63.3	27%	0.266	33%	0.327	S	S	.	.	H	α-helix	trans	-55.7	-44.5	173.1	-175.7	-176.7	-170.7	0	0	110.5	R124 K126 E299 Q306 L307	R124-E303 HydrophobicContact CG-CG 4.49Å; R124-E303 IonicContact CZ-OE2 3.15Å; R124-E303 IonicContact NE-OE2 3.12Å; R124-E303 PolarHBondContact NE-OE2 3.24Å; R124-E303 IonicContact NH2-OE2 3.81Å; R124-E303 PolarHBondContact NH2-OE2 3.4Å; K126-E303 IonicContact NZ-OE1 3.89Å; K126-E303 PolarHBondContact NZ-OE1 2.68Å; K126-E303 IonicContact NZ-OE2 3.07Å; E299-E303 PolarHBondContact O-N 2.78Å; E303-Q306 PolarHBondContact O-N 2.92Å; E303-L307 HydrophobicContact CG-CD1 4.15Å; E303-L307 WeakPolarHBondContact O-CB 3.49Å; E303-L307 VanDerWaalsContact O-CG 3.28Å; E303-L307 WeakPolarHBondContact O-CG 3.47Å; E303-L307 PolarHBondContact O-N 3.11Å
304	T	92.5	Very high	89.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-65	-47	-179.5	-59.2	0	0	0	0	112.5	L120 I123 R124 A300 I301 Q302 Q306 L307 Q308	L120-T304 HydrophobicContact CD1-CG2 4.06Å; L120-T304 WeakPolarHBondContact CD1-OG1 3.41Å; I123-T304 HydrophobicContact CB-CG2 4.05Å; I123-T304 HydrophobicContact CD1-CG2 3.78Å; I123-T304 HydrophobicContact CG2-CG2 3.89Å; R124-T304 WeakPolarHBondContact CD-OG1 3.3Å; R124-T304 VanDerWaalsContact CG-OG1 3.29Å; R124-T304 WeakPolarHBondContact CG-OG1 3.29Å; A300-T304 WeakPolarHBondContact O-CB 3.3Å; A300-T304 PolarHBondContact O-N 2.95Å; A300-T304 PolarHBondContact O-OG1 3.29Å; I301-T304 WeakPolarHBondContact O-CB 3.25Å; I301-T304 PolarHBondContact O-N 2.91Å; Q302-T304 VanDerWaalsContact C-N 3.27Å; Q302-T304 PolarHBondContact O-N 2.85Å; T304-Q306 VanDerWaalsContact C-N 3.32Å; T304-Q306 PolarHBondContact O-N 3.3Å; T304-L307 PolarHBondContact O-N 3.42Å; T304-Q308 WeakPolarHBondContact O-CG 3.06Å; T304-Q308 PolarHBondContact O-N 3.41Å
305	L	91.6	Very high	89.1	Confident	59 Å²	59	66.2 Å²	66.2	31%	0.309	34%	0.34	S	S	.	.	H	α-helix	trans	-62.3	-39.7	178.2	-67.6	172.9	0	0	0	111.5	G113 T166 I301 Q302 Q308 E309	G113-L305 WeakPolarHBondContact O-CD2 3.45Å; T166-L305 HydrophobicContact CG2-CD1 4.31Å; I301-L305 HydrophobicContact CG2-CD1 3.96Å; I301-L305 HydrophobicContact CG2-CG 4.35Å; I301-L305 WeakPolarHBondContact O-CG 3.46Å; I301-L305 PolarHBondContact O-N 3.42Å; Q302-L305 PolarHBondContact O-N 3.38Å; L305-Q308 PolarHBondContact O-N 3.44Å; L305-E309 PolarHBondContact O-N 2.81Å
306	Q	92.5	Very high	88.1	Confident	133 Å²	133	68.2 Å²	68.2	62%	0.621	35%	0.347	S	S	*	.	H	α-helix	trans	-64	-43.7	175.2	-71.8	172.9	9.2	0	0	112.1	Q302 E303 T304 E309 L310	Q302-Q306 VanDerWaalsContact O-CG 3.27Å; Q302-Q306 WeakPolarHBondContact O-CG 3.18Å; Q302-Q306 PolarHBondContact O-N 3.03Å; E303-Q306 PolarHBondContact O-N 2.92Å; T304-Q306 VanDerWaalsContact C-N 3.32Å; T304-Q306 PolarHBondContact O-N 3.3Å; Q306-E309 PolarHBondContact O-N 2.86Å; Q306-L310 WeakPolarHBondContact O-CB 3.41Å; Q306-L310 PolarHBondContact O-N 3.29Å
307	L	91.5	Very high	86.8	Confident	53 Å²	53	74 Å²	74	28%	0.277	37%	0.368	S	S	.	.	H	α-helix	trans	-65	-38.8	177.2	-72.9	172.2	0	0	0	112.1	I123 E303 T304 L310 N311	I123-L307 HydrophobicContact CG2-CB 3.74Å; I123-L307 HydrophobicContact CG2-CD1 4.17Å; E303-L307 HydrophobicContact CG-CD1 4.15Å; E303-L307 WeakPolarHBondContact O-CB 3.49Å; E303-L307 VanDerWaalsContact O-CG 3.28Å; E303-L307 WeakPolarHBondContact O-CG 3.47Å; E303-L307 PolarHBondContact O-N 3.11Å; T304-L307 PolarHBondContact O-N 3.42Å; L307-L310 PolarHBondContact O-N 3.37Å; L307-N311 WeakPolarHBondContact O-CB 3.5Å; L307-N311 PolarHBondContact O-N 2.85Å; L307-N311 PolarHBondContact O-ND2 3.42Å
308	Q	86.7	Confident	85.3	Confident	63 Å²	63	77.1 Å²	77.1	29%	0.294	39%	0.386	S	S	.	.	H	α-helix	trans	-61.1	-47.4	173.7	-75.2	177.1	-24.9	0	0	111.4	I123 T304 L305 L310 N311 S312	I123-Q308 HydrophobicContact CD1-CG 3.82Å; I123-Q308 VanDerWaalsContact CD1-NE2 3.26Å; I123-Q308 HydrophobicContact CG2-CG 4.37Å; T304-Q308 WeakPolarHBondContact O-CG 3.06Å; T304-Q308 PolarHBondContact O-N 3.41Å; L305-Q308 PolarHBondContact O-N 3.44Å; Q308-L310 VanDerWaalsContact C-N 3.32Å; Q308-L310 PolarHBondContact O-N 2.89Å; Q308-N311 PolarHBondContact O-N 3.01Å; Q308-S312 PolarHBondContact O-N 2.98Å; Q308-S312 PolarHBondContact O-OG 2.95Å
309	E	86.5	Confident	83.5	Confident	108 Å²	108	78.5 Å²	78.5	51%	0.505	39%	0.392	S	S	.	.	H	α-helix	trans	-61.4	-41.1	178.2	-166	-171.1	166	0	0	111.8	L305 Q306 S312 K313	L305-E309 PolarHBondContact O-N 2.81Å; Q306-E309 PolarHBondContact O-N 2.86Å; E309-S312 PolarHBondContact O-N 3.47Å; E309-K313 WeakPolarHBondContact O-CG 3.35Å; E309-K313 PolarHBondContact O-N 3.3Å; E309-K313 WeakPolarHBondContact OE1-CE 3.4Å; E309-K313 IonicContact OE1-NZ 3.32Å; E309-K313 PolarHBondContact OE1-NZ 3.11Å
310	L	87.8	Confident	81.5	Confident	106 Å²	106	78.8 Å²	78.8	56%	0.555	39%	0.393	S	S	*	.	H	α-helix	trans	-63.2	-44.3	176.2	-174.9	64.4	0	0	0	111.8	Q306 L307 Q308 K313 L314	Q306-L310 WeakPolarHBondContact O-CB 3.41Å; Q306-L310 PolarHBondContact O-N 3.29Å; L307-L310 PolarHBondContact O-N 3.37Å; Q308-L310 VanDerWaalsContact C-N 3.32Å; Q308-L310 PolarHBondContact O-N 2.89Å; L310-K313 PolarHBondContact O-N 2.96Å; L310-L314 PolarHBondContact O-N 2.95Å
311	N	82	Confident	79.5	Confident	78 Å²	78	81.1 Å²	81.1	42%	0.417	41%	0.413	S	S	.	.	H	α-helix	trans	-65.2	-40.7	178.2	-72.7	-22	0	0	0	111.9	L307 Q308 L314 N315	L307-N311 WeakPolarHBondContact O-CB 3.5Å; L307-N311 PolarHBondContact O-N 2.85Å; L307-N311 PolarHBondContact O-ND2 3.42Å; Q308-N311 PolarHBondContact O-N 3.01Å; N311-L314 PolarHBondContact O-N 3.42Å; N311-N315 WeakPolarHBondContact O-CB 3.46Å; N311-N315 PolarHBondContact O-N 3.32Å
312	S	79	Confident	77.5	Confident	68 Å²	68	90.2 Å²	90.2	48%	0.476	45%	0.448	S	S	.	.	H	α-helix	trans	-61.6	-43.3	173.6	-63.9	0	0	0	0	111.8	Q308 E309 L314 N315 N316	Q308-S312 PolarHBondContact O-N 2.98Å; Q308-S312 PolarHBondContact O-OG 2.95Å; E309-S312 PolarHBondContact O-N 3.47Å; S312-L314 VanDerWaalsContact C-N 3.33Å; S312-L314 PolarHBondContact O-N 3.36Å; S312-N315 PolarHBondContact O-N 2.81Å; S312-N316 PolarHBondContact O-N 2.93Å; S312-N316 PolarHBondContact O-OD1 2.98Å
313	K	79.7	Confident	75.4	Confident	109 Å²	109	92.3 Å²	92.3	47%	0.474	46%	0.463	S	S	.	.	H	α-helix	trans	-63.7	-38	175.8	-73.6	171.9	-175.8	166.8	0	112.3	E309 L310 K317	E309-K313 WeakPolarHBondContact O-CG 3.35Å; E309-K313 PolarHBondContact O-N 3.3Å; E309-K313 WeakPolarHBondContact OE1-CE 3.4Å; E309-K313 IonicContact OE1-NZ 3.32Å; E309-K313 PolarHBondContact OE1-NZ 3.11Å; L310-K313 PolarHBondContact O-N 2.96Å; K313-K317 WeakPolarHBondContact O-CG 3.24Å; K313-K317 PolarHBondContact O-N 3.18Å
314	L	79.5	Confident	73.2	Confident	101 Å²	101	94 Å²	94	53%	0.529	48%	0.481	S	S	.	.	H	α-helix	trans	-68.9	-44.9	178	-171.3	64.2	0	0	0	111.3	L310 N311 S312 N316 K317 V318	L310-L314 PolarHBondContact O-N 2.95Å; N311-L314 PolarHBondContact O-N 3.42Å; S312-L314 VanDerWaalsContact C-N 3.33Å; S312-L314 PolarHBondContact O-N 3.36Å; L314-N316 VanDerWaalsContact C-N 3.33Å; L314-N316 PolarHBondContact O-N 3.47Å; L314-K317 WeakPolarHBondContact O-CB 3.41Å; L314-K317 PolarHBondContact O-N 3.22Å; L314-K317 VanDerWaalsContact O-N 3.13Å; L314-V318 WeakPolarHBondContact O-CG2 3.47Å; L314-V318 PolarHBondContact O-N 2.9Å
315	N	72.9	Confident	70.6	Confident	87 Å²	87	97.2 Å²	97.2	47%	0.465	51%	0.514	S	S	.	.	H	α-helix	trans	-59.5	-43.6	176.8	-75	-14	0	0	0	111.8	N311 S312 K317 V318 E319	N311-N315 WeakPolarHBondContact O-CB 3.46Å; N311-N315 PolarHBondContact O-N 3.32Å; S312-N315 PolarHBondContact O-N 2.81Å; N315-K317 VanDerWaalsContact C-N 3.32Å; N315-K317 PolarHBondContact O-N 3.05Å; N315-V318 PolarHBondContact O-N 3.5Å; N315-E319 WeakPolarHBondContact O-CG 3.49Å; N315-E319 PolarHBondContact O-N 3.36Å
