A0A096MJ54_RAT Loading...

Inositol 1,4,5-trisphosphate receptor-interacting protein

Enhances Ca(2+)-mediated inhibition of inositol 1,4,5-triphosphate receptor (ITPR) Ca(2+) release.

AlphaFold DB , UniProt , Accession A0A096MJ54, Species RAT (Rattus norvegicus, Rat), Gene Itprip, Length 557 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	47.3	Very low	58.7	Low	238 Å²	238	127.7 Å²	127.7	100%	1.172	69%	0.691	S	S	*	*				0	26.2	0	-72.3	-168.8	-93.8	0	0	113.7
2	A	53.5	Low	59.1	Low	88 Å²	88	123.7 Å²	123.7	73%	0.727	67%	0.673	S	S	*	*			trans	-102.3	-9.5	178.1	0	0	0	0	0	114.4
3	M	50.9	Low	59.4	Low	163 Å²	163	120.5 Å²	120.5	80%	0.803	66%	0.659	S	S	*	*	H	α-helix	trans	-89.1	-11.1	179.8	-74.3	-130.7	-72.8	0	0	114.8
4	G	52.8	Low	59.4	Low	48 Å²	48	116.8 Å²	116.8	50%	0.495	64%	0.643	S	S	.	*	H	α-helix	trans	-74.9	-43.4	179.7	0	0	0	0	0	113	F6 R7	G4-F6 PolarHBondContact O-N 3.03Å; G4-R7 PolarHBondContact O-N 3.01Å
5	L	54	Low	59.4	Low	133 Å²	133	113 Å²	113	70%	0.696	63%	0.633	S	S	*	*	H	α-helix	trans	-67.3	-34.5	-177.8	-81.7	157	0	0	0	112.6	R7 V8 C9	L5-R7 VanDerWaalsContact C-N 3.33Å; L5-R7 PolarHBondContact O-N 3.19Å; L5-V8 PolarHBondContact O-N 3.08Å; L5-C9 PolarHBondContact O-N 3.34Å
6	F	57.9	Low	59.2	Low	161 Å²	161	114.4 Å²	114.4	71%	0.706	64%	0.637	S	S	*	*	H	α-helix	trans	-68.3	-31.2	-179.7	-141	-88.2	0	0	0	112.9	G4 L10	G4-F6 PolarHBondContact O-N 3.03Å; F6-L10 HydrophobicContact CD1-CD1 4.09Å; F6-L10 HydrophobicContact CE1-CD1 4.09Å; F6-L10 PolarHBondContact O-N 3.42Å
7	R	60.5	Low	59.2	Low	201 Å²	201	114.9 Å²	114.9	76%	0.758	64%	0.636	S	S	*	*	H	α-helix	trans	-72.4	-36.3	177.1	-76.2	-168.3	177.4	-160.3	-0.1	112.8	G4 L5 V11	G4-R7 PolarHBondContact O-N 3.01Å; L5-R7 VanDerWaalsContact C-N 3.33Å; L5-R7 PolarHBondContact O-N 3.19Å; R7-V11 WeakPolarHBondContact O-CG2 3.43Å; R7-V11 PolarHBondContact O-N 3.48Å
8	V	65.9	Low	58.8	Low	94 Å²	94	115.3 Å²	115.3	57%	0.57	64%	0.637	S	S	*	*	H	α-helix	trans	-69.6	-42.5	-179.4	179	0	0	0	0	110.9	L5 L10 V11 V12	L5-V8 PolarHBondContact O-N 3.08Å; V8-L10 VanDerWaalsContact C-N 3.34Å; V8-L10 PolarHBondContact O-N 2.83Å; V8-V11 PolarHBondContact O-N 2.92Å; V8-V12 WeakPolarHBondContact O-CG2 3.42Å; V8-V12 PolarHBondContact O-N 3.42Å
9	C	67.1	Low	57.7	Low	85 Å²	85	118 Å²	118	57%	0.574	64%	0.644	S	S	*	*	H	α-helix	trans	-64.9	-36.8	177.4	-67.3	0	0	0	0	112.7	L5 V12 V13	L5-C9 PolarHBondContact O-N 3.34Å; C9-V12 PolarHBondContact O-N 3.25Å; C9-V13 WeakPolarHBondContact O-CG2 3.33Å; C9-V13 PolarHBondContact O-N 3.02Å; C9-V13 VanDerWaalsContact O-N 3.09Å
10	L	68.7	Low	56.7	Low	98 Å²	98	117.2 Å²	117.2	51%	0.513	65%	0.645	S	S	.	*	H	α-helix	trans	-67.3	-38.8	178.1	-118.2	152	0	0	0	112.3	F6 V8 V13 T14	F6-L10 HydrophobicContact CD1-CD1 4.09Å; F6-L10 HydrophobicContact CE1-CD1 4.09Å; F6-L10 PolarHBondContact O-N 3.42Å; V8-L10 VanDerWaalsContact C-N 3.34Å; V8-L10 PolarHBondContact O-N 2.83Å; L10-V13 PolarHBondContact O-N 3.14Å; L10-T14 HydrophobicContact CD2-CG2 4.41Å; L10-T14 WeakPolarHBondContact O-CG2 3.36Å; L10-T14 PolarHBondContact O-N 3.48Å; L10-T14 PolarHBondContact O-OG1 2.96Å
11	V	66.6	Low	55.5	Low	96 Å²	96	118.4 Å²	118.4	58%	0.582	65%	0.65	S	S	*	*	H	α-helix	trans	-64	-43	177.2	172.6	0	0	0	0	111.2	R7 V8 T14 A15	R7-V11 WeakPolarHBondContact O-CG2 3.43Å; R7-V11 PolarHBondContact O-N 3.48Å; V8-V11 PolarHBondContact O-N 2.92Å; V11-T14 WeakPolarHBondContact CA-OG1 3.37Å; V11-T14 PolarHBondContact O-N 2.97Å; V11-T14 PolarHBondContact O-OG1 2.94Å; V11-A15 WeakPolarHBondContact O-CB 3.24Å; V11-A15 PolarHBondContact O-N 3.4Å
12	V	63.9	Low	54.9	Low	79 Å²	79	114.8 Å²	114.8	48%	0.479	64%	0.635	S	S	.	*	H	α-helix	trans	-66	-41.7	179	176.7	0	0	0	0	111.4	V8 C9 A15 I16	V8-V12 WeakPolarHBondContact O-CG2 3.42Å; V8-V12 PolarHBondContact O-N 3.42Å; C9-V12 PolarHBondContact O-N 3.25Å; V12-A15 PolarHBondContact O-N 3.19Å; V12-I16 HydrophobicContact CG1-CD1 3.94Å; V12-I16 WeakPolarHBondContact O-CG1 3.43Å; V12-I16 PolarHBondContact O-N 3.42Å; V12-I16 VanDerWaalsContact O-N 3.12Å
13	V	62.7	Low	54	Low	82 Å²	82	119 Å²	119	50%	0.497	64%	0.637	S	S	.	*	H	α-helix	trans	-66.6	-39.2	177.5	175.1	0	0	0	0	111.1	C9 L10 I17	C9-V13 WeakPolarHBondContact O-CG2 3.33Å; C9-V13 PolarHBondContact O-N 3.02Å; C9-V13 VanDerWaalsContact O-N 3.09Å; L10-V13 PolarHBondContact O-N 3.14Å; V13-I17 HydrophobicContact CG1-CD1 3.7Å; V13-I17 VanDerWaalsContact O-CG1 3.26Å; V13-I17 WeakPolarHBondContact O-CG1 3.22Å; V13-I17 PolarHBondContact O-N 2.83Å
14	T	59.9	Low	53.2	Low	69 Å²	69	117.3 Å²	117.3	42%	0.423	64%	0.638	S	S	.	*	H	α-helix	trans	-69.4	-33	175.1	51.8	0	0	0	0	113.4	L10 V11 I17 N18	L10-T14 HydrophobicContact CD2-CG2 4.41Å; L10-T14 WeakPolarHBondContact O-CG2 3.36Å; L10-T14 PolarHBondContact O-N 3.48Å; L10-T14 PolarHBondContact O-OG1 2.96Å; V11-T14 WeakPolarHBondContact CA-OG1 3.37Å; V11-T14 PolarHBondContact O-N 2.97Å; V11-T14 PolarHBondContact O-OG1 2.94Å; T14-I17 PolarHBondContact O-N 3.06Å; T14-N18 WeakPolarHBondContact O-CB 3.37Å; T14-N18 PolarHBondContact O-N 2.68Å; T14-N18 VanDerWaalsContact O-N 3.12Å
15	A	58.6	Low	52.3	Low	60 Å²	60	127 Å²	127	50%	0.496	66%	0.659	S	S	.	*	H	α-helix	trans	-69.5	-36	178.6	0	0	0	0	0	112.2	V11 V12	V11-A15 WeakPolarHBondContact O-CB 3.24Å; V11-A15 PolarHBondContact O-N 3.4Å; V12-A15 PolarHBondContact O-N 3.19Å
16	I	57.2	Low	51.1	Low	135 Å²	135	129 Å²	129	69%	0.692	67%	0.665	S	S	*	*	H	α-helix	trans	-74	-34.1	177.5	-64.4	169.1	0	0	0	111	V12	V12-I16 HydrophobicContact CG1-CD1 3.94Å; V12-I16 WeakPolarHBondContact O-CG1 3.43Å; V12-I16 PolarHBondContact O-N 3.42Å; V12-I16 VanDerWaalsContact O-N 3.12Å
17	I	58.4	Low	49.7	Very low	123 Å²	123	128.3 Å²	128.3	63%	0.631	67%	0.669	S	S	*	*	H	α-helix	trans	-77.7	-28.8	-178.4	-65.5	171.2	0	0	0	112.3	V13 T14	V13-I17 HydrophobicContact CG1-CD1 3.7Å; V13-I17 VanDerWaalsContact O-CG1 3.26Å; V13-I17 WeakPolarHBondContact O-CG1 3.22Å; V13-I17 PolarHBondContact O-N 2.83Å; T14-I17 PolarHBondContact O-N 3.06Å
18	N	51.9	Low	48.4	Very low	123 Å²	123	122.8 Å²	122.8	66%	0.658	67%	0.666	S	S	*	*	S	Bend	trans	-106.2	11.1	-169.7	-91.6	-18.8	0	0	0	117.7	T14	T14-N18 WeakPolarHBondContact O-CB 3.37Å; T14-N18 PolarHBondContact O-N 2.68Å; T14-N18 VanDerWaalsContact O-N 3.12Å
19	H	39.1	Very low	46.8	Very low	166 Å²	166	125.3 Å²	125.3	77%	0.769	68%	0.682	S	S	*	*			trans	-130.7	75.9	172.7	-93.6	-69	0	0	0	114.4
20	P	36.3	Very low	45.6	Very low	101 Å²	101	126.4 Å²	126.4	66%	0.656	69%	0.686	S	S	*	*			trans	-77.7	120.7	165.5	31.4	-29.1	0	0	0	110.8
21	L	33.2	Very low	44.5	Very low	143 Å²	143	128 Å²	128	75%	0.749	70%	0.702	S	S	*	*			trans	43.9	90.9	142	-57.1	173.6	0	0	0	117.3	F23	L21-F23 HydrophobicContact CD2-CE2 4.24Å
22	L	34.5	Very low	43.6	Very low	163 Å²	163	130.8 Å²	130.8	85%	0.853	71%	0.709	S	S	*	*			trans	-114.6	94.5	158.9	-70.3	172.2	0	0	0	108.9	P24	L22-P24 WeakPolarHBondContact O-CD 3.36Å
23	F	33.8	Very low	43.5	Very low	177 Å²	177	132.5 Å²	132.5	78%	0.776	72%	0.715	S	S	*	*			trans	-69.9	122.7	166.8	-79.2	-89.5	0	0	0	109.5	L21	L21-F23 HydrophobicContact CD2-CE2 4.24Å
24	P	35.3	Very low	43.6	Very low	126 Å²	126	136 Å²	136	82%	0.818	73%	0.726	S	S	*	*			trans	-86.9	112.7	168.9	32	-25	0	0	0	108.2	L22	L22-P24 WeakPolarHBondContact O-CD 3.36Å
25	R	32.7	Very low	44.4	Very low	251 Å²	251	140 Å²	140	95%	0.947	74%	0.74	S	S	*	*			trans	-127.9	72.2	174.2	-133.6	-179.3	178.6	177.6	-1.1	109.6
26	E	29.5	Very low	45.1	Very low	175 Å²	175	142 Å²	142	82%	0.818	74%	0.739	S	S	*	*			trans	-87.2	113.1	160.9	-95	175.4	161.6	0	0	108.1
27	N	28.3	Very low	45.8	Very low	147 Å²	147	139.9 Å²	139.9	79%	0.786	73%	0.728	S	S	*	*				168.9	123.7	113.3	-82.5	-30.2	0	0	0	112.8
28	A	33.4	Very low	46.8	Very low	85 Å²	85	138.6 Å²	138.6	70%	0.702	72%	0.722	S	S	*	*			trans	32.2	112.8	139.6	0	0	0	0	0	119.4	V30	A28-V30 PolarHBondContact O-N 3.4Å
29	T	32.6	Very low	48.4	Very low	148 Å²	148	139 Å²	139	91%	0.908	71%	0.714	S	S	*	*			trans	-62.7	109.5	155	46.4	0	0	0	0	110.7
30	V	40.6	Very low	50.5	Low	107 Å²	107	137.7 Å²	137.7	65%	0.648	71%	0.706	S	S	*	*			trans	-133.1	127.9	160.8	-179.7	0	0	0	0	107.2	A28 E32	A28-V30 PolarHBondContact O-N 3.4Å; V30-E32 PolarHBondContact O-N 3.45Å
31	P	45.5	Very low	52.6	Low	132 Å²	132	139 Å²	139	86%	0.857	71%	0.705	S	S	*	*			trans	-77.4	106.1	-176.3	30.3	-30.3	0	0	0	109.2
32	E	49.3	Very low	55.2	Low	155 Å²	155	137.8 Å²	137.8	72%	0.724	70%	0.696	S	S	*	*			trans	-90.7	140.7	174.8	-73.1	-175.4	161.8	0	0	110.9	V30 E34	V30-E32 PolarHBondContact O-N 3.45Å; E32-E34 PolarHBondContact O-N 2.95Å
33	N	59.9	Low	57.9	Low	115 Å²	115	135.7 Å²	135.7	62%	0.615	68%	0.681	S	S	*	*			trans	-57.8	108.3	-169	-154.9	8.7	0	0	0	112.2	E35 E36	N33-E35 PolarHBondContact O-N 3.19Å; N33-E36 PolarHBondContact O-N 3.26Å
34	E	66.7	Low	60.3	Low	154 Å²	154	132.8 Å²	132.8	72%	0.72	67%	0.67	S	S	*	*	H	α-helix	trans	-53	-32.1	-170.7	-66.8	178.9	163.3	0	0	114.3	E32 E36 I37 I38	E32-E34 PolarHBondContact O-N 2.95Å; E34-E36 VanDerWaalsContact C-N 3.33Å; E34-E36 PolarHBondContact O-N 3.49Å; E34-I37 PolarHBondContact O-N 3.43Å; E34-I38 WeakPolarHBondContact O-CG1 3.47Å; E34-I38 PolarHBondContact O-N 3.11Å
35	E	75.6	Confident	62.9	Low	153 Å²	153	132.2 Å²	132.2	72%	0.715	66%	0.656	S	S	*	*	H	α-helix	trans	-64.7	-34.4	-176.7	-66	-178.6	167.7	0	0	113.1	N33 I38 R39	N33-E35 PolarHBondContact O-N 3.19Å; E35-I38 PolarHBondContact O-N 3.24Å; E35-R39 PolarHBondContact O-N 2.91Å
36	E	73.2	Confident	65.7	Low	103 Å²	103	126.1 Å²	126.1	48%	0.481	64%	0.639	S	S	.	*	H	α-helix	trans	-77.8	-26.9	-177.7	-158.1	159.7	-145.6	0	0	112.1	N33 E34 R39 K40	N33-E36 PolarHBondContact O-N 3.26Å; E34-E36 VanDerWaalsContact C-N 3.33Å; E34-E36 PolarHBondContact O-N 3.49Å; E36-R39 IonicContact OE1-NH2 2.64Å; E36-R39 PolarHBondContact OE1-NH2 3.24Å; E36-K40 PolarHBondContact O-N 2.94Å
37	I	72.2	Confident	68.6	Low	90 Å²	90	123.9 Å²	123.9	46%	0.462	63%	0.626	S	S	.	*	H	α-helix	trans	-69.8	-43.1	172.7	-60.6	174.8	0	0	0	110	E34 R39 K40 M41	E34-I37 PolarHBondContact O-N 3.43Å; I37-R39 PolarHBondContact O-N 3.37Å; I37-K40 PolarHBondContact O-N 3.42Å; I37-M41 WeakPolarHBondContact O-CB 3.37Å; I37-M41 PolarHBondContact O-N 2.98Å
38	I	80.1	Confident	71.5	Confident	96 Å²	96	121 Å²	121	49%	0.492	61%	0.61	S	S	.	*	H	α-helix	trans	-62.5	-44.4	179.5	-65.8	167.7	0	0	0	110.9	E34 E35 K40 M41 Q42	E34-I38 WeakPolarHBondContact O-CG1 3.47Å; E34-I38 PolarHBondContact O-N 3.11Å; E35-I38 PolarHBondContact O-N 3.24Å; I38-K40 PolarHBondContact O-N 3.43Å; I38-M41 WeakPolarHBondContact O-CB 3.09Å; I38-M41 PolarHBondContact O-N 3.06Å; I38-Q42 PolarHBondContact O-N 3.09Å
39	R	84.8	Confident	74.3	Confident	132 Å²	132	122.2 Å²	122.2	50%	0.498	60%	0.601	S	S	.	*	H	α-helix	trans	-62.4	-44.8	178.1	-169.4	-179.5	67.2	-146.4	-8	111.9	E35 E36 I37 M41 Q42 E43	E35-R39 PolarHBondContact O-N 2.91Å; E36-R39 IonicContact OE1-NH2 2.64Å; E36-R39 PolarHBondContact OE1-NH2 3.24Å; I37-R39 PolarHBondContact O-N 3.37Å; R39-M41 VanDerWaalsContact C-N 3.31Å; R39-M41 PolarHBondContact O-N 2.9Å; R39-Q42 PolarHBondContact O-N 3.39Å; R39-E43 PolarHBondContact O-N 3.1Å; R39-E43 VanDerWaalsContact O-N 3.12Å
40	K	83.2	Confident	77.1	Confident	138 Å²	138	121.2 Å²	121.2	60%	0.6	59%	0.588	S	S	*	*	H	α-helix	trans	-63.7	-35.5	175.6	-78.5	-177.2	178.6	172.8	0	112.5	E36 I37 I38 H44	E36-K40 PolarHBondContact O-N 2.94Å; I37-K40 PolarHBondContact O-N 3.42Å; I38-K40 PolarHBondContact O-N 3.43Å; K40-H44 VanDerWaalsContact O-CB 3.27Å; K40-H44 WeakPolarHBondContact O-CB 3.29Å; K40-H44 PolarHBondContact O-N 2.88Å
41	M	79.6	Confident	79.4	Confident	128 Å²	128	120.7 Å²	120.7	63%	0.631	58%	0.579	S	S	*	*	H	α-helix	trans	-64	-40.9	174.3	-94.2	-175.9	65.8	0	0	112.2	I37 I38 R39 H44 Q45	I37-M41 WeakPolarHBondContact O-CB 3.37Å; I37-M41 PolarHBondContact O-N 2.98Å; I38-M41 WeakPolarHBondContact O-CB 3.09Å; I38-M41 PolarHBondContact O-N 3.06Å; R39-M41 VanDerWaalsContact C-N 3.31Å; R39-M41 PolarHBondContact O-N 2.9Å; M41-H44 PolarHBondContact O-N 3.33Å; M41-Q45 WeakPolarHBondContact O-CB 3.41Å; M41-Q45 PolarHBondContact O-N 3.48Å
42	Q	88.9	Confident	81.3	Confident	119 Å²	119	120.1 Å²	120.1	56%	0.556	56%	0.564	S	S	*	*	H	α-helix	trans	-67.8	-46.4	179.1	-73.2	-179.8	-23.1	0	0	112.3	I38 R39 H44 Q45 E46	I38-Q42 PolarHBondContact O-N 3.09Å; R39-Q42 PolarHBondContact O-N 3.39Å; Q42-H44 VanDerWaalsContact C-N 3.25Å; Q42-H44 PolarHBondContact O-N 3.41Å; Q42-Q45 PolarHBondContact O-N 3.4Å; Q42-Q45 VanDerWaalsContact O-N 3.11Å; Q42-E46 PolarHBondContact O-N 3.09Å
43	E	89.7	Confident	83.4	Confident	119 Å²	119	118.1 Å²	118.1	56%	0.556	56%	0.558	S	S	*	*	H	α-helix	trans	-60	-37.9	174.7	-72.6	176.9	179.5	0	0	111.7	R39 K47	R39-E43 PolarHBondContact O-N 3.1Å; R39-E43 VanDerWaalsContact O-N 3.12Å; E43-K47 WeakPolarHBondContact O-CB 3.41Å; E43-K47 PolarHBondContact O-N 3.13Å; E43-K47 VanDerWaalsContact O-N 3.09Å
44	H	85.6	Confident	84.9	Confident	115 Å²	115	120.5 Å²	120.5	53%	0.532	56%	0.558	S	S	.	*	H	α-helix	trans	-66.7	-38.7	175.9	-167	65.2	0	0	0	112.1	K40 M41 Q42 K47 L48	K40-H44 VanDerWaalsContact O-CB 3.27Å; K40-H44 WeakPolarHBondContact O-CB 3.29Å; K40-H44 PolarHBondContact O-N 2.88Å; M41-H44 PolarHBondContact O-N 3.33Å; Q42-H44 VanDerWaalsContact C-N 3.25Å; Q42-H44 PolarHBondContact O-N 3.41Å; H44-K47 PolarHBondContact O-N 3.18Å; H44-L48 WeakPolarHBondContact O-CG 3.42Å; H44-L48 PolarHBondContact O-N 2.97Å
45	Q	88.8	Confident	85.9	Confident	114 Å²	114	118.1 Å²	118.1	53%	0.533	55%	0.55	S	S	.	*	H	α-helix	trans	-66.8	-42.4	178	-172.4	177.4	-31.5	0	0	112.2	M41 Q42 L48 Q49	M41-Q45 WeakPolarHBondContact O-CB 3.41Å; M41-Q45 PolarHBondContact O-N 3.48Å; Q42-Q45 PolarHBondContact O-N 3.4Å; Q42-Q45 VanDerWaalsContact O-N 3.11Å; Q45-L48 PolarHBondContact O-N 2.98Å; Q45-Q49 PolarHBondContact O-N 3.49Å; Q45-Q49 VanDerWaalsContact O-N 3.08Å
46	E	92.3	Very high	86.6	Confident	123 Å²	123	115.9 Å²	115.9	58%	0.575	54%	0.54	S	S	*	.	H	α-helix	trans	-64.5	-40.8	175.5	-71.2	-177.1	172.7	0	0	111.7	Q42 L48 Q49 M50	Q42-E46 PolarHBondContact O-N 3.09Å; E46-L48 VanDerWaalsContact C-N 3.32Å; E46-L48 PolarHBondContact O-N 3.07Å; E46-Q49 PolarHBondContact O-N 2.94Å; E46-M50 HydrophobicContact CB-CE 4.43Å; E46-M50 WeakPolarHBondContact O-CE 3.34Å; E46-M50 PolarHBondContact O-N 2.9Å; E46-M50 VanDerWaalsContact O-N 3.1Å
47	K	91.1	Very high	87.5	Confident	128 Å²	128	118.1 Å²	118.1	56%	0.557	55%	0.55	S	S	*	*	H	α-helix	trans	-60.6	-42.2	175.4	-172.7	179.3	177.2	-175.8	0	111.8	E43 H44 M50 E51	E43-K47 WeakPolarHBondContact O-CB 3.41Å; E43-K47 PolarHBondContact O-N 3.13Å; E43-K47 VanDerWaalsContact O-N 3.09Å; H44-K47 PolarHBondContact O-N 3.18Å; K47-M50 PolarHBondContact O-N 3.46Å; K47-E51 PolarHBondContact O-N 3.49Å
48	L	87.9	Confident	88.2	Confident	86 Å²	86	117.3 Å²	117.3	45%	0.45	54%	0.544	S	S	.	.	H	α-helix	trans	-64.4	-38.7	177	-75.7	169.1	0	0	0	112.3	H44 Q45 E46 E51 Q52	H44-L48 WeakPolarHBondContact O-CG 3.42Å; H44-L48 PolarHBondContact O-N 2.97Å; Q45-L48 PolarHBondContact O-N 2.98Å; E46-L48 VanDerWaalsContact C-N 3.32Å; E46-L48 PolarHBondContact O-N 3.07Å; L48-E51 PolarHBondContact O-N 2.93Å; L48-Q52 WeakPolarHBondContact O-CB 3.43Å; L48-Q52 PolarHBondContact O-N 3.3Å
49	Q	92.2	Very high	88.6	Confident	111 Å²	111	117 Å²	117	52%	0.519	55%	0.546	S	S	.	.	H	α-helix	trans	-65.6	-39.4	177	-74.1	-177.5	-22.1	0	0	112.4	Q45 E46 Q52 L53	Q45-Q49 PolarHBondContact O-N 3.49Å; Q45-Q49 VanDerWaalsContact O-N 3.08Å; E46-Q49 PolarHBondContact O-N 2.94Å; Q49-Q52 PolarHBondContact O-N 3.46Å; Q49-L53 PolarHBondContact O-N 3.45Å; Q49-L53 VanDerWaalsContact O-N 3.15Å
50	M	91.9	Very high	88.7	Confident	127 Å²	127	114.4 Å²	114.4	63%	0.626	55%	0.549	S	S	*	.	H	α-helix	trans	-65.6	-40	174	-94.6	173.2	-85.3	0	0	112.6	E46 K47 Q52 R54	E46-M50 HydrophobicContact CB-CE 4.43Å; E46-M50 WeakPolarHBondContact O-CE 3.34Å; E46-M50 PolarHBondContact O-N 2.9Å; E46-M50 VanDerWaalsContact O-N 3.1Å; K47-M50 PolarHBondContact O-N 3.46Å; M50-Q52 VanDerWaalsContact C-N 3.34Å; M50-R54 PolarHBondContact O-N 2.82Å; M50-R54 VanDerWaalsContact O-N 3.16Å
51	E	88.1	Confident	88.9	Confident	97 Å²	97	115.8 Å²	115.8	45%	0.453	55%	0.55	S	S	.	*	H	α-helix	trans	-65.5	-37.6	174.6	-79.9	-176	178.5	0	0	112	K47 L48 R54 L55	K47-E51 PolarHBondContact O-N 3.49Å; L48-E51 PolarHBondContact O-N 2.93Å; E51-R54 PolarHBondContact O-N 3.31Å; E51-L55 WeakPolarHBondContact O-CG 3.37Å; E51-L55 PolarHBondContact O-N 3.12Å
52	Q	87.3	Confident	89.2	Confident	119 Å²	119	114.4 Å²	114.4	56%	0.556	55%	0.545	S	S	*	.	H	α-helix	trans	-63.3	-44.9	177.7	-168.3	177.4	-17.4	0	0	112.1	L48 Q49 M50 R54 L55 E56	L48-Q52 WeakPolarHBondContact O-CB 3.43Å; L48-Q52 PolarHBondContact O-N 3.3Å; Q49-Q52 PolarHBondContact O-N 3.46Å; M50-Q52 VanDerWaalsContact C-N 3.34Å; Q52-R54 VanDerWaalsContact C-N 3.34Å; Q52-R54 PolarHBondContact O-N 3.37Å; Q52-L55 PolarHBondContact O-N 3.27Å; Q52-E56 PolarHBondContact O-N 2.95Å
53	L	93.1	Very high	89.2	Confident	113 Å²	113	112.4 Å²	112.4	59%	0.592	54%	0.541	S	S	*	.	H	α-helix	trans	-63.1	-40.1	176.3	-73.3	171.3	0	0	0	112.3	Q49 L55 E56 E57	Q49-L53 PolarHBondContact O-N 3.45Å; Q49-L53 VanDerWaalsContact O-N 3.15Å; L53-L55 VanDerWaalsContact C-N 3.34Å; L53-L55 PolarHBondContact O-N 2.9Å; L53-E56 PolarHBondContact O-N 3.36Å; L53-E57 PolarHBondContact O-N 3.03Å
54	R	91.1	Very high	89	Confident	165 Å²	165	109.6 Å²	109.6	62%	0.623	54%	0.538	S	S	*	.	H	α-helix	trans	-63.3	-40.8	176.1	-178	-178.6	172.6	173.8	1.8	112	M50 E51 Q52 E57 E58	M50-R54 PolarHBondContact O-N 2.82Å; M50-R54 VanDerWaalsContact O-N 3.16Å; E51-R54 PolarHBondContact O-N 3.31Å; Q52-R54 VanDerWaalsContact C-N 3.34Å; Q52-R54 PolarHBondContact O-N 3.37Å; R54-E57 PolarHBondContact O-N 3.14Å; R54-E58 IonicContact NE-OE1 3.99Å; R54-E58 IonicContact NH2-OE1 3.87Å; R54-E58 PolarHBondContact O-N 3.09Å
55	L	87.9	Confident	89	Confident	104 Å²	104	109.4 Å²	109.4	55%	0.545	54%	0.537	S	S	.	.	H	α-helix	trans	-67	-36.8	177.6	-73.9	167.8	0	0	0	111.9	E51 Q52 L53 E58 V59	E51-L55 WeakPolarHBondContact O-CG 3.37Å; E51-L55 PolarHBondContact O-N 3.12Å; Q52-L55 PolarHBondContact O-N 3.27Å; L53-L55 VanDerWaalsContact C-N 3.34Å; L53-L55 PolarHBondContact O-N 2.9Å; L55-E58 PolarHBondContact O-N 3.44Å; L55-V59 VanDerWaalsContact O-CG2 3.31Å; L55-V59 WeakPolarHBondContact O-CG2 3.41Å; L55-V59 PolarHBondContact O-N 3.19Å
56	E	90.5	Very high	88.5	Confident	106 Å²	106	110.3 Å²	110.3	50%	0.495	54%	0.539	S	S	.	.	H	α-helix	trans	-63.7	-39	175.6	-78.5	179.9	178.3	0	0	112.7	Q52 L53 S60	Q52-E56 PolarHBondContact O-N 2.95Å; L53-E56 PolarHBondContact O-N 3.36Å; E56-S60 WeakPolarHBondContact O-CB 3.33Å; E56-S60 PolarHBondContact O-N 3.2Å; E56-S60 PolarHBondContact O-OG 2.9Å
57	E	90.8	Very high	87.9	Confident	150 Å²	150	110.2 Å²	110.2	70%	0.701	54%	0.539	S	S	*	.	H	α-helix	trans	-65.2	-42.3	173.4	-80.3	-173.7	158.8	0	0	112.4	L53 R54 V59 S60 R61	L53-E57 PolarHBondContact O-N 3.03Å; R54-E57 PolarHBondContact O-N 3.14Å; E57-V59 PolarHBondContact O-N 2.69Å; E57-S60 PolarHBondContact O-N 3.4Å; E57-R61 PolarHBondContact O-N 3.48Å
58	E	87.6	Confident	87.5	Confident	74 Å²	74	106.6 Å²	106.6	35%	0.346	53%	0.533	S	S	.	.	H	α-helix	trans	-64.3	-40.2	177.8	-74.3	-176.7	-173.1	0	0	111.9	R54 L55 R61 L62	R54-E58 IonicContact NE-OE1 3.99Å; R54-E58 IonicContact NH2-OE1 3.87Å; R54-E58 PolarHBondContact O-N 3.09Å; L55-E58 PolarHBondContact O-N 3.44Å; E58-R61 PolarHBondContact O-N 3.3Å; E58-L62 WeakPolarHBondContact O-CG 3.31Å; E58-L62 PolarHBondContact O-N 3.14Å; E58-L62 VanDerWaalsContact O-N 3.11Å
59	V	87.8	Confident	86.9	Confident	88 Å²	88	107.2 Å²	107.2	53%	0.533	54%	0.536	S	S	.	.	H	α-helix	trans	-64.5	-43.3	175.1	171.2	0	0	0	0	111	L55 E57 R61 L62 V63	L55-V59 VanDerWaalsContact O-CG2 3.31Å; L55-V59 WeakPolarHBondContact O-CG2 3.41Å; L55-V59 PolarHBondContact O-N 3.19Å; E57-V59 PolarHBondContact O-N 2.69Å; V59-R61 VanDerWaalsContact C-N 3.3Å; V59-R61 PolarHBondContact O-N 2.94Å; V59-L62 PolarHBondContact O-N 3.14Å; V59-V63 WeakPolarHBondContact O-CG2 3.46Å; V59-V63 PolarHBondContact O-N 3.49Å
60	S	87.4	Confident	86	Confident	79 Å²	79	109 Å²	109	55%	0.552	54%	0.538	S	S	*	.	H	α-helix	trans	-60.5	-40.8	178.8	-56.2	0	0	0	0	111.8	E56 E57 V63 A64	E56-S60 WeakPolarHBondContact O-CB 3.33Å; E56-S60 PolarHBondContact O-N 3.2Å; E56-S60 PolarHBondContact O-OG 2.9Å; E57-S60 PolarHBondContact O-N 3.4Å; S60-V63 PolarHBondContact O-N 3.16Å; S60-A64 PolarHBondContact O-N 3.28Å
61	R	88.6	Confident	85	Confident	166 Å²	166	109.8 Å²	109.8	63%	0.626	54%	0.54	S	S	*	.	H	α-helix	trans	-64.5	-43.5	176.1	-164.9	-176.6	79.5	-147.3	1.3	112.1	E57 E58 V59 V63 A64 E65	E57-R61 PolarHBondContact O-N 3.48Å; E58-R61 PolarHBondContact O-N 3.3Å; V59-R61 VanDerWaalsContact C-N 3.3Å; V59-R61 PolarHBondContact O-N 2.94Å; R61-V63 VanDerWaalsContact C-N 3.33Å; R61-V63 PolarHBondContact O-N 3.35Å; R61-A64 PolarHBondContact O-N 3.48Å; R61-E65 PolarHBondContact O-N 3.1Å; R61-E65 VanDerWaalsContact O-N 3.08Å
62	L	85.8	Confident	84.3	Confident	100 Å²	100	110.3 Å²	110.3	52%	0.524	55%	0.545	S	S	.	.	H	α-helix	trans	-66.1	-33.9	179.4	-73.8	171.1	0	0	0	112.7	E58 V59 K66	E58-L62 WeakPolarHBondContact O-CG 3.31Å; E58-L62 PolarHBondContact O-N 3.14Å; E58-L62 VanDerWaalsContact O-N 3.11Å; V59-L62 PolarHBondContact O-N 3.14Å; L62-K66 WeakPolarHBondContact O-CB 3.22Å; L62-K66 PolarHBondContact O-N 3.25Å
63	V	87	Confident	83.4	Confident	77 Å²	77	110.2 Å²	110.2	47%	0.467	55%	0.545	S	S	.	.	H	α-helix	trans	-65.7	-45.7	175.3	172.6	0	0	0	0	110.8	V59 S60 R61 E65 K66 E67	V59-V63 WeakPolarHBondContact O-CG2 3.46Å; V59-V63 PolarHBondContact O-N 3.49Å; S60-V63 PolarHBondContact O-N 3.16Å; R61-V63 VanDerWaalsContact C-N 3.33Å; R61-V63 PolarHBondContact O-N 3.35Å; V63-E65 VanDerWaalsContact C-N 3.34Å; V63-E65 PolarHBondContact O-N 2.97Å; V63-K66 PolarHBondContact O-N 3.44Å; V63-E67 PolarHBondContact O-N 2.82Å
64	A	86.8	Confident	82.3	Confident	59 Å²	59	109.8 Å²	109.8	49%	0.488	54%	0.543	S	S	.	.	H	α-helix	trans	-62.5	-39.9	177.9	0	0	0	0	0	112.5	S60 R61 K66 E67 A68	S60-A64 PolarHBondContact O-N 3.28Å; R61-A64 PolarHBondContact O-N 3.48Å; A64-K66 VanDerWaalsContact C-N 3.34Å; A64-E67 PolarHBondContact O-N 3.1Å; A64-A68 PolarHBondContact O-N 3.05Å; A64-A68 VanDerWaalsContact O-N 3.13Å
65	E	84.9	Confident	80.8	Confident	111 Å²	111	108.9 Å²	108.9	52%	0.519	55%	0.546	S	S	.	.	H	α-helix	trans	-65.6	-37.8	176.7	-166.9	171.1	-172.6	0	0	111.8	R61 V63 A68 L69	R61-E65 PolarHBondContact O-N 3.1Å; R61-E65 VanDerWaalsContact O-N 3.08Å; V63-E65 VanDerWaalsContact C-N 3.34Å; V63-E65 PolarHBondContact O-N 2.97Å; E65-A68 PolarHBondContact O-N 3.48Å; E65-L69 PolarHBondContact O-N 2.96Å; E65-L69 VanDerWaalsContact O-N 3.08Å
66	K	78.3	Confident	79.5	Confident	134 Å²	134	108.7 Å²	108.7	58%	0.583	55%	0.545	S	S	*	.	H	α-helix	trans	-70.9	-33.5	177.2	-168	170.2	-177.7	173	0	113	L62 V63 A64 R70	L62-K66 WeakPolarHBondContact O-CB 3.22Å; L62-K66 PolarHBondContact O-N 3.25Å; V63-K66 PolarHBondContact O-N 3.44Å; A64-K66 VanDerWaalsContact C-N 3.34Å; K66-R70 PolarHBondContact O-N 3.17Å
67	E	79.9	Confident	78.1	Confident	120 Å²	120	109.9 Å²	109.9	56%	0.561	55%	0.551	S	S	*	*	H	α-helix	trans	-68	-39.4	173.2	-75.2	-178.1	170.8	0	0	111.9	V63 A64 R70 Q71	V63-E67 PolarHBondContact O-N 2.82Å; A64-E67 PolarHBondContact O-N 3.1Å; E67-R70 PolarHBondContact O-N 3.4Å; E67-Q71 PolarHBondContact O-N 2.85Å
68	A	81.9	Confident	76.4	Confident	52 Å²	52	109.3 Å²	109.3	43%	0.43	55%	0.548	S	S	.	.	H	α-helix	trans	-63.6	-39.8	174.2	0	0	0	0	0	112.2	A64 E65 R70 Q71 I72	A64-A68 PolarHBondContact O-N 3.05Å; A64-A68 VanDerWaalsContact O-N 3.13Å; E65-A68 PolarHBondContact O-N 3.48Å; A68-R70 PolarHBondContact O-N 3.34Å; A68-Q71 PolarHBondContact O-N 3.46Å; A68-I72 PolarHBondContact O-N 3.31Å
69	L	76.5	Confident	75.1	Confident	100 Å²	100	112.3 Å²	112.3	52%	0.524	56%	0.562	S	S	.	*	H	α-helix	trans	-64.1	-39.3	177.4	-125.1	105.5	0	0	0	112.6	E65 Q71 I72 E73	E65-L69 PolarHBondContact O-N 2.96Å; E65-L69 VanDerWaalsContact O-N 3.08Å; L69-Q71 VanDerWaalsContact C-N 3.32Å; L69-Q71 PolarHBondContact O-N 3.23Å; L69-I72 PolarHBondContact O-N 3.19Å; L69-E73 PolarHBondContact O-N 3.47Å; L69-E73 VanDerWaalsContact O-N 3.13Å
70	R	73.2	Confident	73.6	Confident	149 Å²	149	114.7 Å²	114.7	56%	0.562	57%	0.568	S	S	*	*	H	α-helix	trans	-62.9	-37.6	177.9	-78.9	178.8	171.5	173.2	-4.1	112.6	K66 E67 A68 I72 E73 D74	K66-R70 PolarHBondContact O-N 3.17Å; E67-R70 PolarHBondContact O-N 3.4Å; A68-R70 PolarHBondContact O-N 3.34Å; R70-I72 VanDerWaalsContact C-N 3.27Å; R70-I72 PolarHBondContact O-N 3.49Å; R70-E73 PolarHBondContact O-N 3.34Å; R70-D74 PolarHBondContact O-N 3.42Å; R70-D74 VanDerWaalsContact O-N 3.1Å
71	Q	70.7	Confident	72.2	Confident	142 Å²	142	116.7 Å²	116.7	66%	0.664	57%	0.571	S	S	*	*	H	α-helix	trans	-64.3	-34.4	176.9	-70.9	-178.6	-9.9	0	0	112.2	E67 A68 L69 E75	E67-Q71 PolarHBondContact O-N 2.85Å; A68-Q71 PolarHBondContact O-N 3.46Å; L69-Q71 VanDerWaalsContact C-N 3.32Å; L69-Q71 PolarHBondContact O-N 3.23Å; Q71-E75 PolarHBondContact O-N 2.8Å
72	I	73.2	Confident	71	Confident	109 Å²	109	115.3 Å²	115.3	56%	0.559	57%	0.572	S	S	*	*	H	α-helix	trans	-70.1	-41.4	176.1	-62.1	169.5	0	0	0	110.7	A68 L69 R70 D74 E75 D76	A68-I72 PolarHBondContact O-N 3.31Å; L69-I72 PolarHBondContact O-N 3.19Å; R70-I72 VanDerWaalsContact C-N 3.27Å; R70-I72 PolarHBondContact O-N 3.49Å; I72-D74 VanDerWaalsContact C-N 3.33Å; I72-D74 PolarHBondContact O-N 2.81Å; I72-E75 PolarHBondContact O-N 2.86Å; I72-D76 PolarHBondContact O-N 3.37Å
73	E	68.6	Low	69.8	Low	117 Å²	117	112.9 Å²	112.9	55%	0.547	57%	0.566	S	S	.	*	H	α-helix	trans	-63.2	-36.6	177.4	-75.5	-178.9	162.9	0	0	112.7	L69 R70 D76 Q77	L69-E73 PolarHBondContact O-N 3.47Å; L69-E73 VanDerWaalsContact O-N 3.13Å; R70-E73 PolarHBondContact O-N 3.34Å; E73-D76 PolarHBondContact O-N 3.38Å; E73-Q77 PolarHBondContact O-N 3.29Å; E73-Q77 VanDerWaalsContact O-N 3.1Å
74	D	69.3	Low	68.7	Low	104 Å²	104	115.2 Å²	115.2	56%	0.556	57%	0.572	S	S	*	*	H	α-helix	trans	-67.2	-35.4	177.6	-74.1	-22.8	0	0	0	112	R70 I72	R70-D74 PolarHBondContact O-N 3.42Å; R70-D74 VanDerWaalsContact O-N 3.1Å; I72-D74 VanDerWaalsContact C-N 3.33Å; I72-D74 PolarHBondContact O-N 2.81Å
75	E	61	Low	67.9	Low	146 Å²	146	116.7 Å²	116.7	68%	0.682	58%	0.575	S	S	*	*	H	α-helix	trans	-68.8	-37.8	174.3	-72.4	-169.9	154.1	0	0	112.3	Q71 I72 Q78 Q79	Q71-E75 PolarHBondContact O-N 2.8Å; I72-E75 PolarHBondContact O-N 2.86Å; E75-Q78 PolarHBondContact O-N 2.57Å; E75-Q79 PolarHBondContact O-N 2.7Å
76	D	60.7	Low	67.3	Low	100 Å²	100	115 Å²	115	54%	0.535	57%	0.573	S	S	.	*	H	α-helix	trans	-69.7	-36.4	-179.4	-128.5	25.3	0	0	0	111.9	I72 E73 Q78 Q79 Q80	I72-D76 PolarHBondContact O-N 3.37Å; E73-D76 PolarHBondContact O-N 3.38Å; D76-Q78 VanDerWaalsContact C-N 3.31Å; D76-Q78 PolarHBondContact O-N 2.88Å; D76-Q79 PolarHBondContact O-N 3.47Å; D76-Q80 PolarHBondContact O-N 2.93Å; D76-Q80 VanDerWaalsContact O-N 3.09Å
77	Q	59.8	Low	67	Low	131 Å²	131	117.8 Å²	117.8	61%	0.612	58%	0.579	S	S	*	*	H	α-helix	trans	-62	-37.4	174.4	-87	-173.8	19.8	0	0	112.8	E73 Q79 Q80 L81	E73-Q77 PolarHBondContact O-N 3.29Å; E73-Q77 VanDerWaalsContact O-N 3.1Å; Q77-Q79 VanDerWaalsContact C-N 3.34Å; Q77-Q79 PolarHBondContact O-N 3.04Å; Q77-Q80 PolarHBondContact O-N 3.03Å; Q77-L81 PolarHBondContact O-N 3.39Å; Q77-L81 VanDerWaalsContact O-N 3.15Å
78	Q	56.5	Low	66.9	Low	137 Å²	137	116.3 Å²	116.3	64%	0.64	58%	0.575	S	S	*	*	H	α-helix	trans	-64	-41	179.5	-162	87.6	5.8	0	0	111.1	E75 D76 L81	E75-Q78 PolarHBondContact O-N 2.57Å; D76-Q78 VanDerWaalsContact C-N 3.31Å; D76-Q78 PolarHBondContact O-N 2.88Å; Q78-L81 PolarHBondContact O-N 3.35Å
79	Q	58.3	Low	67	Low	138 Å²	138	119.1 Å²	119.1	65%	0.645	58%	0.582	S	S	*	*	H	α-helix	trans	-69.4	-37.9	176.9	-72	-174.4	2.1	0	0	112.6	E75 D76 Q77 L81 E82 A83	E75-Q79 PolarHBondContact O-N 2.7Å; D76-Q79 PolarHBondContact O-N 3.47Å; Q77-Q79 VanDerWaalsContact C-N 3.34Å; Q77-Q79 PolarHBondContact O-N 3.04Å; Q79-L81 VanDerWaalsContact C-N 3.31Å; Q79-L81 PolarHBondContact O-N 2.93Å; Q79-E82 PolarHBondContact O-N 3.31Å; Q79-A83 PolarHBondContact O-N 3.18Å
80	Q	56.8	Low	67.3	Low	138 Å²	138	122.8 Å²	122.8	65%	0.645	59%	0.59	S	S	*	*	H	α-helix	trans	-63	-35.9	176.7	-98.1	-178.7	-30	0	0	112.9	D76 Q77 A83 H84	D76-Q80 PolarHBondContact O-N 2.93Å; D76-Q80 VanDerWaalsContact O-N 3.09Å; Q77-Q80 PolarHBondContact O-N 3.03Å; Q80-A83 PolarHBondContact O-N 3.43Å; Q80-H84 PolarHBondContact O-N 2.82Å
81	L	58.5	Low	67.8	Low	120 Å²	120	118.4 Å²	118.4	63%	0.628	58%	0.582	S	S	*	*	H	α-helix	trans	-65.1	-42.1	179.7	-167.4	70.9	0	0	0	111.9	Q77 Q78 Q79 H84 T85	Q77-L81 PolarHBondContact O-N 3.39Å; Q77-L81 VanDerWaalsContact O-N 3.15Å; Q78-L81 PolarHBondContact O-N 3.35Å; Q79-L81 VanDerWaalsContact C-N 3.31Å; Q79-L81 PolarHBondContact O-N 2.93Å; L81-H84 PolarHBondContact O-N 3.4Å; L81-T85 PolarHBondContact O-N 3.37Å
82	E	62.5	Low	68.5	Low	137 Å²	137	115.4 Å²	115.4	64%	0.64	57%	0.573	S	S	*	*	H	α-helix	trans	-63.9	-43.8	176.2	-69.7	-172.5	169.5	0	0	111.3	Q79 H84 T85 T86	Q79-E82 PolarHBondContact O-N 3.31Å; E82-H84 VanDerWaalsContact C-N 3.32Å; E82-H84 PolarHBondContact O-N 3.43Å; E82-T85 PolarHBondContact O-N 2.83Å; E82-T85 PolarHBondContact O-OG1 3.19Å; E82-T86 PolarHBondContact O-N 2.98Å
83	A	62.2	Low	69.4	Low	49 Å²	49	114.4 Å²	114.4	41%	0.405	57%	0.568	S	S	.	*	H	α-helix	trans	-59.8	-41.4	177.1	0	0	0	0	0	112.4	Q79 Q80 T85 T86 W87	Q79-A83 PolarHBondContact O-N 3.18Å; Q80-A83 PolarHBondContact O-N 3.43Å; A83-T85 PolarHBondContact O-N 3.36Å; A83-T86 PolarHBondContact O-N 2.84Å; A83-T86 PolarHBondContact O-OG1 3.3Å; A83-W87 PolarHBondContact O-N 3.03Å
84	H	63.5	Low	70.5	Confident	126 Å²	126	112.3 Å²	112.3	58%	0.583	57%	0.566	S	S	*	*	H	α-helix	trans	-63.5	-40.7	-178.4	-144.7	-70.3	0	0	0	112.4	Q80 L81 E82 T86 W87 D88	Q80-H84 PolarHBondContact O-N 2.82Å; L81-H84 PolarHBondContact O-N 3.4Å; E82-H84 VanDerWaalsContact C-N 3.32Å; E82-H84 PolarHBondContact O-N 3.43Å; H84-T86 VanDerWaalsContact C-N 3.33Å; H84-T86 PolarHBondContact O-N 2.84Å; H84-W87 PolarHBondContact O-N 3Å; H84-D88 IonicContact ND1-OD2 2.63Å; H84-D88 PolarHBondContact O-N 3.47Å
85	T	69.2	Low	71.4	Confident	90 Å²	90	113.3 Å²	113.3	55%	0.552	57%	0.569	S	S	*	*	H	α-helix	trans	-64.8	-34.8	178.7	59	0	0	0	0	113.2	L81 E82 A83 L89	L81-T85 PolarHBondContact O-N 3.37Å; E82-T85 PolarHBondContact O-N 2.83Å; E82-T85 PolarHBondContact O-OG1 3.19Å; A83-T85 PolarHBondContact O-N 3.36Å; T85-L89 PolarHBondContact O-N 3.38Å
86	T	71.9	Confident	72.8	Confident	77 Å²	77	110.8 Å²	110.8	47%	0.472	56%	0.559	S	S	.	*	H	α-helix	trans	-70	-38.4	177.1	64.3	0	0	0	0	112.3	E82 A83 H84 L89 W90	E82-T86 PolarHBondContact O-N 2.98Å; A83-T86 PolarHBondContact O-N 2.84Å; A83-T86 PolarHBondContact O-OG1 3.3Å; H84-T86 VanDerWaalsContact C-N 3.33Å; H84-T86 PolarHBondContact O-N 2.84Å; T86-L89 PolarHBondContact O-N 2.96Å; T86-W90 PolarHBondContact O-N 2.94Å
87	W	72	Confident	74.3	Confident	191 Å²	191	111.4 Å²	111.4	72%	0.723	56%	0.562	S	S	*	*	H	α-helix	trans	-65	-39	178.8	-96.5	66.8	0	0	0	113.2	A83 H84 L89 W90 S91	A83-W87 PolarHBondContact O-N 3.03Å; H84-W87 PolarHBondContact O-N 3Å; W87-L89 VanDerWaalsContact C-N 3.3Å; W87-L89 PolarHBondContact O-N 3.31Å; W87-W90 PolarHBondContact O-N 2.94Å; W87-S91 WeakPolarHBondContact O-CB 3.37Å; W87-S91 PolarHBondContact O-N 3.3Å; W87-S91 PolarHBondContact O-OG 3.22Å
88	D	77.7	Confident	75.8	Confident	89 Å²	89	111.7 Å²	111.7	48%	0.476	56%	0.561	S	S	.	*	H	α-helix	trans	-65.6	-34.6	177.7	-76	-26.3	0	0	0	112	H84 S91 T92	H84-D88 IonicContact ND1-OD2 2.63Å; H84-D88 PolarHBondContact O-N 3.47Å; D88-S91 PolarHBondContact O-N 2.85Å; D88-T92 WeakPolarHBondContact O-CB 3.34Å; D88-T92 WeakPolarHBondContact O-CG2 3.27Å; D88-T92 PolarHBondContact O-N 2.96Å; D88-T92 PolarHBondContact O-OG1 2.87Å
89	L	84.4	Confident	77.2	Confident	111 Å²	111	110.5 Å²	110.5	58%	0.581	56%	0.559	S	S	*	*	H	α-helix	trans	-70.9	-38.9	179.7	-148.4	139.1	0	0	0	112.1	T85 T86 W87 T92 L93	T85-L89 PolarHBondContact O-N 3.38Å; T86-L89 PolarHBondContact O-N 2.96Å; W87-L89 VanDerWaalsContact C-N 3.3Å; W87-L89 PolarHBondContact O-N 3.31Å; L89-T92 WeakPolarHBondContact CA-OG1 3.13Å; L89-T92 PolarHBondContact O-OG1 2.94Å; L89-L93 HydrophobicContact CD2-CD1 4.06Å; L89-L93 WeakPolarHBondContact O-CB 3.46Å; L89-L93 WeakPolarHBondContact O-CG 3.43Å; L89-L93 PolarHBondContact O-N 3.45Å; L89-L93 VanDerWaalsContact O-N 3.1Å
90	W	83.4	Confident	78.5	Confident	178 Å²	178	108.2 Å²	108.2	67%	0.674	55%	0.55	S	S	*	*	H	α-helix	trans	-68.8	-39.6	171.9	-76.4	105.9	0	0	0	112.3	T86 W87 L93 C94	T86-W90 PolarHBondContact O-N 2.94Å; W87-W90 PolarHBondContact O-N 2.94Å; W90-L93 PolarHBondContact O-N 3.42Å; W90-C94 WeakPolarHBondContact O-CB 3.47Å; W90-C94 PolarHBondContact O-N 3.35Å; W90-C94 PolarHBondContact O-SG 2.83Å
91	S	82.7	Confident	79.8	Confident	57 Å²	57	106 Å²	106	40%	0.399	54%	0.542	S	S	.	.	H	α-helix	trans	-63.8	-43.1	178.2	-60.4	0	0	0	0	111.6	W87 D88 C94 M95	W87-S91 WeakPolarHBondContact O-CB 3.37Å; W87-S91 PolarHBondContact O-N 3.3Å; W87-S91 PolarHBondContact O-OG 3.22Å; D88-S91 PolarHBondContact O-N 2.85Å; S91-C94 PolarHBondContact O-N 2.95Å; S91-M95 VanDerWaalsContact O-CG 3.28Å; S91-M95 WeakPolarHBondContact O-CG 3.32Å; S91-M95 PolarHBondContact O-N 3.2Å
92	T	87.1	Confident	80.8	Confident	79 Å²	79	104 Å²	104	49%	0.485	53%	0.529	S	S	.	.	H	α-helix	trans	-65.2	-41.5	175.3	42.8	0	0	0	0	112.5	D88 L89 M95 I96	D88-T92 WeakPolarHBondContact O-CB 3.34Å; D88-T92 WeakPolarHBondContact O-CG2 3.27Å; D88-T92 PolarHBondContact O-N 2.96Å; D88-T92 PolarHBondContact O-OG1 2.87Å; L89-T92 WeakPolarHBondContact CA-OG1 3.13Å; L89-T92 PolarHBondContact O-OG1 2.94Å; T92-M95 PolarHBondContact O-N 3.28Å; T92-I96 VanDerWaalsContact O-CG1 3.29Å; T92-I96 WeakPolarHBondContact O-CG1 3.45Å; T92-I96 PolarHBondContact O-N 3.33Å
93	L	91.5	Very high	81.4	Confident	87 Å²	87	101.7 Å²	101.7	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-61.4	-43.8	173.9	-80.2	168.3	0	0	0	112.5	L89 W90 M95 I96 L97	L89-L93 HydrophobicContact CD2-CD1 4.06Å; L89-L93 WeakPolarHBondContact O-CB 3.46Å; L89-L93 WeakPolarHBondContact O-CG 3.43Å; L89-L93 PolarHBondContact O-N 3.45Å; L89-L93 VanDerWaalsContact O-N 3.1Å; W90-L93 PolarHBondContact O-N 3.42Å; L93-M95 VanDerWaalsContact C-N 3.33Å; L93-M95 PolarHBondContact O-N 3.41Å; L93-I96 PolarHBondContact O-N 2.92Å; L93-L97 WeakPolarHBondContact O-CB 3.31Å; L93-L97 PolarHBondContact O-N 3.41Å
94	C	91	Very high	81.8	Confident	74 Å²	74	108.1 Å²	108.1	50%	0.5	54%	0.538	S	S	.	.	H	α-helix	trans	-61.1	-41.5	175.8	-73.4	0	0	0	0	111.9	W90 S91 L97 F98	W90-C94 WeakPolarHBondContact O-CB 3.47Å; W90-C94 PolarHBondContact O-N 3.35Å; W90-C94 PolarHBondContact O-SG 2.83Å; S91-C94 PolarHBondContact O-N 2.95Å; C94-L97 PolarHBondContact O-N 3.14Å; C94-F98 PolarHBondContact O-N 3.39Å
95	M	88.7	Confident	82.1	Confident	125 Å²	125	107.3 Å²	107.3	62%	0.616	53%	0.53	S	S	*	.	H	α-helix	trans	-65.3	-41.4	176.7	-71.2	-64.5	-70.8	0	0	112.3	S91 T92 L93 L97 F98 L99	S91-M95 VanDerWaalsContact O-CG 3.28Å; S91-M95 WeakPolarHBondContact O-CG 3.32Å; S91-M95 PolarHBondContact O-N 3.2Å; T92-M95 PolarHBondContact O-N 3.28Å; L93-M95 VanDerWaalsContact C-N 3.33Å; L93-M95 PolarHBondContact O-N 3.41Å; M95-L97 VanDerWaalsContact C-N 3.34Å; M95-F98 PolarHBondContact O-N 3.45Å; M95-L99 WeakPolarHBondContact O-CG 3.37Å; M95-L99 PolarHBondContact O-N 2.81Å
96	I	91.1	Very high	81.8	Confident	93 Å²	93	108.2 Å²	108.2	48%	0.477	53%	0.528	S	S	.	.	H	α-helix	trans	-62.4	-44.1	175.5	-68.4	164.7	0	0	0	110.4	T92 L93 F98 L99 I100	T92-I96 VanDerWaalsContact O-CG1 3.29Å; T92-I96 WeakPolarHBondContact O-CG1 3.45Å; T92-I96 PolarHBondContact O-N 3.33Å; L93-I96 PolarHBondContact O-N 2.92Å; I96-F98 VanDerWaalsContact C-N 3.34Å; I96-F98 PolarHBondContact O-N 3.32Å; I96-L99 PolarHBondContact O-N 3.32Å; I96-I100 HydrophobicContact CG2-CD1 3.98Å; I96-I100 WeakPolarHBondContact O-CG1 3.32Å; I96-I100 PolarHBondContact O-N 2.8Å
97	L	92.1	Very high	80.9	Confident	112 Å²	112	110.5 Å²	110.5	59%	0.586	54%	0.537	S	S	*	.	H	α-helix	trans	-65.6	-38.4	-179.7	-153.8	137.7	0	0	0	111.5	L93 C94 M95 I100 I101	L93-L97 WeakPolarHBondContact O-CB 3.31Å; L93-L97 PolarHBondContact O-N 3.41Å; C94-L97 PolarHBondContact O-N 3.14Å; M95-L97 VanDerWaalsContact C-N 3.34Å; L97-I100 PolarHBondContact O-N 2.92Å; L97-I101 HydrophobicContact CD2-CD1 3.84Å; L97-I101 VanDerWaalsContact O-CG1 3.31Å; L97-I101 WeakPolarHBondContact O-CG1 3.41Å; L97-I101 PolarHBondContact O-N 3.07Å; L97-I101 VanDerWaalsContact O-N 3.11Å
98	F	91.1	Very high	79.8	Confident	138 Å²	138	108.8 Å²	108.8	61%	0.605	54%	0.537	S	S	*	.	H	α-helix	trans	-62.6	-43.8	171.2	-105.8	-80.5	0	0	0	112.9	C94 M95 I96 I100 I101 E102	C94-F98 PolarHBondContact O-N 3.39Å; M95-F98 PolarHBondContact O-N 3.45Å; I96-F98 VanDerWaalsContact C-N 3.34Å; I96-F98 PolarHBondContact O-N 3.32Å; F98-I100 VanDerWaalsContact C-N 3.34Å; F98-I100 PolarHBondContact O-N 3.01Å; F98-I101 PolarHBondContact O-N 3.44Å; F98-E102 PolarHBondContact O-N 3.36Å
99	L	86	Confident	78.3	Confident	112 Å²	112	109 Å²	109	59%	0.586	54%	0.535	S	S	*	.	H	α-helix	trans	-63.6	-39.7	177.6	-75.7	169.8	0	0	0	111.9	M95 I96 I101 E102 V103	M95-L99 WeakPolarHBondContact O-CG 3.37Å; M95-L99 PolarHBondContact O-N 2.81Å; I96-L99 PolarHBondContact O-N 3.32Å; L99-I101 VanDerWaalsContact C-N 3.32Å; L99-I101 PolarHBondContact O-N 2.91Å; L99-E102 PolarHBondContact O-N 3.44Å; L99-V103 WeakPolarHBondContact O-CB 3.32Å; L99-V103 VanDerWaalsContact O-CG2 3.27Å; L99-V103 WeakPolarHBondContact O-CG2 3.37Å; L99-V103 PolarHBondContact O-N 2.96Å
100	I	86.2	Confident	76.2	Confident	90 Å²	90	109.1 Å²	109.1	46%	0.462	54%	0.536	S	S	.	.	H	α-helix	trans	-61.9	-43.3	175.3	-68.3	167.3	0	0	0	110.4	I96 L97 F98 V103 W104	I96-I100 HydrophobicContact CG2-CD1 3.98Å; I96-I100 WeakPolarHBondContact O-CG1 3.32Å; I96-I100 PolarHBondContact O-N 2.8Å; L97-I100 PolarHBondContact O-N 2.92Å; F98-I100 VanDerWaalsContact C-N 3.34Å; F98-I100 PolarHBondContact O-N 3.01Å; I100-V103 PolarHBondContact O-N 3.48Å; I100-W104 WeakPolarHBondContact O-CB 3.06Å; I100-W104 VanDerWaalsContact O-CD1 3.25Å; I100-W104 PolarHBondContact O-N 3.38Å
101	I	84	Confident	73.9	Confident	91 Å²	91	102.3 Å²	102.3	47%	0.467	52%	0.521	S	S	.	.	H	α-helix	trans	-63.7	-43.9	177.5	-67.5	166.8	0	0	0	111	L97 F98 L99 W104 R105	L97-I101 HydrophobicContact CD2-CD1 3.84Å; L97-I101 VanDerWaalsContact O-CG1 3.31Å; L97-I101 WeakPolarHBondContact O-CG1 3.41Å; L97-I101 PolarHBondContact O-N 3.07Å; L97-I101 VanDerWaalsContact O-N 3.11Å; F98-I101 PolarHBondContact O-N 3.44Å; L99-I101 VanDerWaalsContact C-N 3.32Å; L99-I101 PolarHBondContact O-N 2.91Å; I101-W104 PolarHBondContact O-N 2.84Å; I101-R105 VanDerWaalsContact O-CB 3.28Å; I101-R105 WeakPolarHBondContact O-CB 3.4Å; I101-R105 PolarHBondContact O-N 3.15Å
102	E	77.9	Confident	71.3	Confident	77 Å²	77	105.5 Å²	105.5	36%	0.36	54%	0.539	S	S	.	.	H	α-helix	trans	-66.5	-40.8	177.4	-76.2	-62.6	153.3	0	0	112	F98 L99 W104 R105 Q106	F98-E102 PolarHBondContact O-N 3.36Å; L99-E102 PolarHBondContact O-N 3.44Å; E102-W104 PolarHBondContact O-N 2.99Å; E102-R105 WeakPolarHBondContact O-CB 3.39Å; E102-R105 PolarHBondContact O-N 3.48Å; E102-R105 IonicContact OE1-NE 3.27Å; E102-R105 IonicContact OE2-CZ 3.23Å; E102-R105 IonicContact OE2-NE 2.77Å; E102-R105 PolarHBondContact OE2-NE 3.17Å; E102-R105 IonicContact OE2-NH2 3.84Å; E102-R105 PolarHBondContact OE2-NH2 3.03Å; E102-Q106 VanDerWaalsContact O-CB 3.24Å; E102-Q106 WeakPolarHBondContact O-CB 3.42Å; E102-Q106 PolarHBondContact O-N 2.96Å
103	V	76	Confident	68.8	Low	90 Å²	90	108.7 Å²	108.7	55%	0.545	55%	0.546	S	S	.	.	H	α-helix	trans	-62	-44.6	175.1	171	0	0	0	0	110.6	L99 I100 R105 Q106 D107	L99-V103 WeakPolarHBondContact O-CB 3.32Å; L99-V103 VanDerWaalsContact O-CG2 3.27Å; L99-V103 WeakPolarHBondContact O-CG2 3.37Å; L99-V103 PolarHBondContact O-N 2.96Å; I100-V103 PolarHBondContact O-N 3.48Å; V103-R105 VanDerWaalsContact C-N 3.32Å; V103-R105 PolarHBondContact O-N 3.43Å; V103-Q106 PolarHBondContact O-N 2.98Å; V103-D107 WeakPolarHBondContact O-CB 3.47Å; V103-D107 PolarHBondContact O-N 3.25Å
104	W	70.1	Confident	66.1	Low	183 Å²	183	109.7 Å²	109.7	69%	0.693	56%	0.557	S	S	*	*	H	α-helix	trans	-63.3	-38.5	175.1	-84.9	45.9	0	0	0	112.3	I100 I101 E102 Q106 H108	I100-W104 WeakPolarHBondContact O-CB 3.06Å; I100-W104 VanDerWaalsContact O-CD1 3.25Å; I100-W104 PolarHBondContact O-N 3.38Å; I101-W104 PolarHBondContact O-N 2.84Å; E102-W104 PolarHBondContact O-N 2.99Å; W104-Q106 VanDerWaalsContact C-N 3.33Å; W104-H108 WeakPolarHBondContact O-CB 3.35Å; W104-H108 PolarHBondContact O-N 2.89Å; W104-H108 VanDerWaalsContact O-N 3.14Å
105	R	70.8	Confident	63.2	Low	110 Å²	110	114.3 Å²	114.3	42%	0.415	58%	0.577	S	S	.	*	H	α-helix	trans	-65.8	-38.5	176.2	-168.2	-180	77.7	102.7	-0.1	111.6	I101 E102 V103 Q109 E503	I101-R105 VanDerWaalsContact O-CB 3.28Å; I101-R105 WeakPolarHBondContact O-CB 3.4Å; I101-R105 PolarHBondContact O-N 3.15Å; E102-R105 WeakPolarHBondContact O-CB 3.39Å; E102-R105 PolarHBondContact O-N 3.48Å; E102-R105 IonicContact OE1-NE 3.27Å; E102-R105 IonicContact OE2-CZ 3.23Å; E102-R105 IonicContact OE2-NE 2.77Å; E102-R105 PolarHBondContact OE2-NE 3.17Å; E102-R105 IonicContact OE2-NH2 3.84Å; E102-R105 PolarHBondContact OE2-NH2 3.03Å; V103-R105 VanDerWaalsContact C-N 3.32Å; V103-R105 PolarHBondContact O-N 3.43Å; R105-Q109 WeakPolarHBondContact O-CG 3.32Å; R105-Q109 PolarHBondContact O-N 3.42Å; R105-E503 IonicContact NH1-OE1 3.65Å
106	Q	62.1	Low	60.3	Low	108 Å²	108	114.3 Å²	114.3	51%	0.505	59%	0.588	S	S	.	*	H	α-helix	trans	-76.8	-38.9	-177.6	-157.4	171.7	-11.7	0	0	111.5	E102 V103 W104 H108 Q109 D110	E102-Q106 VanDerWaalsContact O-CB 3.24Å; E102-Q106 WeakPolarHBondContact O-CB 3.42Å; E102-Q106 PolarHBondContact O-N 2.96Å; V103-Q106 PolarHBondContact O-N 2.98Å; W104-Q106 VanDerWaalsContact C-N 3.33Å; Q106-H108 VanDerWaalsContact C-N 3.31Å; Q106-H108 PolarHBondContact O-N 3.46Å; Q106-Q109 CarbonylContact O-C 3.47Å; Q106-Q109 WeakPolarHBondContact O-CA 3.21Å; Q106-Q109 WeakPolarHBondContact O-CB 3.31Å; Q106-Q109 PolarHBondContact O-N 3.34Å; Q106-D110 PolarHBondContact O-N 2.93Å
107	D	52.4	Low	57.4	Low	125 Å²	125	117.8 Å²	117.8	67%	0.668	61%	0.607	S	S	*	*	H	α-helix	trans	-65.8	-35.4	174.9	-152.7	39.3	0	0	0	111.4	V103 Q109 G111	V103-D107 WeakPolarHBondContact O-CB 3.47Å; V103-D107 PolarHBondContact O-N 3.25Å; D107-Q109 PolarHBondContact O-N 2.82Å; D107-G111 PolarHBondContact O-N 2.79Å
108	H	49.1	Very low	54.4	Low	155 Å²	155	115.9 Å²	115.9	72%	0.718	61%	0.614	S	S	*	*	H	α-helix	trans	-67.2	-20.8	169.5	-98	-70.8	0	0	0	114.2	W104 Q106	W104-H108 WeakPolarHBondContact O-CB 3.35Å; W104-H108 PolarHBondContact O-N 2.89Å; W104-H108 VanDerWaalsContact O-N 3.14Å; Q106-H108 VanDerWaalsContact C-N 3.31Å; Q106-H108 PolarHBondContact O-N 3.46Å
109	Q	46.9	Very low	51.5	Low	94 Å²	94	113.6 Å²	113.6	44%	0.439	62%	0.621	S	S	.	*	H	α-helix	trans	-91.8	-35.6	177.3	-76.5	-176.1	-9.7	0	0	112.8	R105 Q106 D107	R105-Q109 WeakPolarHBondContact O-CG 3.32Å; R105-Q109 PolarHBondContact O-N 3.42Å; Q106-Q109 CarbonylContact O-C 3.47Å; Q106-Q109 WeakPolarHBondContact O-CA 3.21Å; Q106-Q109 WeakPolarHBondContact O-CB 3.31Å; Q106-Q109 PolarHBondContact O-N 3.34Å; D107-Q109 PolarHBondContact O-N 2.82Å
110	D	40.8	Very low	48.8	Very low	114 Å²	114	115.9 Å²	115.9	61%	0.61	63%	0.634	S	S	*	*	H	α-helix	trans	-91.5	-2.7	180	-73	-26.5	0	0	0	113.3	Q106 T112	Q106-D110 PolarHBondContact O-N 2.93Å; D110-T112 VanDerWaalsContact C-N 3.25Å; D110-T112 PolarHBondContact O-N 3.31Å
111	G	33.9	Very low	46.4	Very low	34 Å²	34	119.8 Å²	119.8	35%	0.351	65%	0.65	S	S	.	*			trans	-56.4	87.1	167.8	0	0	0	0	0	111.4	D107 F113	D107-G111 PolarHBondContact O-N 2.79Å; G111-F113 VanDerWaalsContact C-N 3.3Å; G111-F113 VanDerWaalsContact O-CD2 3.31Å; G111-F113 WeakPolarHBondContact O-CD2 3.43Å; G111-F113 PolarHBondContact O-N 3.47Å
112	T	28.2	Very low	44.1	Very low	125 Å²	125	121.9 Å²	121.9	77%	0.767	66%	0.662	S	S	*	*			trans	-49.6	96.9	161	-65.1	0	0	0	0	106.6	D110 P114	D110-T112 VanDerWaalsContact C-N 3.25Å; D110-T112 PolarHBondContact O-N 3.31Å; T112-P114 WeakPolarHBondContact O-CD 3.41Å
113	F	35	Very low	41.9	Very low	146 Å²	146	126.9 Å²	126.9	64%	0.64	69%	0.685	S	S	*	*			trans	-58.3	104.7	174.6	-70.8	-85.5	0	0	0	106.7	G111 D115	G111-F113 VanDerWaalsContact C-N 3.3Å; G111-F113 VanDerWaalsContact O-CD2 3.31Å; G111-F113 WeakPolarHBondContact O-CD2 3.43Å; G111-F113 PolarHBondContact O-N 3.47Å; F113-D115 PolarHBondContact O-N 2.98Å
114	P	35.5	Very low	39.9	Very low	107 Å²	107	128.4 Å²	128.4	70%	0.695	69%	0.69	S	S	*	*			trans	-67.1	137	-179.3	-8.5	25.4	0	0	0	106.8	T112 C116	T112-P114 WeakPolarHBondContact O-CD 3.41Å; P114-C116 PolarHBondContact O-N 3.21Å
115	D	29.9	Very low	38	Very low	172 Å²	172	125.8 Å²	125.8	92%	0.92	70%	0.699	S	S	*	*			trans	-42.6	103.1	167.6	-72.7	-44.8	0	0	0	110	F113	F113-D115 PolarHBondContact O-N 2.98Å
116	C	26.7	Very low	36.2	Very low	124 Å²	124	123.3 Å²	123.3	84%	0.838	71%	0.709	S	S	*	*			trans	-129.7	102.2	168.3	-141.5	0	0	0	0	108.8	P114 G118	P114-C116 PolarHBondContact O-N 3.21Å; C116-G118 PolarHBondContact O-N 2.96Å
117	L	30.2	Very low	35.2	Very low	166 Å²	166	124.7 Å²	124.7	87%	0.869	73%	0.727	S	S	*	*			trans	-58.3	122	170.3	-66.7	163.1	0	0	0	110
118	G	29.2	Very low	34.6	Very low	72 Å²	72	123.1 Å²	123.1	74%	0.742	74%	0.74	S	S	*	*	S	Bend	trans	76.9	122.8	151.4	0	0	0	0	0	116.6	C116	C116-G118 PolarHBondContact O-N 2.96Å
119	A	30.9	Very low	34.8	Very low	91 Å²	91	118.2 Å²	118.2	75%	0.752	73%	0.731	S	S	*	*			trans	67.7	78.5	160.8	0	0	0	0	0	116
120	D	28.6	Very low	36.1	Very low	159 Å²	159	116.5 Å²	116.5	85%	0.85	73%	0.734	S	S	*	*			trans	-137.9	85.4	134.5	-93.6	-28.8	0	0	0	107.9	D122	D120-D122 PolarHBondContact O-N 2.79Å
121	E	36.5	Very low	37.9	Very low	172 Å²	172	114 Å²	114	80%	0.804	72%	0.723	S	S	*	*			trans	-70.4	69.5	154.5	-64.6	-101.6	141.3	0	0	106.9
122	D	35	Very low	40.2	Very low	135 Å²	135	112.5 Å²	112.5	72%	0.722	71%	0.707	S	S	*	*			trans	-163.2	70.9	171.3	-108.3	-17.9	0	0	0	112	D120	D120-D122 PolarHBondContact O-N 2.79Å
123	E	32.7	Very low	42.9	Very low	182 Å²	182	113.7 Å²	113.7	85%	0.85	70%	0.698	S	S	*	*			trans	-137.6	52.8	151.5	-118.2	-176.4	-179.8	0	0	109.3
124	L	32.6	Very low	45	Very low	123 Å²	123	109.2 Å²	109.2	64%	0.644	69%	0.693	S	S	*	*			trans	-95.8	82	164.1	-166	78.5	0	0	0	107.6
125	S	30.8	Very low	47.3	Very low	127 Å²	127	106.4 Å²	106.4	89%	0.888	67%	0.672	S	S	*	*			trans	-138.8	72.4	177	-78.4	0	0	0	0	112.5
126	G	33.6	Very low	49.7	Very low	59 Å²	59	102.7 Å²	102.7	61%	0.608	66%	0.657	S	S	*	*	S	Bend	trans	-161.5	143.2	164	0	0	0	0	0	109.2	G128	G126-G128 PolarHBondContact O-N 3.23Å
127	P	41.4	Very low	52.5	Low	136 Å²	136	98.6 Å²	98.6	88%	0.883	63%	0.626	S	S	*	*	S	Bend		-64.5	109.9	-120.7	33.6	-31	0	0	0	114.5	G129	P127-G129 PolarHBondContact O-N 3.42Å
128	G	38.9	Very low	55.2	Low	93 Å²	93	91.1 Å²	91.1	96%	0.959	59%	0.588	S	S	*	*	S	Bend	trans	60.2	7.4	140.7	0	0	0	0	0	120	G126	G126-G128 PolarHBondContact O-N 3.23Å
129	G	53	Low	57.9	Low	51 Å²	51	92.3 Å²	92.3	53%	0.526	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-90.7	132.9	173.9	0	0	0	0	0	111.1	P127	P127-G129 PolarHBondContact O-N 3.42Å
130	A	74.5	Confident	60.6	Low	59 Å²	59	92.6 Å²	92.6	49%	0.488	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-54.8	140.8	164.2	0	0	0	0	0	109.3	L132 R133	A130-L132 PolarHBondContact O-N 3.43Å; A130-R133 VanDerWaalsContact O-CA 3.31Å; A130-R133 WeakPolarHBondContact O-CA 3.43Å; A130-R133 PolarHBondContact O-N 3.09Å
131	P	79.1	Confident	63.4	Low	61 Å²	61	88.5 Å²	88.5	40%	0.396	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-48.1	139	176	-26.4	32.8	0	0	0	111.1	R133 G134	P131-R133 PolarHBondContact O-N 3.41Å; P131-R133 VanDerWaalsContact O-N 3.13Å; P131-G134 PolarHBondContact O-N 3.37Å
132	L	83	Confident	65.8	Low	2 Å²	2	82.2 Å²	82.2	1%	0.01	52%	0.521	C	S	.	.	G	3₁₀ helix	trans	57.4	24.1	-177.7	-49.5	179	0	0	0	114	A130 G134 L135 L137 Q464 F467 E471 F525 L529	A130-L132 PolarHBondContact O-N 3.43Å; L132-G134 PolarHBondContact O-N 3.49Å; L132-L135 WeakPolarHBondContact O-CB 3.46Å; L132-L135 WeakPolarHBondContact O-CG 3.23Å; L132-L135 PolarHBondContact O-N 3.29Å; L132-L137 HydrophobicContact CD1-CD1 3.68Å; L132-L137 HydrophobicContact CD1-CG 4.3Å; L132-Q464 HydrophobicContact CD1-CG 4.17Å; L132-F467 HydrophobicContact CD1-CB 4.1Å; L132-F467 HydrophobicContact CD2-CB 3.84Å; L132-E471 WeakPolarHBondContact CA-OE1 3.26Å; L132-E471 WeakPolarHBondContact CA-OE2 3.33Å; L132-E471 HydrophobicContact CD2-CB 4.13Å; L132-E471 PolarHBondContact N-OE1 3.33Å; L132-E471 PolarHBondContact N-OE2 3.49Å; L132-F525 HydrophobicContact CD2-CZ 4.45Å; L132-L529 HydrophobicContact CB-CD1 4.22Å; L132-L529 HydrophobicContact CD2-CD1 3.85Å; L132-L529 HydrophobicContact CG-CD1 4.49Å
133	R	84.5	Confident	68.4	Low	151 Å²	151	75.8 Å²	75.8	57%	0.57	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	54.8	26.1	-170.6	-60.6	176.9	-179.8	176.2	0.6	113.7	A130 P131 L135 Y526	A130-R133 VanDerWaalsContact O-CA 3.31Å; A130-R133 WeakPolarHBondContact O-CA 3.43Å; A130-R133 PolarHBondContact O-N 3.09Å; P131-R133 PolarHBondContact O-N 3.41Å; P131-R133 VanDerWaalsContact O-N 3.13Å; R133-L135 PolarHBondContact O-N 3.18Å; R133-Y526 HydrophobicContact CB-CE1 4.36Å; R133-Y526 HydrophobicContact CG-CD1 4.11Å; R133-Y526 HydrophobicContact CG-CE1 3.57Å; R133-Y526 VanDerWaalsContact NE-CZ 3.27Å