316	N	70.6	Confident	68	Low	89 Å²	89	98.1 Å²	98.1	48%	0.476	53%	0.525	S	S	.	.	H	α-helix	trans	-63.3	-36.2	176.3	-67.6	-6.2	0	0	0	112.4	S312 L314 Q320	S312-N316 PolarHBondContact O-N 2.93Å; S312-N316 PolarHBondContact O-OD1 2.98Å; L314-N316 VanDerWaalsContact C-N 3.33Å; L314-N316 PolarHBondContact O-N 3.47Å; N316-Q320 WeakPolarHBondContact O-CB 3.45Å; N316-Q320 VanDerWaalsContact O-CG 3.26Å; N316-Q320 WeakPolarHBondContact O-CG 3.12Å; N316-Q320 PolarHBondContact O-N 3.44Å
317	K	66.5	Low	65	Low	144 Å²	144	97.3 Å²	97.3	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-69	-38.6	175.3	-77.3	-179	177.4	-176	0	112.5	K313 L314 N315 Q320 A321	K313-K317 WeakPolarHBondContact O-CG 3.24Å; K313-K317 PolarHBondContact O-N 3.18Å; L314-K317 WeakPolarHBondContact O-CB 3.41Å; L314-K317 PolarHBondContact O-N 3.22Å; L314-K317 VanDerWaalsContact O-N 3.13Å; N315-K317 VanDerWaalsContact C-N 3.32Å; N315-K317 PolarHBondContact O-N 3.05Å; K317-Q320 PolarHBondContact O-N 3.29Å; K317-A321 WeakPolarHBondContact O-CB 3.29Å; K317-A321 PolarHBondContact O-N 2.81Å
318	V	63.3	Low	62.2	Low	66 Å²	66	99.7 Å²	99.7	40%	0.4	55%	0.551	S	S	.	*	H	α-helix	trans	-65.5	-46.8	176.7	172.4	0	0	0	0	109.5	L314 N315 Q320 A321 Y322	L314-V318 WeakPolarHBondContact O-CG2 3.47Å; L314-V318 PolarHBondContact O-N 2.9Å; N315-V318 PolarHBondContact O-N 3.5Å; V318-Q320 VanDerWaalsContact C-N 3.34Å; V318-Q320 PolarHBondContact O-N 3.37Å; V318-A321 PolarHBondContact O-N 3.46Å; V318-A321 VanDerWaalsContact O-N 3.1Å; V318-Y322 HydrophobicContact CG1-CD2 3.6Å; V318-Y322 HydrophobicContact CG1-CE2 3.53Å; V318-Y322 VanDerWaalsContact O-CD2 3.29Å; V318-Y322 WeakPolarHBondContact O-CD2 3.5Å; V318-Y322 PolarHBondContact O-N 3.03Å
319	E	56.6	Low	59.6	Low	91 Å²	91	104.3 Å²	104.3	43%	0.425	58%	0.577	S	S	.	*	H	α-helix	trans	-57.3	-45.1	175.3	-74.3	175.8	-179.7	0	0	111.8	N315 A321 Y322 D323 K403	N315-E319 WeakPolarHBondContact O-CG 3.49Å; N315-E319 PolarHBondContact O-N 3.36Å; E319-A321 VanDerWaalsContact C-N 3.34Å; E319-A321 PolarHBondContact O-N 3.4Å; E319-Y322 PolarHBondContact O-N 2.85Å; E319-D323 PolarHBondContact O-N 3.11Å; E319-K403 IonicContact OE1-NZ 3.96Å; E319-K403 PolarHBondContact OE1-NZ 3.44Å
320	Q	53.2	Low	57.1	Low	132 Å²	132	105.1 Å²	105.1	62%	0.617	59%	0.589	S	S	*	*	H	α-helix	trans	-62.5	-36.1	174.7	-73.7	173.4	8.5	0	0	113.6	N316 K317 V318 S324	N316-Q320 WeakPolarHBondContact O-CB 3.45Å; N316-Q320 VanDerWaalsContact O-CG 3.26Å; N316-Q320 WeakPolarHBondContact O-CG 3.12Å; N316-Q320 PolarHBondContact O-N 3.44Å; K317-Q320 PolarHBondContact O-N 3.29Å; V318-Q320 VanDerWaalsContact C-N 3.34Å; V318-Q320 PolarHBondContact O-N 3.37Å; Q320-S324 WeakPolarHBondContact O-CB 3.13Å; Q320-S324 PolarHBondContact O-N 3.35Å; Q320-S324 VanDerWaalsContact O-N 3.1Å; Q320-S324 PolarHBondContact O-OG 2.87Å
321	A	52.4	Low	54.3	Low	51 Å²	51	105.6 Å²	105.6	42%	0.421	60%	0.598	S	S	.	*	H	α-helix	trans	-71.7	-36.7	178.4	0	0	0	0	0	112.4	K317 V318 E319 S324	K317-A321 WeakPolarHBondContact O-CB 3.29Å; K317-A321 PolarHBondContact O-N 2.81Å; V318-A321 PolarHBondContact O-N 3.46Å; V318-A321 VanDerWaalsContact O-N 3.1Å; E319-A321 VanDerWaalsContact C-N 3.34Å; E319-A321 PolarHBondContact O-N 3.4Å; A321-S324 PolarHBondContact O-N 3.26Å
322	Y	53.2	Low	52	Low	193 Å²	193	110.8 Å²	110.8	76%	0.757	62%	0.62	S	S	*	*	H	α-helix	trans	-64.6	-43.9	172.6	-89.2	-79.2	0	0	0	111.5	V318 E319 S324 G325	V318-Y322 HydrophobicContact CG1-CD2 3.6Å; V318-Y322 HydrophobicContact CG1-CE2 3.53Å; V318-Y322 VanDerWaalsContact O-CD2 3.29Å; V318-Y322 WeakPolarHBondContact O-CD2 3.5Å; V318-Y322 PolarHBondContact O-N 3.03Å; E319-Y322 PolarHBondContact O-N 2.85Å; Y322-S324 VanDerWaalsContact C-N 3.26Å; Y322-S324 PolarHBondContact O-N 2.85Å; Y322-G325 PolarHBondContact O-N 2.68Å
323	D	51	Low	49.8	Very low	150 Å²	150	114.4 Å²	114.4	80%	0.802	63%	0.634	S	S	*	*	H	α-helix	trans	-68.3	-27.2	-179.9	-137.7	17.6	0	0	0	112.5	E319 G325	E319-D323 PolarHBondContact O-N 3.11Å; D323-G325 VanDerWaalsContact C-N 3.27Å; D323-G325 PolarHBondContact O-N 3.38Å
324	S	49	Very low	47.3	Very low	94 Å²	94	118 Å²	118	66%	0.657	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	5.2	178.4	-56.6	0	0	0	0	114.2	Q320 A321 Y322 S326	Q320-S324 WeakPolarHBondContact O-CB 3.13Å; Q320-S324 PolarHBondContact O-N 3.35Å; Q320-S324 VanDerWaalsContact O-N 3.1Å; Q320-S324 PolarHBondContact O-OG 2.87Å; A321-S324 PolarHBondContact O-N 3.26Å; Y322-S324 VanDerWaalsContact C-N 3.26Å; Y322-S324 PolarHBondContact O-N 2.85Å; S324-S326 PolarHBondContact O-N 3.24Å
325	G	36.8	Very low	44.9	Very low	66 Å²	66	119.3 Å²	119.3	68%	0.68	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.5	15.7	175.2	0	0	0	0	0	115.5	Y322 D323 S327	Y322-G325 PolarHBondContact O-N 2.68Å; D323-G325 VanDerWaalsContact C-N 3.27Å; D323-G325 PolarHBondContact O-N 3.38Å; G325-S327 PolarHBondContact O-N 2.82Å; G325-S327 VanDerWaalsContact O-N 3.15Å
326	S	36.7	Very low	42.6	Very low	79 Å²	79	124.6 Å²	124.6	55%	0.552	69%	0.689	S	S	*	*			trans	-88.6	84.5	-176.9	-165.6	0	0	0	0	110.7	S324 T328	S324-S326 PolarHBondContact O-N 3.24Å; S326-T328 VanDerWaalsContact C-N 3.28Å; S326-T328 PolarHBondContact O-N 2.99Å; S326-T328 PolarHBondContact OG-OG1 2.89Å
327	S	29.9	Very low	40.5	Very low	116 Å²	116	125.8 Å²	125.8	81%	0.811	70%	0.7	S	S	*	*			trans	-67.1	87	167.6	-169	0	0	0	0	109.4	G325	G325-S327 PolarHBondContact O-N 2.82Å; G325-S327 VanDerWaalsContact O-N 3.15Å
328	T	34.1	Very low	38.5	Very low	103 Å²	103	123.1 Å²	123.1	63%	0.632	70%	0.699	S	S	*	*			trans	-114.8	94.3	172	-46.5	0	0	0	0	109.4	S326 V330	S326-T328 VanDerWaalsContact C-N 3.28Å; S326-T328 PolarHBondContact O-N 2.99Å; S326-T328 PolarHBondContact OG-OG1 2.89Å; T328-V330 PolarHBondContact O-N 3.19Å
329	L	31.4	Very low	36.8	Very low	159 Å²	159	127.2 Å²	127.2	83%	0.832	72%	0.724	S	S	*	*			trans	-68.1	121.3	166.5	-71.3	161.2	0	0	0	108.8
330	V	33.9	Very low	35.4	Very low	126 Å²	126	127.5 Å²	127.5	76%	0.764	73%	0.731	S	S	*	*			trans	-107.5	118.2	169.1	-170.6	0	0	0	0	108.4	T328	T328-V330 PolarHBondContact O-N 3.19Å
331	P	28.7	Very low	34.1	Very low	115 Å²	115	128.6 Å²	128.6	75%	0.747	74%	0.742	S	S	*	*			trans	-87.7	131.3	178.3	31.5	-28.3	0	0	0	111
332	Q	34.3	Very low	32.9	Very low	187 Å²	187	133.8 Å²	133.8	87%	0.874	76%	0.759	S	S	*	*			trans	-153	113.1	153.4	-113.3	171.6	4.5	0	0	111.8
333	D	32.4	Very low	31.5	Very low	145 Å²	145	131.3 Å²	131.3	78%	0.775	75%	0.752	S	S	*	*	S	Bend	trans	37.9	105.9	157.5	-63	-26.6	0	0	0	121.5
334	Q	27.8	Very low	30.3	Very low	183 Å²	183	130.3 Å²	130.3	86%	0.855	75%	0.752	S	S	*	*	S	Bend	trans	57	61.7	143.7	-56.2	-172.6	17.4	0	0	118.2
335	T	28.1	Very low	29.1	Very low	130 Å²	130	131.9 Å²	131.9	80%	0.798	75%	0.752	S	S	*	*				170.4	125	127.5	27	0	0	0	0	109	V337	T335-V337 PolarHBondContact O-N 3.37Å
336	M	25.2	Very low	28.6	Very low	198 Å²	198	133.8 Å²	133.8	98%	0.975	75%	0.751	S	S	*	*			trans	-73	114.3	169.9	-69	-138.3	-61.9	0	0	108.6
337	V	25.4	Very low	28.2	Very low	114 Å²	114	132 Å²	132	69%	0.691	74%	0.738	S	S	*	*			trans	-120.7	115.8	166.8	-173.6	0	0	0	0	108	T335 V339	T335-V337 PolarHBondContact O-N 3.37Å; V337-V339 PolarHBondContact O-N 3.48Å
338	S	25.7	Very low	28.1	Very low	88 Å²	88	129.5 Å²	129.5	62%	0.615	73%	0.73	S	S	*	*			trans	-60.5	125	170.8	55.7	0	0	0	0	109.4	V340	S338-V340 PolarHBondContact O-N 2.96Å
339	V	28.1	Very low	27.9	Very low	152 Å²	152	126.4 Å²	126.4	92%	0.921	71%	0.711	S	S	*	*	S	Bend	trans	-75.7	66.5	170.2	-171.2	0	0	0	0	108.6	V337	V337-V339 PolarHBondContact O-N 3.48Å
340	V	27.1	Very low	27.8	Very low	96 Å²	96	122.3 Å²	122.3	58%	0.582	69%	0.69	S	S	*	*			trans	-153.2	75.2	167.4	-114.8	0	0	0	0	106.1	S338	S338-V340 PolarHBondContact O-N 2.96Å
341	D	24.9	Very low	27.5	Very low	156 Å²	156	117.2 Å²	117.2	83%	0.834	66%	0.664	S	S	*	*			trans	-104.8	77.7	164.5	-132.9	-7.3	0	0	0	106.7
342	M	26.4	Very low	27.4	Very low	159 Å²	159	116.8 Å²	116.8	78%	0.783	65%	0.654	S	S	*	*			trans	-135.4	77.1	166.4	-92.6	-165.1	-178.2	0	0	108.1
343	K	24	Very low	27	Very low	142 Å²	142	112.2 Å²	112.2	62%	0.617	64%	0.643	S	S	*	*			trans	-123.1	91.3	157.5	-75.5	-167.3	174.2	-163.9	0	108	E397	K343-E397 IonicContact NZ-OE1 3.11Å; K343-E397 PolarHBondContact NZ-OE1 3.22Å; K343-E397 IonicContact NZ-OE2 3.36Å; K343-E397 PolarHBondContact NZ-OE2 3.36Å
344	T	26.2	Very low	26.8	Very low	128 Å²	128	111.7 Å²	111.7	79%	0.785	65%	0.645	S	S	*	*			trans	-150.3	90.5	157.8	-39.3	0	0	0	0	111.6
345	L	24.6	Very low	26.8	Very low	128 Å²	128	107.5 Å²	107.5	67%	0.67	64%	0.642	S	S	*	*			trans	51.4	84.9	138.4	-63.1	160	0	0	0	118.4
346	T	25.2	Very low	26.8	Very low	106 Å²	106	107.9 Å²	107.9	65%	0.65	64%	0.639	S	S	*	*			trans	-89.4	120	153.3	52.9	0	0	0	0	108.8
347	S	29.1	Very low	27.1	Very low	42 Å²	42	106 Å²	106	29%	0.294	63%	0.632	S	S	.	*			trans	-110.9	128.3	171.6	49.4	0	0	0	0	109.4
348	G	27	Very low	27.2	Very low	62 Å²	62	103.8 Å²	103.8	64%	0.639	63%	0.632	S	S	*	*			trans	-91.5	168.5	178.3	0	0	0	0	0	112.8
349	V	30.1	Very low	27.4	Very low	39 Å²	39	106.1 Å²	106.1	24%	0.236	65%	0.646	C	S	.	*			trans	-103.1	166.2	176.3	-132.8	0	0	0	0	109.4	Y48 E76 A178	Y48-V349 HydrophobicContact CE1-CG2 3.31Å; Y48-V349 VanDerWaalsContact CZ-CG2 3.45Å; Y48-V349 WeakPolarHBondContact OH-CG2 3.34Å; E76-V349 VanDerWaalsContact OE2-CB 3.23Å; E76-V349 WeakPolarHBondContact OE2-CB 3.33Å; E76-V349 WeakPolarHBondContact OE2-CG1 3.36Å; E76-V349 WeakPolarHBondContact OE2-CG2 3.45Å; A178-V349 HydrophobicContact CB-CB 4.12Å; A178-V349 HydrophobicContact CB-CG1 3.55Å; A178-V349 HydrophobicContact CB-CG2 3.39Å
350	N	29.9	Very low	27.3	Very low	72 Å²	72	106.5 Å²	106.5	39%	0.385	64%	0.641	S	S	.	*				177.6	120.8	126.3	-84.1	7.7	0	0	0	112.7	D73 K187	D73-N350 HydrophobicContact CB-CB 4.26Å; D73-N350 VanDerWaalsContact CB-CG 3.41Å; D73-N350 WeakPolarHBondContact CB-OD1 3.28Å; D73-N350 PolarHBondContact N-ND2 3.1Å; D73-N350 PolarHBondContact N-OD1 2.79Å; D73-N350 VanDerWaalsContact OD1-CB 3.31Å; D73-N350 WeakPolarHBondContact OD1-CB 3.26Å; D73-N350 PolarHBondContact OD1-ND2 3.31Å; D73-N350 WeakPolarHBondContact OD2-CA 3.42Å; D73-N350 WeakPolarHBondContact OD2-CB 3.33Å; D73-N350 PolarHBondContact OD2-OD1 3.35Å; K187-N350 PolarHBondContact NZ-O 3.26Å
351	G	27.3	Very low	27.4	Very low	20 Å²	20	111 Å²	111	21%	0.206	66%	0.656	C	S	.	*				99	109.7	125.3	0	0	0	0	0	123.7	D73 K187	D73-G351 WeakPolarHBondContact OD2-CA 3.46Å; D73-G351 PolarHBondContact OD2-N 3.29Å; K187-G351 PolarHBondContact NZ-O 3.02Å
352	L	26.6	Very low	27.4	Very low	106 Å²	106	112.7 Å²	112.7	56%	0.555	66%	0.659	S	S	*	*				92.5	105.4	127.8	-79	119.2	0	0	0	125.3
353	S	26.7	Very low	27.4	Very low	91 Å²	91	110.2 Å²	110.2	64%	0.636	66%	0.657	S	S	*	*				80.5	142.3	120.4	85.3	0	0	0	0	119
354	V	27	Very low	27.6	Very low	134 Å²	134	109.9 Å²	109.9	81%	0.812	67%	0.667	S	S	*	*			cis	-163.9	146.7	20.8	171.5	0	0	0	0	109.2
355	A	29	Very low	27.5	Very low	95 Å²	95	113.8 Å²	113.8	79%	0.785	67%	0.673	S	S	*	*				165.8	96.7	129.9	0	0	0	0	0	116
356	D	28.1	Very low	27.6	Very low	138 Å²	138	112.7 Å²	112.7	74%	0.738	68%	0.682	S	S	*	*			trans	18	128.6	135.4	-153.8	14.6	0	0	0	123.7
357	N	30	Very low	27.5	Very low	158 Å²	158	113.2 Å²	113.2	85%	0.845	69%	0.69	S	S	*	*				171.9	122.3	115.9	-91.7	-56.1	0	0	0	113.6
358	G	29.2	Very low	27.5	Very low	67 Å²	67	117.9 Å²	117.9	69%	0.691	71%	0.712	S	S	*	*			trans	153	126.5	158.7	0	0	0	0	0	115.6
359	P	28.9	Very low	27.5	Very low	137 Å²	137	119.5 Å²	119.5	89%	0.89	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-81	153.3	-156.8	32.3	-35.2	0	0	0	116
360	I	26.5	Very low	27.6	Very low	160 Å²	160	122.2 Å²	122.2	82%	0.821	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-83.5	133.4	175.3	-65	166.4	0	0	0	110
361	E	28.6	Very low	27.7	Very low	192 Å²	192	121.9 Å²	121.9	90%	0.897	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-97.9	129.2	155.4	-81.8	-170.9	156.9	0	0	110
362	E	24.3	Very low	28.1	Very low	191 Å²	191	126 Å²	126	89%	0.893	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-67.2	135.5	175.8	-71.5	177.7	121.7	0	0	112.2
363	S	27	Very low	28.4	Very low	106 Å²	106	123.8 Å²	123.8	74%	0.741	73%	0.729	S	S	*	*			trans	-156	126	136.2	55.4	0	0	0	0	113.7
364	T	27.9	Very low	29	Very low	135 Å²	135	121.3 Å²	121.3	83%	0.828	71%	0.709	S	S	*	*			trans	69.8	92.8	145.7	53.5	0	0	0	0	121.1
365	K	24.1	Very low	29.5	Very low	211 Å²	211	118 Å²	118	92%	0.917	70%	0.701	S	S	*	*			trans	-0.9	117	140.2	-66.7	175.8	177.5	176.1	0	118
366	A	26.6	Very low	29.9	Very low	105 Å²	105	121.3 Å²	121.3	87%	0.868	70%	0.701	S	S	*	*			trans	-142.6	106.4	137.7	0	0	0	0	0	108.1	N368	A366-N368 PolarHBondContact O-N 3.36Å
367	S	24.2	Very low	30	Very low	117 Å²	117	118 Å²	118	82%	0.818	70%	0.699	S	S	*	*			trans	-76.9	110.1	179.6	-73.8	0	0	0	0	110.7
368	N	27.8	Very low	30	Very low	140 Å²	140	113.7 Å²	113.7	75%	0.749	68%	0.678	S	S	*	*			trans	-123.5	99.6	153.7	-78.6	-16.1	0	0	0	107.2	A366	A366-N368 PolarHBondContact O-N 3.36Å
369	S	28.3	Very low	30	Very low	95 Å²	95	117 Å²	117	66%	0.664	69%	0.685	S	S	*	*			trans	-68.9	129.3	-175.6	48	0	0	0	0	112	V371	S369-V371 PolarHBondContact O-N 2.85Å
370	M	32.4	Very low	30	Very low	96 Å²	96	118.3 Å²	118.3	47%	0.473	68%	0.677	S	S	.	*			trans	-64.4	121.2	163.2	179.9	-179.6	-78.1	0	0	108.8	I81 I372	I81-M370 HydrophobicContact CG2-CE 4.37Å; M370-I372 HydrophobicContact CG-CG1 4.16Å; M370-I372 HydrophobicContact SD-CD1 4.25Å; M370-I372 HydrophobicContact SD-CG1 4.41Å
371	V	31.4	Very low	30	Very low	65 Å²	65	116.3 Å²	116.3	39%	0.394	68%	0.677	S	S	.	*			trans	-109.7	116.2	174.8	177.9	0	0	0	0	107	S369 I373	S369-V371 PolarHBondContact O-N 2.85Å; V371-I373 HydrophobicContact CG1-CD1 3.54Å; V371-I373 HydrophobicContact CG1-CG1 3.69Å
372	I	35.7	Very low	30.2	Very low	107 Å²	107	111.7 Å²	111.7	55%	0.549	67%	0.672	S	S	.	*			trans	-103.8	111.7	173.3	-56.7	174.9	0	0	0	106	F100 M370	F100-I372 HydrophobicContact CB-CG2 4.39Å; M370-I372 HydrophobicContact CG-CG1 4.16Å; M370-I372 HydrophobicContact SD-CD1 4.25Å; M370-I372 HydrophobicContact SD-CG1 4.41Å
373	I	33.3	Very low	30.3	Very low	59 Å²	59	109.3 Å²	109.3	30%	0.303	67%	0.67	S	S	.	*			trans	-115.9	121.2	174.5	-67.6	160	0	0	0	107.3	N30 V371	N30-I373 HydrophobicContact CB-CD1 4.11Å; N30-I373 WeakPolarHBondContact OD1-CD1 3.4Å; V371-I373 HydrophobicContact CG1-CD1 3.54Å; V371-I373 HydrophobicContact CG1-CG1 3.69Å
374	D	37.8	Very low	30.6	Very low	39 Å²	39	114 Å²	114	21%	0.209	68%	0.677	C	S	.	*			trans	-79.4	160.4	166.2	64	7.6	0	0	0	110.3	F100 E376 G377 T378	F100-D374 HydrophobicContact CD1-CB 4.44Å; D374-E376 PolarHBondContact O-N 3.07Å; D374-E376 PolarHBondContact OD1-N 2.7Å; D374-G377 PolarHBondContact O-N 3.2Å; D374-G377 VanDerWaalsContact O-N 3.08Å; D374-G377 PolarHBondContact OD1-N 3.18Å; D374-T378 PolarHBondContact OD1-N 2.77Å