134	G	78.1	Confident	71	Confident	52 Å²	52	69.7 Å²	69.7	54%	0.536	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	68.1	16.9	-176.4	0	0	0	0	0	114.3	P131 L132	P131-G134 PolarHBondContact O-N 3.37Å; L132-G134 PolarHBondContact O-N 3.49Å
135	L	83.5	Confident	73.4	Confident	47 Å²	47	67.8 Å²	67.8	25%	0.246	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-66.8	127	175.6	-68.7	171.5	0	0	0	109.8	L132 R133 L137 Y526 L529 K530	L132-L135 WeakPolarHBondContact O-CB 3.46Å; L132-L135 WeakPolarHBondContact O-CG 3.23Å; L132-L135 PolarHBondContact O-N 3.29Å; R133-L135 PolarHBondContact O-N 3.18Å; L135-L137 PolarHBondContact O-N 3.13Å; L135-Y526 HydrophobicContact CD1-CD1 4.27Å; L135-L529 HydrophobicContact CD1-CB 3.76Å; L135-K530 HydrophobicContact CD1-CB 4.3Å; L135-K530 HydrophobicContact CD2-CB 4.19Å; L135-K530 HydrophobicContact CD2-CG 4.39Å
136	P	80.7	Confident	76.1	Confident	94 Å²	94	61.8 Å²	61.8	61%	0.61	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-70.8	131.3	-179.1	28.6	-33.3	0	0	0	110	P533	P136-P533 WeakPolarHBondContact O-CG 3.46Å
137	L	86	Confident	78.5	Confident	38 Å²	38	61.1 Å²	61.1	20%	0.199	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-89.8	151.8	167.4	-73.6	170.5	0	0	0	110.3	L132 L135 N139 Q464 F467 L529	L132-L137 HydrophobicContact CD1-CD1 3.68Å; L132-L137 HydrophobicContact CD1-CG 4.3Å; L135-L137 PolarHBondContact O-N 3.13Å; L137-N139 PolarHBondContact O-N 3.44Å; L137-Q464 VanDerWaalsContact CD1-CA 3.47Å; L137-Q464 HydrophobicContact CD1-CB 3.61Å; L137-Q464 HydrophobicContact CD1-CG 3.86Å; L137-F467 HydrophobicContact CD1-CD2 3.99Å; L137-F467 HydrophobicContact CD2-CD2 3.86Å; L137-F467 HydrophobicContact CD2-CE2 3.99Å; L137-L529 HydrophobicContact CD2-CD2 4.17Å
138	P	86.3	Confident	80.5	Confident	10 Å²	10	58.4 Å²	58.4	7%	0.065	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-58.1	140.3	177	-3.7	7.5	0	0	0	111.1	T142 L143 I536	P138-T142 HydrophobicContact CB-CG2 4.41Å; P138-L143 HydrophobicContact CB-CD2 3.89Å; P138-L143 HydrophobicContact CB-CG 4.16Å; P138-L143 HydrophobicContact CG-CD2 3.86Å; P138-I536 HydrophobicContact CB-CD1 4.47Å; P138-I536 HydrophobicContact CB-CG2 4.32Å; P138-I536 HydrophobicContact CG-CB 4.17Å; P138-I536 HydrophobicContact CG-CD1 3.43Å; P138-I536 VanDerWaalsContact CG-CD1 3.43Å; P138-I536 HydrophobicContact CG-CG1 4.33Å; P138-I536 HydrophobicContact CG-CG2 4.29Å
139	N	87.1	Confident	82.4	Confident	96 Å²	96	58.9 Å²	58.9	51%	0.513	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-68.9	162.7	177.3	68.3	23.5	0	0	0	111.6	L137 A141 T142 L143	L137-N139 PolarHBondContact O-N 3.44Å; N139-A141 VanDerWaalsContact C-N 3.33Å; N139-A141 PolarHBondContact O-N 3.21Å; N139-A141 PolarHBondContact OD1-N 3.44Å; N139-T142 PolarHBondContact O-N 3.43Å; N139-T142 VanDerWaalsContact O-N 3.1Å; N139-T142 WeakPolarHBondContact OD1-CB 3.46Å; N139-T142 PolarHBondContact OD1-N 3.41Å; N139-T142 PolarHBondContact OD1-OG1 3.34Å; N139-L143 WeakPolarHBondContact O-CG 3.49Å; N139-L143 PolarHBondContact O-N 3.48Å
140	R	87.3	Confident	83.5	Confident	98 Å²	98	57.5 Å²	57.5	37%	0.37	32%	0.319	S	S	.	.	H	α-helix	trans	-49.4	-48.1	179.4	179.5	178.9	164.2	-166.6	-2.2	114.2	T142 L143 D144 S457 D460	R140-T142 VanDerWaalsContact C-N 3.25Å; R140-T142 PolarHBondContact O-N 3.37Å; R140-L143 PolarHBondContact O-N 3.31Å; R140-L143 VanDerWaalsContact O-N 3.1Å; R140-D144 WeakPolarHBondContact CG-OD2 3.22Å; R140-D144 IonicContact NE-OD2 2.62Å; R140-D144 PolarHBondContact NE-OD2 3.06Å; R140-D144 WeakPolarHBondContact O-CB 3.29Å; R140-D144 PolarHBondContact O-N 3.4Å; R140-S457 VanDerWaalsContact CZ-CA 3.43Å; R140-S457 VanDerWaalsContact NH1-CB 3.32Å; R140-D460 HydrophobicContact CB-CB 4.23Å
141	A	86	Confident	83.6	Confident	72 Å²	72	55.5 Å²	55.5	60%	0.595	30%	0.3	S	S	*	.	H	α-helix	trans	-60.3	-37.8	-176.8	0	0	0	0	0	112.2	N139 H145	N139-A141 VanDerWaalsContact C-N 3.33Å; N139-A141 PolarHBondContact O-N 3.21Å; N139-A141 PolarHBondContact OD1-N 3.44Å; A141-H145 WeakPolarHBondContact O-CB 3.5Å; A141-H145 PolarHBondContact O-N 3.22Å; A141-H145 VanDerWaalsContact O-N 3.16Å
142	T	86.9	Confident	83.5	Confident	41 Å²	41	58.2 Å²	58.2	25%	0.252	30%	0.302	S	S	.	.	H	α-helix	trans	-70.6	-39.9	176.4	-49	0	0	0	0	111.1	P138 N139 R140 F146 I536	P138-T142 HydrophobicContact CB-CG2 4.41Å; N139-T142 PolarHBondContact O-N 3.43Å; N139-T142 VanDerWaalsContact O-N 3.1Å; N139-T142 WeakPolarHBondContact OD1-CB 3.46Å; N139-T142 PolarHBondContact OD1-N 3.41Å; N139-T142 PolarHBondContact OD1-OG1 3.34Å; R140-T142 VanDerWaalsContact C-N 3.25Å; R140-T142 PolarHBondContact O-N 3.37Å; T142-F146 VanDerWaalsContact O-CB 3.27Å; T142-F146 WeakPolarHBondContact O-CB 3.38Å; T142-F146 PolarHBondContact O-N 3.11Å; T142-I536 HydrophobicContact CG2-CG2 3.9Å
143	L	90.5	Very high	82.6	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-66.4	-45.2	177.2	-65	175.6	0	0	0	112.5	P138 N139 R140 H145 F146 Y147 I416 L459 D460 L463 I536	P138-L143 HydrophobicContact CB-CD2 3.89Å; P138-L143 HydrophobicContact CB-CG 4.16Å; P138-L143 HydrophobicContact CG-CD2 3.86Å; N139-L143 WeakPolarHBondContact O-CG 3.49Å; N139-L143 PolarHBondContact O-N 3.48Å; R140-L143 PolarHBondContact O-N 3.31Å; R140-L143 VanDerWaalsContact O-N 3.1Å; L143-H145 VanDerWaalsContact C-N 3.34Å; L143-H145 PolarHBondContact O-N 3.08Å; L143-F146 PolarHBondContact O-N 3.08Å; L143-Y147 VanDerWaalsContact O-CB 3.29Å; L143-Y147 WeakPolarHBondContact O-CB 3.3Å; L143-Y147 PolarHBondContact O-N 3.44Å; L143-I416 HydrophobicContact CB-CD1 4.5Å; L143-I416 HydrophobicContact CD2-CD1 4.26Å; L143-I416 HydrophobicContact CD2-CG2 4.33Å; L143-L459 HydrophobicContact CB-CD2 3.75Å; L143-L459 HydrophobicContact CB-CG 4.36Å; L143-L459 HydrophobicContact CD1-CG 4.24Å; L143-D460 HydrophobicContact CD1-CB 3.89Å; L143-L463 HydrophobicContact CD1-CD2 3.92Å; L143-L463 HydrophobicContact CD2-CD2 3.86Å; L143-I536 HydrophobicContact CD2-CD1 3.92Å; L143-I536 HydrophobicContact CD2-CG2 4.32Å
144	D	86.5	Confident	81.7	Confident	54 Å²	54	54.7 Å²	54.7	29%	0.289	30%	0.302	S	S	.	.	H	α-helix	trans	-61.1	-45.1	178.3	-73.7	-16.5	0	0	0	110.1	R140 Y147 E148 L459	R140-D144 WeakPolarHBondContact CG-OD2 3.22Å; R140-D144 IonicContact NE-OD2 2.62Å; R140-D144 PolarHBondContact NE-OD2 3.06Å; R140-D144 WeakPolarHBondContact O-CB 3.29Å; R140-D144 PolarHBondContact O-N 3.4Å; D144-Y147 PolarHBondContact O-N 3.21Å; D144-E148 WeakPolarHBondContact O-CB 3.22Å; D144-E148 WeakPolarHBondContact O-CG 3.44Å; D144-E148 PolarHBondContact O-N 3.35Å; D144-L459 WeakPolarHBondContact OD1-CD2 3.39Å
145	H	85	Confident	81.1	Confident	83 Å²	83	55.2 Å²	55.2	38%	0.384	29%	0.294	S	S	.	.	H	α-helix	trans	-64.8	-44.2	177.2	-171.7	-91.7	0	0	0	112.6	A141 L143 Y147 E148 H149 S540	A141-H145 WeakPolarHBondContact O-CB 3.5Å; A141-H145 PolarHBondContact O-N 3.22Å; A141-H145 VanDerWaalsContact O-N 3.16Å; L143-H145 VanDerWaalsContact C-N 3.34Å; L143-H145 PolarHBondContact O-N 3.08Å; H145-Y147 VanDerWaalsContact C-N 3.35Å; H145-E148 PolarHBondContact O-N 3.42Å; H145-H149 AromaticContact CD2-CD2 3.85Å; H145-H149 AromaticContact CD2-NE2 3.89Å; H145-H149 AromaticContact CE1-CD2 3.3Å; H145-H149 PolarHBondContact CE1-CD2 3.5Å; H145-H149 AromaticContact CE1-NE2 3.74Å; H145-H149 AromaticContact CG-CD2 3.97Å; H145-H149 AromaticContact ND1-CD2 3.63Å; H145-H149 AromaticContact NE2-CD2 3.44Å; H145-H149 PolarHBondContact NE2-CD2 2.97Å; H145-H149 AromaticContact NE2-NE2 3.4Å; H145-H149 PolarHBondContact NE2-NE2 3.33Å; H145-H149 PolarHBondContact O-CD2 3.17Å; H145-H149 PolarHBondContact O-N 3.13Å; H145-H149 VanDerWaalsContact O-N 3.14Å; H145-S540 PolarHBondContact CE1-O 3.42Å; H145-S540 WeakPolarHBondContact ND1-CB 3.36Å
146	F	86.2	Confident	80.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.3	-46.8	174.6	172.5	-103.9	0	0	0	111.4	T142 L143 H149 C150 I151 I416 F419 I536 Y539 S540	T142-F146 VanDerWaalsContact O-CB 3.27Å; T142-F146 WeakPolarHBondContact O-CB 3.38Å; T142-F146 PolarHBondContact O-N 3.11Å; L143-F146 PolarHBondContact O-N 3.08Å; F146-H149 PolarHBondContact O-N 3.27Å; F146-C150 HydrophobicContact CD2-CB 3.91Å; F146-C150 HydrophobicContact CE2-CB 3.61Å; F146-C150 HydrophobicContact CZ-CB 3.99Å; F146-C150 VanDerWaalsContact O-CB 3.23Å; F146-C150 WeakPolarHBondContact O-CB 3.3Å; F146-C150 PolarHBondContact O-N 3.32Å; F146-I151 HydrophobicContact CD1-CD1 4.09Å; F146-I151 HydrophobicContact CE1-CD1 3.55Å; F146-I151 HydrophobicContact CE1-CG1 4.1Å; F146-I151 HydrophobicContact CZ-CD1 4.37Å; F146-I416 HydrophobicContact CD1-CG1 4.11Å; F146-I416 HydrophobicContact CE1-CG1 4.05Å; F146-F419 HydrophobicContact CE1-CD1 4.26Å; F146-F419 HydrophobicContact CE1-CG 4.5Å; F146-F419 HydrophobicContact CE2-CD1 4.32Å; F146-F419 AromaticContact CE2-CE1 3.87Å; F146-F419 HydrophobicContact CE2-CE1 3.87Å; F146-F419 HydrophobicContact CE2-CE2 4.47Å; F146-F419 AromaticContact CE2-CZ 3.95Å; F146-F419 HydrophobicContact CE2-CZ 3.95Å; F146-F419 AromaticContact CZ-CD1 3.51Å; F146-F419 HydrophobicContact CZ-CD1 3.51Å; F146-F419 HydrophobicContact CZ-CD2 4.1Å; F146-F419 AromaticContact CZ-CE1 3.53Å; F146-F419 HydrophobicContact CZ-CE1 3.53Å; F146-F419 HydrophobicContact CZ-CE2 4.1Å; F146-F419 AromaticContact CZ-CG 3.81Å; F146-F419 HydrophobicContact CZ-CG 3.81Å; F146-F419 AromaticContact CZ-CZ 3.83Å; F146-F419 HydrophobicContact CZ-CZ 3.83Å; F146-I536 HydrophobicContact CB-CG2 3.64Å; F146-I536 HydrophobicContact CD1-CG2 4.31Å; F146-I536 HydrophobicContact CD2-CG2 4.13Å; F146-I536 HydrophobicContact CG-CG2 3.77Å; F146-Y539 HydrophobicContact CE2-CG 4.45Å; F146-S540 WeakPolarHBondContact CA-OG 3.44Å; F146-S540 WeakPolarHBondContact CB-OG 2.96Å
147	Y	84.7	Confident	80.4	Confident	46 Å²	46	53.6 Å²	53.6	18%	0.18	29%	0.292	C	S	.	.	I	π-helix	trans	-59.3	-50.1	-179.9	-177.9	-94.8	0	0	0	111.5	L143 D144 H145 H149 I151 R152 S412 Q415	L143-Y147 VanDerWaalsContact O-CB 3.29Å; L143-Y147 WeakPolarHBondContact O-CB 3.3Å; L143-Y147 PolarHBondContact O-N 3.44Å; D144-Y147 PolarHBondContact O-N 3.21Å; H145-Y147 VanDerWaalsContact C-N 3.35Å; Y147-H149 VanDerWaalsContact C-N 3.35Å; Y147-H149 PolarHBondContact O-N 3.45Å; Y147-I151 HydrophobicContact CD2-CB 3.89Å; Y147-I151 HydrophobicContact CD2-CD1 3.85Å; Y147-I151 HydrophobicContact CD2-CG1 4.45Å; Y147-I151 HydrophobicContact CD2-CG2 3.96Å; Y147-I151 HydrophobicContact CE2-CB 4.06Å; Y147-I151 HydrophobicContact CE2-CD1 4.44Å; Y147-I151 HydrophobicContact CE2-CG2 3.62Å; Y147-I151 HydrophobicContact CG-CB 4.48Å; Y147-I151 CarbonylContact O-C 3.1Å; Y147-I151 WeakPolarHBondContact O-CA 3.47Å; Y147-I151 WeakPolarHBondContact O-CB 3.49Å; Y147-I151 PolarHBondContact O-N 3.04Å; Y147-R152 HydrophobicContact CD1-CB 4.41Å; Y147-R152 HydrophobicContact CE1-CB 4.08Å; Y147-R152 PolarHBondContact O-N 3.47Å; Y147-S412 WeakPolarHBondContact CE2-OG 3.44Å; Y147-Q415 VanDerWaalsContact CE2-OE1 3.24Å; Y147-Q415 PolarHBondContact OH-OE1 3.12Å
148	E	83.3	Confident	80.4	Confident	78 Å²	78	52 Å²	52	36%	0.364	29%	0.285	S	S	.	.	I	π-helix	trans	-59.5	-42.7	-179.2	-78.9	-64.4	121.5	0	0	112.8	D144 H145 R152	D144-E148 WeakPolarHBondContact O-CB 3.22Å; D144-E148 WeakPolarHBondContact O-CG 3.44Å; D144-E148 PolarHBondContact O-N 3.35Å; H145-E148 PolarHBondContact O-N 3.42Å; E148-R152 WeakPolarHBondContact OE1-CD 3.24Å; E148-R152 IonicContact OE1-NE 3.13Å; E148-R152 PolarHBondContact OE1-NE 2.97Å; E148-R152 VanDerWaalsContact OE1-NE 3.08Å; E148-R152 IonicContact OE2-CZ 3.19Å; E148-R152 IonicContact OE2-NE 3Å; E148-R152 PolarHBondContact OE2-NE 3.28Å; E148-R152 IonicContact OE2-NH2 3.32Å; E148-R152 PolarHBondContact OE2-NH2 3.49Å
149	H	77.8	Confident	80.4	Confident	104 Å²	104	54.7 Å²	54.7	48%	0.481	30%	0.301	S	S	.	.	I	π-helix	trans	-86.5	-42.8	-176.2	-73.7	-46.3	0	0	0	114.1	H145 F146 Y147 S153	H145-H149 AromaticContact CD2-CD2 3.85Å; H145-H149 AromaticContact CD2-NE2 3.89Å; H145-H149 AromaticContact CE1-CD2 3.3Å; H145-H149 PolarHBondContact CE1-CD2 3.5Å; H145-H149 AromaticContact CE1-NE2 3.74Å; H145-H149 AromaticContact CG-CD2 3.97Å; H145-H149 AromaticContact ND1-CD2 3.63Å; H145-H149 AromaticContact NE2-CD2 3.44Å; H145-H149 PolarHBondContact NE2-CD2 2.97Å; H145-H149 AromaticContact NE2-NE2 3.4Å; H145-H149 PolarHBondContact NE2-NE2 3.33Å; H145-H149 PolarHBondContact O-CD2 3.17Å; H145-H149 PolarHBondContact O-N 3.13Å; H145-H149 VanDerWaalsContact O-N 3.14Å; F146-H149 PolarHBondContact O-N 3.27Å; Y147-H149 VanDerWaalsContact C-N 3.35Å; Y147-H149 PolarHBondContact O-N 3.45Å; H149-S153 PolarHBondContact O-OG 3.34Å
150	C	76.6	Confident	80.5	Confident	22 Å²	22	58.1 Å²	58.1	15%	0.149	31%	0.307	C	S	.	.	I	π-helix	trans	-93.5	-35.1	-171.4	-64.3	0	0	0	0	113.5	F146 R205 Y539	F146-C150 HydrophobicContact CD2-CB 3.91Å; F146-C150 HydrophobicContact CE2-CB 3.61Å; F146-C150 HydrophobicContact CZ-CB 3.99Å; F146-C150 VanDerWaalsContact O-CB 3.23Å; F146-C150 WeakPolarHBondContact O-CB 3.3Å; F146-C150 PolarHBondContact O-N 3.32Å; C150-R205 PolarHBondContact O-NH2 2.88Å; C150-Y539 PolarHBondContact SG-O 3.07Å
151	I	77.4	Confident	80.6	Confident	16 Å²	16	54.1 Å²	54.1	8%	0.082	29%	0.293	C	S	.	.	I	π-helix	trans	-102.4	-56.6	-171.7	-62.4	170.3	0	0	0	111.1	F146 Y147 S153 A154 Q415 I416	F146-I151 HydrophobicContact CD1-CD1 4.09Å; F146-I151 HydrophobicContact CE1-CD1 3.55Å; F146-I151 HydrophobicContact CE1-CG1 4.1Å; F146-I151 HydrophobicContact CZ-CD1 4.37Å; Y147-I151 HydrophobicContact CD2-CB 3.89Å; Y147-I151 HydrophobicContact CD2-CD1 3.85Å; Y147-I151 HydrophobicContact CD2-CG1 4.45Å; Y147-I151 HydrophobicContact CD2-CG2 3.96Å; Y147-I151 HydrophobicContact CE2-CB 4.06Å; Y147-I151 HydrophobicContact CE2-CD1 4.44Å; Y147-I151 HydrophobicContact CE2-CG2 3.62Å; Y147-I151 HydrophobicContact CG-CB 4.48Å; Y147-I151 CarbonylContact O-C 3.1Å; Y147-I151 WeakPolarHBondContact O-CA 3.47Å; Y147-I151 WeakPolarHBondContact O-CB 3.49Å; Y147-I151 PolarHBondContact O-N 3.04Å; I151-S153 VanDerWaalsContact C-N 3.28Å; I151-S153 PolarHBondContact O-N 3.35Å; I151-A154 WeakPolarHBondContact O-CB 3.48Å; I151-A154 PolarHBondContact O-N 3.16Å; I151-Q415 HydrophobicContact CD1-CB 3.94Å; I151-Q415 HydrophobicContact CG2-CB 4Å; I151-Q415 HydrophobicContact CG2-CG 4.22Å; I151-I416 HydrophobicContact CD1-CG1 3.72Å
152	R	76.7	Confident	80.9	Confident	118 Å²	118	54.5 Å²	54.5	45%	0.445	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-61.1	-35.3	-173.5	-171.6	-178.3	59.8	71.4	0.1	113	Y147 E148 A154 T155	Y147-R152 HydrophobicContact CD1-CB 4.41Å; Y147-R152 HydrophobicContact CE1-CB 4.08Å; Y147-R152 PolarHBondContact O-N 3.47Å; E148-R152 WeakPolarHBondContact OE1-CD 3.24Å; E148-R152 IonicContact OE1-NE 3.13Å; E148-R152 PolarHBondContact OE1-NE 2.97Å; E148-R152 VanDerWaalsContact OE1-NE 3.08Å; E148-R152 IonicContact OE2-CZ 3.19Å; E148-R152 IonicContact OE2-NE 3Å; E148-R152 PolarHBondContact OE2-NE 3.28Å; E148-R152 IonicContact OE2-NH2 3.32Å; E148-R152 PolarHBondContact OE2-NH2 3.49Å; R152-A154 PolarHBondContact O-N 3.47Å; R152-T155 PolarHBondContact O-N 3.23Å; R152-T155 VanDerWaalsContact O-N 3.16Å; R152-T155 PolarHBondContact O-OG1 3.06Å
153	S	63.5	Low	81.2	Confident	65 Å²	65	57.9 Å²	57.9	46%	0.455	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-57.8	-15.4	177.4	59.8	0	0	0	0	113.9	H149 I151	H149-S153 PolarHBondContact O-OG 3.34Å; I151-S153 VanDerWaalsContact C-N 3.28Å; I151-S153 PolarHBondContact O-N 3.35Å
154	A	65.3	Low	81.4	Confident	15 Å²	15	61.3 Å²	61.3	12%	0.124	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-83.1	-22.1	179.4	0	0	0	0	0	115.2	I151 R152 G156 D157 A158 R205	I151-A154 WeakPolarHBondContact O-CB 3.48Å; I151-A154 PolarHBondContact O-N 3.16Å; R152-A154 PolarHBondContact O-N 3.47Å; A154-G156 PolarHBondContact O-N 3.09Å; A154-D157 PolarHBondContact O-N 3.44Å; A154-A158 PolarHBondContact O-N 3.26Å; A154-R205 VanDerWaalsContact CB-NH2 3.29Å
155	T	66.7	Low	81.8	Confident	62 Å²	62	58.8 Å²	58.8	38%	0.38	29%	0.294	S	S	.	.	H	α-helix	trans	-68.9	-35	-164.9	53.7	0	0	0	0	113.6	R152 D157 A158 T159	R152-T155 PolarHBondContact O-N 3.23Å; R152-T155 VanDerWaalsContact O-N 3.16Å; R152-T155 PolarHBondContact O-OG1 3.06Å; T155-D157 VanDerWaalsContact C-N 3.28Å; T155-D157 PolarHBondContact O-N 3.4Å; T155-A158 WeakPolarHBondContact O-CB 3.5Å; T155-A158 PolarHBondContact O-N 3.44Å; T155-A158 VanDerWaalsContact O-N 3.09Å; T155-T159 PolarHBondContact O-N 3.33Å
156	G	70.1	Confident	82.3	Confident	48 Å²	48	56.8 Å²	56.8	50%	0.495	29%	0.285	S	S	.	.	H	α-helix	trans	-64.5	-31.9	177.4	0	0	0	0	0	113.5	A154 A158	A154-G156 PolarHBondContact O-N 3.09Å; G156-A158 VanDerWaalsContact C-N 3.32Å
157	D	79.3	Confident	82.8	Confident	59 Å²	59	58.4 Å²	58.4	32%	0.316	30%	0.301	S	S	.	.	H	α-helix	trans	-74.4	-26.4	175.6	-68.2	-25.8	0	0	0	111.1	A154 T155 T161 L207 R547	A154-D157 PolarHBondContact O-N 3.44Å; T155-D157 VanDerWaalsContact C-N 3.28Å; T155-D157 PolarHBondContact O-N 3.4Å; D157-T161 VanDerWaalsContact O-CB 3.27Å; D157-T161 WeakPolarHBondContact O-CB 3.28Å; D157-T161 PolarHBondContact O-N 3.1Å; D157-T161 PolarHBondContact O-OG1 3.46Å; D157-L207 HydrophobicContact CB-CD1 4.28Å; D157-R547 IonicContact OD2-NH2 3.57Å; D157-R547 PolarHBondContact OD2-NH2 3Å
158	A	84.5	Confident	83.3	Confident	6 Å²	6	56.3 Å²	56.3	5%	0.05	29%	0.293	C	S	.	.	H	α-helix	trans	-68.5	-47.8	178.7	0	0	0	0	0	113.3	A154 T155 G156 R160 T161 R162 M197 Q202 L207	A154-A158 PolarHBondContact O-N 3.26Å; T155-A158 WeakPolarHBondContact O-CB 3.5Å; T155-A158 PolarHBondContact O-N 3.44Å; T155-A158 VanDerWaalsContact O-N 3.09Å; G156-A158 VanDerWaalsContact C-N 3.32Å; A158-R160 PolarHBondContact O-N 2.69Å; A158-T161 PolarHBondContact O-N 3.08Å; A158-R162 WeakPolarHBondContact O-CB 3.37Å; A158-R162 PolarHBondContact O-N 3.32Å; A158-M197 HydrophobicContact CB-CE 4.41Å; A158-M197 HydrophobicContact CB-SD 4Å; A158-Q202 HydrophobicContact CB-CG 4.39Å; A158-L207 HydrophobicContact CB-CD1 4.05Å; A158-L207 HydrophobicContact CB-CD2 4.43Å
159	T	87.5	Confident	83.9	Confident	66 Å²	66	52.6 Å²	52.6	41%	0.405	28%	0.276	S	S	.	.	H	α-helix	trans	-59.3	-46.9	179	-54.2	0	0	0	0	111.6	T155 T161 R162 E163	T155-T159 PolarHBondContact O-N 3.33Å; T159-T161 PolarHBondContact O-N 3.21Å; T159-R162 PolarHBondContact O-N 3Å; T159-E163 WeakPolarHBondContact CG2-OE1 3.32Å; T159-E163 WeakPolarHBondContact O-CG 3.43Å; T159-E163 PolarHBondContact O-N 2.73Å
160	R	88.8	Confident	84.8	Confident	168 Å²	168	50.9 Å²	50.9	63%	0.634	27%	0.27	S	S	*	.	H	α-helix	trans	-63.8	-41.3	178.2	-170.5	-172.3	-58.4	144.5	6.3	112	A158 R162 F164	A158-R160 PolarHBondContact O-N 2.69Å; R160-R162 VanDerWaalsContact C-N 3.35Å; R160-F164 VanDerWaalsContact O-CB 3.29Å; R160-F164 WeakPolarHBondContact O-CB 3.42Å; R160-F164 PolarHBondContact O-N 2.93Å; R160-F164 VanDerWaalsContact O-N 3.07Å
161	T	89.7	Confident	85.7	Confident	13 Å²	13	52 Å²	52	8%	0.08	27%	0.274	C	S	.	.	H	α-helix	trans	-62.4	-45.5	177.1	-62.5	0	0	0	0	110.6	D157 A158 T159 F164 V165 L207 M349	D157-T161 VanDerWaalsContact O-CB 3.27Å; D157-T161 WeakPolarHBondContact O-CB 3.28Å; D157-T161 PolarHBondContact O-N 3.1Å; D157-T161 PolarHBondContact O-OG1 3.46Å; A158-T161 PolarHBondContact O-N 3.08Å; T159-T161 PolarHBondContact O-N 3.21Å; T161-F164 PolarHBondContact O-N 3.11Å; T161-V165 HydrophobicContact CG2-CG2 4.36Å; T161-V165 WeakPolarHBondContact O-CB 3.29Å; T161-V165 VanDerWaalsContact O-CG2 3.28Å; T161-V165 WeakPolarHBondContact O-CG2 3.34Å; T161-V165 PolarHBondContact O-N 2.98Å; T161-L207 HydrophobicContact CG2-CB 4.31Å; T161-M349 HydrophobicContact CG2-CE 3.78Å; T161-M349 HydrophobicContact CG2-CG 4.18Å; T161-M349 HydrophobicContact CG2-SD 3.44Å; T161-M349 WeakPolarHBondContact CG2-SD 3.09Å
162	R	92.2	Very high	86.5	Confident	80 Å²	80	51.2 Å²	51.2	30%	0.302	27%	0.27	S	S	.	.	H	α-helix	trans	-60.3	-54.3	178.1	-179.2	-176	64.5	152.3	3.4	111.5	A158 T159 R160 F164 V165 E166 M197 Y198	A158-R162 WeakPolarHBondContact O-CB 3.37Å; A158-R162 PolarHBondContact O-N 3.32Å; T159-R162 PolarHBondContact O-N 3Å; R160-R162 VanDerWaalsContact C-N 3.35Å; R162-F164 VanDerWaalsContact C-N 3.26Å; R162-F164 PolarHBondContact O-N 3.16Å; R162-V165 PolarHBondContact O-N 3.24Å; R162-E166 WeakPolarHBondContact CD-OE1 3.41Å; R162-E166 VanDerWaalsContact CG-CD 3.45Å; R162-E166 HydrophobicContact CG-CG 4.12Å; R162-E166 WeakPolarHBondContact CG-OE1 3.27Å; R162-E166 WeakPolarHBondContact O-CB 3.45Å; R162-E166 VanDerWaalsContact O-CG 3.23Å; R162-E166 WeakPolarHBondContact O-CG 3.37Å; R162-E166 PolarHBondContact O-N 2.99Å; R162-M197 HydrophobicContact CB-CG 4.49Å; R162-M197 HydrophobicContact CB-SD 4.31Å; R162-Y198 HydrophobicContact CG-CE1 4.07Å
163	E	93.7	Very high	87.4	Confident	112 Å²	112	45.6 Å²	45.6	52%	0.523	25%	0.249	S	C	.	.	H	α-helix	trans	-57.4	-40.9	-179.7	-72.2	169	-178	0	0	112.1	T159 G167	T159-E163 WeakPolarHBondContact CG2-OE1 3.32Å; T159-E163 WeakPolarHBondContact O-CG 3.43Å; T159-E163 PolarHBondContact O-N 2.73Å; E163-G167 PolarHBondContact O-N 3.44Å
164	F	94	Very high	88.8	Confident	73 Å²	73	48.2 Å²	48.2	32%	0.32	25%	0.254	S	S	.	.	H	α-helix	trans	-66.5	-45.5	177.3	177.9	-99.2	0	0	0	112.6	R160 T161 R162 F168 F326 I341 F343	R160-F164 VanDerWaalsContact O-CB 3.29Å; R160-F164 WeakPolarHBondContact O-CB 3.42Å; R160-F164 PolarHBondContact O-N 2.93Å; R160-F164 VanDerWaalsContact O-N 3.07Å; T161-F164 PolarHBondContact O-N 3.11Å; R162-F164 VanDerWaalsContact C-N 3.26Å; R162-F164 PolarHBondContact O-N 3.16Å; F164-F168 WeakPolarHBondContact O-CB 3.47Å; F164-F168 PolarHBondContact O-N 3.04Å; F164-F168 VanDerWaalsContact O-N 3.09Å; F164-F326 HydrophobicContact CE1-CE1 4.45Å; F164-F326 HydrophobicContact CE2-CE1 4.18Å; F164-F326 HydrophobicContact CZ-CD1 4.11Å; F164-F326 AromaticContact CZ-CE1 3.51Å; F164-F326 HydrophobicContact CZ-CE1 3.51Å; F164-F326 HydrophobicContact CZ-CZ 4.17Å; F164-I341 HydrophobicContact CD1-CD1 4.33Å; F164-I341 HydrophobicContact CE1-CD1 3.6Å; F164-I341 HydrophobicContact CE1-CG2 4.48Å; F164-I341 HydrophobicContact CZ-CD1 4.41Å; F164-F343 HydrophobicContact CE1-CE1 4.22Å; F164-F343 AromaticContact CE1-CZ 3.67Å; F164-F343 HydrophobicContact CE1-CZ 3.67Å; F164-F343 AromaticContact CZ-CE1 3.84Å; F164-F343 HydrophobicContact CZ-CE1 3.84Å; F164-F343 AromaticContact CZ-CZ 3.77Å; F164-F343 HydrophobicContact CZ-CZ 3.77Å
165	V	94.3	Very high	90.1	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.4	-42.2	178.8	172.6	0	0	0	0	110.7	T161 R162 F168 V169 C209 L211 M349 F351	T161-V165 HydrophobicContact CG2-CG2 4.36Å; T161-V165 WeakPolarHBondContact O-CB 3.29Å; T161-V165 VanDerWaalsContact O-CG2 3.28Å; T161-V165 WeakPolarHBondContact O-CG2 3.34Å; T161-V165 PolarHBondContact O-N 2.98Å; R162-V165 PolarHBondContact O-N 3.24Å; V165-F168 PolarHBondContact O-N 3.36Å; V165-V169 HydrophobicContact CG1-CG2 4.08Å; V165-V169 WeakPolarHBondContact O-CB 3.31Å; V165-V169 WeakPolarHBondContact O-CG2 3.33Å; V165-V169 PolarHBondContact O-N 3.43Å; V165-C209 HydrophobicContact CB-CB 4.45Å; V165-C209 HydrophobicContact CG1-CB 3.89Å; V165-L211 HydrophobicContact CG1-CD1 4.15Å; V165-M349 HydrophobicContact CG2-CG 4.28Å; V165-F351 HydrophobicContact CG1-CB 3.88Å; V165-F351 HydrophobicContact CG1-CD2 4.13Å; V165-F351 HydrophobicContact CG1-CG 4.01Å
166	E	96.5	Very high	91.3	Very high	42 Å²	42	45.1 Å²	45.1	20%	0.196	23%	0.234	C	C	.	.	H	α-helix	trans	-59.5	-53.1	177.4	-74.4	176.3	173.4	0	0	111.3	R162 F168 V169 D170 F191 Y198	R162-E166 WeakPolarHBondContact CD-OE1 3.41Å; R162-E166 VanDerWaalsContact CG-CD 3.45Å; R162-E166 HydrophobicContact CG-CG 4.12Å; R162-E166 WeakPolarHBondContact CG-OE1 3.27Å; R162-E166 WeakPolarHBondContact O-CB 3.45Å; R162-E166 VanDerWaalsContact O-CG 3.23Å; R162-E166 WeakPolarHBondContact O-CG 3.37Å; R162-E166 PolarHBondContact O-N 2.99Å; E166-F168 VanDerWaalsContact C-N 3.28Å; E166-F168 PolarHBondContact O-N 3.13Å; E166-V169 PolarHBondContact O-N 3.18Å; E166-V169 VanDerWaalsContact O-N 3.11Å; E166-D170 PolarHBondContact O-N 2.94Å; E166-F191 HydrophobicContact CB-CE2 4.26Å; E166-F191 HydrophobicContact CB-CZ 3.7Å; E166-F191 HydrophobicContact CG-CE2 3.75Å; E166-F191 HydrophobicContact CG-CZ 3.72Å; E166-Y198 WeakPolarHBondContact CG-OH 3.37Å; E166-Y198 WeakPolarHBondContact OE1-CE1 3.37Å; E166-Y198 PolarHBondContact OE1-OH 3.35Å
167	G	96	Very high	92.2	Very high	33 Å²	33	47.1 Å²	47.1	34%	0.34	23%	0.227	S	C	.	.	H	α-helix	trans	-61.3	-36.4	178.5	0	0	0	0	0	113.2	E163 D171	E163-G167 PolarHBondContact O-N 3.44Å; G167-D171 PolarHBondContact O-N 3.47Å
168	F	95.7	Very high	92.6	Very high	3 Å²	3	48.8 Å²	48.8	1%	0.013	24%	0.243	C	C	.	.	H	α-helix	trans	-67.5	-42.2	174.2	170.9	-112.4	0	0	0	112.6	F164 V165 E166 D171 L172 W317 I320 Y324 F326 L328 I341 F351	F164-F168 WeakPolarHBondContact O-CB 3.47Å; F164-F168 PolarHBondContact O-N 3.04Å; F164-F168 VanDerWaalsContact O-N 3.09Å; V165-F168 PolarHBondContact O-N 3.36Å; E166-F168 VanDerWaalsContact C-N 3.28Å; E166-F168 PolarHBondContact O-N 3.13Å; F168-D171 PolarHBondContact O-N 3.43Å; F168-L172 HydrophobicContact CE1-CD2 4.32Å; F168-L172 HydrophobicContact CZ-CD2 4.34Å; F168-L172 WeakPolarHBondContact O-CB 3.4Å; F168-L172 PolarHBondContact O-N 3.3Å; F168-W317 HydrophobicContact CE2-CE3 4.11Å; F168-W317 AromaticContact CE2-CZ3 3.8Å; F168-W317 HydrophobicContact CE2-CZ3 3.8Å; F168-W317 HydrophobicContact CZ-CE3 4.14Å; F168-W317 HydrophobicContact CZ-CZ3 4.13Å; F168-I320 HydrophobicContact CE2-CD1 4.22Å; F168-Y324 HydrophobicContact CD2-CD2 4.38Å; F168-Y324 HydrophobicContact CD2-CE1 4.07Å; F168-Y324 AromaticContact CD2-CE2 3.97Å; F168-Y324 HydrophobicContact CD2-CE2 3.97Å; F168-Y324 AromaticContact CD2-CZ 3.78Å; F168-Y324 HydrophobicContact CE2-CD2 4.33Å; F168-Y324 HydrophobicContact CE2-CE2 4.22Å; F168-F326 AromaticContact CD2-CE2 3.97Å; F168-F326 HydrophobicContact CD2-CE2 3.97Å; F168-F326 AromaticContact CD2-CZ 3.65Å; F168-F326 HydrophobicContact CD2-CZ 3.65Å; F168-F326 AromaticContact CE2-CE2 3.72Å; F168-F326 HydrophobicContact CE2-CE2 3.72Å; F168-F326 AromaticContact CE2-CZ 3.89Å; F168-F326 HydrophobicContact CE2-CZ 3.89Å; F168-F326 HydrophobicContact CG-CZ 4.2Å; F168-F326 HydrophobicContact CZ-CE2 4.12Å; F168-L328 HydrophobicContact CE1-CD1 4.02Å; F168-L328 HydrophobicContact CZ-CD1 4.12Å; F168-L328 HydrophobicContact CZ-CD2 4.23Å; F168-I341 HydrophobicContact CD1-CD1 3.71Å; F168-I341 HydrophobicContact CD1-CG1 4.34Å; F168-I341 HydrophobicContact CE1-CD1 4.13Å; F168-I341 HydrophobicContact CE1-CG1 4.26Å; F168-I341 HydrophobicContact CG-CD1 4.17Å; F168-F351 HydrophobicContact CD1-CZ 4.15Å; F168-F351 HydrophobicContact CE1-CE1 4.24Å; F168-F351 HydrophobicContact CE1-CE2 4.44Å; F168-F351 AromaticContact CE1-CZ 3.69Å; F168-F351 HydrophobicContact CE1-CZ 3.69Å
169	V	95.6	Very high	92.6	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-71	-36	-178.9	174.2	0	0	0	0	110.7	V165 E166 L172 L173 F191 L211 F351 L353	V165-V169 HydrophobicContact CG1-CG2 4.08Å; V165-V169 WeakPolarHBondContact O-CB 3.31Å; V165-V169 WeakPolarHBondContact O-CG2 3.33Å; V165-V169 PolarHBondContact O-N 3.43Å; E166-V169 PolarHBondContact O-N 3.18Å; E166-V169 VanDerWaalsContact O-N 3.11Å; V169-L172 PolarHBondContact O-N 3.47Å; V169-L173 HydrophobicContact CG1-CD1 4.07Å; V169-L173 HydrophobicContact CG1-CG 4.12Å; V169-L173 WeakPolarHBondContact O-CB 3.49Å; V169-L173 WeakPolarHBondContact O-CG 2.92Å; V169-L173 PolarHBondContact O-N 2.68Å; V169-F191 HydrophobicContact CB-CD1 4.09Å; V169-F191 HydrophobicContact CB-CE1 4Å; V169-F191 HydrophobicContact CG1-CB 4.49Å; V169-F191 HydrophobicContact CG1-CD1 3.44Å; V169-F191 VanDerWaalsContact CG1-CD1 3.44Å; V169-F191 HydrophobicContact CG1-CE1 3.88Å; V169-F191 HydrophobicContact CG1-CG 4.13Å; V169-L211 HydrophobicContact CB-CD1 4.02Å; V169-L211 HydrophobicContact CG1-CD1 3.92Å; V169-L211 HydrophobicContact CG2-CD1 3.73Å; V169-F351 HydrophobicContact CG2-CD2 4.06Å; V169-F351 HydrophobicContact CG2-CE2 3.79Å; V169-L353 HydrophobicContact CG1-CD1 4.3Å; V169-L353 HydrophobicContact CG1-CD2 3.71Å; V169-L353 HydrophobicContact CG2-CD2 3.94Å
170	D	96.8	Very high	92.2	Very high	68 Å²	68	49.8 Å²	49.8	36%	0.364	25%	0.247	S	C	.	.	H	α-helix	trans	-56.3	-51.4	171.2	-80	-34.7	0	0	0	110.9	E166 L172 L173 E174 F191	E166-D170 PolarHBondContact O-N 2.94Å; D170-L172 VanDerWaalsContact C-N 3.28Å; D170-L172 PolarHBondContact O-N 3.35Å; D170-L173 PolarHBondContact O-N 2.94Å; D170-E174 WeakPolarHBondContact O-CB 3.35Å; D170-E174 PolarHBondContact O-N 3.03Å; D170-F191 HydrophobicContact CB-CE1 4.41Å; D170-F191 WeakPolarHBondContact OD1-CE1 3.38Å
171	D	95.6	Very high	91.5	Very high	44 Å²	44	45.6 Å²	45.6	24%	0.235	24%	0.237	C	C	.	.	H	α-helix	trans	-58.4	-39.2	175.9	-93.6	21.7	0	0	0	112.5	G167 F168 A175 I320 Y324	G167-D171 PolarHBondContact O-N 3.47Å; F168-D171 PolarHBondContact O-N 3.43Å; D171-A175 WeakPolarHBondContact O-CB 3.45Å; D171-A175 PolarHBondContact O-N 3.01Å; D171-I320 HydrophobicContact CB-CD1 4.24Å; D171-Y324 HydrophobicContact CB-CE2 4.45Å; D171-Y324 WeakPolarHBondContact CB-OH 3.47Å; D171-Y324 PolarHBondContact OD2-OH 3.49Å
172	L	94.5	Very high	90.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-69	-42.8	179.6	-174.4	64.5	0	0	0	111.8	F168 V169 D170 A175 L176 L313 A316 W317 I320 L328 L353	F168-L172 HydrophobicContact CE1-CD2 4.32Å; F168-L172 HydrophobicContact CZ-CD2 4.34Å; F168-L172 WeakPolarHBondContact O-CB 3.4Å; F168-L172 PolarHBondContact O-N 3.3Å; V169-L172 PolarHBondContact O-N 3.47Å; D170-L172 VanDerWaalsContact C-N 3.28Å; D170-L172 PolarHBondContact O-N 3.35Å; L172-A175 PolarHBondContact O-N 2.81Å; L172-L176 WeakPolarHBondContact O-CB 3.41Å; L172-L176 PolarHBondContact O-N 3.41Å; L172-L313 HydrophobicContact CD2-CD2 3.83Å; L172-L313 HydrophobicContact CG-CD2 4.13Å; L172-A316 HydrophobicContact CD1-CB 3.76Å; L172-W317 HydrophobicContact CD1-CB 4.22Å; L172-I320 HydrophobicContact CB-CD1 4.05Å; L172-I320 HydrophobicContact CD1-CD1 3.91Å; L172-I320 HydrophobicContact CD1-CG1 4.48Å; L172-L328 HydrophobicContact CD2-CD2 4.47Å; L172-L353 HydrophobicContact CD2-CD1 4.12Å
173	L	94.4	Very high	89.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-71.8	-35.7	176.9	-66.6	-176.9	0	0	0	111.7	V169 D170 L176 R177 F191 V213	V169-L173 HydrophobicContact CG1-CD1 4.07Å; V169-L173 HydrophobicContact CG1-CG 4.12Å; V169-L173 WeakPolarHBondContact O-CB 3.49Å; V169-L173 WeakPolarHBondContact O-CG 2.92Å; V169-L173 PolarHBondContact O-N 2.68Å; D170-L173 PolarHBondContact O-N 2.94Å; L173-L176 HydrophobicContact CD2-CD2 4.35Å; L173-L176 WeakPolarHBondContact O-CB 3.35Å; L173-L176 PolarHBondContact O-N 3.37Å; L173-R177 VanDerWaalsContact O-CG 3.27Å; L173-R177 WeakPolarHBondContact O-CG 3.17Å; L173-R177 PolarHBondContact O-N 2.88Å; L173-F191 HydrophobicContact CD1-CB 4.15Å; L173-F191 HydrophobicContact CD1-CD1 3.94Å; L173-V213 HydrophobicContact CD1-CG1 3.72Å; L173-V213 HydrophobicContact CD1-CG2 4.47Å; L173-V213 HydrophobicContact CD2-CG1 3.76Å; L173-V213 HydrophobicContact CG-CG1 4.43Å
174	E	93.9	Very high	88	Confident	121 Å²	121	54.1 Å²	54.1	57%	0.565	28%	0.281	S	S	*	.	H	α-helix	trans	-62	-45.3	172.3	-172.4	-179.1	-163.7	0	0	110.8	D170 L176 R177 S178	D170-E174 WeakPolarHBondContact O-CB 3.35Å; D170-E174 PolarHBondContact O-N 3.03Å; E174-L176 VanDerWaalsContact C-N 3.3Å; E174-L176 PolarHBondContact O-N 2.84Å; E174-R177 PolarHBondContact O-N 3.21Å; E174-S178 PolarHBondContact O-N 2.77Å
175	A	93	Very high	87.4	Confident	8 Å²	8	53.4 Å²	53.4	7%	0.066	28%	0.281	C	S	.	.	H	α-helix	trans	-61.4	-39.5	174.8	0	0	0	0	0	112.2	D171 L172 S178 I179 A316 I320	D171-A175 WeakPolarHBondContact O-CB 3.45Å; D171-A175 PolarHBondContact O-N 3.01Å; L172-A175 PolarHBondContact O-N 2.81Å; A175-S178 PolarHBondContact O-N 3.27Å; A175-S178 PolarHBondContact O-OG 3.43Å; A175-I179 WeakPolarHBondContact O-CD1 3.18Å; A175-I179 WeakPolarHBondContact O-CG1 3.16Å; A175-I179 PolarHBondContact O-N 3.17Å; A175-A316 HydrophobicContact CB-CB 4.19Å; A175-I320 HydrophobicContact CB-CG2 3.51Å
176	L	90.4	Very high	87	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-61	-51.2	174.8	-166.3	88.2	0	0	0	111.5	L172 L173 E174 S178 I179 C180 M188 A312 A316	L172-L176 WeakPolarHBondContact O-CB 3.41Å; L172-L176 PolarHBondContact O-N 3.41Å; L173-L176 HydrophobicContact CD2-CD2 4.35Å; L173-L176 WeakPolarHBondContact O-CB 3.35Å; L173-L176 PolarHBondContact O-N 3.37Å; E174-L176 VanDerWaalsContact C-N 3.3Å; E174-L176 PolarHBondContact O-N 2.84Å; L176-S178 PolarHBondContact O-N 2.88Å; L176-I179 WeakPolarHBondContact O-CB 3.37Å; L176-I179 PolarHBondContact O-N 3.23Å; L176-C180 PolarHBondContact O-N 2.77Å; L176-C180 VanDerWaalsContact O-N 3.14Å; L176-C180 PolarHBondContact O-SG 3.4Å; L176-C180 VanDerWaalsContact O-SG 3.38Å; L176-M188 HydrophobicContact CD2-CB 4.14Å; L176-M188 HydrophobicContact CD2-CG 3.32Å; L176-M188 HydrophobicContact CD2-SD 4.49Å; L176-A312 HydrophobicContact CD1-CB 3.51Å; L176-A312 VanDerWaalsContact CD1-O 3.23Å; L176-A312 WeakPolarHBondContact CD1-O 2.84Å; L176-A316 HydrophobicContact CB-CB 4Å; L176-A316 HydrophobicContact CD1-CB 3.86Å
177	R	90.2	Very high	86.5	Confident	90 Å²	90	54.7 Å²	54.7	34%	0.34	29%	0.287	S	S	.	.	H	α-helix	trans	-59	-32.7	177.6	-69.8	170.1	-166.2	147.2	6.9	112.3	L173 E174 I179 M188 E189 D190	L173-R177 VanDerWaalsContact O-CG 3.27Å; L173-R177 WeakPolarHBondContact O-CG 3.17Å; L173-R177 PolarHBondContact O-N 2.88Å; E174-R177 PolarHBondContact O-N 3.21Å; R177-I179 VanDerWaalsContact C-N 3.26Å; R177-I179 PolarHBondContact O-N 2.67Å; R177-M188 PolarHBondContact NE-O 3.21Å; R177-E189 PolarHBondContact NH2-O 3.28Å; R177-D190 IonicContact CZ-OD1 2.67Å; R177-D190 IonicContact NH1-OD1 3.52Å; R177-D190 PolarHBondContact NH1-OD1 3.39Å; R177-D190 VanDerWaalsContact NH2-CA 3.34Å; R177-D190 VanDerWaalsContact NH2-N 3.18Å; R177-D190 IonicContact NH2-OD1 3.58Å; R177-D190 PolarHBondContact NH2-OD1 3.35Å
178	S	88.1	Confident	86.2	Confident	94 Å²	94	53.6 Å²	53.6	66%	0.657	27%	0.273	S	S	*	.	H	α-helix	trans	-69	-21.9	176	81.6	0	0	0	0	114.1	E174 A175 L176	E174-S178 PolarHBondContact O-N 2.77Å; A175-S178 PolarHBondContact O-N 3.27Å; A175-S178 PolarHBondContact O-OG 3.43Å; L176-S178 PolarHBondContact O-N 2.88Å
179	I	83.1	Confident	86	Confident	63 Å²	63	57.2 Å²	57.2	32%	0.323	29%	0.29	S	S	.	.	H	α-helix	trans	-90.2	-34.6	179.1	-61.6	161.4	0	0	0	110.6	A175 L176 R177 K315 A316 R319	A175-I179 WeakPolarHBondContact O-CD1 3.18Å; A175-I179 WeakPolarHBondContact O-CG1 3.16Å; A175-I179 PolarHBondContact O-N 3.17Å; L176-I179 WeakPolarHBondContact O-CB 3.37Å; L176-I179 PolarHBondContact O-N 3.23Å; R177-I179 VanDerWaalsContact C-N 3.26Å; R177-I179 PolarHBondContact O-N 2.67Å; I179-K315 HydrophobicContact CD1-CB 4.19Å; I179-A316 HydrophobicContact CD1-CB 4.39Å; I179-R319 HydrophobicContact CD1-CG 3.95Å; I179-R319 HydrophobicContact CG1-CG 4.4Å
180	C	79.4	Confident	86	Confident	30 Å²	30	62 Å²	62	20%	0.203	32%	0.316	C	S	.	.			trans	-66.4	131.9	-176.8	-66.4	0	0	0	0	111.9	L176 D185	L176-C180 PolarHBondContact O-N 2.77Å; L176-C180 VanDerWaalsContact O-N 3.14Å; L176-C180 PolarHBondContact O-SG 3.4Å; L176-C180 VanDerWaalsContact O-SG 3.38Å; C180-D185 WeakPolarHBondContact CA-OD2 3.47Å; C180-D185 HydrophobicContact CB-CB 3.97Å
181	N	74.7	Confident	85.9	Confident	80 Å²	80	60.3 Å²	60.3	43%	0.428	31%	0.305	S	S	.	.			trans	-87	116.6	166.4	178.2	11.1	0	0	0	109.4	N183 T184 D185	N181-N183 PolarHBondContact O-N 3.48Å; N181-N183 PolarHBondContact OD1-N 3.34Å; N181-T184 WeakPolarHBondContact CB-OG1 3.21Å; N181-T184 PolarHBondContact ND2-OG1 3.07Å; N181-T184 PolarHBondContact O-N 3.16Å; N181-D185 PolarHBondContact N-OD2 3.37Å; N181-D185 PolarHBondContact O-N 2.87Å
182	R	66.3	Low	86	Confident	177 Å²	177	60 Å²	60	67%	0.668	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-25.9	-175.8	-56.1	-168.3	76.8	179.9	5.5	114.9	E187	R182-E187 WeakPolarHBondContact CB-OE1 3.24Å; R182-E187 WeakPolarHBondContact CG-OE1 3.29Å; R182-E187 IonicContact CZ-OE1 3.83Å; R182-E187 IonicContact NE-OE1 3.64Å; R182-E187 PolarHBondContact NE-OE1 2.73Å; R182-E187 IonicContact NH2-OE1 3.68Å; R182-E187 PolarHBondContact NH2-OE1 2.81Å; R182-E187 IonicContact NH2-OE2 2.9Å
183	N	65.3	Low	86	Confident	123 Å²	123	60.2 Å²	60.2	66%	0.658	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-14.5	-176.6	-62.5	-19.6	0	0	0	114	N181	N181-N183 PolarHBondContact O-N 3.48Å; N181-N183 PolarHBondContact OD1-N 3.34Å
184	T	69.9	Low	85.9	Confident	84 Å²	84	60.4 Å²	60.4	52%	0.515	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.9	-28.3	-172.1	60.2	0	0	0	0	113.3	N181	N181-T184 WeakPolarHBondContact CB-OG1 3.21Å; N181-T184 PolarHBondContact ND2-OG1 3.07Å; N181-T184 PolarHBondContact O-N 3.16Å
185	D	81.6	Confident	85.7	Confident	59 Å²	59	55.3 Å²	55.3	32%	0.316	29%	0.286	S	S	.	.	S	Bend	trans	-104.6	151.5	-173.7	-57.2	-25.7	0	0	0	110.2	C180 N181 E187	C180-D185 WeakPolarHBondContact CA-OD2 3.47Å; C180-D185 HydrophobicContact CB-CB 3.97Å; N181-D185 PolarHBondContact N-OD2 3.37Å; N181-D185 PolarHBondContact O-N 2.87Å; D185-E187 PolarHBondContact O-N 3.31Å
186	M	87	Confident	85.6	Confident	6 Å²	6	56 Å²	56	3%	0.03	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-62	135.6	173	-52.7	-80.9	166.1	0	0	109.8	F215 V216 P217 F223 L291 L292 W308	M186-F215 HydrophobicContact CB-CD2 4.34Å; M186-F215 HydrophobicContact CG-CD2 4.48Å; M186-F215 HydrophobicContact SD-CD2 4.28Å; M186-F215 HydrophobicContact SD-CE2 4.39Å; M186-V216 WeakPolarHBondContact CA-O 3.21Å; M186-P217 VanDerWaalsContact SD-CA 3.59Å; M186-P217 HydrophobicContact SD-CB 4.13Å; M186-F223 HydrophobicContact SD-CZ 3.97Å; M186-L291 HydrophobicContact CE-CB 4.42Å; M186-L291 HydrophobicContact CE-CD2 3.97Å; M186-L292 HydrophobicContact CE-CD1 4.3Å; M186-L292 HydrophobicContact CE-CG 4.45Å; M186-W308 HydrophobicContact CB-CH2 3.59Å; M186-W308 HydrophobicContact CB-CZ2 3.54Å; M186-W308 HydrophobicContact CG-CH2 4.04Å; M186-W308 HydrophobicContact CG-CZ2 3.9Å
187	E	85.8	Confident	85.6	Confident	62 Å²	62	56.1 Å²	56.1	29%	0.29	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	133.4	175.1	-59.8	-165.8	154.1	0	0	109.5	R182 D185 F215 V216	R182-E187 WeakPolarHBondContact CB-OE1 3.24Å; R182-E187 WeakPolarHBondContact CG-OE1 3.29Å; R182-E187 IonicContact CZ-OE1 3.83Å; R182-E187 IonicContact NE-OE1 3.64Å; R182-E187 PolarHBondContact NE-OE1 2.73Å; R182-E187 IonicContact NH2-OE1 3.68Å; R182-E187 PolarHBondContact NH2-OE1 2.81Å; R182-E187 IonicContact NH2-OE2 2.9Å; D185-E187 PolarHBondContact O-N 3.31Å; E187-F215 CarbonylContact O-C 3.6Å; E187-F215 VanDerWaalsContact O-CA 3.23Å; E187-F215 WeakPolarHBondContact O-CA 3.4Å; E187-F215 WeakPolarHBondContact O-CB 3.45Å; E187-V216 HydrophobicContact CB-CG2 3.78Å; E187-V216 PolarHBondContact N-O 3.49Å; E187-V216 PolarHBondContact O-N 2.99Å
188	M	89.1	Confident	85.6	Confident	10 Å²	10	52.6 Å²	52.6	5%	0.049	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.2	175.3	-58.2	-63.5	-56.8	0	0	110.6	L176 R177 V213 F215 W308 F309	L176-M188 HydrophobicContact CD2-CB 4.14Å; L176-M188 HydrophobicContact CD2-CG 3.32Å; L176-M188 HydrophobicContact CD2-SD 4.49Å; R177-M188 PolarHBondContact NE-O 3.21Å; M188-V213 HydrophobicContact CB-CG1 4.35Å; M188-V213 HydrophobicContact CE-CB 3.58Å; M188-V213 HydrophobicContact CE-CG1 3.22Å; M188-V213 WeakPolarHBondContact CE-O 3.43Å; M188-F215 HydrophobicContact CE-CB 3.8Å; M188-F215 HydrophobicContact SD-CB 3.33Å; M188-F215 WeakPolarHBondContact SD-CB 3.38Å; M188-F215 HydrophobicContact SD-CG 4.18Å; M188-W308 HydrophobicContact CG-CH2 4.49Å; M188-W308 HydrophobicContact SD-CH2 3.44Å; M188-W308 WeakPolarHBondContact SD-CH2 3.32Å; M188-W308 HydrophobicContact SD-CZ2 4.48Å; M188-W308 HydrophobicContact SD-CZ3 3.99Å; M188-F309 HydrophobicContact CE-CD2 4.07Å; M188-F309 HydrophobicContact CE-CE2 3.51Å; M188-F309 HydrophobicContact CE-CZ 4.38Å; M188-F309 HydrophobicContact SD-CD2 4.36Å; M188-F309 HydrophobicContact SD-CE2 4.24Å
189	E	91.9	Very high	85.8	Confident	79 Å²	79	48.5 Å²	48.5	37%	0.369	25%	0.248	S	C	.	.			trans	-82.1	-179.7	172	-60.2	-176.8	-175.8	0	0	111.6	R177 P214	R177-E189 PolarHBondContact NH2-O 3.28Å; E189-P214 HydrophobicContact CB-CB 4.04Å; E189-P214 HydrophobicContact CB-CG 4.34Å; E189-P214 HydrophobicContact CG-CB 4.31Å; E189-P214 PolarHBondContact N-O 2.92Å
190	D	94.5	Very high	86.1	Confident	100 Å²	100	50.5 Å²	50.5	54%	0.535	26%	0.26	S	S	.	.			trans	-70.1	153	175	-68	-31.6	0	0	0	111.1	R177 P214	R177-D190 IonicContact CZ-OD1 2.67Å; R177-D190 IonicContact NH1-OD1 3.52Å; R177-D190 PolarHBondContact NH1-OD1 3.39Å; R177-D190 VanDerWaalsContact NH2-CA 3.34Å; R177-D190 VanDerWaalsContact NH2-N 3.18Å; R177-D190 IonicContact NH2-OD1 3.58Å; R177-D190 PolarHBondContact NH2-OD1 3.35Å; D190-P214 VanDerWaalsContact O-CD 3.25Å; D190-P214 WeakPolarHBondContact O-CD 3.41Å
191	F	95.9	Very high	86.5	Confident	34 Å²	34	49.7 Å²	49.7	15%	0.149	25%	0.253	C	S	.	.			trans	-75.5	155.5	-177.4	64.3	-102.4	0	0	0	112.5	E166 V169 D170 L173 L211 F212 V213	E166-F191 HydrophobicContact CB-CE2 4.26Å; E166-F191 HydrophobicContact CB-CZ 3.7Å; E166-F191 HydrophobicContact CG-CE2 3.75Å; E166-F191 HydrophobicContact CG-CZ 3.72Å; V169-F191 HydrophobicContact CB-CD1 4.09Å; V169-F191 HydrophobicContact CB-CE1 4Å; V169-F191 HydrophobicContact CG1-CB 4.49Å; V169-F191 HydrophobicContact CG1-CD1 3.44Å; V169-F191 VanDerWaalsContact CG1-CD1 3.44Å; V169-F191 HydrophobicContact CG1-CE1 3.88Å; V169-F191 HydrophobicContact CG1-CG 4.13Å; D170-F191 HydrophobicContact CB-CE1 4.41Å; D170-F191 WeakPolarHBondContact OD1-CE1 3.38Å; L173-F191 HydrophobicContact CD1-CB 4.15Å; L173-F191 HydrophobicContact CD1-CD1 3.94Å; F191-L211 HydrophobicContact CB-CB 4.23Å; F191-L211 HydrophobicContact CD2-CD1 4.17Å; F191-L211 HydrophobicContact CD2-CD2 3.63Å; F191-L211 HydrophobicContact CD2-CG 4.34Å; F191-L211 HydrophobicContact CE2-CD2 4.08Å; F191-L211 HydrophobicContact CG-CD1 4.25Å; F191-L211 HydrophobicContact CG-CD2 4.37Å; F191-F212 CarbonylContact C-O 3.59Å; F191-F212 WeakPolarHBondContact CA-O 3.44Å; F191-F212 WeakPolarHBondContact CB-O 3.3Å; F191-V213 HydrophobicContact CB-CG2 4.31Å
192	I	96.1	Very high	86.9	Confident	38 Å²	38	47.1 Å²	47.1	20%	0.195	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	115	175.9	-53.1	167.5	0	0	0	108.4	V194 L211 F212 P214 Y365 V391	I192-V194 HydrophobicContact CG2-CG1 4.28Å; I192-L211 WeakPolarHBondContact O-CA 3.21Å; I192-F212 HydrophobicContact CB-CB 4.32Å; I192-F212 PolarHBondContact N-O 3.46Å; I192-F212 PolarHBondContact O-N 3.32Å; I192-P214 HydrophobicContact CD1-CG 3.85Å; I192-P214 HydrophobicContact CG1-CG 4.46Å; I192-Y365 HydrophobicContact CD1-CE1 4.06Å; I192-Y365 HydrophobicContact CD1-CE2 4.17Å; I192-Y365 WeakPolarHBondContact CD1-OH 3.33Å; I192-V391 HydrophobicContact CG2-CG2 3.91Å
193	G	95	Very high	86.9	Confident	4 Å²	4	40.1 Å²	40.1	4%	0.041	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	127.1	175.5	0	0	0	0	0	113.2	Y198 R394	G193-Y198 VanDerWaalsContact C-CD2 3.41Å; G193-Y198 VanDerWaalsContact CA-CD2 3.47Å; G193-Y198 VanDerWaalsContact CA-CE2 3.48Å; G193-R394 WeakPolarHBondContact O-CD 3.45Å; G193-R394 PolarHBondContact O-NH1 3.14Å
194	V	93.2	Very high	87	Confident	4 Å²	4	37 Å²	37	2%	0.024	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	162.7	-176.1	-66.2	0	0	0	0	112.3	I192 Y198 H210 F212 A390 V391	I192-V194 HydrophobicContact CG2-CG1 4.28Å; V194-Y198 VanDerWaalsContact N-CD2 3.3Å; V194-Y198 WeakPolarHBondContact O-CD2 3.46Å; V194-H210 HydrophobicContact CG2-CB 3.96Å; V194-H210 PolarHBondContact N-O 2.96Å; V194-F212 HydrophobicContact CG1-CD2 4Å; V194-F212 HydrophobicContact CG1-CE2 4.15Å; V194-F212 HydrophobicContact CG1-CG 4.39Å; V194-F212 HydrophobicContact CG2-CD1 3.81Å; V194-F212 HydrophobicContact CG2-CD2 4.27Å; V194-F212 HydrophobicContact CG2-CE1 3.75Å; V194-F212 HydrophobicContact CG2-CE2 4.2Å; V194-F212 HydrophobicContact CG2-CG 4.09Å; V194-F212 HydrophobicContact CG2-CZ 3.94Å; V194-A390 HydrophobicContact CB-CB 3.86Å; V194-A390 HydrophobicContact CG1-CB 4.01Å; V194-A390 HydrophobicContact CG2-CB 4.41Å; V194-V391 HydrophobicContact CG1-CG2 3.81Å
195	G	89.6	Confident	87.3	Confident	14 Å²	14	40.2 Å²	40.2	14%	0.144	20%	0.199	C	C	.	.	S	Bend	trans	80.5	-165.8	176	0	0	0	0	0	114.4	M197 Y198 E199	G195-M197 VanDerWaalsContact C-N 3.28Å; G195-M197 PolarHBondContact O-N 3.33Å; G195-M197 VanDerWaalsContact O-N 3.13Å; G195-Y198 PolarHBondContact O-N 3.48Å; G195-E199 WeakPolarHBondContact O-CB 3.34Å; G195-E199 VanDerWaalsContact O-CG 3.27Å; G195-E199 WeakPolarHBondContact O-CG 3.5Å; G195-E199 PolarHBondContact O-N 2.92Å
196	S	90	Very high	87.2	Confident	23 Å²	23	40.6 Å²	40.6	16%	0.161	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-36.4	-166	66.1	0	0	0	0	114.3	Y198 E199 N200 W201 Q202	S196-Y198 VanDerWaalsContact C-N 3.33Å; S196-Y198 PolarHBondContact O-N 2.91Å; S196-E199 PolarHBondContact O-N 3.34Å; S196-N200 PolarHBondContact O-N 3.05Å; S196-W201 PolarHBondContact O-N 3.28Å; S196-Q202 PolarHBondContact O-NE2 3.37Å
197	M	90	Very high	87.1	Confident	5 Å²	5	41.4 Å²	41.4	3%	0.025	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-41.4	174.5	-176.6	58.4	69.6	0	0	112.8	A158 R162 G195 Q202 L207	A158-M197 HydrophobicContact CB-CE 4.41Å; A158-M197 HydrophobicContact CB-SD 4Å; R162-M197 HydrophobicContact CB-CG 4.49Å; R162-M197 HydrophobicContact CB-SD 4.31Å; G195-M197 VanDerWaalsContact C-N 3.28Å; G195-M197 PolarHBondContact O-N 3.33Å; G195-M197 VanDerWaalsContact O-N 3.13Å; M197-Q202 HydrophobicContact CE-CG 4.31Å; M197-Q202 PolarHBondContact O-NE2 3.26Å; M197-Q202 HydrophobicContact SD-CG 4.02Å; M197-L207 HydrophobicContact CE-CB 3.7Å; M197-L207 HydrophobicContact CE-CD1 4.34Å; M197-L207 HydrophobicContact CE-CD2 3.96Å; M197-L207 HydrophobicContact CE-CG 4.21Å
198	Y	92	Very high	87.2	Confident	16 Å²	16	39.6 Å²	39.6	6%	0.063	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-5.3	-173.9	-71.3	-84.8	0	0	0	113.8	R162 E166 G193 V194 G195 S196 C209 L211 R394	R162-Y198 HydrophobicContact CG-CE1 4.07Å; E166-Y198 WeakPolarHBondContact CG-OH 3.37Å; E166-Y198 WeakPolarHBondContact OE1-CE1 3.37Å; E166-Y198 PolarHBondContact OE1-OH 3.35Å; G193-Y198 VanDerWaalsContact C-CD2 3.41Å; G193-Y198 VanDerWaalsContact CA-CD2 3.47Å; G193-Y198 VanDerWaalsContact CA-CE2 3.48Å; V194-Y198 VanDerWaalsContact N-CD2 3.3Å; V194-Y198 WeakPolarHBondContact O-CD2 3.46Å; G195-Y198 PolarHBondContact O-N 3.48Å; S196-Y198 VanDerWaalsContact C-N 3.33Å; S196-Y198 PolarHBondContact O-N 2.91Å; Y198-C209 HydrophobicContact CE2-CB 4.46Å; Y198-L211 HydrophobicContact CE2-CD2 3.73Å; Y198-L211 WeakPolarHBondContact OH-CD2 3.48Å; Y198-R394 PolarHBondContact O-NE 3.45Å
199	E	92.5	Very high	87.3	Confident	7 Å²	7	39.1 Å²	39.1	3%	0.033	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.1	4.3	-178.8	-67.9	169.3	179.1	0	0	112.9	G195 S196 W201 R394 L397 K439	G195-E199 WeakPolarHBondContact O-CB 3.34Å; G195-E199 VanDerWaalsContact O-CG 3.27Å; G195-E199 WeakPolarHBondContact O-CG 3.5Å; G195-E199 PolarHBondContact O-N 2.92Å; S196-E199 PolarHBondContact O-N 3.34Å; E199-W201 VanDerWaalsContact C-N 3.35Å; E199-W201 VanDerWaalsContact CB-NE1 3.34Å; E199-W201 PolarHBondContact O-N 3.37Å; E199-W201 PolarHBondContact OE2-NE1 2.94Å; E199-R394 HydrophobicContact CG-CB 3.98Å; E199-R394 HydrophobicContact CG-CG 4.15Å; E199-L397 HydrophobicContact CB-CD1 3.95Å; E199-L397 HydrophobicContact CG-CD1 3.98Å; E199-K439 IonicContact OE1-NZ 3.43Å; E199-K439 PolarHBondContact OE1-NZ 2.94Å; E199-K439 WeakPolarHBondContact OE2-CE 3.39Å; E199-K439 IonicContact OE2-NZ 2.88Å; E199-K439 PolarHBondContact OE2-NZ 3.36Å
200	N	88.4	Confident	87.3	Confident	105 Å²	105	37.9 Å²	37.9	56%	0.561	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	67	22.5	173.4	-56.9	-43	0	0	0	116.4	S196 Q202 L411	S196-N200 PolarHBondContact O-N 3.05Å; N200-Q202 VanDerWaalsContact CA-NE2 3.35Å; N200-L411 HydrophobicContact CB-CD1 3.86Å
201	W	87.7	Confident	87.3	Confident	14 Å²	14	33.1 Å²	33.1	5%	0.053	17%	0.167	C	C	.	.			trans	-121.5	34.1	176.7	63	-86.6	0	0	0	113	S196 E199 V203 L411 L414 Q415 D435 K439	S196-W201 PolarHBondContact O-N 3.28Å; E199-W201 VanDerWaalsContact C-N 3.35Å; E199-W201 VanDerWaalsContact CB-NE1 3.34Å; E199-W201 PolarHBondContact O-N 3.37Å; E199-W201 PolarHBondContact OE2-NE1 2.94Å; W201-V203 HydrophobicContact CE3-CG2 3.96Å; W201-V203 HydrophobicContact CZ3-CG2 4.32Å; W201-V203 WeakPolarHBondContact O-CG2 3.43Å; W201-V203 PolarHBondContact O-N 3.2Å; W201-L411 HydrophobicContact CB-CB 4.42Å; W201-L411 HydrophobicContact CB-CD2 4.16Å; W201-L414 HydrophobicContact CB-CD2 4.18Å; W201-L414 HydrophobicContact CD2-CD2 3.4Å; W201-L414 HydrophobicContact CD2-CG 3.91Å; W201-L414 HydrophobicContact CE3-CD1 4.45Å; W201-L414 HydrophobicContact CE3-CD2 3.7Å; W201-L414 HydrophobicContact CE3-CG 3.68Å; W201-L414 HydrophobicContact CG-CD2 3.61Å; W201-L414 HydrophobicContact CG-CG 4.29Å; W201-L414 HydrophobicContact CZ2-CD2 4.36Å; W201-L414 HydrophobicContact CZ3-CD2 4.3Å; W201-L414 HydrophobicContact CZ3-CG 4.22Å; W201-Q415 HydrophobicContact CB-CG 3.86Å; W201-D435 HydrophobicContact CH2-CB 3.88Å; W201-D435 HydrophobicContact CZ3-CB 4.05Å; W201-K439 HydrophobicContact CZ2-CD 4.07Å