375	G	37.4	Very low	30.5	Very low	64 Å²	64	116.3 Å²	116.3	66%	0.66	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	4.9	177.9	0	0	0	0	0	115.5
376	E	37.4	Very low	30.8	Very low	166 Å²	166	115.7 Å²	115.7	78%	0.776	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.5	9.8	177.2	-64	-167.4	154.9	0	0	113.5	D374 T378	D374-E376 PolarHBondContact O-N 3.07Å; D374-E376 PolarHBondContact OD1-N 2.7Å; E376-T378 VanDerWaalsContact C-N 3.33Å; E376-T378 PolarHBondContact O-N 2.88Å; E376-T378 PolarHBondContact O-OG1 2.96Å
377	G	30.2	Very low	30.8	Very low	67 Å²	67	116.3 Å²	116.3	69%	0.691	68%	0.677	S	S	*	*			trans	66.3	27.2	171.3	0	0	0	0	0	115	D374	D374-G377 PolarHBondContact O-N 3.2Å; D374-G377 VanDerWaalsContact O-N 3.08Å; D374-G377 PolarHBondContact OD1-N 3.18Å
378	T	30.6	Very low	31.2	Very low	68 Å²	68	115 Å²	115	42%	0.417	67%	0.673	S	S	.	*			trans	-119.4	119.3	-178.5	-49.1	0	0	0	0	112	D374 E376 K380	D374-T378 PolarHBondContact OD1-N 2.77Å; E376-T378 VanDerWaalsContact C-N 3.33Å; E376-T378 PolarHBondContact O-N 2.88Å; E376-T378 PolarHBondContact O-OG1 2.96Å; T378-K380 HydrophobicContact CG2-CG 4.22Å; T378-K380 PolarHBondContact O-N 3.32Å; T378-K380 VanDerWaalsContact O-N 3.16Å
379	V	28.8	Very low	31.3	Very low	136 Å²	136	115.2 Å²	115.2	82%	0.824	68%	0.68	S	S	*	*			trans	-69.4	109.2	171.3	-178.8	0	0	0	0	109.1
380	K	30.8	Very low	31.3	Very low	165 Å²	165	120 Å²	120	72%	0.717	69%	0.691	S	S	*	*			trans	-114.6	107.4	171.7	-75.1	-177.9	-179.2	164.3	0	111.6	T378	T378-K380 HydrophobicContact CG2-CG 4.22Å; T378-K380 PolarHBondContact O-N 3.32Å; T378-K380 VanDerWaalsContact O-N 3.16Å
381	S	26.4	Very low	31.2	Very low	118 Å²	118	121.1 Å²	121.1	83%	0.825	71%	0.709	S	S	*	*			trans	-80.3	122	153.9	65.7	0	0	0	0	108.6
382	A	32.6	Very low	31.1	Very low	96 Å²	96	124.2 Å²	124.2	79%	0.793	73%	0.73	S	S	*	*			trans	-155.5	96	164.1	0	0	0	0	0	112.1
383	V	26.5	Very low	30.8	Very low	141 Å²	141	124.2 Å²	124.2	86%	0.855	74%	0.74	S	S	*	*			trans	-65.4	127.2	149.1	173.2	0	0	0	0	107.5
384	K	32.8	Very low	30.7	Very low	204 Å²	204	129.6 Å²	129.6	89%	0.887	77%	0.768	S	S	*	*			trans	-164.7	117.9	145.7	-109.8	171	-174.7	-171.4	0	111.6
385	Q	25.9	Very low	30.1	Very low	184 Å²	184	138.8 Å²	138.8	86%	0.86	80%	0.8	S	S	*	*			trans	-64.6	140.8	164.9	-70.4	168.6	-44.4	0	0	109.9
386	E	31	Very low	30	Very low	198 Å²	198	144 Å²	144	93%	0.925	80%	0.8	S	S	*	*			trans	-157	132.5	142.5	-112.3	167.8	-151.7	0	0	110.5
387	S	25.5	Very low	29.6	Very low	118 Å²	118	143.3 Å²	143.3	83%	0.825	80%	0.796	S	S	*	*			trans	-88.7	141	-172.4	51.7	0	0	0	0	112.8
388	A	32.6	Very low	30.1	Very low	90 Å²	90	144.8 Å²	144.8	74%	0.744	79%	0.785	S	S	*	*			trans	-165	109.9	148.6	0	0	0	0	0	114.2
389	T	31	Very low	30	Very low	144 Å²	144	144.9 Å²	144.9	88%	0.883	80%	0.8	S	S	*	*			trans	55.8	122.7	136.7	51.6	0	0	0	0	122.9
390	E	26.9	Very low	30.1	Very low	194 Å²	194	142.4 Å²	142.4	91%	0.907	79%	0.794	S	S	*	*			trans	-68.6	154	178.7	-63	175.8	140.2	0	0	116.2
391	S	30.5	Very low	30.5	Very low	120 Å²	120	138.9 Å²	138.9	84%	0.839	79%	0.79	S	S	*	*			trans	-152.2	132.2	152.5	-66.6	0	0	0	0	108.9
392	P	29	Very low	31.1	Very low	130 Å²	130	138.9 Å²	138.9	84%	0.844	78%	0.777	S	S	*	*			trans	-98.8	135.2	-167.7	35.3	-29.6	0	0	0	112.4
393	S	30.1	Very low	31.5	Very low	107 Å²	107	141.4 Å²	141.4	75%	0.748	77%	0.77	S	S	*	*			trans	-161.5	112.6	156.7	56.3	0	0	0	0	115.7
394	L	30.8	Very low	32.1	Very low	172 Å²	172	140.8 Å²	140.8	90%	0.901	76%	0.756	S	S	*	*				57.7	99.2	128.8	-65.2	159.3	0	0	0	119.5
395	R	26.5	Very low	32.5	Very low	232 Å²	232	134.2 Å²	134.2	88%	0.875	73%	0.733	S	S	*	*			trans	-61.4	141	162.4	-70.4	179.2	174.4	-179.9	-3.4	112
396	R	33.3	Very low	32.9	Very low	174 Å²	174	130.3 Å²	130.3	66%	0.657	71%	0.71	S	S	*	*			trans	-140	123.4	157.2	-120.1	179.4	176.1	132.4	-6.7	110.3
397	E	30.2	Very low	33.2	Very low	151 Å²	151	122.7 Å²	122.7	71%	0.706	68%	0.678	S	S	*	*			trans	-67.7	126.6	168.3	-53	177.5	129.8	0	0	109.8	K343	K343-E397 IonicContact NZ-OE1 3.11Å; K343-E397 PolarHBondContact NZ-OE1 3.22Å; K343-E397 IonicContact NZ-OE2 3.36Å; K343-E397 PolarHBondContact NZ-OE2 3.36Å
398	E	40.5	Very low	33.8	Very low	98 Å²	98	123.6 Å²	123.6	46%	0.458	67%	0.667	S	S	.	*			trans	-142.3	105.3	159.5	-70.7	-178.5	146.4	0	0	109	R445	E398-R445 VanDerWaalsContact CD-CZ 3.42Å; E398-R445 VanDerWaalsContact CD-NH1 3.33Å; E398-R445 WeakPolarHBondContact OE1-CD 3.49Å; E398-R445 IonicContact OE1-CZ 3.32Å; E398-R445 IonicContact OE1-NE 2.64Å; E398-R445 PolarHBondContact OE1-NE 3.33Å; E398-R445 IonicContact OE1-NH1 2.9Å; E398-R445 IonicContact OE2-CZ 3.48Å; E398-R445 IonicContact OE2-NE 3.36Å; E398-R445 IonicContact OE2-NH1 3.02Å; E398-R445 PolarHBondContact OE2-NH1 3.27Å; E398-R445 IonicContact OE2-NH2 2.73Å
399	G	29.1	Very low	34.3	Very low	70 Å²	70	124.8 Å²	124.8	72%	0.722	67%	0.665	S	S	*	*			trans	-83.8	166.6	168.5	0	0	0	0	0	112
400	A	31.3	Very low	35.1	Very low	85 Å²	85	124.2 Å²	124.2	70%	0.702	66%	0.657	S	S	*	*	S	Bend	trans	75.2	60.4	169.9	0	0	0	0	0	117.3
401	S	38.3	Very low	36.2	Very low	91 Å²	91	117.1 Å²	117.1	64%	0.636	64%	0.635	S	S	*	*			trans	-164	26.8	149.1	-169.6	0	0	0	0	113.5	K403	S401-K403 PolarHBondContact O-N 3.09Å
402	E	37.9	Very low	37.5	Very low	117 Å²	117	115.2 Å²	115.2	55%	0.547	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.9	1.7	-159.7	-85.1	-171.9	-163.5	0	0	117.7	R406	E402-R406 IonicContact OE2-NH2 2.76Å; E402-R406 PolarHBondContact OE2-NH2 2.94Å
403	K	41	Very low	39.7	Very low	150 Å²	150	113.8 Å²	113.8	65%	0.652	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-13.8	-176.3	-81	-173.2	173.5	-176.5	0	115.3	E319 S401	E319-K403 IonicContact OE1-NZ 3.96Å; E319-K403 PolarHBondContact OE1-NZ 3.44Å; S401-K403 PolarHBondContact O-N 3.09Å
404	F	39.9	Very low	41.6	Very low	127 Å²	127	112 Å²	112	56%	0.557	58%	0.579	S	S	*	*	S	Bend	trans	-124.4	-6.7	-178.1	-88.9	-93.4	0	0	0	115.6	P407	F404-P407 WeakPolarHBondContact O-CD 3.11Å
405	V	40.6	Very low	43.8	Very low	66 Å²	66	107.5 Å²	107.5	40%	0.4	55%	0.552	S	S	.	*	S	Bend	trans	-84.5	-23.5	-176.1	-177.6	0	0	0	0	113	F408	V405-F408 PolarHBondContact O-N 3.03Å
406	R	35.6	Very low	46.4	Very low	102 Å²	102	99.4 Å²	99.4	39%	0.385	53%	0.525	S	S	.	.	H	α-helix	trans	-66.4	-37.8	-173.2	-67.9	-169.1	-173.1	-155.9	5.4	116	K42 E45 E402 F408 V409	K42-R406 VanDerWaalsContact NZ-NH1 3.13Å; E45-R406 VanDerWaalsContact CD-NH1 3.29Å; E45-R406 IonicContact OE1-CZ 3.42Å; E45-R406 IonicContact OE1-NH1 2.98Å; E45-R406 PolarHBondContact OE1-NH1 2.9Å; E45-R406 IonicContact OE1-NH2 3.66Å; E45-R406 IonicContact OE2-CZ 3.32Å; E45-R406 VanDerWaalsContact OE2-CZ 3.32Å; E45-R406 IonicContact OE2-NH1 2.88Å; E45-R406 PolarHBondContact OE2-NH1 3.14Å; E45-R406 IonicContact OE2-NH2 2.81Å; E45-R406 PolarHBondContact OE2-NH2 2.91Å; E402-R406 IonicContact OE2-NH2 2.76Å; E402-R406 PolarHBondContact OE2-NH2 2.94Å; R406-F408 PolarHBondContact O-N 3.42Å; R406-F408 VanDerWaalsContact O-N 3.16Å; R406-V409 PolarHBondContact O-N 3.28Å
407	P	36.7	Very low	48.6	Very low	38 Å²	38	98.4 Å²	98.4	25%	0.247	53%	0.526	C	S	.	.	H	α-helix	trans	-63.4	-24.9	-179.1	-19.6	31.2	0	0	0	113.8	F404 G411 F415	F404-P407 WeakPolarHBondContact O-CD 3.11Å; P407-G411 PolarHBondContact O-N 3.47Å; P407-F415 HydrophobicContact CB-CE1 3.8Å; P407-F415 HydrophobicContact CB-CZ 4.3Å; P407-F415 HydrophobicContact CG-CE1 4.3Å
408	F	38.7	Very low	50.9	Low	137 Å²	137	99 Å²	99	60%	0.601	53%	0.529	S	S	*	.	H	α-helix	trans	-84.2	-17.4	-176.1	-80.7	-84.6	0	0	0	114.1	V405 R406 F413 L431	V405-F408 PolarHBondContact O-N 3.03Å; R406-F408 PolarHBondContact O-N 3.42Å; R406-F408 VanDerWaalsContact O-N 3.16Å; F408-F413 HydrophobicContact CE1-CE1 4.41Å; F408-L431 HydrophobicContact CZ-CD1 4.28Å
409	V	41.8	Very low	52.7	Low	115 Å²	115	95.8 Å²	95.8	70%	0.697	51%	0.514	S	S	*	.	H	α-helix	trans	-90.7	-35.5	-179.3	-174.5	0	0	0	0	111.4	R406	R406-V409 PolarHBondContact O-N 3.28Å
410	D	49.2	Very low	55.5	Low	133 Å²	133	96.5 Å²	96.5	71%	0.711	51%	0.506	S	S	*	.	H	α-helix	trans	-95.7	-6.3	-177.7	-61.1	-30.2	0	0	0	113.4	D412	D410-D412 PolarHBondContact O-N 2.92Å
411	G	48.7	Very low	58	Low	44 Å²	44	97.6 Å²	97.6	45%	0.454	50%	0.499	S	S	.	.			trans	67.2	12.7	179.1	0	0	0	0	0	114.6	P407 F413	P407-G411 PolarHBondContact O-N 3.47Å; G411-F413 WeakPolarHBondContact O-CD2 3.21Å; G411-F413 PolarHBondContact O-N 3.25Å
412	D	58	Low	60.3	Low	81 Å²	81	100.2 Å²	100.2	43%	0.433	50%	0.502	S	S	.	.			trans	-81.1	102.8	177.2	-173.1	4.5	0	0	0	110.9	D410 D414 F415	D410-D412 PolarHBondContact O-N 2.92Å; D412-D414 WeakPolarHBondContact OD1-CB 3.33Å; D412-D414 PolarHBondContact OD1-N 3.11Å; D412-F415 WeakPolarHBondContact O-CE1 3.32Å
413	F	75	Confident	62.4	Low	99 Å²	99	98 Å²	98	43%	0.434	49%	0.491	S	S	.	.			trans	-104.6	10.4	176.4	-60.7	-72.7	0	0	0	112.9	F408 G411 F415 L416	F408-F413 HydrophobicContact CE1-CE1 4.41Å; G411-F413 WeakPolarHBondContact O-CD2 3.21Å; G411-F413 PolarHBondContact O-N 3.25Å; F413-F415 HydrophobicContact CD1-CE1 4.47Å; F413-F415 PolarHBondContact O-N 2.87Å; F413-L416 HydrophobicContact CB-CD1 3.87Å; F413-L416 HydrophobicContact CB-CG 4.31Å; F413-L416 HydrophobicContact CD1-CD1 4.06Å; F413-L416 HydrophobicContact CG-CD1 4.34Å; F413-L416 VanDerWaalsContact O-CB 3.28Å; F413-L416 WeakPolarHBondContact O-CB 3.32Å; F413-L416 WeakPolarHBondContact O-CG 3.33Å; F413-L416 PolarHBondContact O-N 3.11Å
414	D	71.3	Confident	64.5	Low	70 Å²	70	93.6 Å²	93.6	37%	0.374	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-61.7	-29.8	-175	-92.1	-13.5	0	0	0	112.5	D412 L416 K417	D412-D414 WeakPolarHBondContact OD1-CB 3.33Å; D412-D414 PolarHBondContact OD1-N 3.11Å; D414-L416 PolarHBondContact O-N 3.17Å; D414-L416 VanDerWaalsContact O-N 3.16Å; D414-K417 WeakPolarHBondContact O-CB 3.34Å; D414-K417 WeakPolarHBondContact O-CG 3.31Å; D414-K417 PolarHBondContact O-N 2.91Å; D414-K417 VanDerWaalsContact O-N 3.09Å; D414-K417 WeakPolarHBondContact OD1-CE 3.46Å; D414-K417 IonicContact OD1-NZ 2.67Å; D414-K417 PolarHBondContact OD1-NZ 3.05Å; D414-K417 IonicContact OD2-NZ 3.96Å
415	F	75.9	Confident	66.7	Low	77 Å²	77	92.5 Å²	92.5	34%	0.338	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-58.3	-27.6	176	75.3	-85.9	0	0	0	113	P407 D412 F413 K417 H418 I419	P407-F415 HydrophobicContact CB-CE1 3.8Å; P407-F415 HydrophobicContact CB-CZ 4.3Å; P407-F415 HydrophobicContact CG-CE1 4.3Å; D412-F415 WeakPolarHBondContact O-CE1 3.32Å; F413-F415 HydrophobicContact CD1-CE1 4.47Å; F413-F415 PolarHBondContact O-N 2.87Å; F415-K417 PolarHBondContact O-N 3.37Å; F415-H418 PolarHBondContact O-N 3.26Å; F415-I419 HydrophobicContact CD2-CD1 3.74Å; F415-I419 HydrophobicContact CE2-CD1 3.85Å
416	L	81.7	Confident	68.7	Low	62 Å²	62	95.3 Å²	95.3	33%	0.325	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-61.4	-26.3	178.5	-62.2	-179.4	0	0	0	112.3	F413 D414 H418 I419 L424	F413-L416 HydrophobicContact CB-CD1 3.87Å; F413-L416 HydrophobicContact CB-CG 4.31Å; F413-L416 HydrophobicContact CD1-CD1 4.06Å; F413-L416 HydrophobicContact CG-CD1 4.34Å; F413-L416 VanDerWaalsContact O-CB 3.28Å; F413-L416 WeakPolarHBondContact O-CB 3.32Å; F413-L416 WeakPolarHBondContact O-CG 3.33Å; F413-L416 PolarHBondContact O-N 3.11Å; D414-L416 PolarHBondContact O-N 3.17Å; D414-L416 VanDerWaalsContact O-N 3.16Å; L416-H418 PolarHBondContact O-N 3.36Å; L416-I419 HydrophobicContact CD2-CD1 4.13Å; L416-I419 PolarHBondContact O-N 2.99Å; L416-L424 HydrophobicContact CB-CD2 4.34Å; L416-L424 HydrophobicContact CD2-CD2 3.88Å
417	K	79	Confident	71	Confident	154 Å²	154	94.5 Å²	94.5	67%	0.67	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-63	-22.6	179.1	-66.9	170.5	176.5	161.8	0	113.3	D414 F415	D414-K417 WeakPolarHBondContact O-CB 3.34Å; D414-K417 WeakPolarHBondContact O-CG 3.31Å; D414-K417 PolarHBondContact O-N 2.91Å; D414-K417 VanDerWaalsContact O-N 3.09Å; D414-K417 WeakPolarHBondContact OD1-CE 3.46Å; D414-K417 IonicContact OD1-NZ 2.67Å; D414-K417 PolarHBondContact OD1-NZ 3.05Å; D414-K417 IonicContact OD2-NZ 3.96Å; F415-K417 PolarHBondContact O-N 3.37Å
418	H	78.3	Confident	73.5	Confident	164 Å²	164	98.2 Å²	98.2	76%	0.759	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-104.1	1.9	-175.1	-58.7	-60.7	0	0	0	113.3	F415 L416	F415-H418 PolarHBondContact O-N 3.26Å; L416-H418 PolarHBondContact O-N 3.36Å
419	I	79.4	Confident	75.9	Confident	30 Å²	30	98 Å²	98	15%	0.154	50%	0.498	C	S	.	.	S	Bend	trans	-92.4	133.2	-177.8	-63.2	-175.5	0	0	0	110.2	F415 L416 E423 L424	F415-I419 HydrophobicContact CD2-CD1 3.74Å; F415-I419 HydrophobicContact CE2-CD1 3.85Å; L416-I419 HydrophobicContact CD2-CD1 4.13Å; L416-I419 PolarHBondContact O-N 2.99Å; I419-E423 HydrophobicContact CG2-CB 3.55Å; I419-E423 HydrophobicContact CG2-CG 3.29Å; I419-L424 HydrophobicContact CB-CD2 3.95Å; I419-L424 HydrophobicContact CB-CG 4.14Å; I419-L424 HydrophobicContact CD1-CD2 4.49Å; I419-L424 HydrophobicContact CG2-CD2 3.88Å; I419-L424 HydrophobicContact CG2-CG 3.85Å
420	P	86.9	Confident	78	Confident	84 Å²	84	93.9 Å²	93.9	55%	0.545	48%	0.477	S	S	.	.			trans	-56.6	148.6	173.2	-24.6	34.4	0	0	0	112.9	E422 E423 L424	P420-E422 VanDerWaalsContact C-N 3.27Å; P420-E422 PolarHBondContact O-N 2.55Å; P420-E423 PolarHBondContact O-N 3.02Å; P420-E423 VanDerWaalsContact O-N 3.08Å; P420-L424 PolarHBondContact O-N 3.33Å; P420-L424 VanDerWaalsContact O-N 3.09Å
421	L	84.9	Confident	79.8	Confident	109 Å²	109	90.9 Å²	90.9	57%	0.571	46%	0.46	S	S	*	.	H	α-helix	trans	-58.1	-38.7	-176.3	-177.7	62.8	0	0	0	112.6	E423 L424 H425	L421-E423 VanDerWaalsContact C-N 3.33Å; L421-E423 PolarHBondContact O-N 3.31Å; L421-L424 PolarHBondContact O-N 3.36Å; L421-H425 PolarHBondContact O-N 3.21Å; L421-H425 VanDerWaalsContact O-N 3.1Å; L421-H425 PolarHBondContact O-ND1 3.15Å
422	E	86	Confident	81.6	Confident	146 Å²	146	93.8 Å²	93.8	68%	0.682	47%	0.465	S	S	*	.	H	α-helix	trans	-61.2	-40.7	177.7	-69.6	74.8	-165.9	0	0	112.3	P420 H425 H426	P420-E422 VanDerWaalsContact C-N 3.27Å; P420-E422 PolarHBondContact O-N 2.55Å; E422-H425 PolarHBondContact O-N 3.43Å; E422-H426 PolarHBondContact O-N 3.36Å
423	E	81.3	Confident	82.8	Confident	71 Å²	71	92.5 Å²	92.5	33%	0.332	46%	0.463	S	S	.	.	H	α-helix	trans	-70.6	-35.7	178.2	174	62	-161.4	0	0	111.2	I419 P420 L421 H425 H426 R427	I419-E423 HydrophobicContact CG2-CB 3.55Å; I419-E423 HydrophobicContact CG2-CG 3.29Å; P420-E423 PolarHBondContact O-N 3.02Å; P420-E423 VanDerWaalsContact O-N 3.08Å; L421-E423 VanDerWaalsContact C-N 3.33Å; L421-E423 PolarHBondContact O-N 3.31Å; E423-H425 VanDerWaalsContact C-N 3.35Å; E423-H425 PolarHBondContact O-N 2.97Å; E423-H426 PolarHBondContact O-N 3.11Å; E423-R427 WeakPolarHBondContact O-CG 2.97Å; E423-R427 PolarHBondContact O-N 3.35Å; E423-R427 IonicContact OE1-CZ 2.59Å; E423-R427 IonicContact OE1-NE 3.54Å; E423-R427 PolarHBondContact OE1-NE 3.44Å; E423-R427 IonicContact OE1-NH2 3.56Å; E423-R427 PolarHBondContact OE1-NH2 3.04Å