202	Q	83.2	Confident	87.3	Confident	26 Å²	26	31.9 Å²	31.9	12%	0.121	16%	0.162	C	C	.	.			trans	-52.4	107.4	-171.8	-56.5	85.1	8.1	0	0	113.7	A158 S196 M197 N200 L207	A158-Q202 HydrophobicContact CB-CG 4.39Å; S196-Q202 PolarHBondContact O-NE2 3.37Å; M197-Q202 HydrophobicContact CE-CG 4.31Å; M197-Q202 PolarHBondContact O-NE2 3.26Å; M197-Q202 HydrophobicContact SD-CG 4.02Å; N200-Q202 VanDerWaalsContact CA-NE2 3.35Å; Q202-L207 HydrophobicContact CB-CD2 3.85Å; Q202-L207 HydrophobicContact CG-CD2 4.36Å
203	V	67	Low	87.2	Confident	29 Å²	29	30.1 Å²	30.1	18%	0.176	15%	0.153	C	C	.	.			trans	-104.8	-35.5	-179.4	173.5	0	0	0	0	112.5	W201 R205 Q415 S418	W201-V203 HydrophobicContact CE3-CG2 3.96Å; W201-V203 HydrophobicContact CZ3-CG2 4.32Å; W201-V203 WeakPolarHBondContact O-CG2 3.43Å; W201-V203 PolarHBondContact O-N 3.2Å; V203-R205 PolarHBondContact O-N 3.22Å; V203-Q415 HydrophobicContact CG2-CB 4.2Å; V203-Q415 HydrophobicContact CG2-CG 4.14Å; V203-S418 VanDerWaalsContact CG2-CB 3.42Å
204	E	67.4	Low	87.2	Confident	58 Å²	58	30 Å²	30	27%	0.271	15%	0.151	S	C	.	.			trans	-68.6	134.2	-177	-65.5	-158.7	141.5	0	0	111.4	P206 L208 K372	E204-P206 CarbonylContact C-O 3.53Å; E204-P206 CarbonylContact O-C 3.46Å; E204-L208 WeakPolarHBondContact OE2-CD2 3.43Å; E204-K372 IonicContact OE1-NZ 3.28Å; E204-K372 PolarHBondContact OE1-NZ 3.45Å; E204-K372 IonicContact OE2-NZ 3.19Å
205	R	74.9	Confident	87.2	Confident	152 Å²	152	30 Å²	30	57%	0.574	15%	0.151	S	C	*	.	S	Bend	trans	-123.7	126.1	166.3	-68.4	-161.5	-172.9	-178.2	8.6	109.4	C150 A154 V203	C150-R205 PolarHBondContact O-NH2 2.88Å; A154-R205 VanDerWaalsContact CB-NH2 3.29Å; V203-R205 PolarHBondContact O-N 3.22Å
206	P	79.5	Confident	87.2	Confident	66 Å²	66	31.8 Å²	31.8	43%	0.429	16%	0.159	S	C	.	.	S	Bend	cis	-62.6	153.7	0.1	29.9	-37.7	0	0	0	113	E204 F348 P350	E204-P206 CarbonylContact C-O 3.53Å; E204-P206 CarbonylContact O-C 3.46Å; P206-F348 HydrophobicContact CG-CE2 4.15Å; P206-P350 HydrophobicContact CB-CG 4.11Å; P206-P350 HydrophobicContact CG-CG 3.66Å
207	L	85.6	Confident	87.2	Confident	23 Å²	23	31.7 Å²	31.7	12%	0.12	16%	0.158	C	C	.	.			trans	-59.7	135.7	176.9	-71.5	170.7	0	0	0	109.8	D157 A158 T161 M197 Q202	D157-L207 HydrophobicContact CB-CD1 4.28Å; A158-L207 HydrophobicContact CB-CD1 4.05Å; A158-L207 HydrophobicContact CB-CD2 4.43Å; T161-L207 HydrophobicContact CG2-CB 4.31Å; M197-L207 HydrophobicContact CE-CB 3.7Å; M197-L207 HydrophobicContact CE-CD1 4.34Å; M197-L207 HydrophobicContact CE-CD2 3.96Å; M197-L207 HydrophobicContact CE-CG 4.21Å; Q202-L207 HydrophobicContact CB-CD2 3.85Å; Q202-L207 HydrophobicContact CG-CD2 4.36Å
208	L	87.2	Confident	87	Confident	25 Å²	25	31.7 Å²	31.7	13%	0.131	16%	0.158	C	C	.	.			trans	-124.8	120.9	-173.5	-172.7	63.5	0	0	0	110.2	E204 H210 P350 V352	E204-L208 WeakPolarHBondContact OE2-CD2 3.43Å; L208-H210 WeakPolarHBondContact CD2-NE2 3.32Å; L208-H210 WeakPolarHBondContact CG-NE2 2.89Å; L208-P350 HydrophobicContact CD1-CB 3.72Å; L208-P350 HydrophobicContact CD1-CG 3.97Å; L208-V352 HydrophobicContact CD1-CG2 4.09Å; L208-V352 HydrophobicContact CD2-CG2 4.39Å; L208-V352 HydrophobicContact CG-CG2 4.4Å
209	C	91	Very high	86.3	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	123.7	173.1	-67	0	0	0	0	109.6	V165 Y198 F351 V352	V165-C209 HydrophobicContact CB-CB 4.45Å; V165-C209 HydrophobicContact CG1-CB 3.89Å; Y198-C209 HydrophobicContact CE2-CB 4.46Å; C209-F351 HydrophobicContact CB-CB 4.06Å; C209-F351 CarbonylContact O-C 3.55Å; C209-F351 WeakPolarHBondContact O-CA 3.35Å; C209-V352 PolarHBondContact O-N 3.28Å
210	H	92.4	Very high	85.6	Confident	52 Å²	52	41.3 Å²	41.3	24%	0.241	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124	169.5	-69.8	-172.5	0	0	0	109.2	V194 L208	V194-H210 HydrophobicContact CG2-CB 3.96Å; V194-H210 PolarHBondContact N-O 2.96Å; L208-H210 WeakPolarHBondContact CD2-NE2 3.32Å; L208-H210 WeakPolarHBondContact CG-NE2 2.89Å
211	L	95.1	Very high	85.4	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	122.9	-176.6	-59.9	177.1	0	0	0	108.9	V165 V169 F191 I192 Y198 V352 L353 T354	V165-L211 HydrophobicContact CG1-CD1 4.15Å; V169-L211 HydrophobicContact CB-CD1 4.02Å; V169-L211 HydrophobicContact CG1-CD1 3.92Å; V169-L211 HydrophobicContact CG2-CD1 3.73Å; F191-L211 HydrophobicContact CB-CB 4.23Å; F191-L211 HydrophobicContact CD2-CD1 4.17Å; F191-L211 HydrophobicContact CD2-CD2 3.63Å; F191-L211 HydrophobicContact CD2-CG 4.34Å; F191-L211 HydrophobicContact CE2-CD2 4.08Å; F191-L211 HydrophobicContact CG-CD1 4.25Å; F191-L211 HydrophobicContact CG-CD2 4.37Å; I192-L211 WeakPolarHBondContact O-CA 3.21Å; Y198-L211 HydrophobicContact CE2-CD2 3.73Å; Y198-L211 WeakPolarHBondContact OH-CD2 3.48Å; L211-V352 PolarHBondContact N-O 3.23Å; L211-L353 HydrophobicContact CB-CD2 3.67Å; L211-L353 HydrophobicContact CD1-CD2 3.7Å; L211-L353 HydrophobicContact CG-CD2 4.22Å; L211-L353 WeakPolarHBondContact O-CA 3.43Å; L211-T354 PolarHBondContact O-N 3.48Å
212	F	95.1	Very high	85.3	Confident	9 Å²	9	39.8 Å²	39.8	4%	0.039	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	137	168.8	-74.4	-3.8	0	0	0	109.4	F191 I192 V194 T354 V356 Y365 S388 A390 V391	F191-F212 CarbonylContact C-O 3.59Å; F191-F212 WeakPolarHBondContact CA-O 3.44Å; F191-F212 WeakPolarHBondContact CB-O 3.3Å; I192-F212 HydrophobicContact CB-CB 4.32Å; I192-F212 PolarHBondContact N-O 3.46Å; I192-F212 PolarHBondContact O-N 3.32Å; V194-F212 HydrophobicContact CG1-CD2 4Å; V194-F212 HydrophobicContact CG1-CE2 4.15Å; V194-F212 HydrophobicContact CG1-CG 4.39Å; V194-F212 HydrophobicContact CG2-CD1 3.81Å; V194-F212 HydrophobicContact CG2-CD2 4.27Å; V194-F212 HydrophobicContact CG2-CE1 3.75Å; V194-F212 HydrophobicContact CG2-CE2 4.2Å; V194-F212 HydrophobicContact CG2-CG 4.09Å; V194-F212 HydrophobicContact CG2-CZ 3.94Å; F212-T354 CarbonylContact C-O 3.43Å; F212-T354 WeakPolarHBondContact CA-O 3.35Å; F212-V356 HydrophobicContact CB-CG1 4.03Å; F212-V356 HydrophobicContact CB-CG2 3.77Å; F212-V356 HydrophobicContact CD1-CG1 3.87Å; F212-V356 HydrophobicContact CD2-CG1 4.03Å; F212-V356 HydrophobicContact CD2-CG2 4.44Å; F212-V356 HydrophobicContact CE1-CG1 4.31Å; F212-V356 HydrophobicContact CE2-CG1 4.47Å; F212-V356 HydrophobicContact CG-CG1 3.71Å; F212-V356 HydrophobicContact CG-CG2 4.24Å; F212-Y365 HydrophobicContact CD2-CG 4.43Å; F212-S388 VanDerWaalsContact CE2-OG 3.3Å; F212-S388 WeakPolarHBondContact CE2-OG 3.33Å; F212-S388 VanDerWaalsContact CZ-OG 3.23Å; F212-S388 WeakPolarHBondContact CZ-OG 3.31Å; F212-A390 HydrophobicContact CE2-CB 4.15Å; F212-A390 HydrophobicContact CZ-CB 4.23Å; F212-V391 HydrophobicContact CD2-CG2 4.48Å
213	V	94.8	Very high	85.6	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	98.3	175.5	-160.4	0	0	0	0	107.7	L173 M188 F191 F309 L353 T354 P355 V356	L173-V213 HydrophobicContact CD1-CG1 3.72Å; L173-V213 HydrophobicContact CD1-CG2 4.47Å; L173-V213 HydrophobicContact CD2-CG1 3.76Å; L173-V213 HydrophobicContact CG-CG1 4.43Å; M188-V213 HydrophobicContact CB-CG1 4.35Å; M188-V213 HydrophobicContact CE-CB 3.58Å; M188-V213 HydrophobicContact CE-CG1 3.22Å; M188-V213 WeakPolarHBondContact CE-O 3.43Å; F191-V213 HydrophobicContact CB-CG2 4.31Å; V213-F309 HydrophobicContact CB-CZ 4.34Å; V213-F309 HydrophobicContact CG2-CZ 4.16Å; V213-L353 HydrophobicContact CG2-CB 4.43Å; V213-L353 HydrophobicContact CG2-CD2 4.31Å; V213-T354 PolarHBondContact N-O 2.93Å; V213-P355 WeakPolarHBondContact O-CA 3.34Å; V213-V356 PolarHBondContact O-N 2.96Å
214	P	94.9	Very high	86.5	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.013	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	145.5	177.6	-16.9	30.3	0	0	0	111.1	E189 D190 I192 V356 Y365	E189-P214 HydrophobicContact CB-CB 4.04Å; E189-P214 HydrophobicContact CB-CG 4.34Å; E189-P214 HydrophobicContact CG-CB 4.31Å; E189-P214 PolarHBondContact N-O 2.92Å; D190-P214 VanDerWaalsContact O-CD 3.25Å; D190-P214 WeakPolarHBondContact O-CD 3.41Å; I192-P214 HydrophobicContact CD1-CG 3.85Å; I192-P214 HydrophobicContact CG1-CG 4.46Å; P214-V356 VanDerWaalsContact CA-O 3.27Å; P214-V356 WeakPolarHBondContact CA-O 3.06Å; P214-V356 HydrophobicContact CB-CG2 4.25Å; P214-V356 HydrophobicContact CG-CG2 4.07Å; P214-Y365 HydrophobicContact CB-CE1 4.4Å; P214-Y365 HydrophobicContact CG-CE1 4Å
215	F	92.7	Very high	87.4	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.018	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	151	175.3	73	-85.8	0	0	0	112.1	M186 E187 M188 F223 V305 W308 P355 V356 I357 W385	M186-F215 HydrophobicContact CB-CD2 4.34Å; M186-F215 HydrophobicContact CG-CD2 4.48Å; M186-F215 HydrophobicContact SD-CD2 4.28Å; M186-F215 HydrophobicContact SD-CE2 4.39Å; E187-F215 CarbonylContact O-C 3.6Å; E187-F215 VanDerWaalsContact O-CA 3.23Å; E187-F215 WeakPolarHBondContact O-CA 3.4Å; E187-F215 WeakPolarHBondContact O-CB 3.45Å; M188-F215 HydrophobicContact CE-CB 3.8Å; M188-F215 HydrophobicContact SD-CB 3.33Å; M188-F215 WeakPolarHBondContact SD-CB 3.38Å; M188-F215 HydrophobicContact SD-CG 4.18Å; F215-F223 AromaticContact CD2-CE2 3.93Å; F215-F223 HydrophobicContact CD2-CE2 3.93Å; F215-F223 HydrophobicContact CD2-CZ 4.22Å; F215-F223 AromaticContact CE2-CE2 3.68Å; F215-F223 HydrophobicContact CE2-CE2 3.68Å; F215-F223 AromaticContact CE2-CZ 3.77Å; F215-F223 HydrophobicContact CE2-CZ 3.77Å; F215-F223 HydrophobicContact CZ-CE2 4.47Å; F215-V305 HydrophobicContact CE1-CG1 3.92Å; F215-V305 HydrophobicContact CE2-CG1 4.4Å; F215-V305 HydrophobicContact CZ-CG1 3.59Å; F215-V305 HydrophobicContact CZ-CG2 4.27Å; F215-W308 HydrophobicContact CD2-CZ3 4.46Å; F215-P355 HydrophobicContact CD1-CB 3.99Å; F215-P355 HydrophobicContact CE1-CB 3.92Å; F215-V356 WeakPolarHBondContact CD1-O 3.36Å; F215-V356 PolarHBondContact N-O 3.47Å; F215-V356 VanDerWaalsContact N-O 3.1Å; F215-I357 HydrophobicContact CD1-CG1 4.32Å; F215-I357 HydrophobicContact CE1-CD1 4.2Å; F215-I357 HydrophobicContact CE1-CG1 3.63Å; F215-I357 HydrophobicContact CE2-CD1 4.38Å; F215-I357 HydrophobicContact CE2-CG1 4.18Å; F215-I357 HydrophobicContact CZ-CD1 3.7Å; F215-I357 HydrophobicContact CZ-CG1 3.55Å; F215-W385 HydrophobicContact CZ-CH2 4.43Å
216	V	90.5	Very high	87.8	Confident	52 Å²	52	37.4 Å²	37.4	32%	0.315	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	149.8	-177.7	-62.7	0	0	0	0	110.3	M186 E187	M186-V216 WeakPolarHBondContact CA-O 3.21Å; E187-V216 HydrophobicContact CB-CG2 3.78Å; E187-V216 PolarHBondContact N-O 3.49Å; E187-V216 PolarHBondContact O-N 2.99Å
217	P	89.3	Confident	87.7	Confident	20 Å²	20	35.8 Å²	35.8	13%	0.13	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-73.9	156.1	179.5	30.9	-29.3	0	0	0	111.6	M186 F223	M186-P217 VanDerWaalsContact SD-CA 3.59Å; M186-P217 HydrophobicContact SD-CB 4.13Å; P217-F223 HydrophobicContact CB-CD1 4.12Å; P217-F223 HydrophobicContact CB-CE1 3.54Å; P217-F223 HydrophobicContact CB-CE2 4.27Å; P217-F223 HydrophobicContact CB-CZ 3.62Å; P217-F223 VanDerWaalsContact CD-CE2 3.44Å; P217-F223 HydrophobicContact CG-CD1 3.75Å; P217-F223 HydrophobicContact CG-CD2 4.12Å; P217-F223 HydrophobicContact CG-CE1 3.68Å; P217-F223 HydrophobicContact CG-CE2 4.06Å; P217-F223 HydrophobicContact CG-CG 3.97Å; P217-F223 HydrophobicContact CG-CZ 3.84Å
218	P	85.3	Confident	86.8	Confident	5 Å²	5	36.4 Å²	36.4	3%	0.032	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-64.8	148.5	172.8	27.9	-34.3	0	0	0	111	Y221 L291	P218-Y221 HydrophobicContact CG-CD2 4.47Å; P218-Y221 WeakPolarHBondContact O-CB 3.4Å; P218-Y221 WeakPolarHBondContact O-CD2 3.5Å; P218-Y221 PolarHBondContact O-N 3.4Å; P218-L291 HydrophobicContact CG-CD2 4.03Å
219	E	79	Confident	85.3	Confident	152 Å²	152	36.2 Å²	36.2	71%	0.71	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	140.3	171.3	-70.5	-175.5	-173.1	0	0	110.5
220	P	76.6	Confident	83.3	Confident	73 Å²	73	39.5 Å²	39.5	47%	0.474	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	cis	-99.2	25	8.9	40.1	-37.1	0	0	0	113.7	L248 A249	P220-L248 HydrophobicContact CG-CD1 3.76Å; P220-L248 HydrophobicContact CG-CG 4.18Å; P220-A249 WeakPolarHBondContact O-CB 3.37Å; P220-A249 PolarHBondContact O-N 3.41Å
221	Y	84	Confident	81.3	Confident	61 Å²	61	49 Å²	49	24%	0.239	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	157.6	-176.9	-59.4	-82.4	0	0	0	112	P218 V246 T247 L248 L291	P218-Y221 HydrophobicContact CG-CD2 4.47Å; P218-Y221 WeakPolarHBondContact O-CB 3.4Å; P218-Y221 WeakPolarHBondContact O-CD2 3.5Å; P218-Y221 PolarHBondContact O-N 3.4Å; Y221-V246 HydrophobicContact CD1-CG1 4.22Å; Y221-T247 CarbonylContact C-O 3.4Å; Y221-T247 WeakPolarHBondContact CA-O 3.36Å; Y221-L248 HydrophobicContact CD1-CD1 3.89Å; Y221-L248 HydrophobicContact CE1-CD1 3.59Å; Y221-L291 HydrophobicContact CD1-CD1 3.6Å; Y221-L291 HydrophobicContact CD2-CD1 3.95Å; Y221-L291 HydrophobicContact CD2-CD2 3.91Å; Y221-L291 HydrophobicContact CE1-CD1 3.46Å; Y221-L291 VanDerWaalsContact CE1-CD1 3.46Å; Y221-L291 HydrophobicContact CE2-CD1 3.83Å; Y221-L291 HydrophobicContact CE2-CD2 4.14Å; Y221-L291 HydrophobicContact CE2-CG 4.49Å; Y221-L291 HydrophobicContact CG-CD1 3.84Å; Y221-L291 HydrophobicContact CG-CD2 4.3Å
222	S	85	Confident	78.7	Confident	26 Å²	26	55.6 Å²	55.6	18%	0.182	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	147.2	174.4	55.7	0	0	0	0	111.4	T247	S222-T247 PolarHBondContact N-O 2.96Å; S222-T247 PolarHBondContact O-N 3.36Å; S222-T247 PolarHBondContact O-OG1 3.1Å; S222-T247 PolarHBondContact OG-OG1 2.95Å; S222-T247 VanDerWaalsContact OG-OG1 3.07Å
223	F	89.7	Confident	76.4	Confident	29 Å²	29	61.2 Å²	61.2	13%	0.127	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	129.5	170.7	-65.4	-24.9	0	0	0	110.1	M186 F215 P217 I244 V246 L300 I357	M186-F223 HydrophobicContact SD-CZ 3.97Å; F215-F223 AromaticContact CD2-CE2 3.93Å; F215-F223 HydrophobicContact CD2-CE2 3.93Å; F215-F223 HydrophobicContact CD2-CZ 4.22Å; F215-F223 AromaticContact CE2-CE2 3.68Å; F215-F223 HydrophobicContact CE2-CE2 3.68Å; F215-F223 AromaticContact CE2-CZ 3.77Å; F215-F223 HydrophobicContact CE2-CZ 3.77Å; F215-F223 HydrophobicContact CZ-CE2 4.47Å; P217-F223 HydrophobicContact CB-CD1 4.12Å; P217-F223 HydrophobicContact CB-CE1 3.54Å; P217-F223 HydrophobicContact CB-CE2 4.27Å; P217-F223 HydrophobicContact CB-CZ 3.62Å; P217-F223 VanDerWaalsContact CD-CE2 3.44Å; P217-F223 HydrophobicContact CG-CD1 3.75Å; P217-F223 HydrophobicContact CG-CD2 4.12Å; P217-F223 HydrophobicContact CG-CE1 3.68Å; P217-F223 HydrophobicContact CG-CE2 4.06Å; P217-F223 HydrophobicContact CG-CG 3.97Å; P217-F223 HydrophobicContact CG-CZ 3.84Å; F223-I244 HydrophobicContact CB-CG2 3.66Å; F223-I244 HydrophobicContact CD1-CG2 4.01Å; F223-I244 HydrophobicContact CG-CG2 3.86Å; F223-V246 HydrophobicContact CD1-CG2 3.95Å; F223-V246 HydrophobicContact CE1-CG2 3.91Å; F223-L300 HydrophobicContact CD1-CD1 3.97Å; F223-L300 HydrophobicContact CE1-CD1 3.62Å; F223-L300 HydrophobicContact CE1-CD2 4.11Å; F223-L300 HydrophobicContact CE1-CG 4.21Å; F223-L300 HydrophobicContact CE2-CD1 4.28Å; F223-L300 HydrophobicContact CG-CD1 4.45Å; F223-L300 HydrophobicContact CZ-CD1 3.8Å; F223-I357 HydrophobicContact CB-CG2 4.35Å; F223-I357 HydrophobicContact CD2-CD1 4.29Å; F223-I357 HydrophobicContact CD2-CG1 4.12Å; F223-I357 HydrophobicContact CD2-CG2 3.78Å; F223-I357 HydrophobicContact CE2-CD1 4.28Å; F223-I357 HydrophobicContact CE2-CG1 4.12Å; F223-I357 HydrophobicContact CG-CG2 4.43Å
224	H	86.9	Confident	74.3	Confident	89 Å²	89	64.4 Å²	64.4	41%	0.412	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	99.2	170.7	-66.4	-39.3	0	0	0	109.1	E226 K245 T247	H224-E226 PolarHBondContact O-N 3.44Å; H224-K245 HydrophobicContact CB-CB 4.4Å; H224-K245 PolarHBondContact N-O 2.82Å; H224-K245 PolarHBondContact O-N 3.44Å; H224-T247 PolarHBondContact CD2-OG1 3.44Å; H224-T247 PolarHBondContact NE2-OG1 3.36Å
225	P	86.5	Confident	72.3	Confident	18 Å²	18	67.4 Å²	67.4	12%	0.117	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	122.8	178.5	-8.6	24.6	0	0	0	111	I244 F366	P225-I244 HydrophobicContact CB-CG1 4.46Å; P225-F366 HydrophobicContact CB-CD2 3.95Å; P225-F366 HydrophobicContact CB-CE2 3.2Å; P225-F366 HydrophobicContact CB-CZ 3.61Å; P225-F366 HydrophobicContact CG-CE2 4.11Å
226	E	83.2	Confident	70.4	Confident	80 Å²	80	71.5 Å²	71.5	37%	0.374	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	109.9	177.1	-63.4	-179.5	-166.3	0	0	108.5	H224 G242 Q243 Y299	H224-E226 PolarHBondContact O-N 3.44Å; E226-G242 CarbonylContact O-C 3.58Å; E226-G242 WeakPolarHBondContact O-CA 3.32Å; E226-Q243 PolarHBondContact N-O 3.31Å; E226-Q243 PolarHBondContact O-N 3.27Å; E226-Y299 PolarHBondContact OE2-OH 2.96Å
227	F	76.2	Confident	68.8	Low	32 Å²	32	76.1 Å²	76.1	14%	0.14	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	148	-177.8	56	-84.1	0	0	0	113.1	C229 F366 L387 V498	F227-C229 VanDerWaalsContact C-N 3.34Å; F227-C229 HydrophobicContact CD2-CB 3.8Å; F227-C229 HydrophobicContact CE2-CB 4.06Å; F227-C229 PolarHBondContact O-N 3.44Å; F227-F366 HydrophobicContact CB-CE1 4.33Å; F227-F366 HydrophobicContact CB-CZ 4.01Å; F227-F366 HydrophobicContact CD1-CZ 4.47Å; F227-L387 HydrophobicContact CB-CD1 4.01Å; F227-V498 HydrophobicContact CD2-CG1 4.43Å; F227-V498 HydrophobicContact CE2-CB 3.58Å; F227-V498 HydrophobicContact CE2-CG1 3.36Å; F227-V498 HydrophobicContact CE2-CG2 4.4Å; F227-V498 HydrophobicContact CZ-CB 3.65Å; F227-V498 HydrophobicContact CZ-CG1 3.81Å; F227-V498 HydrophobicContact CZ-CG2 4.02Å
228	W	68.2	Low	67.4	Low	35 Å²	35	79.3 Å²	79.3	13%	0.133	40%	0.399	C	S	.	.	S	Bend	trans	-94.6	54	-169.7	-57.1	-30.1	0	0	0	113.1	M234 R238 Y241 Q243 D384	W228-M234 HydrophobicContact CB-CE 4.16Å; W228-M234 HydrophobicContact CB-CG 4.3Å; W228-M234 HydrophobicContact CD2-CE 3.53Å; W228-M234 HydrophobicContact CE3-CE 4.07Å; W228-M234 HydrophobicContact CG-CE 3.61Å; W228-M234 HydrophobicContact CZ2-CE 4.21Å; W228-R238 HydrophobicContact CE3-CB 3.59Å; W228-R238 HydrophobicContact CE3-CG 4.31Å; W228-R238 HydrophobicContact CZ3-CB 3.58Å; W228-R238 HydrophobicContact CZ3-CG 3.78Å; W228-Y241 WeakPolarHBondContact CB-O 3.47Å; W228-Y241 PolarHBondContact N-O 3.38Å; W228-Y241 VanDerWaalsContact N-O 3.1Å; W228-Q243 HydrophobicContact CH2-CG 4.12Å; W228-Q243 HydrophobicContact CZ2-CG 3.56Å; W228-D384 VanDerWaalsContact CH2-OD1 3.32Å; W228-D384 WeakPolarHBondContact CH2-OD1 3.36Å
229	C	54.3	Low	66.4	Low	22 Å²	22	81 Å²	81	15%	0.149	41%	0.407	C	S	.	.			trans	-104	-3.3	175.6	-68.1	0	0	0	0	113.9	F227 V498 A502	F227-C229 VanDerWaalsContact C-N 3.34Å; F227-C229 HydrophobicContact CD2-CB 3.8Å; F227-C229 HydrophobicContact CE2-CB 4.06Å; F227-C229 PolarHBondContact O-N 3.44Å; C229-V498 HydrophobicContact CB-CG1 4.3Å; C229-A502 HydrophobicContact CB-CB 3.96Å
230	S	48.9	Very low	66.1	Low	68 Å²	68	74.2 Å²	74.2	48%	0.476	38%	0.377	S	S	.	.	S	Bend	trans	-76.9	146.1	-179.7	-55.6	0	0	0	0	111.4	L232	S230-L232 PolarHBondContact O-N 3.27Å
231	R	49.9	Very low	66.3	Low	252 Å²	252	71.8 Å²	71.8	95%	0.951	36%	0.359	S	S	*	.	S	Bend	trans	-55.1	-2.7	178.6	-65.2	-174.2	-177.6	-164	-1.1	116
232	L	42.3	Very low	66.3	Low	138 Å²	138	68.9 Å²	68.9	72%	0.723	35%	0.347	S	S	*	.	S	Bend	trans	-74	137.9	-179.6	-67	168.9	0	0	0	109.2	S230 M234	S230-L232 PolarHBondContact O-N 3.27Å; L232-M234 VanDerWaalsContact C-N 3.34Å; L232-M234 WeakPolarHBondContact O-CG 3.4Å; L232-M234 PolarHBondContact O-N 3.34Å
233	S	45.9	Very low	66.4	Low	127 Å²	127	69.1 Å²	69.1	89%	0.888	35%	0.346	S	S	*	.			trans	-49.2	84.6	-172.2	-54.6	0	0	0	0	113.8
234	M	50.9	Low	66.5	Low	67 Å²	67	67.8 Å²	67.8	33%	0.33	34%	0.34	S	S	.	.			trans	-99.5	141.9	175.5	-71.8	-57.6	-66.1	0	0	110.2	W228 L232 L236	W228-M234 HydrophobicContact CB-CE 4.16Å; W228-M234 HydrophobicContact CB-CG 4.3Å; W228-M234 HydrophobicContact CD2-CE 3.53Å; W228-M234 HydrophobicContact CE3-CE 4.07Å; W228-M234 HydrophobicContact CG-CE 3.61Å; W228-M234 HydrophobicContact CZ2-CE 4.21Å; L232-M234 VanDerWaalsContact C-N 3.34Å; L232-M234 WeakPolarHBondContact O-CG 3.4Å; L232-M234 PolarHBondContact O-N 3.34Å; M234-L236 PolarHBondContact O-N 3.5Å; M234-L236 VanDerWaalsContact O-N 3.11Å
235	P	52.1	Low	66.6	Low	66 Å²	66	66.8 Å²	66.8	43%	0.429	33%	0.334	S	S	.	.			trans	-55.9	122.2	172	-20.6	31.3	0	0	0	108.5	E237 R238	P235-E237 PolarHBondContact O-N 3.32Å; P235-R238 WeakPolarHBondContact O-CB 3.32Å; P235-R238 PolarHBondContact O-N 3.4Å
236	L	54	Low	66.7	Low	90 Å²	90	66.3 Å²	66.3	47%	0.471	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-63.9	-16.3	-168.3	-63.6	115.8	0	0	0	114.2	M234 R238 R509	M234-L236 PolarHBondContact O-N 3.5Å; M234-L236 VanDerWaalsContact O-N 3.11Å; L236-R238 PolarHBondContact O-N 3.25Å; L236-R509 VanDerWaalsContact CB-NH1 3.31Å
237	E	55.8	Low	66.7	Low	149 Å²	149	64 Å²	64	70%	0.696	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-65.9	-21.1	172.1	-64.9	175.6	172	0	0	112.9	P235	P235-E237 PolarHBondContact O-N 3.32Å
238	R	60.7	Low	66.8	Low	86 Å²	86	67.6 Å²	67.6	33%	0.325	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-94.5	3.4	-176.6	-69.1	-176.2	179	-176.7	2.2	113.8	W228 P235 L236 G240 Y241	W228-R238 HydrophobicContact CE3-CB 3.59Å; W228-R238 HydrophobicContact CE3-CG 4.31Å; W228-R238 HydrophobicContact CZ3-CB 3.58Å; W228-R238 HydrophobicContact CZ3-CG 3.78Å; P235-R238 WeakPolarHBondContact O-CB 3.32Å; P235-R238 PolarHBondContact O-N 3.4Å; L236-R238 PolarHBondContact O-N 3.25Å; R238-G240 PolarHBondContact O-N 3.05Å; R238-Y241 WeakPolarHBondContact O-CB 3.31Å; R238-Y241 PolarHBondContact O-N 3.37Å; R238-Y241 VanDerWaalsContact O-N 3.12Å
239	Q	64.6	Low	66.8	Low	42 Å²	42	68 Å²	68	20%	0.196	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	130.4	179.6	-70.7	178.7	-22	0	0	111.7	R376 L505	Q239-R376 PolarHBondContact O-NH1 3.41Å; Q239-L505 HydrophobicContact CB-CD1 3.6Å
240	G	71.4	Confident	66.8	Low	9 Å²	9	73.8 Å²	73.8	9%	0.093	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	3.2	-175.5	0	0	0	0	0	115	R238 L387	R238-G240 PolarHBondContact O-N 3.05Å; G240-L387 WeakPolarHBondContact O-CB 3.38Å; G240-L387 PolarHBondContact O-N 3.07Å
241	Y	80.6	Confident	66.8	Low	22 Å²	22	72 Å²	72	9%	0.086	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	163.9	166.6	-68.7	-92.6	0	0	0	111.1	W228 R238 D384 W385 L386	W228-Y241 WeakPolarHBondContact CB-O 3.47Å; W228-Y241 PolarHBondContact N-O 3.38Å; W228-Y241 VanDerWaalsContact N-O 3.1Å; R238-Y241 WeakPolarHBondContact O-CB 3.31Å; R238-Y241 PolarHBondContact O-N 3.37Å; R238-Y241 VanDerWaalsContact O-N 3.12Å; Y241-D384 HydrophobicContact CD1-CB 4.04Å; Y241-W385 CarbonylContact C-O 3.46Å; Y241-W385 WeakPolarHBondContact CA-O 3.12Å; Y241-W385 WeakPolarHBondContact CD1-O 3.27Å; Y241-L386 HydrophobicContact CD1-CB 4.35Å; Y241-L386 HydrophobicContact CD1-CD1 4.46Å; Y241-L386 HydrophobicContact CE1-CB 4.19Å; Y241-L386 HydrophobicContact CE1-CD1 4.2Å
242	G	85.2	Confident	66.5	Low	0 Å²	0	66 Å²	66	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	-175.2	165.6	0	0	0	0	0	110.9	E226 W385	E226-G242 CarbonylContact O-C 3.58Å; E226-G242 WeakPolarHBondContact O-CA 3.32Å; G242-W385 PolarHBondContact N-O 2.74Å; G242-W385 PolarHBondContact O-N 2.93Å
243	Q	87.9	Confident	66.7	Low	31 Å²	31	63.5 Å²	63.5	15%	0.145	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	148.1	179	-55.6	-170.6	-44.1	0	0	108.6	E226 W228 Y299 T383 D384	E226-Q243 PolarHBondContact N-O 3.31Å; E226-Q243 PolarHBondContact O-N 3.27Å; W228-Q243 HydrophobicContact CH2-CG 4.12Å; W228-Q243 HydrophobicContact CZ2-CG 3.56Å; Q243-Y299 HydrophobicContact CB-CD1 3.58Å; Q243-Y299 HydrophobicContact CB-CE1 3.81Å; Q243-Y299 HydrophobicContact CB-CG 4.45Å; Q243-T383 WeakPolarHBondContact CG-O 3.26Å; Q243-T383 PolarHBondContact NE2-OG1 2.97Å; Q243-D384 PolarHBondContact NE2-OD1 3.45Å