424	L	85.6	Confident	83.2	Confident	57 Å²	57	91.2 Å²	91.2	30%	0.298	46%	0.458	S	S	.	.	H	α-helix	trans	-62.3	-40.7	172.6	-69.4	174.6	0	0	0	112.2	L416 I419 P420 L421 R427 L428	L416-L424 HydrophobicContact CB-CD2 4.34Å; L416-L424 HydrophobicContact CD2-CD2 3.88Å; I419-L424 HydrophobicContact CB-CD2 3.95Å; I419-L424 HydrophobicContact CB-CG 4.14Å; I419-L424 HydrophobicContact CD1-CD2 4.49Å; I419-L424 HydrophobicContact CG2-CD2 3.88Å; I419-L424 HydrophobicContact CG2-CG 3.85Å; P420-L424 PolarHBondContact O-N 3.33Å; P420-L424 VanDerWaalsContact O-N 3.09Å; L421-L424 PolarHBondContact O-N 3.36Å; L424-R427 PolarHBondContact O-N 3.33Å; L424-L428 PolarHBondContact O-N 2.75Å
425	H	87	Confident	83.8	Confident	103 Å²	103	92 Å²	92	48%	0.477	46%	0.461	S	S	.	.	H	α-helix	trans	-64.1	-46.2	174.8	-74.1	92	0	0	0	111.4	L421 E422 E423 R427 L428 D429	L421-H425 PolarHBondContact O-N 3.21Å; L421-H425 VanDerWaalsContact O-N 3.1Å; L421-H425 PolarHBondContact O-ND1 3.15Å; E422-H425 PolarHBondContact O-N 3.43Å; E423-H425 VanDerWaalsContact C-N 3.35Å; E423-H425 PolarHBondContact O-N 2.97Å; H425-R427 VanDerWaalsContact C-N 3.31Å; H425-R427 PolarHBondContact O-N 3Å; H425-L428 PolarHBondContact O-N 3.46Å; H425-L428 VanDerWaalsContact O-N 3.13Å; H425-D429 PolarHBondContact O-N 3.5Å
426	H	82.5	Confident	84.4	Confident	125 Å²	125	93.2 Å²	93.2	58%	0.579	47%	0.471	S	S	*	.	H	α-helix	trans	-60	-41	178.7	-173.2	-92.3	0	0	0	112.2	E422 E423 D429 A430	E422-H426 PolarHBondContact O-N 3.36Å; E423-H426 PolarHBondContact O-N 3.11Å; H426-D429 PolarHBondContact O-N 2.8Å; H426-A430 WeakPolarHBondContact O-CB 3.47Å; H426-A430 PolarHBondContact O-N 2.87Å
427	R	83.9	Confident	84.6	Confident	86 Å²	86	98 Å²	98	33%	0.325	48%	0.484	S	S	.	.	H	α-helix	trans	-63	-41.3	174.6	-73.9	177.3	-178.1	-133.2	0.2	112.5	E423 L424 H425 A430 L431	E423-R427 WeakPolarHBondContact O-CG 2.97Å; E423-R427 PolarHBondContact O-N 3.35Å; E423-R427 IonicContact OE1-CZ 2.59Å; E423-R427 IonicContact OE1-NE 3.54Å; E423-R427 PolarHBondContact OE1-NE 3.44Å; E423-R427 IonicContact OE1-NH2 3.56Å; E423-R427 PolarHBondContact OE1-NH2 3.04Å; L424-R427 PolarHBondContact O-N 3.33Å; H425-R427 VanDerWaalsContact C-N 3.31Å; H425-R427 PolarHBondContact O-N 3Å; R427-A430 PolarHBondContact O-N 3.41Å; R427-L431 PolarHBondContact O-N 3.38Å; R427-L431 VanDerWaalsContact O-N 3.1Å
428	L	89.1	Confident	84.7	Confident	116 Å²	116	95.6 Å²	95.6	61%	0.607	48%	0.476	S	S	*	.	H	α-helix	trans	-65.4	-43.5	177.2	-172.9	63.2	0	0	0	111.3	L424 H425 A430 L431	L424-L428 PolarHBondContact O-N 2.75Å; H425-L428 PolarHBondContact O-N 3.46Å; H425-L428 VanDerWaalsContact O-N 3.13Å; L428-A430 VanDerWaalsContact C-N 3.3Å; L428-A430 PolarHBondContact O-N 3.29Å; L428-L431 HydrophobicContact CD1-CD2 4.49Å; L428-L431 WeakPolarHBondContact O-CB 3.46Å; L428-L431 PolarHBondContact O-N 3.01Å
429	D	88.3	Confident	85.1	Confident	131 Å²	131	91 Å²	91	70%	0.701	46%	0.456	S	S	*	.	H	α-helix	trans	-64.9	-33.5	177.6	-71.5	-18.1	0	0	0	112.3	H425 H426	H425-D429 PolarHBondContact O-N 3.5Å; H426-D429 PolarHBondContact O-N 2.8Å
430	A	86.4	Confident	85.6	Confident	29 Å²	29	95 Å²	95	24%	0.24	47%	0.474	C	S	.	.	H	α-helix	trans	-78.3	-21.7	178	0	0	0	0	0	113.6	H426 R427 L428 D432 S433 E434	H426-A430 WeakPolarHBondContact O-CB 3.47Å; H426-A430 PolarHBondContact O-N 2.87Å; R427-A430 PolarHBondContact O-N 3.41Å; L428-A430 VanDerWaalsContact C-N 3.3Å; L428-A430 PolarHBondContact O-N 3.29Å; A430-D432 PolarHBondContact O-N 3.23Å; A430-S433 PolarHBondContact O-N 3.46Å; A430-S433 VanDerWaalsContact O-N 3.09Å; A430-S433 PolarHBondContact O-OG 3.27Å; A430-E434 PolarHBondContact O-N 3.21Å
431	L	85.6	Confident	85.4	Confident	70 Å²	70	95.7 Å²	95.7	37%	0.366	47%	0.47	S	S	.	.	H	α-helix	trans	-58.7	-45.9	-168	-171.6	65.6	0	0	0	113	F408 R427 L428 S433 E434 M435	F408-L431 HydrophobicContact CZ-CD1 4.28Å; R427-L431 PolarHBondContact O-N 3.38Å; R427-L431 VanDerWaalsContact O-N 3.1Å; L428-L431 HydrophobicContact CD1-CD2 4.49Å; L428-L431 WeakPolarHBondContact O-CB 3.46Å; L428-L431 PolarHBondContact O-N 3.01Å; L431-S433 VanDerWaalsContact C-N 3.3Å; L431-S433 PolarHBondContact O-N 3.27Å; L431-E434 PolarHBondContact O-N 3.25Å; L431-M435 WeakPolarHBondContact O-CB 3.48Å; L431-M435 PolarHBondContact O-N 3.49Å
432	D	86.6	Confident	85.4	Confident	105 Å²	105	96 Å²	96	56%	0.561	47%	0.472	S	S	*	.	H	α-helix	trans	-62.3	-39.7	179.1	-74.9	-26.2	0	0	0	111.4	A430 M435 D436	A430-D432 PolarHBondContact O-N 3.23Å; D432-M435 PolarHBondContact O-N 2.77Å; D432-D436 WeakPolarHBondContact O-CB 3.45Å; D432-D436 PolarHBondContact O-N 2.82Å
433	S	84.7	Confident	85.6	Confident	55 Å²	55	96.9 Å²	96.9	39%	0.385	47%	0.469	S	S	.	.	H	α-helix	trans	-70.4	-31.6	178.7	78.3	0	0	0	0	113.1	A430 L431 R437	A430-S433 PolarHBondContact O-N 3.46Å; A430-S433 VanDerWaalsContact O-N 3.09Å; A430-S433 PolarHBondContact O-OG 3.27Å; L431-S433 VanDerWaalsContact C-N 3.3Å; L431-S433 PolarHBondContact O-N 3.27Å; S433-R437 WeakPolarHBondContact O-CG 3.47Å; S433-R437 PolarHBondContact O-N 3.41Å; S433-R437 PolarHBondContact O-NE 3.44Å; S433-R437 PolarHBondContact OG-NH2 3.39Å
434	E	82.2	Confident	85.9	Confident	71 Å²	71	102.6 Å²	102.6	33%	0.332	49%	0.487	S	S	.	.	H	α-helix	trans	-71.5	-47	173.4	-170.6	168.7	-160.5	0	0	110.9	A430 L431 D436 R437 E438	A430-E434 PolarHBondContact O-N 3.21Å; L431-E434 PolarHBondContact O-N 3.25Å; E434-D436 VanDerWaalsContact C-N 3.35Å; E434-D436 PolarHBondContact O-N 3.08Å; E434-R437 WeakPolarHBondContact O-CB 3.32Å; E434-R437 PolarHBondContact O-N 2.89Å; E434-R437 VanDerWaalsContact O-N 3.13Å; E434-E438 PolarHBondContact O-N 3.05Å
435	M	84.5	Confident	85.8	Confident	88 Å²	88	103.9 Å²	103.9	43%	0.433	49%	0.488	S	S	.	.	H	α-helix	trans	-56.5	-46.4	174.3	179.5	-179.2	59.6	0	0	111.8	L431 D432 R437 E438 I439	L431-M435 WeakPolarHBondContact O-CB 3.48Å; L431-M435 PolarHBondContact O-N 3.49Å; D432-M435 PolarHBondContact O-N 2.77Å; M435-R437 VanDerWaalsContact C-N 3.31Å; M435-R437 PolarHBondContact O-N 2.96Å; M435-E438 PolarHBondContact O-N 3.17Å; M435-I439 HydrophobicContact CG-CD1 3.75Å; M435-I439 HydrophobicContact CG-CG1 4.37Å; M435-I439 WeakPolarHBondContact O-CB 3.34Å; M435-I439 VanDerWaalsContact O-CG1 3.27Å; M435-I439 WeakPolarHBondContact O-CG1 3.28Å; M435-I439 PolarHBondContact O-N 2.84Å; M435-I439 HydrophobicContact SD-CD1 4.42Å
436	D	89.3	Confident	86	Confident	102 Å²	102	106.9 Å²	106.9	55%	0.545	50%	0.496	S	S	.	.	H	α-helix	trans	-62.1	-38.6	178	-83.1	-20.3	0	0	0	112.2	D432 E434 E440	D432-D436 WeakPolarHBondContact O-CB 3.45Å; D432-D436 PolarHBondContact O-N 2.82Å; E434-D436 VanDerWaalsContact C-N 3.35Å; E434-D436 PolarHBondContact O-N 3.08Å; D436-E440 WeakPolarHBondContact O-CB 3.16Å; D436-E440 PolarHBondContact O-N 3.36Å
437	R	84.5	Confident	86.4	Confident	161 Å²	161	105.3 Å²	105.3	61%	0.608	49%	0.489	S	S	*	.	H	α-helix	trans	-65	-45.5	174.9	-77.4	178.9	-68.5	-156.4	2.3	111.7	S433 E434 M435 E440 E441	S433-R437 WeakPolarHBondContact O-CG 3.47Å; S433-R437 PolarHBondContact O-N 3.41Å; S433-R437 PolarHBondContact O-NE 3.44Å; S433-R437 PolarHBondContact OG-NH2 3.39Å; E434-R437 WeakPolarHBondContact O-CB 3.32Å; E434-R437 PolarHBondContact O-N 2.89Å; E434-R437 VanDerWaalsContact O-N 3.13Å; M435-R437 VanDerWaalsContact C-N 3.31Å; M435-R437 PolarHBondContact O-N 2.96Å; R437-E440 PolarHBondContact O-N 3.3Å; R437-E441 PolarHBondContact O-N 3.07Å
438	E	82.1	Confident	86.6	Confident	105 Å²	105	105.9 Å²	105.9	49%	0.491	50%	0.502	S	S	.	.	H	α-helix	trans	-62.9	-43.6	176.8	-72.5	-170.7	171.9	0	0	111.9	E434 M435 E440 E441 L442	E434-E438 PolarHBondContact O-N 3.05Å; M435-E438 PolarHBondContact O-N 3.17Å; E438-E440 PolarHBondContact O-N 3.3Å; E438-E441 PolarHBondContact O-N 3.14Å; E438-L442 WeakPolarHBondContact O-CB 3.4Å; E438-L442 PolarHBondContact O-N 3.18Å
439	I	87.2	Confident	86.6	Confident	66 Å²	66	104.4 Å²	104.4	34%	0.338	49%	0.491	S	S	.	.	H	α-helix	trans	-61.9	-43.7	176.4	-71.3	171.6	0	0	0	110.6	M435 L442 R443	M435-I439 HydrophobicContact CG-CD1 3.75Å; M435-I439 HydrophobicContact CG-CG1 4.37Å; M435-I439 WeakPolarHBondContact O-CB 3.34Å; M435-I439 VanDerWaalsContact O-CG1 3.27Å; M435-I439 WeakPolarHBondContact O-CG1 3.28Å; M435-I439 PolarHBondContact O-N 2.84Å; M435-I439 HydrophobicContact SD-CD1 4.42Å; I439-L442 PolarHBondContact O-N 2.8Å; I439-R443 HydrophobicContact CG2-CG 4.36Å; I439-R443 WeakPolarHBondContact O-CB 3.38Å; I439-R443 VanDerWaalsContact O-CG 3.23Å; I439-R443 WeakPolarHBondContact O-CG 3.44Å; I439-R443 PolarHBondContact O-N 2.91Å
440	E	88.7	Confident	86.9	Confident	115 Å²	115	103.9 Å²	103.9	54%	0.537	48%	0.479	S	S	.	.	H	α-helix	trans	-67.3	-39	179.2	-171.5	56.8	-153.3	0	0	111.7	D436 R437 E438 R443 R444	D436-E440 WeakPolarHBondContact O-CB 3.16Å; D436-E440 PolarHBondContact O-N 3.36Å; R437-E440 PolarHBondContact O-N 3.3Å; E438-E440 PolarHBondContact O-N 3.3Å; E440-R443 PolarHBondContact O-N 3.11Å; E440-R444 WeakPolarHBondContact O-CB 3.31Å; E440-R444 PolarHBondContact O-N 2.93Å
441	E	82.5	Confident	87.2	Confident	99 Å²	99	106 Å²	106	46%	0.463	49%	0.485	S	S	.	.	H	α-helix	trans	-63.1	-44.3	172.9	-171.7	173.4	-178.3	0	0	111.6	R437 E438 R443 R444 R445	R437-E441 PolarHBondContact O-N 3.07Å; E438-E441 PolarHBondContact O-N 3.14Å; E441-R443 PolarHBondContact O-N 3.12Å; E441-R444 WeakPolarHBondContact O-CB 3.23Å; E441-R444 PolarHBondContact O-N 3.07Å; E441-R445 WeakPolarHBondContact O-CG 3.4Å; E441-R445 PolarHBondContact O-N 3.36Å; E441-R445 IonicContact OE1-CZ 2.86Å; E441-R445 IonicContact OE1-NE 3.89Å; E441-R445 IonicContact OE1-NH2 2.85Å; E441-R445 PolarHBondContact OE1-NH2 2.89Å
442	L	85.3	Confident	87.5	Confident	116 Å²	116	106.4 Å²	106.4	61%	0.607	49%	0.491	S	S	*	.	H	α-helix	trans	-62.4	-42.8	176.7	-171.7	66.1	0	0	0	111.5	E438 I439 R445 Y446	E438-L442 WeakPolarHBondContact O-CB 3.4Å; E438-L442 PolarHBondContact O-N 3.18Å; I439-L442 PolarHBondContact O-N 2.8Å; L442-R445 PolarHBondContact O-N 2.96Å; L442-Y446 WeakPolarHBondContact O-CB 3.32Å; L442-Y446 PolarHBondContact O-N 3.47Å
443	R	89.5	Confident	87.9	Confident	164 Å²	164	106.4 Å²	106.4	62%	0.619	49%	0.49	S	S	*	.	H	α-helix	trans	-60.3	-44.9	174	-77.2	173.3	179.7	-160.1	3	111.3	I439 E440 E441 Y446 Q447	I439-R443 HydrophobicContact CG2-CG 4.36Å; I439-R443 WeakPolarHBondContact O-CB 3.38Å; I439-R443 VanDerWaalsContact O-CG 3.23Å; I439-R443 WeakPolarHBondContact O-CG 3.44Å; I439-R443 PolarHBondContact O-N 2.91Å; E440-R443 PolarHBondContact O-N 3.11Å; E441-R443 PolarHBondContact O-N 3.12Å; R443-Y446 PolarHBondContact O-N 3.07Å; R443-Q447 WeakPolarHBondContact O-CB 3.45Å; R443-Q447 PolarHBondContact O-N 3.2Å
444	R	88.4	Confident	88.2	Confident	190 Å²	190	106.2 Å²	106.2	72%	0.717	48%	0.484	S	S	*	.	H	α-helix	trans	-61.5	-47.6	177	-166.3	-179.6	-169.1	-178	4.2	111.4	E440 E441 Y446 Q447 T448	E440-R444 WeakPolarHBondContact O-CB 3.31Å; E440-R444 PolarHBondContact O-N 2.93Å; E441-R444 WeakPolarHBondContact O-CB 3.23Å; E441-R444 PolarHBondContact O-N 3.07Å; R444-Y446 VanDerWaalsContact C-N 3.32Å; R444-Y446 PolarHBondContact O-N 2.73Å; R444-Q447 PolarHBondContact O-N 2.97Å; R444-T448 PolarHBondContact O-N 2.76Å; R444-T448 PolarHBondContact O-OG1 3.05Å; R444-T448 VanDerWaalsContact O-OG1 3.11Å
445	R	84.5	Confident	88.8	Confident	85 Å²	85	106.3 Å²	106.3	32%	0.321	49%	0.487	S	S	.	.	H	α-helix	trans	-58.5	-43.7	175.3	-74	-176.7	-171.3	164.6	5.9	111.4	E398 E441 L442 T448 K449	E398-R445 VanDerWaalsContact CD-CZ 3.42Å; E398-R445 VanDerWaalsContact CD-NH1 3.33Å; E398-R445 WeakPolarHBondContact OE1-CD 3.49Å; E398-R445 IonicContact OE1-CZ 3.32Å; E398-R445 IonicContact OE1-NE 2.64Å; E398-R445 PolarHBondContact OE1-NE 3.33Å; E398-R445 IonicContact OE1-NH1 2.9Å; E398-R445 IonicContact OE2-CZ 3.48Å; E398-R445 IonicContact OE2-NE 3.36Å; E398-R445 IonicContact OE2-NH1 3.02Å; E398-R445 PolarHBondContact OE2-NH1 3.27Å; E398-R445 IonicContact OE2-NH2 2.73Å; E441-R445 WeakPolarHBondContact O-CG 3.4Å; E441-R445 PolarHBondContact O-N 3.36Å; E441-R445 IonicContact OE1-CZ 2.86Å; E441-R445 IonicContact OE1-NE 3.89Å; E441-R445 IonicContact OE1-NH2 2.85Å; E441-R445 PolarHBondContact OE1-NH2 2.89Å; L442-R445 PolarHBondContact O-N 2.96Å; R445-T448 PolarHBondContact O-N 3.07Å; R445-K449 VanDerWaalsContact O-CG 3.29Å; R445-K449 WeakPolarHBondContact O-CG 3.42Å; R445-K449 PolarHBondContact O-N 3.04Å
446	Y	90.7	Very high	89.1	Confident	166 Å²	166	104.9 Å²	104.9	65%	0.651	49%	0.486	S	S	*	.	H	α-helix	trans	-65.4	-42.2	178.2	-161.3	-97.2	0	0	0	111.8	L442 R443 R444 K449 R450	L442-Y446 WeakPolarHBondContact O-CB 3.32Å; L442-Y446 PolarHBondContact O-N 3.47Å; R443-Y446 PolarHBondContact O-N 3.07Å; R444-Y446 VanDerWaalsContact C-N 3.32Å; R444-Y446 PolarHBondContact O-N 2.73Å; Y446-K449 PolarHBondContact O-N 2.67Å; Y446-R450 VanDerWaalsContact O-CB 3.3Å; Y446-R450 WeakPolarHBondContact O-CB 3.33Å; Y446-R450 PolarHBondContact O-N 2.7Å
447	Q	89.8	Confident	89.2	Confident	91 Å²	91	104.9 Å²	104.9	43%	0.425	48%	0.484	S	S	.	.	H	α-helix	trans	-62.4	-45	176.4	-170.9	64.5	17.5	0	0	111.5	R443 R444 K449 R450 Q451	R443-Q447 WeakPolarHBondContact O-CB 3.45Å; R443-Q447 PolarHBondContact O-N 3.2Å; R444-Q447 PolarHBondContact O-N 2.97Å; Q447-K449 VanDerWaalsContact C-N 3.33Å; Q447-K449 PolarHBondContact O-N 2.82Å; Q447-R450 PolarHBondContact O-N 2.81Å; Q447-Q451 WeakPolarHBondContact O-CB 3.45Å; Q447-Q451 PolarHBondContact O-N 3.3Å
448	T	89.7	Confident	89.6	Confident	98 Å²	98	101.7 Å²	101.7	60%	0.601	48%	0.476	S	S	*	.	H	α-helix	trans	-60.8	-40.3	175.1	-58.7	0	0	0	0	112.1	R444 R445 R450 P452	R444-T448 PolarHBondContact O-N 2.76Å; R444-T448 PolarHBondContact O-OG1 3.05Å; R444-T448 VanDerWaalsContact O-OG1 3.11Å; R445-T448 PolarHBondContact O-N 3.07Å; T448-R450 VanDerWaalsContact C-N 3.35Å; T448-P452 VanDerWaalsContact O-CD 3.32Å; T448-P452 WeakPolarHBondContact O-CD 3.32Å
449	K	89.1	Confident	89.9	Confident	86 Å²	86	101.8 Å²	101.8	37%	0.374	48%	0.476	S	S	.	.	H	α-helix	trans	-67.7	-34.4	175.9	-70.8	172.6	-167.2	-175.1	0	112.3	R445 Y446 Q447	R445-K449 VanDerWaalsContact O-CG 3.29Å; R445-K449 WeakPolarHBondContact O-CG 3.42Å; R445-K449 PolarHBondContact O-N 3.04Å; Y446-K449 PolarHBondContact O-N 2.67Å; Q447-K449 VanDerWaalsContact C-N 3.33Å; Q447-K449 PolarHBondContact O-N 2.82Å
450	R	94.5	Very high	90.1	Very high	119 Å²	119	105.5 Å²	105.5	45%	0.449	49%	0.49	S	S	.	.	H	α-helix	trans	-83.7	-27.8	-176.7	-171	174.4	178	-121.8	1.7	113.3	Y446 Q447 T448 I453 L454	Y446-R450 VanDerWaalsContact O-CB 3.3Å; Y446-R450 WeakPolarHBondContact O-CB 3.33Å; Y446-R450 PolarHBondContact O-N 2.7Å; Q447-R450 PolarHBondContact O-N 2.81Å; T448-R450 VanDerWaalsContact C-N 3.35Å; R450-I453 WeakPolarHBondContact O-CB 3.31Å; R450-I453 PolarHBondContact O-N 3.32Å; R450-L454 HydrophobicContact CG-CD1 4.05Å; R450-L454 HydrophobicContact CG-CG 4.05Å; R450-L454 PolarHBondContact O-N 2.73Å; R450-L454 VanDerWaalsContact O-N 3.07Å
451	Q	91.8	Very high	90.2	Very high	75 Å²	75	105.6 Å²	105.6	35%	0.35	49%	0.488	S	S	.	.	H	α-helix	trans	-54.5	-47.3	-175	-166.9	64.3	42.9	0	0	113.7	Q447 I453 L454 D455	Q447-Q451 WeakPolarHBondContact O-CB 3.45Å; Q447-Q451 PolarHBondContact O-N 3.3Å; Q451-I453 PolarHBondContact O-N 3.1Å; Q451-L454 PolarHBondContact O-N 3.08Å; Q451-L454 VanDerWaalsContact O-N 3.12Å; Q451-D455 PolarHBondContact NE2-OD1 2.65Å; Q451-D455 PolarHBondContact O-N 3.3Å