244	I	90.4	Very high	66.9	Low	0 Å²	0	65 Å²	65	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	113.6	174.3	-61.2	101	0	0	0	108.4	F223 P225 Y299 L300 I357 F366 W385	F223-I244 HydrophobicContact CB-CG2 3.66Å; F223-I244 HydrophobicContact CD1-CG2 4.01Å; F223-I244 HydrophobicContact CG-CG2 3.86Å; P225-I244 HydrophobicContact CB-CG1 4.46Å; I244-Y299 CarbonylContact O-C 3.54Å; I244-Y299 VanDerWaalsContact O-CA 3.26Å; I244-Y299 WeakPolarHBondContact O-CA 3.48Å; I244-L300 HydrophobicContact CB-CB 4.38Å; I244-L300 HydrophobicContact CB-CD1 3.94Å; I244-L300 HydrophobicContact CB-CG 4.33Å; I244-L300 HydrophobicContact CG2-CD1 3.68Å; I244-L300 HydrophobicContact CG2-CG 4.22Å; I244-L300 PolarHBondContact O-N 2.78Å; I244-I357 HydrophobicContact CB-CD1 4.32Å; I244-I357 HydrophobicContact CD1-CD1 3.66Å; I244-I357 HydrophobicContact CG1-CD1 3.83Å; I244-I357 HydrophobicContact CG1-CG2 4.45Å; I244-I357 HydrophobicContact CG2-CD1 4.29Å; I244-F366 HydrophobicContact CD1-CB 3.9Å; I244-F366 HydrophobicContact CD1-CD1 4.23Å; I244-F366 HydrophobicContact CD1-CG 4.04Å; I244-F366 HydrophobicContact CG1-CG 4.41Å; I244-W385 HydrophobicContact CD1-CB 3.8Å; I244-W385 VanDerWaalsContact CD1-CD1 3.4Å; I244-W385 HydrophobicContact CD1-CD2 3.36Å; I244-W385 HydrophobicContact CD1-CE3 3.99Å; I244-W385 HydrophobicContact CD1-CG 3.24Å; I244-W385 HydrophobicContact CD1-CZ2 4.44Å
245	K	89.2	Confident	67	Low	69 Å²	69	64.9 Å²	64.9	30%	0.3	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	130.2	172.8	-167.1	177.3	-178.2	177.5	0	109.2	H224 T247 Y299	H224-K245 HydrophobicContact CB-CB 4.4Å; H224-K245 PolarHBondContact N-O 2.82Å; H224-K245 PolarHBondContact O-N 3.44Å; K245-T247 HydrophobicContact CD-CG2 4.23Å; K245-T247 HydrophobicContact CG-CG2 4.17Å; K245-Y299 HydrophobicContact CB-CD1 3.91Å; K245-Y299 HydrophobicContact CB-CE1 3.65Å; K245-Y299 HydrophobicContact CD-CE1 4.45Å; K245-Y299 HydrophobicContact CG-CD1 4.43Å; K245-Y299 HydrophobicContact CG-CE1 4.11Å
246	V	88.3	Confident	67.3	Low	7 Å²	7	63 Å²	63	4%	0.042	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	126.3	170	-171.3	0	0	0	0	108.3	Y221 F223 L291 C293 S298 L300	Y221-V246 HydrophobicContact CD1-CG1 4.22Å; F223-V246 HydrophobicContact CD1-CG2 3.95Å; F223-V246 HydrophobicContact CE1-CG2 3.91Å; V246-L291 HydrophobicContact CG1-CD1 4.21Å; V246-C293 WeakPolarHBondContact CG2-SG 3.5Å; V246-S298 PolarHBondContact N-O 3.41Å; V246-L300 HydrophobicContact CG2-CD1 4.4Å; V246-L300 HydrophobicContact CG2-CD2 3.49Å; V246-L300 VanDerWaalsContact CG2-CD2 3.49Å; V246-L300 HydrophobicContact CG2-CG 3.58Å
247	T	82.8	Confident	67.6	Low	32 Å²	32	63.5 Å²	63.5	20%	0.196	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	158.7	176.7	52.1	0	0	0	0	109.1	Y221 S222 H224 K245 A249	Y221-T247 CarbonylContact C-O 3.4Å; Y221-T247 WeakPolarHBondContact CA-O 3.36Å; S222-T247 PolarHBondContact N-O 2.96Å; S222-T247 PolarHBondContact O-N 3.36Å; S222-T247 PolarHBondContact O-OG1 3.1Å; S222-T247 PolarHBondContact OG-OG1 2.95Å; S222-T247 VanDerWaalsContact OG-OG1 3.07Å; H224-T247 PolarHBondContact CD2-OG1 3.44Å; H224-T247 PolarHBondContact NE2-OG1 3.36Å; K245-T247 HydrophobicContact CD-CG2 4.23Å; K245-T247 HydrophobicContact CG-CG2 4.17Å; T247-A249 PolarHBondContact O-N 3.33Å
248	L	78.8	Confident	67.9	Low	107 Å²	107	58.8 Å²	58.8	56%	0.56	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	129.1	159.7	-143.3	74.7	0	0	0	106.3	P220 Y221 D250	P220-L248 HydrophobicContact CG-CD1 3.76Å; P220-L248 HydrophobicContact CG-CG 4.18Å; Y221-L248 HydrophobicContact CD1-CD1 3.89Å; Y221-L248 HydrophobicContact CE1-CD1 3.59Å; L248-D250 PolarHBondContact O-N 3.49Å
249	A	67.6	Low	67.6	Low	45 Å²	45	58.5 Å²	58.5	37%	0.372	37%	0.367	S	S	.	.			trans	-54.3	112.4	169.1	0	0	0	0	0	106.2	P220 T247 G251	P220-A249 WeakPolarHBondContact O-CB 3.37Å; P220-A249 PolarHBondContact O-N 3.41Å; T247-A249 PolarHBondContact O-N 3.33Å; A249-G251 VanDerWaalsContact C-N 3.25Å; A249-G251 PolarHBondContact O-N 3.39Å
250	D	54.7	Low	67.2	Low	142 Å²	142	65.1 Å²	65.1	76%	0.759	40%	0.395	S	S	*	.			trans	-62.6	98.1	-176.5	-153.9	-1	0	0	0	105.6	L248 D252	L248-D250 PolarHBondContact O-N 3.49Å; D250-D252 PolarHBondContact O-N 3.1Å
251	G	48.7	Very low	66.3	Low	32 Å²	32	67.4 Å²	67.4	33%	0.33	41%	0.407	S	S	.	.			trans	-71.2	79.1	176.3	0	0	0	0	0	104.9	A249 S253	A249-G251 VanDerWaalsContact C-N 3.25Å; A249-G251 PolarHBondContact O-N 3.39Å; G251-S253 WeakPolarHBondContact O-CA 3.45Å; G251-S253 PolarHBondContact O-N 3.15Å; G251-S253 PolarHBondContact O-OG 2.8Å
252	D	44.1	Very low	65.1	Low	124 Å²	124	77 Å²	77	66%	0.663	45%	0.449	S	S	*	.			trans	-58.3	87.7	178.6	-126.4	-13.9	0	0	0	106.2	D250 L254	D250-D252 PolarHBondContact O-N 3.1Å; D252-L254 PolarHBondContact O-N 3.36Å
253	S	45.9	Very low	63.5	Low	86 Å²	86	82.3 Å²	82.3	60%	0.601	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	0.8	-164.7	-59.5	0	0	0	0	110.9	G251	G251-S253 WeakPolarHBondContact O-CA 3.45Å; G251-S253 PolarHBondContact O-N 3.15Å; G251-S253 PolarHBondContact O-OG 2.8Å
254	L	50.9	Low	61.9	Low	158 Å²	158	83.5 Å²	83.5	83%	0.827	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-21.8	-175.7	-83.3	93.1	0	0	0	113	D252	D252-L254 PolarHBondContact O-N 3.36Å
255	G	52.5	Low	60.4	Low	65 Å²	65	93 Å²	93	67%	0.67	54%	0.537	S	S	*	.	S	Bend	trans	-94.4	-40	-172.9	0	0	0	0	0	116	I257	G255-I257 PolarHBondContact O-N 3.37Å
256	C	59.3	Low	59	Low	26 Å²	26	97.5 Å²	97.5	18%	0.176	57%	0.565	C	S	.	*			trans	-78.1	123.6	-175	-166.2	0	0	0	0	112.1	C258 C269 L271 H272	C256-C258 HydrophobicContact CB-CB 3.97Å; C256-C258 WeakPolarHBondContact CB-SG 3.27Å; C256-C258 PolarHBondContact O-N 3.1Å; C256-C258 WeakPolarHBondContact SG-CB 3.49Å; C256-C258 PolarHBondContact SG-N 3.21Å; C256-C258 CovalentContact SG-SG 2.06Å; C256-C258 PolarHBondContact SG-SG 3.37Å; C256-C269 PolarHBondContact SG-SG 2.94Å; C256-L271 HydrophobicContact CB-CD1 4.36Å; C256-H272 WeakPolarHBondContact CB-CE1 3.34Å
257	I	60.1	Low	57.6	Low	102 Å²	102	103.6 Å²	103.6	52%	0.523	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-62	-5.2	168.8	58.3	172.1	0	0	0	114.3	G255 G259 K260 T261 F263	G255-I257 PolarHBondContact O-N 3.37Å; I257-G259 PolarHBondContact O-N 3.4Å; I257-G259 VanDerWaalsContact O-N 3.08Å; I257-K260 WeakPolarHBondContact O-CA 3.35Å; I257-K260 PolarHBondContact O-N 3.02Å; I257-T261 PolarHBondContact O-N 3.46Å; I257-T261 VanDerWaalsContact O-N 3.15Å; I257-T261 PolarHBondContact O-OG1 3.39Å; I257-F263 HydrophobicContact CD1-CE2 3.99Å
258	C	62.6	Low	56.4	Low	49 Å²	49	107.9 Å²	107.9	33%	0.331	62%	0.615	S	S	.	*	G	3₁₀ helix	trans	-45.9	-39.1	177.4	-59.1	0	0	0	0	114	C256 C269 H272	C256-C258 HydrophobicContact CB-CB 3.97Å; C256-C258 WeakPolarHBondContact CB-SG 3.27Å; C256-C258 PolarHBondContact O-N 3.1Å; C256-C258 WeakPolarHBondContact SG-CB 3.49Å; C256-C258 PolarHBondContact SG-N 3.21Å; C256-C258 CovalentContact SG-SG 2.06Å; C256-C258 PolarHBondContact SG-SG 3.37Å; C258-C269 VanDerWaalsContact SG-CB 3.57Å; C258-C269 PolarHBondContact SG-SG 3.11Å; C258-H272 VanDerWaalsContact SG-CE1 3.59Å; C258-H272 PolarHBondContact SG-ND1 3Å
259	G	54.8	Low	55.6	Low	80 Å²	80	104.6 Å²	104.6	83%	0.825	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-82	-14	177.9	0	0	0	0	0	114.7	I257	I257-G259 PolarHBondContact O-N 3.4Å; I257-G259 VanDerWaalsContact O-N 3.08Å
260	K	56.2	Low	55.4	Low	181 Å²	181	110.8 Å²	110.8	79%	0.787	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-18.9	-173.9	-64.8	-175.1	-178.3	174.4	0	113.6	I257	I257-K260 WeakPolarHBondContact O-CA 3.35Å; I257-K260 PolarHBondContact O-N 3.02Å
261	T	51.4	Low	55.4	Low	58 Å²	58	110.6 Å²	110.6	36%	0.356	63%	0.625	S	S	.	*			trans	-131.8	119.2	-175.6	39.2	0	0	0	0	110.8	I257 F263	I257-T261 PolarHBondContact O-N 3.46Å; I257-T261 VanDerWaalsContact O-N 3.15Å; I257-T261 PolarHBondContact O-OG1 3.39Å; T261-F263 VanDerWaalsContact CB-CE2 3.46Å; T261-F263 HydrophobicContact CG2-CE2 4.17Å; T261-F263 HydrophobicContact CG2-CZ 4.44Å; T261-F263 PolarHBondContact O-N 2.72Å; T261-F263 VanDerWaalsContact OG1-CD2 3.29Å; T261-F263 WeakPolarHBondContact OG1-CD2 3.39Å; T261-F263 WeakPolarHBondContact OG1-CE2 3.44Å
262	K	56.1	Low	55.7	Low	222 Å²	222	111.4 Å²	111.4	97%	0.965	62%	0.62	S	S	*	*			trans	-67.4	74.6	167.4	-66.2	-177.1	178.2	-177	0	109.2
263	F	51.3	Low	55.9	Low	113 Å²	113	108 Å²	108	50%	0.496	61%	0.614	S	S	.	*			trans	-70.2	137.1	165.5	-72.6	-70.7	0	0	0	108.1	I257 T261 M267	I257-F263 HydrophobicContact CD1-CE2 3.99Å; T261-F263 VanDerWaalsContact CB-CE2 3.46Å; T261-F263 HydrophobicContact CG2-CE2 4.17Å; T261-F263 HydrophobicContact CG2-CZ 4.44Å; T261-F263 PolarHBondContact O-N 2.72Å; T261-F263 VanDerWaalsContact OG1-CD2 3.29Å; T261-F263 WeakPolarHBondContact OG1-CD2 3.39Å; T261-F263 WeakPolarHBondContact OG1-CE2 3.44Å; F263-M267 HydrophobicContact CB-CB 4.05Å; F263-M267 HydrophobicContact CB-SD 4.1Å; F263-M267 HydrophobicContact CD1-SD 3.44Å; F263-M267 WeakPolarHBondContact CD1-SD 3.29Å; F263-M267 HydrophobicContact CE1-SD 4.02Å; F263-M267 HydrophobicContact CG-SD 3.85Å
264	G	53.6	Low	55.7	Low	56 Å²	56	114.6 Å²	114.6	58%	0.577	63%	0.626	S	S	*	*			trans	-55.1	159.5	177.5	0	0	0	0	0	111.4	D266 M267	G264-D266 PolarHBondContact O-N 3.02Å; G264-M267 PolarHBondContact O-N 3.15Å; G264-M267 VanDerWaalsContact O-N 3.12Å
265	E	58.5	Low	55.4	Low	198 Å²	198	114.1 Å²	114.1	93%	0.925	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	-10.4	-170.2	-59.8	179.7	176.4	0	0	114.8
266	D	59.9	Low	54.8	Low	165 Å²	165	117.2 Å²	117.2	88%	0.882	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-3.4	-179	-68.4	-29.3	0	0	0	115.5	G264	G264-D266 PolarHBondContact O-N 3.02Å
267	M	58.8	Low	53.6	Low	134 Å²	134	118.7 Å²	118.7	66%	0.66	64%	0.636	S	S	*	*			trans	-99.5	110	173.9	-82.8	-173.3	170.7	0	0	111.7	F263 G264	F263-M267 HydrophobicContact CB-CB 4.05Å; F263-M267 HydrophobicContact CB-SD 4.1Å; F263-M267 HydrophobicContact CD1-SD 3.44Å; F263-M267 WeakPolarHBondContact CD1-SD 3.29Å; F263-M267 HydrophobicContact CE1-SD 4.02Å; F263-M267 HydrophobicContact CG-SD 3.85Å; G264-M267 PolarHBondContact O-N 3.15Å; G264-M267 VanDerWaalsContact O-N 3.12Å
268	L	58.5	Low	52.4	Low	122 Å²	122	117.8 Å²	117.8	64%	0.639	64%	0.643	S	S	*	*			trans	-79.4	127.5	171.1	-62.5	172.7	0	0	0	109.6	L270 R274	L268-L270 PolarHBondContact O-N 2.96Å; L268-R274 HydrophobicContact CD2-CB 4.05Å
269	C	62.1	Low	51.1	Low	38 Å²	38	124.4 Å²	124.4	26%	0.257	66%	0.662	S	S	.	*	B	Isolated β-bridge	trans	-74.2	118.7	167	180	0	0	0	0	108.8	C256 C258 L271 H272	C256-C269 PolarHBondContact SG-SG 2.94Å; C258-C269 VanDerWaalsContact SG-CB 3.57Å; C258-C269 PolarHBondContact SG-SG 3.11Å; C269-L271 PolarHBondContact O-N 3.05Å; C269-L271 VanDerWaalsContact O-N 3.07Å; C269-L271 VanDerWaalsContact SG-CB 3.6Å; C269-L271 PolarHBondContact SG-N 3.02Å; C269-H272 HydrophobicContact CB-CB 3.99Å; C269-H272 CarbonylContact O-C 3.45Å; C269-H272 PolarHBondContact O-N 3.37Å; C269-H272 PolarHBondContact SG-N 3.34Å
270	L	62.5	Low	50.3	Low	176 Å²	176	125 Å²	125	92%	0.921	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-13.9	175.7	-59.7	178.3	0	0	0	113.2	L268	L268-L270 PolarHBondContact O-N 2.96Å
271	L	54.8	Low	49.1	Very low	138 Å²	138	127.1 Å²	127.1	72%	0.723	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-19.6	174.9	-54.5	173.6	0	0	0	113	C256 C269	C256-L271 HydrophobicContact CB-CD1 4.36Å; C269-L271 PolarHBondContact O-N 3.05Å; C269-L271 VanDerWaalsContact O-N 3.07Å; C269-L271 VanDerWaalsContact SG-CB 3.6Å; C269-L271 PolarHBondContact SG-N 3.02Å
272	H	55.4	Low	48.5	Very low	48 Å²	48	129.8 Å²	129.8	22%	0.222	68%	0.675	C	S	.	*	B	Isolated β-bridge	trans	-131.9	112	-176	-60.2	147	0	0	0	110.8	C256 C258 C269 R274 R276	C256-H272 WeakPolarHBondContact CB-CE1 3.34Å; C258-H272 VanDerWaalsContact SG-CE1 3.59Å; C258-H272 PolarHBondContact SG-ND1 3Å; C269-H272 HydrophobicContact CB-CB 3.99Å; C269-H272 CarbonylContact O-C 3.45Å; C269-H272 PolarHBondContact O-N 3.37Å; C269-H272 PolarHBondContact SG-N 3.34Å; H272-R274 PolarHBondContact O-N 3.42Å; H272-R276 PolarHBondContact CD2-NH2 3.33Å; H272-R276 PolarHBondContact NE2-NH2 3.49Å
273	G	48.8	Very low	47.3	Very low	52 Å²	52	122.8 Å²	122.8	54%	0.536	67%	0.665	S	S	.	*			trans	-51.6	138	168.9	0	0	0	0	0	111.6	N275	G273-N275 PolarHBondContact O-N 3.04Å; G273-N275 VanDerWaalsContact O-N 3.14Å
274	R	41.5	Very low	46.6	Very low	226 Å²	226	119.4 Å²	119.4	85%	0.853	66%	0.662	S	S	*	*	S	Bend	trans	-55.5	120.2	175.1	174.6	173	153.8	-147.5	-3.2	107.7	L268 H272	L268-R274 HydrophobicContact CD2-CB 4.05Å; H272-R274 PolarHBondContact O-N 3.42Å
275	N	43.8	Very low	46.3	Very low	148 Å²	148	121.7 Å²	121.7	79%	0.791	67%	0.67	S	S	*	*			trans	101.1	64.1	172.2	-140.4	24.8	0	0	0	116.7	G273 G277	G273-N275 PolarHBondContact O-N 3.04Å; G273-N275 VanDerWaalsContact O-N 3.14Å; N275-G277 PolarHBondContact O-N 3.08Å
276	R	40.7	Very low	45.9	Very low	129 Å²	129	117.4 Å²	117.4	49%	0.487	65%	0.653	S	S	.	*			trans	-68.3	37.6	154.3	-72.8	-174.1	-178.6	-117.1	7.1	112.1	H272 A278	H272-R276 PolarHBondContact CD2-NH2 3.33Å; H272-R276 PolarHBondContact NE2-NH2 3.49Å; R276-A278 PolarHBondContact O-N 2.9Å
277	G	34.5	Very low	45.6	Very low	58 Å²	58	112.9 Å²	112.9	60%	0.598	63%	0.627	S	S	*	*			trans	-93.7	33.5	-168.1	0	0	0	0	0	114.4	N275	N275-G277 PolarHBondContact O-N 3.08Å
278	A	35.1	Very low	45.3	Very low	82 Å²	82	109.5 Å²	109.5	68%	0.678	61%	0.61	S	S	*	*			trans	179.2	87	162.9	0	0	0	0	0	106.9	R276 P280	R276-A278 PolarHBondContact O-N 2.9Å; A278-P280 WeakPolarHBondContact O-CD 3.1Å
279	W	35.5	Very low	45.2	Very low	189 Å²	189	107 Å²	107	72%	0.716	60%	0.595	S	S	*	*			trans	-59.9	120.4	153.5	-79.8	26.6	0	0	0	106.1	R281	W279-R281 PolarHBondContact O-N 3.32Å
280	P	37.2	Very low	45.6	Very low	92 Å²	92	110.9 Å²	110.9	60%	0.597	61%	0.613	S	S	*	*			trans	-66.3	91.5	168.7	-12.7	28.9	0	0	0	106.4	A278 S282	A278-P280 WeakPolarHBondContact O-CD 3.1Å; P280-S282 PolarHBondContact O-N 3.36Å
281	R	31.7	Very low	46.1	Very low	226 Å²	226	103 Å²	103	85%	0.853	57%	0.572	S	S	*	*			trans	-68.5	118.7	170	-64.8	177.9	93.1	176.7	6.5	105.1	W279	W279-R281 PolarHBondContact O-N 3.32Å
282	S	37.6	Very low	47.5	Very low	114 Å²	114	97.4 Å²	97.4	80%	0.797	54%	0.543	S	S	*	.	S	Bend	trans	98.7	85.3	178.9	-57.8	0	0	0	0	114.4	P280 G284	P280-S282 PolarHBondContact O-N 3.36Å; S282-G284 PolarHBondContact O-N 3.26Å
283	G	32.6	Very low	48.9	Very low	74 Å²	74	95.1 Å²	95.1	76%	0.763	53%	0.532	S	S	*	.			trans	-56.5	119.8	170.5	0	0	0	0	0	112.1
284	G	36.6	Very low	50.5	Low	42 Å²	42	93.7 Å²	93.7	43%	0.433	51%	0.514	S	S	.	.			trans	-106.9	144.7	163.7	0	0	0	0	0	109	S282 N286 E287	S282-G284 PolarHBondContact O-N 3.26Å; G284-N286 PolarHBondContact O-N 3.25Å; G284-E287 PolarHBondContact O-N 3.44Å
285	S	45.5	Very low	52.1	Low	105 Å²	105	91.6 Å²	91.6	73%	0.734	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-18.8	174.9	53.4	0	0	0	0	114.8	M288	S285-M288 PolarHBondContact O-N 3.12Å
286	N	50.3	Low	53.5	Low	107 Å²	107	92.2 Å²	92.2	57%	0.572	50%	0.504	S	S	*	.	H	α-helix	trans	-65.3	-34.9	-179.2	-115.3	50.1	0	0	0	113.3	G284 M288 E289 D290	G284-N286 PolarHBondContact O-N 3.25Å; N286-M288 PolarHBondContact O-N 3.04Å; N286-E289 PolarHBondContact O-N 3.22Å; N286-D290 PolarHBondContact O-N 3.47Å
287	E	54.8	Low	55.4	Low	70 Å²	70	87.8 Å²	87.8	33%	0.327	49%	0.493	S	S	.	.	H	α-helix	trans	-63.1	-28.1	-178.9	-65.6	179.3	171.7	0	0	112	G284 D290 L291	G284-E287 PolarHBondContact O-N 3.44Å; E287-D290 WeakPolarHBondContact O-CB 3.34Å; E287-D290 PolarHBondContact O-N 3.26Å; E287-L291 PolarHBondContact O-N 2.68Å
288	M	52.8	Low	57.7	Low	64 Å²	64	86.6 Å²	86.6	32%	0.315	48%	0.476	S	S	.	.	H	α-helix	trans	-75.9	-35.8	-179.8	-163.6	65.7	94.1	0	0	111.7	S285 N286 D290 L291 C293	S285-M288 PolarHBondContact O-N 3.12Å; N286-M288 PolarHBondContact O-N 3.04Å; M288-D290 VanDerWaalsContact C-N 3.28Å; M288-L291 PolarHBondContact O-N 3.09Å; M288-C293 HydrophobicContact CG-CB 3.54Å; M288-C293 WeakPolarHBondContact O-CB 3.36Å; M288-C293 PolarHBondContact O-N 3.4Å; M288-C293 HydrophobicContact SD-CB 3.62Å; M288-C293 VanDerWaalsContact SD-SG 3.61Å
289	E	56.4	Low	60.3	Low	69 Å²	69	85 Å²	85	32%	0.322	45%	0.452	S	S	.	.	H	α-helix	trans	-64.7	-35.2	170.3	-76.9	-175.1	178.8	0	0	110.7	N286 L291 L292 R295	N286-E289 PolarHBondContact O-N 3.22Å; E289-L291 PolarHBondContact O-N 3.5Å; E289-L292 PolarHBondContact O-N 3.03Å; E289-L292 VanDerWaalsContact O-N 3.14Å; E289-R295 IonicContact OE1-CZ 2.81Å; E289-R295 VanDerWaalsContact OE1-CZ 3.28Å; E289-R295 IonicContact OE1-NE 2.66Å; E289-R295 PolarHBondContact OE1-NE 3.36Å; E289-R295 IonicContact OE1-NH2 3.11Å; E289-R295 PolarHBondContact OE1-NH2 3.18Å
290	D	69.5	Low	63	Low	120 Å²	120	76 Å²	76	64%	0.642	42%	0.418	S	S	*	.	H	α-helix	trans	-64.5	-25.1	175.9	-64.6	-30.6	0	0	0	112.4	N286 E287 M288	N286-D290 PolarHBondContact O-N 3.47Å; E287-D290 WeakPolarHBondContact O-CB 3.34Å; E287-D290 PolarHBondContact O-N 3.26Å; M288-D290 VanDerWaalsContact C-N 3.28Å
291	L	74.2	Confident	65.5	Low	11 Å²	11	72.2 Å²	72.2	6%	0.058	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	11.2	176.5	-65.6	171.1	0	0	0	114.3	M186 P218 Y221 V246 E287 M288 E289 C293 L300	M186-L291 HydrophobicContact CE-CB 4.42Å; M186-L291 HydrophobicContact CE-CD2 3.97Å; P218-L291 HydrophobicContact CG-CD2 4.03Å; Y221-L291 HydrophobicContact CD1-CD1 3.6Å; Y221-L291 HydrophobicContact CD2-CD1 3.95Å; Y221-L291 HydrophobicContact CD2-CD2 3.91Å; Y221-L291 HydrophobicContact CE1-CD1 3.46Å; Y221-L291 VanDerWaalsContact CE1-CD1 3.46Å; Y221-L291 HydrophobicContact CE2-CD1 3.83Å; Y221-L291 HydrophobicContact CE2-CD2 4.14Å; Y221-L291 HydrophobicContact CE2-CG 4.49Å; Y221-L291 HydrophobicContact CG-CD1 3.84Å; Y221-L291 HydrophobicContact CG-CD2 4.3Å; V246-L291 HydrophobicContact CG1-CD1 4.21Å; E287-L291 PolarHBondContact O-N 2.68Å; M288-L291 PolarHBondContact O-N 3.09Å; E289-L291 PolarHBondContact O-N 3.5Å; L291-C293 PolarHBondContact O-N 3.03Å; L291-L300 WeakPolarHBondContact O-CD2 3.42Å
292	L	82.7	Confident	68.1	Low	19 Å²	19	61.9 Å²	61.9	10%	0.099	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	19.7	176.1	-42.6	172.1	0	0	0	113.6	M186 E289 D301 Q304 V305 W308	M186-L292 HydrophobicContact CE-CD1 4.3Å; M186-L292 HydrophobicContact CE-CG 4.45Å; E289-L292 PolarHBondContact O-N 3.03Å; E289-L292 VanDerWaalsContact O-N 3.14Å; L292-D301 PolarHBondContact O-N 2.86Å; L292-Q304 HydrophobicContact CB-CB 4.01Å; L292-V305 HydrophobicContact CB-CG2 4.06Å; L292-V305 HydrophobicContact CD1-CG2 4.11Å; L292-W308 HydrophobicContact CD1-CB 3.63Å; L292-W308 HydrophobicContact CD1-CD2 3.68Å; L292-W308 HydrophobicContact CD1-CE3 3.87Å; L292-W308 HydrophobicContact CD1-CG 3.56Å; L292-W308 HydrophobicContact CD2-CB 3.67Å; L292-W308 HydrophobicContact CD2-CG 4.09Å; L292-W308 HydrophobicContact CG-CB 4.32Å; L292-W308 HydrophobicContact CG-CG 4.46Å
293	C	85.6	Confident	70.4	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-80.2	154.7	176.1	-73.2	0	0	0	0	111.6	V246 M288 L291 Y299 Q304	V246-C293 WeakPolarHBondContact CG2-SG 3.5Å; M288-C293 HydrophobicContact CG-CB 3.54Å; M288-C293 WeakPolarHBondContact O-CB 3.36Å; M288-C293 PolarHBondContact O-N 3.4Å; M288-C293 HydrophobicContact SD-CB 3.62Å; M288-C293 VanDerWaalsContact SD-SG 3.61Å; L291-C293 PolarHBondContact O-N 3.03Å; C293-Y299 WeakPolarHBondContact CA-O 3.27Å; C293-Q304 PolarHBondContact O-NE2 3.06Å
294	S	81.9	Confident	73	Confident	22 Å²	22	60.5 Å²	60.5	15%	0.154	32%	0.318	C	S	.	.			trans	-57.7	146	170.6	-176.3	0	0	0	0	111	E296 S297 Y299	S294-E296 PolarHBondContact O-N 3.27Å; S294-S297 WeakPolarHBondContact CB-OG 3.4Å; S294-S297 PolarHBondContact O-N 3.37Å; S294-Y299 PolarHBondContact N-O 3.36Å
295	R	74.3	Confident	75.5	Confident	183 Å²	183	58.5 Å²	58.5	69%	0.691	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-31.1	-172.5	-55.8	-178.1	90.4	-167.2	7.9	112.5	E289	E289-R295 IonicContact OE1-CZ 2.81Å; E289-R295 VanDerWaalsContact OE1-CZ 3.28Å; E289-R295 IonicContact OE1-NE 2.66Å; E289-R295 PolarHBondContact OE1-NE 3.36Å; E289-R295 IonicContact OE1-NH2 3.11Å; E289-R295 PolarHBondContact OE1-NH2 3.18Å
296	E	73.8	Confident	77.5	Confident	161 Å²	161	54.1 Å²	54.1	75%	0.752	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-0.1	-176.9	-56	78.8	-163.7	0	0	113.9	S294	S294-E296 PolarHBondContact O-N 3.27Å
297	S	80.1	Confident	79.2	Confident	36 Å²	36	56.1 Å²	56.1	25%	0.252	27%	0.269	S	S	.	.	S	Bend	trans	-146.3	157.5	-175.5	82.9	0	0	0	0	113.1	S294 Y299	S294-S297 WeakPolarHBondContact CB-OG 3.4Å; S294-S297 PolarHBondContact O-N 3.37Å; S297-Y299 PolarHBondContact O-N 3.4Å; S297-Y299 PolarHBondContact OG-N 3.43Å
298	S	84.6	Confident	80.8	Confident	33 Å²	33	55.2 Å²	55.2	23%	0.231	26%	0.263	C	S	.	.	S	Bend	trans	-83.9	23.9	173.7	71.7	0	0	0	0	112.5	V246	V246-S298 PolarHBondContact N-O 3.41Å
299	Y	89.6	Confident	82.5	Confident	48 Å²	48	52.1 Å²	52.1	19%	0.188	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-102.5	141.4	178.2	-67.5	-84.5	0	0	0	110.6	E226 Q243 I244 K245 C293 S294 S297 D301	E226-Y299 PolarHBondContact OE2-OH 2.96Å; Q243-Y299 HydrophobicContact CB-CD1 3.58Å; Q243-Y299 HydrophobicContact CB-CE1 3.81Å; Q243-Y299 HydrophobicContact CB-CG 4.45Å; I244-Y299 CarbonylContact O-C 3.54Å; I244-Y299 VanDerWaalsContact O-CA 3.26Å; I244-Y299 WeakPolarHBondContact O-CA 3.48Å; K245-Y299 HydrophobicContact CB-CD1 3.91Å; K245-Y299 HydrophobicContact CB-CE1 3.65Å; K245-Y299 HydrophobicContact CD-CE1 4.45Å; K245-Y299 HydrophobicContact CG-CD1 4.43Å; K245-Y299 HydrophobicContact CG-CE1 4.11Å; C293-Y299 WeakPolarHBondContact CA-O 3.27Å; S294-Y299 PolarHBondContact N-O 3.36Å; S297-Y299 PolarHBondContact O-N 3.4Å; S297-Y299 PolarHBondContact OG-N 3.43Å; Y299-D301 PolarHBondContact O-N 2.88Å
300	L	90.9	Very high	84	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-63.1	128.2	177.4	-72.5	179.3	0	0	0	111.3	F223 I244 V246 L291 I357 W385	F223-L300 HydrophobicContact CD1-CD1 3.97Å; F223-L300 HydrophobicContact CE1-CD1 3.62Å; F223-L300 HydrophobicContact CE1-CD2 4.11Å; F223-L300 HydrophobicContact CE1-CG 4.21Å; F223-L300 HydrophobicContact CE2-CD1 4.28Å; F223-L300 HydrophobicContact CG-CD1 4.45Å; F223-L300 HydrophobicContact CZ-CD1 3.8Å; I244-L300 HydrophobicContact CB-CB 4.38Å; I244-L300 HydrophobicContact CB-CD1 3.94Å; I244-L300 HydrophobicContact CB-CG 4.33Å; I244-L300 HydrophobicContact CG2-CD1 3.68Å; I244-L300 HydrophobicContact CG2-CG 4.22Å; I244-L300 PolarHBondContact O-N 2.78Å; V246-L300 HydrophobicContact CG2-CD1 4.4Å; V246-L300 HydrophobicContact CG2-CD2 3.49Å; V246-L300 VanDerWaalsContact CG2-CD2 3.49Å; V246-L300 HydrophobicContact CG2-CG 3.58Å; L291-L300 WeakPolarHBondContact O-CD2 3.42Å; L300-I357 HydrophobicContact CD1-CD1 3.42Å; L300-I357 VanDerWaalsContact CD1-CD1 3.42Å; L300-W385 HydrophobicContact CB-CZ2 4.03Å; L300-W385 PolarHBondContact O-NE1 2.62Å; L300-W385 VanDerWaalsContact O-NE1 3.12Å
301	D	89.2	Confident	84.9	Confident	13 Å²	13	49 Å²	49	7%	0.07	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-87.4	117.1	172.6	-176.3	-50.5	0	0	0	109.2	L292 Y299 M303 Q304 V305 N382	L292-D301 PolarHBondContact O-N 2.86Å; Y299-D301 PolarHBondContact O-N 2.88Å; D301-M303 VanDerWaalsContact C-N 3.25Å; D301-M303 PolarHBondContact O-N 3.38Å; D301-M303 WeakPolarHBondContact OD1-CA 3.2Å; D301-M303 VanDerWaalsContact OD1-CB 3.32Å; D301-M303 WeakPolarHBondContact OD1-CB 3.18Å; D301-M303 PolarHBondContact OD1-N 2.89Å; D301-Q304 HydrophobicContact CB-CB 4.02Å; D301-Q304 HydrophobicContact CB-CG 3.88Å; D301-Q304 PolarHBondContact O-N 3.14Å; D301-Q304 VanDerWaalsContact O-N 3.14Å; D301-Q304 PolarHBondContact OD1-N 3.21Å; D301-Q304 VanDerWaalsContact OD1-N 3.1Å; D301-V305 WeakPolarHBondContact O-CG2 3.45Å; D301-V305 PolarHBondContact O-N 3.43Å; D301-N382 WeakPolarHBondContact OD2-CB 3.35Å
302	A	87.8	Confident	85.7	Confident	9 Å²	9	49.1 Å²	49.1	7%	0.074	24%	0.236	C	C	.	.	H	α-helix	trans	-57.9	-35.9	-178.9	0	0	0	0	0	112.6	M306 N382 W385	A302-M306 VanDerWaalsContact O-CG 3.3Å; A302-M306 WeakPolarHBondContact O-CG 3.37Å; A302-M306 PolarHBondContact O-N 2.91Å; A302-N382 VanDerWaalsContact CB-O 3.27Å; A302-N382 WeakPolarHBondContact CB-O 3.29Å; A302-N382 PolarHBondContact N-O 2.85Å; A302-W385 HydrophobicContact CB-CZ2 4.12Å
303	M	85.3	Confident	86.1	Confident	109 Å²	109	48.4 Å²	48.4	54%	0.537	23%	0.233	S	C	.	.	H	α-helix	trans	-72.7	-37.6	178.1	-60.7	-165	-54	0	0	111.8	D301 M306 K307 N382	D301-M303 VanDerWaalsContact C-N 3.25Å; D301-M303 PolarHBondContact O-N 3.38Å; D301-M303 WeakPolarHBondContact OD1-CA 3.2Å; D301-M303 VanDerWaalsContact OD1-CB 3.32Å; D301-M303 WeakPolarHBondContact OD1-CB 3.18Å; D301-M303 PolarHBondContact OD1-N 2.89Å; M303-M306 PolarHBondContact O-N 2.89Å; M303-K307 WeakPolarHBondContact O-CB 3.49Å; M303-K307 PolarHBondContact O-N 2.89Å; M303-N382 HydrophobicContact CE-CB 4.36Å; M303-N382 VanDerWaalsContact CE-CG 3.45Å; M303-N382 WeakPolarHBondContact CE-ND2 3.08Å