452	P	92.3	Very high	90.3	Very high	77 Å²	77	105.6 Å²	105.6	50%	0.5	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-30.7	178.4	-22.3	33.9	0	0	0	113.6	T448 S456	T448-P452 VanDerWaalsContact O-CD 3.32Å; T448-P452 WeakPolarHBondContact O-CD 3.32Å; P452-S456 VanDerWaalsContact O-CB 3.31Å; P452-S456 WeakPolarHBondContact O-CB 3.23Å; P452-S456 PolarHBondContact O-N 3.12Å; P452-S456 VanDerWaalsContact O-N 3.08Å; P452-S456 PolarHBondContact O-OG 2.96Å
453	I	94.6	Very high	90.2	Very high	106 Å²	106	108.2 Å²	108.2	54%	0.544	49%	0.49	S	S	.	.	H	α-helix	trans	-70.8	-44.8	177.2	-56.1	174.9	0	0	0	109.6	R450 Q451 S456 M457	R450-I453 WeakPolarHBondContact O-CB 3.31Å; R450-I453 PolarHBondContact O-N 3.32Å; Q451-I453 PolarHBondContact O-N 3.1Å; I453-S456 PolarHBondContact O-N 3.15Å; I453-M457 HydrophobicContact CG2-SD 4.45Å; I453-M457 WeakPolarHBondContact O-CG 3.41Å; I453-M457 PolarHBondContact O-N 3.27Å
454	L	92.2	Very high	89.6	Confident	50 Å²	50	106.7 Å²	106.7	26%	0.262	49%	0.492	S	S	.	.	H	α-helix	trans	-63.3	-46	176.9	-69.2	173.4	0	0	0	111.8	R450 Q451 S456 M457 E458	R450-L454 HydrophobicContact CG-CD1 4.05Å; R450-L454 HydrophobicContact CG-CG 4.05Å; R450-L454 PolarHBondContact O-N 2.73Å; R450-L454 VanDerWaalsContact O-N 3.07Å; Q451-L454 PolarHBondContact O-N 3.08Å; Q451-L454 VanDerWaalsContact O-N 3.12Å; L454-S456 VanDerWaalsContact C-N 3.27Å; L454-S456 PolarHBondContact O-N 3.03Å; L454-M457 WeakPolarHBondContact O-CB 3.44Å; L454-M457 PolarHBondContact O-N 3.4Å; L454-M457 VanDerWaalsContact O-N 3.11Å; L454-E458 PolarHBondContact O-N 3.2Å
455	D	93.1	Very high	88.9	Confident	73 Å²	73	102.8 Å²	102.8	39%	0.39	49%	0.489	S	S	.	.	H	α-helix	trans	-59.9	-40.9	177.6	-62.7	-18.2	0	0	0	110.8	Q451 E458 Q459	Q451-D455 PolarHBondContact NE2-OD1 2.65Å; Q451-D455 PolarHBondContact O-N 3.3Å; D455-E458 PolarHBondContact O-N 3.29Å; D455-Q459 WeakPolarHBondContact O-CG 3.46Å; D455-Q459 PolarHBondContact O-N 2.99Å
456	S	91.2	Very high	87.9	Confident	59 Å²	59	105.3 Å²	105.3	41%	0.413	51%	0.509	S	S	.	.	H	α-helix	trans	-65.7	-37.6	175.7	-62.5	0	0	0	0	112.9	P452 I453 L454 K460	P452-S456 VanDerWaalsContact O-CB 3.31Å; P452-S456 WeakPolarHBondContact O-CB 3.23Å; P452-S456 PolarHBondContact O-N 3.12Å; P452-S456 VanDerWaalsContact O-N 3.08Å; P452-S456 PolarHBondContact O-OG 2.96Å; I453-S456 PolarHBondContact O-N 3.15Å; L454-S456 VanDerWaalsContact C-N 3.27Å; L454-S456 PolarHBondContact O-N 3.03Å; S456-K460 WeakPolarHBondContact O-CG 3.5Å; S456-K460 PolarHBondContact O-N 3.02Å
457	M	91.8	Very high	86	Confident	102 Å²	102	108.9 Å²	108.9	50%	0.502	53%	0.529	S	S	.	.	H	α-helix	trans	-67.1	-42	175.4	-73.8	178.4	70.1	0	0	111.7	I453 L454 K460 K461	I453-M457 HydrophobicContact CG2-SD 4.45Å; I453-M457 WeakPolarHBondContact O-CG 3.41Å; I453-M457 PolarHBondContact O-N 3.27Å; L454-M457 WeakPolarHBondContact O-CB 3.44Å; L454-M457 PolarHBondContact O-N 3.4Å; L454-M457 VanDerWaalsContact O-N 3.11Å; M457-K460 PolarHBondContact O-N 3.24Å; M457-K461 PolarHBondContact O-N 2.95Å
458	E	92.1	Very high	85.8	Confident	94 Å²	94	109.8 Å²	109.8	44%	0.439	53%	0.534	S	S	.	.	H	α-helix	trans	-65.4	-45.2	179.4	-175.6	54.7	-147.2	0	0	111.5	L454 D455 K460 K461 Q462	L454-E458 PolarHBondContact O-N 3.2Å; D455-E458 PolarHBondContact O-N 3.29Å; E458-K460 VanDerWaalsContact C-N 3.27Å; E458-K460 PolarHBondContact O-N 3.28Å; E458-K461 PolarHBondContact O-N 3.48Å; E458-K461 VanDerWaalsContact O-N 3.12Å; E458-Q462 WeakPolarHBondContact O-CG 3.09Å; E458-Q462 PolarHBondContact O-N 3.3Å; E458-Q462 PolarHBondContact OE1-NE2 3.32Å
459	Q	88.9	Confident	85.6	Confident	106 Å²	106	110.4 Å²	110.4	50%	0.495	53%	0.53	S	S	.	.	H	α-helix	trans	-58.3	-38.7	173.6	-72	176.9	23.9	0	0	112.5	D455 R463	D455-Q459 WeakPolarHBondContact O-CG 3.46Å; D455-Q459 PolarHBondContact O-N 2.99Å; Q459-R463 WeakPolarHBondContact O-CG 3.37Å; Q459-R463 PolarHBondContact O-N 3.18Å
460	K	92.4	Very high	85.4	Confident	144 Å²	144	111.8 Å²	111.8	63%	0.626	54%	0.539	S	S	*	.	H	α-helix	trans	-68.5	-39.3	175.9	-78.2	172.2	179.6	-86	0	112	S456 M457 E458 R463 M464	S456-K460 WeakPolarHBondContact O-CG 3.5Å; S456-K460 PolarHBondContact O-N 3.02Å; M457-K460 PolarHBondContact O-N 3.24Å; E458-K460 VanDerWaalsContact C-N 3.27Å; E458-K460 PolarHBondContact O-N 3.28Å; K460-R463 PolarHBondContact O-N 3.12Å; K460-M464 WeakPolarHBondContact O-CG 3.35Å; K460-M464 PolarHBondContact O-N 3.2Å
461	K	90	Very high	84.9	Confident	117 Å²	117	111.4 Å²	111.4	51%	0.509	54%	0.544	S	S	.	.	H	α-helix	trans	-62.9	-47.4	175.9	-77.9	-178.5	178.5	179.8	0	112.3	M457 E458 R463 M464 T465	M457-K461 PolarHBondContact O-N 2.95Å; E458-K461 PolarHBondContact O-N 3.48Å; E458-K461 VanDerWaalsContact O-N 3.12Å; K461-R463 VanDerWaalsContact C-N 3.27Å; K461-R463 PolarHBondContact O-N 3.25Å; K461-M464 HydrophobicContact CG-CE 4.32Å; K461-M464 PolarHBondContact O-N 3.13Å; K461-T465 PolarHBondContact O-N 3.44Å; K461-T465 PolarHBondContact O-OG1 3.3Å
462	Q	85.2	Confident	84.4	Confident	100 Å²	100	113.6 Å²	113.6	47%	0.467	56%	0.556	S	S	.	*	H	α-helix	trans	-61.2	-35.7	179.8	-69.8	175.3	8.6	0	0	112.7	E458 M464 T465 N466	E458-Q462 WeakPolarHBondContact O-CG 3.09Å; E458-Q462 PolarHBondContact O-N 3.3Å; E458-Q462 PolarHBondContact OE1-NE2 3.32Å; Q462-M464 VanDerWaalsContact C-N 3.34Å; Q462-T465 WeakPolarHBondContact CA-OG1 3.47Å; Q462-T465 PolarHBondContact O-OG1 3.34Å; Q462-T465 VanDerWaalsContact O-OG1 3.07Å; Q462-N466 PolarHBondContact O-N 3.48Å; Q462-N466 PolarHBondContact O-ND2 3.07Å
463	R	81.9	Confident	83.9	Confident	171 Å²	171	116.1 Å²	116.1	65%	0.645	56%	0.56	S	S	*	*	H	α-helix	trans	-65.4	-36.5	174	-72.2	177.4	-171.6	-174.4	4.4	112.2	Q459 K460 K461 F467	Q459-R463 WeakPolarHBondContact O-CG 3.37Å; Q459-R463 PolarHBondContact O-N 3.18Å; K460-R463 PolarHBondContact O-N 3.12Å; K461-R463 VanDerWaalsContact C-N 3.27Å; K461-R463 PolarHBondContact O-N 3.25Å; R463-F467 WeakPolarHBondContact O-CD2 3.18Å
464	M	77.6	Confident	83.2	Confident	132 Å²	132	116.8 Å²	116.8	65%	0.65	56%	0.561	S	S	*	*	H	α-helix	trans	-74.5	-29	-179.7	-68.2	-174.2	-59.8	0	0	113.5	K460 K461 Q462 N466	K460-M464 WeakPolarHBondContact O-CG 3.35Å; K460-M464 PolarHBondContact O-N 3.2Å; K461-M464 HydrophobicContact CG-CE 4.32Å; K461-M464 PolarHBondContact O-N 3.13Å; Q462-M464 VanDerWaalsContact C-N 3.34Å; M464-N466 VanDerWaalsContact C-N 3.31Å
465	T	74.2	Confident	82.5	Confident	108 Å²	108	121.9 Å²	121.9	66%	0.663	58%	0.584	S	S	*	*	H	α-helix	trans	-80	-11.4	177	40.3	0	0	0	0	114.1	K461 Q462	K461-T465 PolarHBondContact O-N 3.44Å; K461-T465 PolarHBondContact O-OG1 3.3Å; Q462-T465 WeakPolarHBondContact CA-OG1 3.47Å; Q462-T465 PolarHBondContact O-OG1 3.34Å; Q462-T465 VanDerWaalsContact O-OG1 3.07Å
466	N	62.1	Low	81.6	Confident	138 Å²	138	126 Å²	126	74%	0.738	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	9.2	179.6	-70.1	-14.1	0	0	0	113.3	Q462 M464	Q462-N466 PolarHBondContact O-N 3.48Å; Q462-N466 PolarHBondContact O-ND2 3.07Å; M464-N466 VanDerWaalsContact C-N 3.31Å
467	F	51.8	Low	80.7	Confident	241 Å²	241	132.1 Å²	132.1	100%	1.057	62%	0.617	S	S	*	*			trans	-116.3	0	166.3	-73.1	-79.8	0	0	0	108.8	R463	R463-F467 WeakPolarHBondContact O-CD2 3.18Å

Retrieved 467 of 467 residues in 703.3 ms (Link to these results)

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