304	Q	87.1	Confident	86.3	Confident	50 Å²	50	50.6 Å²	50.6	23%	0.234	25%	0.246	C	C	.	.	H	α-helix	trans	-64.8	-42.6	175	-67.1	-169.1	73	0	0	111.2	L292 C293 D301 K307 W308	L292-Q304 HydrophobicContact CB-CB 4.01Å; C293-Q304 PolarHBondContact O-NE2 3.06Å; D301-Q304 HydrophobicContact CB-CB 4.02Å; D301-Q304 HydrophobicContact CB-CG 3.88Å; D301-Q304 PolarHBondContact O-N 3.14Å; D301-Q304 VanDerWaalsContact O-N 3.14Å; D301-Q304 PolarHBondContact OD1-N 3.21Å; D301-Q304 VanDerWaalsContact OD1-N 3.1Å; Q304-K307 PolarHBondContact O-N 3.13Å; Q304-W308 WeakPolarHBondContact O-CB 3.32Å; Q304-W308 PolarHBondContact O-N 3.45Å
305	V	89.4	Confident	86.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.9	-47.3	173.3	176.9	0	0	0	0	111.3	F215 L292 D301 K307 W308 F309 P355 W385	F215-V305 HydrophobicContact CE1-CG1 3.92Å; F215-V305 HydrophobicContact CE2-CG1 4.4Å; F215-V305 HydrophobicContact CZ-CG1 3.59Å; F215-V305 HydrophobicContact CZ-CG2 4.27Å; L292-V305 HydrophobicContact CB-CG2 4.06Å; L292-V305 HydrophobicContact CD1-CG2 4.11Å; D301-V305 WeakPolarHBondContact O-CG2 3.45Å; D301-V305 PolarHBondContact O-N 3.43Å; V305-K307 PolarHBondContact O-N 3.46Å; V305-W308 HydrophobicContact CG1-CE3 4.31Å; V305-W308 PolarHBondContact O-N 3.26Å; V305-F309 VanDerWaalsContact O-CB 3.29Å; V305-F309 WeakPolarHBondContact O-CB 3.11Å; V305-F309 PolarHBondContact O-N 3.34Å; V305-P355 HydrophobicContact CG1-CB 4.37Å; V305-P355 HydrophobicContact CG1-CG 4.24Å; V305-W385 HydrophobicContact CB-CH2 3.96Å; V305-W385 HydrophobicContact CB-CZ2 4.26Å; V305-W385 HydrophobicContact CG1-CH2 3.97Å; V305-W385 HydrophobicContact CG2-CH2 3.95Å; V305-W385 HydrophobicContact CG2-CZ2 3.89Å
306	M	87	Confident	87.6	Confident	12 Å²	12	46.7 Å²	46.7	6%	0.059	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-42.4	178.3	-71.8	-46.8	-59	0	0	112.4	A302 M303 F309 Q310 P336 P355 S368	A302-M306 VanDerWaalsContact O-CG 3.3Å; A302-M306 WeakPolarHBondContact O-CG 3.37Å; A302-M306 PolarHBondContact O-N 2.91Å; M303-M306 PolarHBondContact O-N 2.89Å; M306-F309 PolarHBondContact O-N 2.76Å; M306-Q310 WeakPolarHBondContact O-CB 3.36Å; M306-Q310 WeakPolarHBondContact O-CG 3.29Å; M306-Q310 PolarHBondContact O-N 3.39Å; M306-P336 HydrophobicContact CB-CB 4.05Å; M306-P336 HydrophobicContact CB-CG 4.03Å; M306-P336 HydrophobicContact CE-CB 3.55Å; M306-P336 HydrophobicContact CE-CG 3.64Å; M306-P336 HydrophobicContact CG-CB 4.27Å; M306-P336 HydrophobicContact CG-CG 3.79Å; M306-P336 HydrophobicContact SD-CG 4.38Å; M306-P355 HydrophobicContact CE-CG 4.13Å; M306-P355 HydrophobicContact SD-CG 3.45Å; M306-P355 WeakPolarHBondContact SD-CG 3.4Å; M306-S368 PolarHBondContact SD-OG 3.43Å
307	K	86	Confident	88.6	Confident	149 Å²	149	40.1 Å²	40.1	65%	0.648	20%	0.2	S	C	*	.	H	α-helix	trans	-64.4	-43.5	178.3	-176.9	-178.3	178.4	-174.4	0	111.9	M303 Q304 V305 T311	M303-K307 WeakPolarHBondContact O-CB 3.49Å; M303-K307 PolarHBondContact O-N 2.89Å; Q304-K307 PolarHBondContact O-N 3.13Å; V305-K307 PolarHBondContact O-N 3.46Å; K307-T311 WeakPolarHBondContact O-CB 3.42Å; K307-T311 PolarHBondContact O-N 3Å; K307-T311 PolarHBondContact O-OG1 2.84Å
308	W	88.3	Confident	89.2	Confident	51 Å²	51	44.7 Å²	44.7	19%	0.193	22%	0.217	C	C	.	.	H	α-helix	trans	-59.7	-50.2	174.1	162.9	81.7	0	0	0	110.5	M186 M188 F215 L292 Q304 V305 Q310 T311 A312	M186-W308 HydrophobicContact CB-CH2 3.59Å; M186-W308 HydrophobicContact CB-CZ2 3.54Å; M186-W308 HydrophobicContact CG-CH2 4.04Å; M186-W308 HydrophobicContact CG-CZ2 3.9Å; M188-W308 HydrophobicContact CG-CH2 4.49Å; M188-W308 HydrophobicContact SD-CH2 3.44Å; M188-W308 WeakPolarHBondContact SD-CH2 3.32Å; M188-W308 HydrophobicContact SD-CZ2 4.48Å; M188-W308 HydrophobicContact SD-CZ3 3.99Å; F215-W308 HydrophobicContact CD2-CZ3 4.46Å; L292-W308 HydrophobicContact CD1-CB 3.63Å; L292-W308 HydrophobicContact CD1-CD2 3.68Å; L292-W308 HydrophobicContact CD1-CE3 3.87Å; L292-W308 HydrophobicContact CD1-CG 3.56Å; L292-W308 HydrophobicContact CD2-CB 3.67Å; L292-W308 HydrophobicContact CD2-CG 4.09Å; L292-W308 HydrophobicContact CG-CB 4.32Å; L292-W308 HydrophobicContact CG-CG 4.46Å; Q304-W308 WeakPolarHBondContact O-CB 3.32Å; Q304-W308 PolarHBondContact O-N 3.45Å; V305-W308 HydrophobicContact CG1-CE3 4.31Å; V305-W308 PolarHBondContact O-N 3.26Å; W308-Q310 PolarHBondContact O-N 3.25Å; W308-T311 WeakPolarHBondContact O-CB 3.29Å; W308-T311 PolarHBondContact O-N 3.17Å; W308-T311 VanDerWaalsContact O-N 3.11Å; W308-A312 WeakPolarHBondContact O-CB 3.42Å; W308-A312 PolarHBondContact O-N 3.44Å
309	F	89.7	Confident	89.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-45.6	-177.9	-172.3	-117.4	0	0	0	111.7	M188 V213 V305 M306 T311 A312 L313 L353 P355	M188-F309 HydrophobicContact CE-CD2 4.07Å; M188-F309 HydrophobicContact CE-CE2 3.51Å; M188-F309 HydrophobicContact CE-CZ 4.38Å; M188-F309 HydrophobicContact SD-CD2 4.36Å; M188-F309 HydrophobicContact SD-CE2 4.24Å; V213-F309 HydrophobicContact CB-CZ 4.34Å; V213-F309 HydrophobicContact CG2-CZ 4.16Å; V305-F309 VanDerWaalsContact O-CB 3.29Å; V305-F309 WeakPolarHBondContact O-CB 3.11Å; V305-F309 PolarHBondContact O-N 3.34Å; M306-F309 PolarHBondContact O-N 2.76Å; F309-T311 PolarHBondContact O-N 2.73Å; F309-A312 PolarHBondContact O-N 2.81Å; F309-L313 HydrophobicContact CD1-CD1 3.77Å; F309-L313 HydrophobicContact CD1-CG 4.39Å; F309-L313 HydrophobicContact CE1-CD1 3.44Å; F309-L313 VanDerWaalsContact CE1-CD1 3.44Å; F309-L313 HydrophobicContact CE1-CG 4.16Å; F309-L313 HydrophobicContact CE2-CD1 4.38Å; F309-L313 HydrophobicContact CE2-CD2 4.3Å; F309-L313 HydrophobicContact CE2-CG 4.23Å; F309-L313 HydrophobicContact CG-CD1 4.4Å; F309-L313 HydrophobicContact CZ-CD1 3.78Å; F309-L313 HydrophobicContact CZ-CD2 4.11Å; F309-L313 HydrophobicContact CZ-CG 4.07Å; F309-L313 WeakPolarHBondContact O-CB 3.16Å; F309-L313 VanDerWaalsContact O-CG 3.29Å; F309-L313 WeakPolarHBondContact O-CG 3.47Å; F309-L313 PolarHBondContact O-N 3.31Å; F309-L353 HydrophobicContact CE1-CB 3.94Å; F309-L353 HydrophobicContact CZ-CB 4.15Å; F309-P355 HydrophobicContact CB-CB 4.4Å; F309-P355 HydrophobicContact CB-CG 4.08Å; F309-P355 HydrophobicContact CD1-CB 4.1Å; F309-P355 HydrophobicContact CD1-CG 3.72Å; F309-P355 HydrophobicContact CD2-CB 4.03Å; F309-P355 HydrophobicContact CD2-CG 4.45Å; F309-P355 HydrophobicContact CE1-CB 4.35Å; F309-P355 HydrophobicContact CE1-CG 4.23Å; F309-P355 HydrophobicContact CE2-CB 4.33Å; F309-P355 HydrophobicContact CG-CB 3.92Å; F309-P355 HydrophobicContact CG-CG 3.83Å; F309-P355 HydrophobicContact CZ-CB 4.46Å
310	Q	87.7	Confident	89.8	Confident	57 Å²	57	49.2 Å²	49.2	27%	0.266	23%	0.229	S	C	.	.	H	α-helix	trans	-59.7	-43.3	174.1	-75.1	-177.5	-19.8	0	0	112.9	M306 W308 A312 T314 P336	M306-Q310 WeakPolarHBondContact O-CB 3.36Å; M306-Q310 WeakPolarHBondContact O-CG 3.29Å; M306-Q310 PolarHBondContact O-N 3.39Å; W308-Q310 PolarHBondContact O-N 3.25Å; Q310-A312 VanDerWaalsContact C-N 3.33Å; Q310-T314 WeakPolarHBondContact O-CB 3.49Å; Q310-T314 PolarHBondContact O-N 3.42Å; Q310-T314 PolarHBondContact O-OG1 3.27Å; Q310-P336 WeakPolarHBondContact CG-O 3.43Å; Q310-P336 PolarHBondContact NE2-O 3.14Å
311	T	88.4	Confident	89.9	Confident	67 Å²	67	51.2 Å²	51.2	41%	0.411	24%	0.243	S	C	.	.	H	α-helix	trans	-64.3	-41.9	178.3	-57.8	0	0	0	0	110.7	K307 W308 F309 T314 K315	K307-T311 WeakPolarHBondContact O-CB 3.42Å; K307-T311 PolarHBondContact O-N 3Å; K307-T311 PolarHBondContact O-OG1 2.84Å; W308-T311 WeakPolarHBondContact O-CB 3.29Å; W308-T311 PolarHBondContact O-N 3.17Å; W308-T311 VanDerWaalsContact O-N 3.11Å; F309-T311 PolarHBondContact O-N 2.73Å; T311-T314 WeakPolarHBondContact O-CB 3.28Å; T311-T314 PolarHBondContact O-N 2.95Å; T311-K315 WeakPolarHBondContact O-CG 3.36Å; T311-K315 PolarHBondContact O-N 3.36Å
312	A	90.1	Very high	90	Very high	13 Å²	13	57.7 Å²	57.7	11%	0.107	27%	0.272	C	S	.	.	H	α-helix	trans	-66.5	-47.6	179.5	0	0	0	0	0	110.8	L176 W308 F309 Q310 T314 K315 A316	L176-A312 HydrophobicContact CD1-CB 3.51Å; L176-A312 VanDerWaalsContact CD1-O 3.23Å; L176-A312 WeakPolarHBondContact CD1-O 2.84Å; W308-A312 WeakPolarHBondContact O-CB 3.42Å; W308-A312 PolarHBondContact O-N 3.44Å; F309-A312 PolarHBondContact O-N 2.81Å; Q310-A312 VanDerWaalsContact C-N 3.33Å; A312-T314 VanDerWaalsContact C-N 3.29Å; A312-T314 PolarHBondContact O-N 3.26Å; A312-K315 WeakPolarHBondContact O-CB 3.4Å; A312-K315 PolarHBondContact O-N 3.1Å; A312-K315 VanDerWaalsContact O-N 3.13Å; A312-A316 PolarHBondContact O-N 3.11Å
313	L	91.1	Very high	90.3	Very high	3 Å²	3	62.9 Å²	62.9	2%	0.016	29%	0.293	C	S	.	.	H	α-helix	trans	-58.3	-39.6	173.2	-71.6	177.1	0	0	0	112.3	L172 F309 A316 W317 F330 L339 L353	L172-L313 HydrophobicContact CD2-CD2 3.83Å; L172-L313 HydrophobicContact CG-CD2 4.13Å; F309-L313 HydrophobicContact CD1-CD1 3.77Å; F309-L313 HydrophobicContact CD1-CG 4.39Å; F309-L313 HydrophobicContact CE1-CD1 3.44Å; F309-L313 VanDerWaalsContact CE1-CD1 3.44Å; F309-L313 HydrophobicContact CE1-CG 4.16Å; F309-L313 HydrophobicContact CE2-CD1 4.38Å; F309-L313 HydrophobicContact CE2-CD2 4.3Å; F309-L313 HydrophobicContact CE2-CG 4.23Å; F309-L313 HydrophobicContact CG-CD1 4.4Å; F309-L313 HydrophobicContact CZ-CD1 3.78Å; F309-L313 HydrophobicContact CZ-CD2 4.11Å; F309-L313 HydrophobicContact CZ-CG 4.07Å; F309-L313 WeakPolarHBondContact O-CB 3.16Å; F309-L313 VanDerWaalsContact O-CG 3.29Å; F309-L313 WeakPolarHBondContact O-CG 3.47Å; F309-L313 PolarHBondContact O-N 3.31Å; L313-A316 PolarHBondContact O-N 3.14Å; L313-W317 WeakPolarHBondContact O-CB 3.29Å; L313-W317 PolarHBondContact O-N 3Å; L313-F330 HydrophobicContact CB-CE1 3.97Å; L313-F330 HydrophobicContact CB-CZ 4.19Å; L313-L339 HydrophobicContact CD1-CD1 4.13Å; L313-L353 HydrophobicContact CD1-CD1 4.19Å; L313-L353 HydrophobicContact CD2-CD1 3.99Å
314	T	90.2	Very high	90.6	Very high	47 Å²	47	60.1 Å²	60.1	29%	0.288	28%	0.277	S	S	.	.	H	α-helix	trans	-61.7	-46.2	176	-59.5	0	0	0	0	110.7	Q310 T311 A312 W317 H318 F330	Q310-T314 WeakPolarHBondContact O-CB 3.49Å; Q310-T314 PolarHBondContact O-N 3.42Å; Q310-T314 PolarHBondContact O-OG1 3.27Å; T311-T314 WeakPolarHBondContact O-CB 3.28Å; T311-T314 PolarHBondContact O-N 2.95Å; A312-T314 VanDerWaalsContact C-N 3.29Å; A312-T314 PolarHBondContact O-N 3.26Å; T314-W317 PolarHBondContact O-N 2.93Å; T314-H318 PolarHBondContact O-N 2.82Å; T314-H318 VanDerWaalsContact O-N 3.1Å; T314-H318 PolarHBondContact O-ND1 2.87Å; T314-F330 WeakPolarHBondContact OG1-CE2 3.38Å; T314-F330 WeakPolarHBondContact OG1-CZ 3.38Å
315	K	91.2	Very high	90.8	Very high	122 Å²	122	64.8 Å²	64.8	53%	0.53	30%	0.299	S	S	.	.	H	α-helix	trans	-62.9	-42.7	176.9	-70.2	173	-179.7	177.6	0	111.9	I179 T311 A312 H318 R319	I179-K315 HydrophobicContact CD1-CB 4.19Å; T311-K315 WeakPolarHBondContact O-CG 3.36Å; T311-K315 PolarHBondContact O-N 3.36Å; A312-K315 WeakPolarHBondContact O-CB 3.4Å; A312-K315 PolarHBondContact O-N 3.1Å; A312-K315 VanDerWaalsContact O-N 3.13Å; K315-H318 PolarHBondContact O-N 2.86Å; K315-R319 PolarHBondContact O-N 3.48Å
316	A	92.3	Very high	91	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.3	-46	176.5	0	0	0	0	0	111.4	L172 A175 L176 I179 A312 L313 H318 R319 I320	L172-A316 HydrophobicContact CD1-CB 3.76Å; A175-A316 HydrophobicContact CB-CB 4.19Å; L176-A316 HydrophobicContact CB-CB 4Å; L176-A316 HydrophobicContact CD1-CB 3.86Å; I179-A316 HydrophobicContact CD1-CB 4.39Å; A312-A316 PolarHBondContact O-N 3.11Å; L313-A316 PolarHBondContact O-N 3.14Å; A316-H318 PolarHBondContact O-N 3.29Å; A316-R319 WeakPolarHBondContact O-CB 3.28Å; A316-R319 PolarHBondContact O-N 3.11Å; A316-I320 PolarHBondContact O-N 3.38Å
317	W	94	Very high	91.2	Very high	24 Å²	24	69.9 Å²	69.9	9%	0.091	33%	0.326	C	S	.	.	H	α-helix	trans	-57.8	-44.4	175.8	172.5	-119.2	0	0	0	112.4	F168 L172 L313 T314 R319 I320 S321 Y324 F326 L328	F168-W317 HydrophobicContact CE2-CE3 4.11Å; F168-W317 AromaticContact CE2-CZ3 3.8Å; F168-W317 HydrophobicContact CE2-CZ3 3.8Å; F168-W317 HydrophobicContact CZ-CE3 4.14Å; F168-W317 HydrophobicContact CZ-CZ3 4.13Å; L172-W317 HydrophobicContact CD1-CB 4.22Å; L313-W317 WeakPolarHBondContact O-CB 3.29Å; L313-W317 PolarHBondContact O-N 3Å; T314-W317 PolarHBondContact O-N 2.93Å; W317-R319 PolarHBondContact O-N 3.45Å; W317-R319 VanDerWaalsContact O-N 3.15Å; W317-I320 HydrophobicContact CE3-CD1 4.44Å; W317-I320 HydrophobicContact CE3-CG1 4.05Å; W317-I320 HydrophobicContact CZ3-CG1 4.46Å; W317-I320 PolarHBondContact O-N 3.2Å; W317-I320 VanDerWaalsContact O-N 3.14Å; W317-S321 WeakPolarHBondContact O-CA 3.39Å; W317-S321 VanDerWaalsContact O-CB 3.23Å; W317-S321 WeakPolarHBondContact O-CB 3.47Å; W317-S321 PolarHBondContact O-N 3.09Å; W317-Y324 HydrophobicContact CZ3-CD2 4.16Å; W317-F326 HydrophobicContact CH2-CD2 4.06Å; W317-F326 HydrophobicContact CH2-CE2 4.03Å; W317-F326 VanDerWaalsContact CH2-O 3.29Å; W317-F326 WeakPolarHBondContact CH2-O 3.34Å; W317-F326 WeakPolarHBondContact CZ2-O 3.29Å; W317-F326 HydrophobicContact CZ3-CE2 4.1Å; W317-L328 HydrophobicContact CB-CD2 4.01Å; W317-L328 HydrophobicContact CD2-CB 3.65Å; W317-L328 HydrophobicContact CD2-CD2 4.14Å; W317-L328 HydrophobicContact CE3-CB 4.1Å; W317-L328 HydrophobicContact CE3-CD2 4.39Å; W317-L328 HydrophobicContact CG-CB 4Å; W317-L328 HydrophobicContact CG-CD2 3.96Å; W317-L328 HydrophobicContact CH2-CB 4.45Å; W317-L328 HydrophobicContact CZ2-CB 4.05Å; W317-L328 HydrophobicContact CZ3-CB 4.48Å
318	H	93.5	Very high	91.5	Very high	132 Å²	132	63.5 Å²	63.5	61%	0.611	30%	0.299	S	S	*	.	H	α-helix	trans	-58.5	-30.6	177.2	-76.4	83.5	0	0	0	112.6	T314 K315 A316 S321	T314-H318 PolarHBondContact O-N 2.82Å; T314-H318 VanDerWaalsContact O-N 3.1Å; T314-H318 PolarHBondContact O-ND1 2.87Å; K315-H318 PolarHBondContact O-N 2.86Å; A316-H318 PolarHBondContact O-N 3.29Å; H318-S321 PolarHBondContact O-OG 3.06Å
319	R	92.4	Very high	91.4	Very high	168 Å²	168	62.4 Å²	62.4	63%	0.634	30%	0.301	S	S	*	.	H	α-helix	trans	-71.4	-42.8	176.1	-68.6	-65.7	-168.8	163.9	2.4	112.8	I179 K315 A316 W317 H322	I179-R319 HydrophobicContact CD1-CG 3.95Å; I179-R319 HydrophobicContact CG1-CG 4.4Å; K315-R319 PolarHBondContact O-N 3.48Å; A316-R319 WeakPolarHBondContact O-CB 3.28Å; A316-R319 PolarHBondContact O-N 3.11Å; W317-R319 PolarHBondContact O-N 3.45Å; W317-R319 VanDerWaalsContact O-N 3.15Å; R319-H322 PolarHBondContact O-CE1 3.37Å; R319-H322 PolarHBondContact O-ND1 3.29Å
320	I	94	Very high	90.9	Very high	8 Å²	8	65.6 Å²	65.6	4%	0.041	32%	0.315	C	S	.	.	H	α-helix	trans	-100.1	-7.1	-173.6	61.7	167.9	0	0	0	114.5	F168 D171 L172 A175 A316 W317 H322 K323 Y324	F168-I320 HydrophobicContact CE2-CD1 4.22Å; D171-I320 HydrophobicContact CB-CD1 4.24Å; L172-I320 HydrophobicContact CB-CD1 4.05Å; L172-I320 HydrophobicContact CD1-CD1 3.91Å; L172-I320 HydrophobicContact CD1-CG1 4.48Å; A175-I320 HydrophobicContact CB-CG2 3.51Å; A316-I320 PolarHBondContact O-N 3.38Å; W317-I320 HydrophobicContact CE3-CD1 4.44Å; W317-I320 HydrophobicContact CE3-CG1 4.05Å; W317-I320 HydrophobicContact CZ3-CG1 4.46Å; W317-I320 PolarHBondContact O-N 3.2Å; W317-I320 VanDerWaalsContact O-N 3.14Å; I320-H322 PolarHBondContact O-N 3.07Å; I320-K323 HydrophobicContact CB-CD 4.42Å; I320-K323 WeakPolarHBondContact O-CB 3.49Å; I320-K323 PolarHBondContact O-N 3.46Å; I320-Y324 HydrophobicContact CD1-CE2 4.1Å
321	S	92.9	Very high	89.8	Confident	41 Å²	41	64.2 Å²	64.2	29%	0.287	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-51	-36	-177.5	56.9	0	0	0	0	113.4	W317 H318 K323 Y324	W317-S321 WeakPolarHBondContact O-CA 3.39Å; W317-S321 VanDerWaalsContact O-CB 3.23Å; W317-S321 WeakPolarHBondContact O-CB 3.47Å; W317-S321 PolarHBondContact O-N 3.09Å; H318-S321 PolarHBondContact O-OG 3.06Å; S321-K323 PolarHBondContact O-N 2.83Å; S321-Y324 PolarHBondContact O-N 3.5Å; S321-Y324 VanDerWaalsContact O-O 3.13Å
322	H	92.4	Very high	88.7	Confident	149 Å²	149	67.6 Å²	67.6	69%	0.69	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-67	-18.4	178.3	69.7	-88.1	0	0	0	114.7	R319 I320 Y324	R319-H322 PolarHBondContact O-CE1 3.37Å; R319-H322 PolarHBondContact O-ND1 3.29Å; I320-H322 PolarHBondContact O-N 3.07Å; H322-Y324 VanDerWaalsContact C-N 3.34Å
323	K	92.5	Very high	86.9	Confident	119 Å²	119	75 Å²	75	52%	0.517	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-78.8	-19.4	176.8	-63.1	-176.7	177	-179.6	0	112.6	I320 S321	I320-K323 HydrophobicContact CB-CD 4.42Å; I320-K323 WeakPolarHBondContact O-CB 3.49Å; I320-K323 PolarHBondContact O-N 3.46Å; S321-K323 PolarHBondContact O-N 2.83Å
324	Y	92.9	Very high	84.9	Confident	50 Å²	50	81.2 Å²	81.2	20%	0.196	40%	0.397	C	S	.	.			trans	-118.1	142.2	-168.1	-68.7	-77.2	0	0	0	111.5	F168 D171 W317 I320 S321 H322 F326	F168-Y324 HydrophobicContact CD2-CD2 4.38Å; F168-Y324 HydrophobicContact CD2-CE1 4.07Å; F168-Y324 AromaticContact CD2-CE2 3.97Å; F168-Y324 HydrophobicContact CD2-CE2 3.97Å; F168-Y324 AromaticContact CD2-CZ 3.78Å; F168-Y324 HydrophobicContact CE2-CD2 4.33Å; F168-Y324 HydrophobicContact CE2-CE2 4.22Å; D171-Y324 HydrophobicContact CB-CE2 4.45Å; D171-Y324 WeakPolarHBondContact CB-OH 3.47Å; D171-Y324 PolarHBondContact OD2-OH 3.49Å; W317-Y324 HydrophobicContact CZ3-CD2 4.16Å; I320-Y324 HydrophobicContact CD1-CE2 4.1Å; S321-Y324 PolarHBondContact O-N 3.5Å; S321-Y324 VanDerWaalsContact O-O 3.13Å; H322-Y324 VanDerWaalsContact C-N 3.34Å; Y324-F326 VanDerWaalsContact C-N 3.27Å; Y324-F326 HydrophobicContact CD1-CD1 4.24Å; Y324-F326 AromaticContact CD1-CE1 3.23Å; Y324-F326 HydrophobicContact CD1-CE1 3.23Å; Y324-F326 HydrophobicContact CD1-CE2 4.14Å; Y324-F326 AromaticContact CD1-CZ 3.18Å; Y324-F326 HydrophobicContact CD1-CZ 3.18Å; Y324-F326 HydrophobicContact CD2-CZ 4.34Å; Y324-F326 HydrophobicContact CE1-CE1 4.01Å; Y324-F326 AromaticContact CE1-CZ 3.78Å; Y324-F326 HydrophobicContact CE1-CZ 3.78Å; Y324-F326 AromaticContact CG-CE1 3.81Å; Y324-F326 HydrophobicContact CG-CE1 3.81Å; Y324-F326 AromaticContact CG-CE2 3.99Å; Y324-F326 HydrophobicContact CG-CE2 3.99Å; Y324-F326 AromaticContact CG-CZ 3.48Å; Y324-F326 HydrophobicContact CG-CZ 3.48Å; Y324-F326 VanDerWaalsContact CG-CZ 3.48Å; Y324-F326 PolarHBondContact O-N 2.76Å
325	E	90.5	Very high	83.6	Confident	148 Å²	148	80 Å²	80	69%	0.692	39%	0.39	S	S	*	.	S	Bend	trans	-92.4	22.6	177.6	-59.8	-166.6	154.9	0	0	113.4
326	F	94	Very high	82.1	Confident	15 Å²	15	75.7 Å²	75.7	7%	0.066	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	161.9	178.5	55.8	-110.7	0	0	0	110.4	F164 F168 W317 Y324 I341 K342 F343	F164-F326 HydrophobicContact CE1-CE1 4.45Å; F164-F326 HydrophobicContact CE2-CE1 4.18Å; F164-F326 HydrophobicContact CZ-CD1 4.11Å; F164-F326 AromaticContact CZ-CE1 3.51Å; F164-F326 HydrophobicContact CZ-CE1 3.51Å; F164-F326 HydrophobicContact CZ-CZ 4.17Å; F168-F326 AromaticContact CD2-CE2 3.97Å; F168-F326 HydrophobicContact CD2-CE2 3.97Å; F168-F326 AromaticContact CD2-CZ 3.65Å; F168-F326 HydrophobicContact CD2-CZ 3.65Å; F168-F326 AromaticContact CE2-CE2 3.72Å; F168-F326 HydrophobicContact CE2-CE2 3.72Å; F168-F326 AromaticContact CE2-CZ 3.89Å; F168-F326 HydrophobicContact CE2-CZ 3.89Å; F168-F326 HydrophobicContact CG-CZ 4.2Å; F168-F326 HydrophobicContact CZ-CE2 4.12Å; W317-F326 HydrophobicContact CH2-CD2 4.06Å; W317-F326 HydrophobicContact CH2-CE2 4.03Å; W317-F326 VanDerWaalsContact CH2-O 3.29Å; W317-F326 WeakPolarHBondContact CH2-O 3.34Å; W317-F326 WeakPolarHBondContact CZ2-O 3.29Å; W317-F326 HydrophobicContact CZ3-CE2 4.1Å; Y324-F326 VanDerWaalsContact C-N 3.27Å; Y324-F326 HydrophobicContact CD1-CD1 4.24Å; Y324-F326 AromaticContact CD1-CE1 3.23Å; Y324-F326 HydrophobicContact CD1-CE1 3.23Å; Y324-F326 HydrophobicContact CD1-CE2 4.14Å; Y324-F326 AromaticContact CD1-CZ 3.18Å; Y324-F326 HydrophobicContact CD1-CZ 3.18Å; Y324-F326 HydrophobicContact CD2-CZ 4.34Å; Y324-F326 HydrophobicContact CE1-CE1 4.01Å; Y324-F326 AromaticContact CE1-CZ 3.78Å; Y324-F326 HydrophobicContact CE1-CZ 3.78Å; Y324-F326 AromaticContact CG-CE1 3.81Å; Y324-F326 HydrophobicContact CG-CE1 3.81Å; Y324-F326 AromaticContact CG-CE2 3.99Å; Y324-F326 HydrophobicContact CG-CE2 3.99Å; Y324-F326 AromaticContact CG-CZ 3.48Å; Y324-F326 HydrophobicContact CG-CZ 3.48Å; Y324-F326 VanDerWaalsContact CG-CZ 3.48Å; Y324-F326 PolarHBondContact O-N 2.76Å; F326-I341 HydrophobicContact CB-CG2 3.81Å; F326-I341 HydrophobicContact CD1-CG2 3.9Å; F326-I341 HydrophobicContact CD2-CB 4.48Å; F326-I341 HydrophobicContact CD2-CG2 3.4Å; F326-I341 HydrophobicContact CE1-CG2 4.27Å; F326-I341 HydrophobicContact CE2-CD1 4.44Å; F326-I341 HydrophobicContact CE2-CG1 4.33Å; F326-I341 HydrophobicContact CE2-CG2 3.81Å; F326-I341 HydrophobicContact CG-CG2 3.43Å; F326-I341 VanDerWaalsContact CG-CG2 3.43Å; F326-I341 HydrophobicContact CZ-CD1 4.42Å; F326-I341 HydrophobicContact CZ-CG2 4.21Å; F326-K342 WeakPolarHBondContact CA-O 3.41Å; F326-K342 WeakPolarHBondContact CB-O 3.47Å; F326-F343 HydrophobicContact CB-CD1 4.03Å; F326-F343 HydrophobicContact CB-CE1 4.39Å; F326-F343 HydrophobicContact CD1-CD1 4.35Å; F326-F343 AromaticContact CD1-CE1 3.96Å; F326-F343 HydrophobicContact CD1-CE1 3.96Å; F326-F343 HydrophobicContact CG-CE1 4.47Å
327	D	91.5	Very high	81.3	Confident	104 Å²	104	76 Å²	76	56%	0.556	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	147.7	173.3	-64.4	-44.8	0	0	0	110.5	K342	D327-K342 HydrophobicContact CB-CB 4.42Å; D327-K342 PolarHBondContact N-O 3.4Å; D327-K342 PolarHBondContact O-N 3.42Å
328	L	91.8	Very high	80.9	Confident	16 Å²	16	76.3 Å²	76.3	8%	0.084	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	125.5	168	-174.2	66.3	0	0	0	109.5	F168 L172 W317 F330 L339 I341 F351	F168-L328 HydrophobicContact CE1-CD1 4.02Å; F168-L328 HydrophobicContact CZ-CD1 4.12Å; F168-L328 HydrophobicContact CZ-CD2 4.23Å; L172-L328 HydrophobicContact CD2-CD2 4.47Å; W317-L328 HydrophobicContact CB-CD2 4.01Å; W317-L328 HydrophobicContact CD2-CB 3.65Å; W317-L328 HydrophobicContact CD2-CD2 4.14Å; W317-L328 HydrophobicContact CE3-CB 4.1Å; W317-L328 HydrophobicContact CE3-CD2 4.39Å; W317-L328 HydrophobicContact CG-CB 4Å; W317-L328 HydrophobicContact CG-CD2 3.96Å; W317-L328 HydrophobicContact CH2-CB 4.45Å; W317-L328 HydrophobicContact CZ2-CB 4.05Å; W317-L328 HydrophobicContact CZ3-CB 4.48Å; L328-F330 HydrophobicContact CD2-CZ 4.44Å; L328-L339 HydrophobicContact CD1-CB 4.27Å; L328-L339 HydrophobicContact CD1-CD2 4.25Å; L328-L339 HydrophobicContact CD2-CD2 4.25Å; L328-L339 HydrophobicContact CG-CD2 4.26Å; L328-I341 HydrophobicContact CD1-CG1 4.45Å; L328-F351 HydrophobicContact CD1-CE1 3.88Å; L328-F351 HydrophobicContact CD1-CZ 3.79Å
329	A	86.7	Confident	80.8	Confident	28 Å²	28	70 Å²	70	23%	0.231	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.4	172.3	0	0	0	0	0	110.5	K340	A329-K340 HydrophobicContact CB-CD 4.4Å; A329-K340 HydrophobicContact CB-CG 3.76Å; A329-K340 PolarHBondContact N-O 3.35Å; A329-K340 PolarHBondContact O-N 3.41Å
330	F	77.8	Confident	80.7	Confident	66 Å²	66	66.3 Å²	66.3	29%	0.289	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	130.7	167.4	-62.3	-94.5	0	0	0	108.2	L313 T314 L328 L339	L313-F330 HydrophobicContact CB-CE1 3.97Å; L313-F330 HydrophobicContact CB-CZ 4.19Å; T314-F330 WeakPolarHBondContact OG1-CE2 3.38Å; T314-F330 WeakPolarHBondContact OG1-CZ 3.38Å; L328-F330 HydrophobicContact CD2-CZ 4.44Å; F330-L339 HydrophobicContact CD1-CD2 3.39Å; F330-L339 HydrophobicContact CE1-CD2 3.54Å; F330-L339 HydrophobicContact CG-CD2 3.96Å; F330-L339 HydrophobicContact CZ-CD2 4.2Å
331	G	66.3	Low	80.6	Confident	29 Å²	29	66 Å²	66	30%	0.299	34%	0.341	S	S	.	.			trans	-72.9	-150.6	-171.8	0	0	0	0	0	113.4	S338	G331-S338 VanDerWaalsContact CA-O 3.29Å; G331-S338 WeakPolarHBondContact CA-O 3.4Å; G331-S338 PolarHBondContact N-O 2.76Å
332	E	64.2	Low	80.6	Confident	138 Å²	138	69.5 Å²	69.5	65%	0.645	35%	0.351	S	S	*	.			trans	-63.7	139.9	-178.7	-68.7	165.8	-175.8	0	0	111	D334 T335	E332-D334 PolarHBondContact O-N 3.28Å; E332-D334 VanDerWaalsContact O-N 3.11Å; E332-T335 CarbonylContact O-C 3.48Å; E332-T335 PolarHBondContact O-N 3.13Å
333	L	51.6	Low	80.5	Confident	167 Å²	167	65.2 Å²	65.2	87%	0.874	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-30	176.3	-76.7	159.8	0	0	0	112.1	T335	L333-T335 VanDerWaalsContact C-N 3.29Å; L333-T335 PolarHBondContact O-N 2.98Å
334	D	50.2	Low	80.3	Confident	134 Å²	134	69.4 Å²	69.4	72%	0.717	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-15	-178.4	-57.1	-20.7	0	0	0	113.1	E332	E332-D334 PolarHBondContact O-N 3.28Å; E332-D334 VanDerWaalsContact O-N 3.11Å
335	T	63	Low	80.1	Confident	22 Å²	22	71.3 Å²	71.3	14%	0.135	36%	0.363	C	S	.	.	S	Bend	trans	-128.6	78.3	177.8	51.3	0	0	0	0	109.3	E332 L333 G337 S338 P371	E332-T335 CarbonylContact O-C 3.48Å; E332-T335 PolarHBondContact O-N 3.13Å; L333-T335 VanDerWaalsContact C-N 3.29Å; L333-T335 PolarHBondContact O-N 2.98Å; T335-G337 PolarHBondContact O-N 3.39Å; T335-S338 WeakPolarHBondContact O-CB 3.29Å; T335-S338 PolarHBondContact O-N 3.21Å; T335-S338 WeakPolarHBondContact OG1-CB 3.28Å; T335-P371 HydrophobicContact CG2-CB 3.59Å; T335-P371 HydrophobicContact CG2-CG 4.03Å
336	P	60.5	Low	79.8	Confident	32 Å²	32	66.8 Å²	66.8	21%	0.208	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.5	-166.3	17.2	-28	0	0	0	115	M306 Q310	M306-P336 HydrophobicContact CB-CB 4.05Å; M306-P336 HydrophobicContact CB-CG 4.03Å; M306-P336 HydrophobicContact CE-CB 3.55Å; M306-P336 HydrophobicContact CE-CG 3.64Å; M306-P336 HydrophobicContact CG-CB 4.27Å; M306-P336 HydrophobicContact CG-CG 3.79Å; M306-P336 HydrophobicContact SD-CG 4.38Å; Q310-P336 WeakPolarHBondContact CG-O 3.43Å; Q310-P336 PolarHBondContact NE2-O 3.14Å
337	G	74.9	Confident	79.6	Confident	7 Å²	7	73.4 Å²	73.4	7%	0.072	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-5.6	172.3	0	0	0	0	0	115.7	T335 L339 V352 L353	T335-G337 PolarHBondContact O-N 3.39Å; G337-L339 PolarHBondContact O-N 2.84Å; G337-V352 CarbonylContact O-C 3.53Å; G337-V352 WeakPolarHBondContact O-CA 3.46Å; G337-L353 WeakPolarHBondContact CA-O 3.27Å; G337-L353 PolarHBondContact O-N 2.9Å
338	S	85.8	Confident	79.4	Confident	29 Å²	29	74.2 Å²	74.2	20%	0.203	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	122.4	-178.5	-174.2	0	0	0	0	110.3	G331 T335	G331-S338 VanDerWaalsContact CA-O 3.29Å; G331-S338 WeakPolarHBondContact CA-O 3.4Å; G331-S338 PolarHBondContact N-O 2.76Å; T335-S338 WeakPolarHBondContact O-CB 3.29Å; T335-S338 PolarHBondContact O-N 3.21Å; T335-S338 WeakPolarHBondContact OG1-CB 3.28Å
339	L	90.3	Very high	79.3	Confident	1 Å²	1	75.3 Å²	75.3	1%	0.005	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	152.7	179.8	-69.1	160.4	0	0	0	109	L313 L328 F330 G337 P350 F351 L353	L313-L339 HydrophobicContact CD1-CD1 4.13Å; L328-L339 HydrophobicContact CD1-CB 4.27Å; L328-L339 HydrophobicContact CD1-CD2 4.25Å; L328-L339 HydrophobicContact CD2-CD2 4.25Å; L328-L339 HydrophobicContact CG-CD2 4.26Å; F330-L339 HydrophobicContact CD1-CD2 3.39Å; F330-L339 HydrophobicContact CE1-CD2 3.54Å; F330-L339 HydrophobicContact CG-CD2 3.96Å; F330-L339 HydrophobicContact CZ-CD2 4.2Å; G337-L339 PolarHBondContact O-N 2.84Å; L339-P350 WeakPolarHBondContact O-CA 3.47Å; L339-F351 CarbonylContact C-O 3.59Å; L339-F351 HydrophobicContact CB-CD1 4.08Å; L339-F351 HydrophobicContact CB-CD2 4.3Å; L339-F351 HydrophobicContact CB-CE1 3.49Å; L339-F351 VanDerWaalsContact CB-CE1 3.49Å; L339-F351 HydrophobicContact CB-CE2 3.8Å; L339-F351 HydrophobicContact CB-CG 4.42Å; L339-F351 HydrophobicContact CB-CZ 3.34Å; L339-F351 HydrophobicContact CD1-CD2 4.43Å; L339-F351 HydrophobicContact CD1-CE2 3.55Å; L339-F351 HydrophobicContact CD1-CZ 3.65Å; L339-F351 HydrophobicContact CG-CE2 4.33Å; L339-F351 HydrophobicContact CG-CZ 4.1Å; L339-F351 PolarHBondContact N-O 3.45Å; L339-F351 PolarHBondContact O-N 3.14Å; L339-L353 HydrophobicContact CD1-CB 4.07Å; L339-L353 HydrophobicContact CD1-CD1 3.61Å; L339-L353 HydrophobicContact CD1-CG 3.7Å
340	K	90.8	Very high	79.5	Confident	90 Å²	90	74.9 Å²	74.9	39%	0.391	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	130.1	173.1	64.8	-168.9	175.9	-171.5	0	111.3	A329 M349	A329-K340 HydrophobicContact CB-CD 4.4Å; A329-K340 HydrophobicContact CB-CG 3.76Å; A329-K340 PolarHBondContact N-O 3.35Å; A329-K340 PolarHBondContact O-N 3.41Å; K340-M349 WeakPolarHBondContact CA-O 3.19Å
341	I	92.5	Very high	80.2	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	121.2	170.9	-61.2	173.8	0	0	0	107.4	F164 F168 F326 L328 F343 F348 M349 F351	F164-I341 HydrophobicContact CD1-CD1 4.33Å; F164-I341 HydrophobicContact CE1-CD1 3.6Å; F164-I341 HydrophobicContact CE1-CG2 4.48Å; F164-I341 HydrophobicContact CZ-CD1 4.41Å; F168-I341 HydrophobicContact CD1-CD1 3.71Å; F168-I341 HydrophobicContact CD1-CG1 4.34Å; F168-I341 HydrophobicContact CE1-CD1 4.13Å; F168-I341 HydrophobicContact CE1-CG1 4.26Å; F168-I341 HydrophobicContact CG-CD1 4.17Å; F326-I341 HydrophobicContact CB-CG2 3.81Å; F326-I341 HydrophobicContact CD1-CG2 3.9Å; F326-I341 HydrophobicContact CD2-CB 4.48Å; F326-I341 HydrophobicContact CD2-CG2 3.4Å; F326-I341 HydrophobicContact CE1-CG2 4.27Å; F326-I341 HydrophobicContact CE2-CD1 4.44Å; F326-I341 HydrophobicContact CE2-CG1 4.33Å; F326-I341 HydrophobicContact CE2-CG2 3.81Å; F326-I341 HydrophobicContact CG-CG2 3.43Å; F326-I341 VanDerWaalsContact CG-CG2 3.43Å; F326-I341 HydrophobicContact CZ-CD1 4.42Å; F326-I341 HydrophobicContact CZ-CG2 4.21Å; L328-I341 HydrophobicContact CD1-CG1 4.45Å; I341-F343 HydrophobicContact CB-CE2 4.5Å; I341-F343 HydrophobicContact CG2-CD1 4.49Å; I341-F343 HydrophobicContact CG2-CD2 4.4Å; I341-F343 HydrophobicContact CG2-CE1 4.01Å; I341-F343 HydrophobicContact CG2-CE2 3.91Å; I341-F343 HydrophobicContact CG2-CZ 3.7Å; I341-F348 CarbonylContact O-C 3.44Å; I341-F348 WeakPolarHBondContact O-CA 3.12Å; I341-M349 HydrophobicContact CB-CB 4.26Å; I341-M349 PolarHBondContact N-O 2.96Å; I341-M349 PolarHBondContact O-N 2.93Å; I341-F351 HydrophobicContact CD1-CD1 4.46Å; I341-F351 HydrophobicContact CD1-CE1 4.16Å; I341-F351 HydrophobicContact CG1-CD1 4.24Å; I341-F351 HydrophobicContact CG1-CE1 3.7Å
342	K	92	Very high	81.4	Confident	115 Å²	115	70.6 Å²	70.6	50%	0.5	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	111.4	179.2	-174.5	-176	178.9	-172.7	0	109.6	F326 D327	F326-K342 WeakPolarHBondContact CA-O 3.41Å; F326-K342 WeakPolarHBondContact CB-O 3.47Å; D327-K342 HydrophobicContact CB-CB 4.42Å; D327-K342 PolarHBondContact N-O 3.4Å; D327-K342 PolarHBondContact O-N 3.42Å
343	F	91.1	Very high	82.7	Confident	59 Å²	59	64 Å²	64	26%	0.259	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	155	176.7	-60.6	-81.9	0	0	0	111.2	F164 F326 I341 S345 G346 K347 M349	F164-F343 HydrophobicContact CE1-CE1 4.22Å; F164-F343 AromaticContact CE1-CZ 3.67Å; F164-F343 HydrophobicContact CE1-CZ 3.67Å; F164-F343 AromaticContact CZ-CE1 3.84Å; F164-F343 HydrophobicContact CZ-CE1 3.84Å; F164-F343 AromaticContact CZ-CZ 3.77Å; F164-F343 HydrophobicContact CZ-CZ 3.77Å; F326-F343 HydrophobicContact CB-CD1 4.03Å; F326-F343 HydrophobicContact CB-CE1 4.39Å; F326-F343 HydrophobicContact CD1-CD1 4.35Å; F326-F343 AromaticContact CD1-CE1 3.96Å; F326-F343 HydrophobicContact CD1-CE1 3.96Å; F326-F343 HydrophobicContact CG-CE1 4.47Å; I341-F343 HydrophobicContact CB-CE2 4.5Å; I341-F343 HydrophobicContact CG2-CD1 4.49Å; I341-F343 HydrophobicContact CG2-CD2 4.4Å; I341-F343 HydrophobicContact CG2-CE1 4.01Å; I341-F343 HydrophobicContact CG2-CE2 3.91Å; I341-F343 HydrophobicContact CG2-CZ 3.7Å; F343-S345 PolarHBondContact O-N 3.49Å; F343-S345 VanDerWaalsContact O-N 3.11Å; F343-G346 PolarHBondContact O-N 3.42Å; F343-K347 HydrophobicContact CD2-CB 4.42Å; F343-K347 WeakPolarHBondContact CD2-O 3.47Å; F343-K347 PolarHBondContact N-O 3.48Å; F343-M349 HydrophobicContact CE2-CB 4Å
344	R	88.9	Confident	84.6	Confident	208 Å²	208	56.6 Å²	56.6	79%	0.785	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.4	173.7	-66.8	-177.4	178.4	174.9	0.9	113.9	G346	R344-G346 PolarHBondContact O-N 2.91Å
345	S	87.8	Confident	86.7	Confident	89 Å²	89	50.2 Å²	50.2	62%	0.622	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-7.5	174.2	61.7	0	0	0	0	113.9	F343 K347	F343-S345 PolarHBondContact O-N 3.49Å; F343-S345 VanDerWaalsContact O-N 3.11Å; S345-K347 PolarHBondContact O-N 3.25Å; S345-K347 PolarHBondContact OG-N 3.11Å
346	G	85.2	Confident	88.1	Confident	54 Å²	54	49.1 Å²	49.1	56%	0.557	25%	0.248	S	C	*	.	S	Bend	trans	84.1	-9.1	-172.9	0	0	0	0	0	113.7	F343 R344	F343-G346 PolarHBondContact O-N 3.42Å; R344-G346 PolarHBondContact O-N 2.91Å
347	K	88.6	Confident	89.7	Confident	154 Å²	154	47.8 Å²	47.8	67%	0.67	24%	0.239	S	C	*	.			trans	-68.5	148.7	171.7	-63.6	-173.7	178.2	-175.7	0	110.2	F343 S345	F343-K347 HydrophobicContact CD2-CB 4.42Å; F343-K347 WeakPolarHBondContact CD2-O 3.47Å; F343-K347 PolarHBondContact N-O 3.48Å; S345-K347 PolarHBondContact O-N 3.25Å; S345-K347 PolarHBondContact OG-N 3.11Å
348	F	87.8	Confident	90.5	Very high	120 Å²	120	50.2 Å²	50.2	53%	0.526	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	146.5	174.2	58.8	-88.5	0	0	0	110.8	P206 I341	P206-F348 HydrophobicContact CG-CE2 4.15Å; I341-F348 CarbonylContact O-C 3.44Å; I341-F348 WeakPolarHBondContact O-CA 3.12Å
349	M	89.8	Confident	90.6	Very high	39 Å²	39	48.9 Å²	48.9	19%	0.192	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	107.2	173.8	-169.4	76.4	80.3	0	0	108.7	T161 V165 K340 I341 F343	T161-M349 HydrophobicContact CG2-CE 3.78Å; T161-M349 HydrophobicContact CG2-CG 4.18Å; T161-M349 HydrophobicContact CG2-SD 3.44Å; T161-M349 WeakPolarHBondContact CG2-SD 3.09Å; V165-M349 HydrophobicContact CG2-CG 4.28Å; K340-M349 WeakPolarHBondContact CA-O 3.19Å; I341-M349 HydrophobicContact CB-CB 4.26Å; I341-M349 PolarHBondContact N-O 2.96Å; I341-M349 PolarHBondContact O-N 2.93Å; F343-M349 HydrophobicContact CE2-CB 4Å
350	P	90	Very high	90.2	Very high	20 Å²	20	54 Å²	54	13%	0.13	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	147	178.9	34.1	-32.6	0	0	0	111.5	P206 L208 L339	P206-P350 HydrophobicContact CB-CG 4.11Å; P206-P350 HydrophobicContact CG-CG 3.66Å; L208-P350 HydrophobicContact CD1-CB 3.72Å; L208-P350 HydrophobicContact CD1-CG 3.97Å; L339-P350 WeakPolarHBondContact O-CA 3.47Å
351	F	92.2	Very high	89.8	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	158.9	171.9	66.7	-73.9	0	0	0	108.9	V165 F168 V169 C209 L328 L339 I341 L353	V165-F351 HydrophobicContact CG1-CB 3.88Å; V165-F351 HydrophobicContact CG1-CD2 4.13Å; V165-F351 HydrophobicContact CG1-CG 4.01Å; F168-F351 HydrophobicContact CD1-CZ 4.15Å; F168-F351 HydrophobicContact CE1-CE1 4.24Å; F168-F351 HydrophobicContact CE1-CE2 4.44Å; F168-F351 AromaticContact CE1-CZ 3.69Å; F168-F351 HydrophobicContact CE1-CZ 3.69Å; V169-F351 HydrophobicContact CG2-CD2 4.06Å; V169-F351 HydrophobicContact CG2-CE2 3.79Å; C209-F351 HydrophobicContact CB-CB 4.06Å; C209-F351 CarbonylContact O-C 3.55Å; C209-F351 WeakPolarHBondContact O-CA 3.35Å; L328-F351 HydrophobicContact CD1-CE1 3.88Å; L328-F351 HydrophobicContact CD1-CZ 3.79Å; L339-F351 CarbonylContact C-O 3.59Å; L339-F351 HydrophobicContact CB-CD1 4.08Å; L339-F351 HydrophobicContact CB-CD2 4.3Å; L339-F351 HydrophobicContact CB-CE1 3.49Å; L339-F351 VanDerWaalsContact CB-CE1 3.49Å; L339-F351 HydrophobicContact CB-CE2 3.8Å; L339-F351 HydrophobicContact CB-CG 4.42Å; L339-F351 HydrophobicContact CB-CZ 3.34Å; L339-F351 HydrophobicContact CD1-CD2 4.43Å; L339-F351 HydrophobicContact CD1-CE2 3.55Å; L339-F351 HydrophobicContact CD1-CZ 3.65Å; L339-F351 HydrophobicContact CG-CE2 4.33Å; L339-F351 HydrophobicContact CG-CZ 4.1Å; L339-F351 PolarHBondContact N-O 3.45Å; L339-F351 PolarHBondContact O-N 3.14Å; I341-F351 HydrophobicContact CD1-CD1 4.46Å; I341-F351 HydrophobicContact CD1-CE1 4.16Å; I341-F351 HydrophobicContact CG1-CD1 4.24Å; I341-F351 HydrophobicContact CG1-CE1 3.7Å; F351-L353 HydrophobicContact CD2-CD2 4.09Å; F351-L353 HydrophobicContact CD2-CG 4.04Å; F351-L353 HydrophobicContact CE2-CD1 4Å; F351-L353 HydrophobicContact CE2-CD2 4.11Å; F351-L353 HydrophobicContact CE2-CG 3.74Å
352	V	91.7	Very high	89.7	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.024	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122.4	-177.5	-177	0	0	0	0	108.5	L208 C209 L211 G337 P371	L208-V352 HydrophobicContact CD1-CG2 4.09Å; L208-V352 HydrophobicContact CD2-CG2 4.39Å; L208-V352 HydrophobicContact CG-CG2 4.4Å; C209-V352 PolarHBondContact O-N 3.28Å; L211-V352 PolarHBondContact N-O 3.23Å; G337-V352 CarbonylContact O-C 3.53Å; G337-V352 WeakPolarHBondContact O-CA 3.46Å; V352-P371 HydrophobicContact CG1-CG 4.33Å
353	L	92.4	Very high	89.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	117.5	167.8	-63.1	-173.5	0	0	0	108.7	V169 L172 L211 V213 F309 L313 G337 L339 F351	V169-L353 HydrophobicContact CG1-CD1 4.3Å; V169-L353 HydrophobicContact CG1-CD2 3.71Å; V169-L353 HydrophobicContact CG2-CD2 3.94Å; L172-L353 HydrophobicContact CD2-CD1 4.12Å; L211-L353 HydrophobicContact CB-CD2 3.67Å; L211-L353 HydrophobicContact CD1-CD2 3.7Å; L211-L353 HydrophobicContact CG-CD2 4.22Å; L211-L353 WeakPolarHBondContact O-CA 3.43Å; V213-L353 HydrophobicContact CG2-CB 4.43Å; V213-L353 HydrophobicContact CG2-CD2 4.31Å; F309-L353 HydrophobicContact CE1-CB 3.94Å; F309-L353 HydrophobicContact CZ-CB 4.15Å; L313-L353 HydrophobicContact CD1-CD1 4.19Å; L313-L353 HydrophobicContact CD2-CD1 3.99Å; G337-L353 WeakPolarHBondContact CA-O 3.27Å; G337-L353 PolarHBondContact O-N 2.9Å; L339-L353 HydrophobicContact CD1-CB 4.07Å; L339-L353 HydrophobicContact CD1-CD1 3.61Å; L339-L353 HydrophobicContact CD1-CG 3.7Å; F351-L353 HydrophobicContact CD2-CD2 4.09Å; F351-L353 HydrophobicContact CD2-CG 4.04Å; F351-L353 HydrophobicContact CE2-CD1 4Å; F351-L353 HydrophobicContact CE2-CD2 4.11Å; F351-L353 HydrophobicContact CE2-CG 3.74Å
354	T	91.7	Very high	89.7	Confident	11 Å²	11	52.7 Å²	52.7	7%	0.067	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	118.6	178.9	-57.5	0	0	0	0	109.4	L211 F212 V213 V356 T367	L211-T354 PolarHBondContact O-N 3.48Å; F212-T354 CarbonylContact C-O 3.43Å; F212-T354 WeakPolarHBondContact CA-O 3.35Å; V213-T354 PolarHBondContact N-O 2.93Å; T354-V356 HydrophobicContact CG2-CG1 4.06Å; T354-V356 PolarHBondContact O-N 3.39Å; T354-T367 VanDerWaalsContact CG2-OG1 3.26Å; T354-T367 WeakPolarHBondContact CG2-OG1 3.39Å
355	P	92.8	Very high	89.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	129.9	172	30.3	-31.9	0	0	0	108.6	V213 F215 V305 M306 F309	V213-P355 WeakPolarHBondContact O-CA 3.34Å; F215-P355 HydrophobicContact CD1-CB 3.99Å; F215-P355 HydrophobicContact CE1-CB 3.92Å; V305-P355 HydrophobicContact CG1-CB 4.37Å; V305-P355 HydrophobicContact CG1-CG 4.24Å; M306-P355 HydrophobicContact CE-CG 4.13Å; M306-P355 HydrophobicContact SD-CG 3.45Å; M306-P355 WeakPolarHBondContact SD-CG 3.4Å; F309-P355 HydrophobicContact CB-CB 4.4Å; F309-P355 HydrophobicContact CB-CG 4.08Å; F309-P355 HydrophobicContact CD1-CB 4.1Å; F309-P355 HydrophobicContact CD1-CG 3.72Å; F309-P355 HydrophobicContact CD2-CB 4.03Å; F309-P355 HydrophobicContact CD2-CG 4.45Å; F309-P355 HydrophobicContact CE1-CB 4.35Å; F309-P355 HydrophobicContact CE1-CG 4.23Å; F309-P355 HydrophobicContact CE2-CB 4.33Å; F309-P355 HydrophobicContact CG-CB 3.92Å; F309-P355 HydrophobicContact CG-CG 3.83Å; F309-P355 HydrophobicContact CZ-CB 4.46Å
356	V	93.6	Very high	90.1	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	158.1	-177.7	-61.9	0	0	0	0	111.9	F212 V213 P214 F215 T354 Y365 F366	F212-V356 HydrophobicContact CB-CG1 4.03Å; F212-V356 HydrophobicContact CB-CG2 3.77Å; F212-V356 HydrophobicContact CD1-CG1 3.87Å; F212-V356 HydrophobicContact CD2-CG1 4.03Å; F212-V356 HydrophobicContact CD2-CG2 4.44Å; F212-V356 HydrophobicContact CE1-CG1 4.31Å; F212-V356 HydrophobicContact CE2-CG1 4.47Å; F212-V356 HydrophobicContact CG-CG1 3.71Å; F212-V356 HydrophobicContact CG-CG2 4.24Å; V213-V356 PolarHBondContact O-N 2.96Å; P214-V356 VanDerWaalsContact CA-O 3.27Å; P214-V356 WeakPolarHBondContact CA-O 3.06Å; P214-V356 HydrophobicContact CB-CG2 4.25Å; P214-V356 HydrophobicContact CG-CG2 4.07Å; F215-V356 WeakPolarHBondContact CD1-O 3.36Å; F215-V356 PolarHBondContact N-O 3.47Å; F215-V356 VanDerWaalsContact N-O 3.1Å; T354-V356 HydrophobicContact CG2-CG1 4.06Å; T354-V356 PolarHBondContact O-N 3.39Å; V356-Y365 HydrophobicContact CB-CD1 4.12Å; V356-Y365 HydrophobicContact CB-CG 4.49Å; V356-Y365 HydrophobicContact CG2-CD1 3.51Å; V356-Y365 HydrophobicContact CG2-CE1 4.19Å; V356-Y365 HydrophobicContact CG2-CG 4.15Å; V356-F366 VanDerWaalsContact CA-O 3.27Å; V356-F366 WeakPolarHBondContact CA-O 3.38Å; V356-F366 WeakPolarHBondContact CB-O 3.13Å
357	I	93	Very high	90.3	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.021	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	125.3	174.6	-62.9	157.6	0	0	0	108	F215 F223 I244 L300 Y365 F366 W385	F215-I357 HydrophobicContact CD1-CG1 4.32Å; F215-I357 HydrophobicContact CE1-CD1 4.2Å; F215-I357 HydrophobicContact CE1-CG1 3.63Å; F215-I357 HydrophobicContact CE2-CD1 4.38Å; F215-I357 HydrophobicContact CE2-CG1 4.18Å; F215-I357 HydrophobicContact CZ-CD1 3.7Å; F215-I357 HydrophobicContact CZ-CG1 3.55Å; F223-I357 HydrophobicContact CB-CG2 4.35Å; F223-I357 HydrophobicContact CD2-CD1 4.29Å; F223-I357 HydrophobicContact CD2-CG1 4.12Å; F223-I357 HydrophobicContact CD2-CG2 3.78Å; F223-I357 HydrophobicContact CE2-CD1 4.28Å; F223-I357 HydrophobicContact CE2-CG1 4.12Å; F223-I357 HydrophobicContact CG-CG2 4.43Å; I244-I357 HydrophobicContact CB-CD1 4.32Å; I244-I357 HydrophobicContact CD1-CD1 3.66Å; I244-I357 HydrophobicContact CG1-CD1 3.83Å; I244-I357 HydrophobicContact CG1-CG2 4.45Å; I244-I357 HydrophobicContact CG2-CD1 4.29Å; L300-I357 HydrophobicContact CD1-CD1 3.42Å; L300-I357 VanDerWaalsContact CD1-CD1 3.42Å; I357-Y365 CarbonylContact O-C 3.58Å; I357-Y365 WeakPolarHBondContact O-CA 3.49Å; I357-F366 HydrophobicContact CB-CB 4.36Å; I357-F366 PolarHBondContact N-O 3.07Å; I357-F366 VanDerWaalsContact N-O 3.11Å; I357-F366 PolarHBondContact O-N 3.22Å; I357-W385 HydrophobicContact CD1-CE3 4.49Å; I357-W385 HydrophobicContact CD1-CH2 4.02Å; I357-W385 HydrophobicContact CD1-CZ2 4.31Å; I357-W385 HydrophobicContact CD1-CZ3 4.12Å
358	Q	92.6	Very high	89.8	Confident	57 Å²	57	29.7 Å²	29.7	27%	0.266	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	138.1	176.8	-166.8	177.6	18.8	0	0	110.5	S362 Y365	Q358-S362 WeakPolarHBondContact CG-O 3.12Å; Q358-S362 PolarHBondContact NE2-O 2.96Å; Q358-Y365 HydrophobicContact CB-CD1 4.1Å; Q358-Y365 HydrophobicContact CB-CE1 3.73Å; Q358-Y365 HydrophobicContact CG-CD1 4.39Å; Q358-Y365 HydrophobicContact CG-CE1 3.8Å
359	C	87.9	Confident	88.7	Confident	1 Å²	1	29 Å²	29	1%	0.007	15%	0.152	C	C	.	.			trans	-95.1	114.8	178.1	-174.1	0	0	0	0	110.7	D361 S362 L364 F366	C359-D361 VanDerWaalsContact C-N 3.28Å; C359-D361 PolarHBondContact O-N 3.44Å; C359-D361 VanDerWaalsContact O-N 3.13Å; C359-S362 WeakPolarHBondContact O-CB 3.38Å; C359-S362 PolarHBondContact O-N 2.97Å; C359-S362 PolarHBondContact O-OG 3.29Å; C359-L364 HydrophobicContact CB-CB 4.03Å; C359-L364 HydrophobicContact CB-CD2 4.25Å; C359-L364 HydrophobicContact CB-CG 4.25Å; C359-L364 VanDerWaalsContact CB-O 3.32Å; C359-L364 WeakPolarHBondContact CB-O 3.47Å; C359-L364 PolarHBondContact N-O 2.78Å; C359-F366 HydrophobicContact CB-CD2 4.18Å; C359-F366 HydrophobicContact CB-CE2 3.69Å
360	N	81.1	Confident	86.9	Confident	109 Å²	109	30.4 Å²	30.4	58%	0.583	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.5	47.3	169.4	-57.2	-40.1	0	0	0	113.8	S362	N360-S362 PolarHBondContact O-N 3.38Å
361	D	83.5	Confident	84.6	Confident	154 Å²	154	31.3 Å²	31.3	82%	0.824	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	23.4	-179.4	-49.5	-40.6	0	0	0	115.2	C359	C359-D361 VanDerWaalsContact C-N 3.28Å; C359-D361 PolarHBondContact O-N 3.44Å; C359-D361 VanDerWaalsContact O-N 3.13Å
362	S	89.5	Confident	82.4	Confident	17 Å²	17	38.2 Å²	38.2	12%	0.119	20%	0.196	C	C	.	.	S	Bend	trans	-102.3	168.7	176.3	73	0	0	0	0	111.9	Q358 C359 N360 L364	Q358-S362 WeakPolarHBondContact CG-O 3.12Å; Q358-S362 PolarHBondContact NE2-O 2.96Å; C359-S362 WeakPolarHBondContact O-CB 3.38Å; C359-S362 PolarHBondContact O-N 2.97Å; C359-S362 PolarHBondContact O-OG 3.29Å; N360-S362 PolarHBondContact O-N 3.38Å; S362-L364 PolarHBondContact O-N 3.01Å; S362-L364 WeakPolarHBondContact OG-CB 3.34Å; S362-L364 PolarHBondContact OG-N 2.93Å
363	D	92.5	Very high	80.2	Confident	66 Å²	66	40.6 Å²	40.6	35%	0.353	21%	0.207	S	C	.	.	S	Bend	trans	-77.1	19.3	173.8	-71.6	-31.4	0	0	0	112.7	Y365 V391 Y392	D363-Y365 WeakPolarHBondContact O-CD2 3.38Å; D363-Y365 WeakPolarHBondContact O-CE2 3.22Å; D363-V391 HydrophobicContact CB-CB 4.23Å; D363-V391 HydrophobicContact CB-CG1 3.82Å; D363-Y392 HydrophobicContact CB-CD1 4.25Å; D363-Y392 HydrophobicContact CB-CD2 4.26Å; D363-Y392 HydrophobicContact CB-CE1 3.87Å; D363-Y392 HydrophobicContact CB-CE2 3.89Å; D363-Y392 HydrophobicContact CB-CG 4.44Å; D363-Y392 PolarHBondContact N-OH 3.32Å; D363-Y392 WeakPolarHBondContact O-CD2 3.45Å; D363-Y392 WeakPolarHBondContact O-CE2 3.43Å
364	L	91.9	Very high	77.7	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.236	C	C	.	.			trans	-96.9	131.6	175.3	-171.1	65.4	0	0	0	109.7	C359 S362 L387 F389 Y392 P496 V499	C359-L364 HydrophobicContact CB-CB 4.03Å; C359-L364 HydrophobicContact CB-CD2 4.25Å; C359-L364 HydrophobicContact CB-CG 4.25Å; C359-L364 VanDerWaalsContact CB-O 3.32Å; C359-L364 WeakPolarHBondContact CB-O 3.47Å; C359-L364 PolarHBondContact N-O 2.78Å; S362-L364 PolarHBondContact O-N 3.01Å; S362-L364 WeakPolarHBondContact OG-CB 3.34Å; S362-L364 PolarHBondContact OG-N 2.93Å; L364-L387 HydrophobicContact CD1-CB 4.49Å; L364-L387 HydrophobicContact CD1-CD2 4.32Å; L364-L387 HydrophobicContact CD2-CD2 3.84Å; L364-L387 HydrophobicContact CG-CD2 3.97Å; L364-F389 HydrophobicContact CD1-CD1 3.72Å; L364-F389 HydrophobicContact CD1-CD2 4.24Å; L364-F389 HydrophobicContact CD1-CE1 3.42Å; L364-F389 VanDerWaalsContact CD1-CE1 3.42Å; L364-F389 HydrophobicContact CD1-CE2 4Å; L364-F389 HydrophobicContact CD1-CG 4.11Å; L364-F389 HydrophobicContact CD1-CZ 3.58Å; L364-Y392 HydrophobicContact CB-CE2 3.97Å; L364-P496 HydrophobicContact CD2-CG 4.48Å; L364-V499 HydrophobicContact CD2-CG2 4.16Å
365	Y	93.2	Very high	75.3	Confident	10 Å²	10	45.4 Å²	45.4	4%	0.039	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	141.4	-175	-67.3	-87.3	0	0	0	111.9	I192 F212 P214 V356 I357 Q358 D363 S388 V391	I192-Y365 HydrophobicContact CD1-CE1 4.06Å; I192-Y365 HydrophobicContact CD1-CE2 4.17Å; I192-Y365 WeakPolarHBondContact CD1-OH 3.33Å; F212-Y365 HydrophobicContact CD2-CG 4.43Å; P214-Y365 HydrophobicContact CB-CE1 4.4Å; P214-Y365 HydrophobicContact CG-CE1 4Å; V356-Y365 HydrophobicContact CB-CD1 4.12Å; V356-Y365 HydrophobicContact CB-CG 4.49Å; V356-Y365 HydrophobicContact CG2-CD1 3.51Å; V356-Y365 HydrophobicContact CG2-CE1 4.19Å; V356-Y365 HydrophobicContact CG2-CG 4.15Å; I357-Y365 CarbonylContact O-C 3.58Å; I357-Y365 WeakPolarHBondContact O-CA 3.49Å; Q358-Y365 HydrophobicContact CB-CD1 4.1Å; Q358-Y365 HydrophobicContact CB-CE1 3.73Å; Q358-Y365 HydrophobicContact CG-CD1 4.39Å; Q358-Y365 HydrophobicContact CG-CE1 3.8Å; D363-Y365 WeakPolarHBondContact O-CD2 3.38Å; D363-Y365 WeakPolarHBondContact O-CE2 3.22Å; Y365-S388 PolarHBondContact N-O 3.31Å; Y365-S388 PolarHBondContact O-N 3.2Å; Y365-V391 HydrophobicContact CD2-CG2 3.86Å; Y365-V391 HydrophobicContact CE2-CB 4.22Å; Y365-V391 HydrophobicContact CE2-CG2 3.64Å
366	F	91.3	Very high	73.1	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.9	168.9	-71.1	-92.1	0	0	0	110.4	P225 F227 I244 V356 I357 C359 W385 L386 L387	P225-F366 HydrophobicContact CB-CD2 3.95Å; P225-F366 HydrophobicContact CB-CE2 3.2Å; P225-F366 HydrophobicContact CB-CZ 3.61Å; P225-F366 HydrophobicContact CG-CE2 4.11Å; F227-F366 HydrophobicContact CB-CE1 4.33Å; F227-F366 HydrophobicContact CB-CZ 4.01Å; F227-F366 HydrophobicContact CD1-CZ 4.47Å; I244-F366 HydrophobicContact CD1-CB 3.9Å; I244-F366 HydrophobicContact CD1-CD1 4.23Å; I244-F366 HydrophobicContact CD1-CG 4.04Å; I244-F366 HydrophobicContact CG1-CG 4.41Å; V356-F366 VanDerWaalsContact CA-O 3.27Å; V356-F366 WeakPolarHBondContact CA-O 3.38Å; V356-F366 WeakPolarHBondContact CB-O 3.13Å; I357-F366 HydrophobicContact CB-CB 4.36Å; I357-F366 PolarHBondContact N-O 3.07Å; I357-F366 VanDerWaalsContact N-O 3.11Å; I357-F366 PolarHBondContact O-N 3.22Å; C359-F366 HydrophobicContact CB-CD2 4.18Å; C359-F366 HydrophobicContact CB-CE2 3.69Å; F366-W385 HydrophobicContact CB-CB 4.07Å; F366-W385 HydrophobicContact CB-CE3 4.14Å; F366-W385 HydrophobicContact CD1-CB 3.76Å; F366-W385 HydrophobicContact CG-CB 4.37Å; F366-L386 WeakPolarHBondContact CA-O 3.38Å; F366-L387 HydrophobicContact CD1-CD2 3.8Å; F366-L387 HydrophobicContact CD1-CG 4.48Å; F366-L387 HydrophobicContact CD2-CD2 4.22Å; F366-L387 HydrophobicContact CE1-CD2 3.38Å; F366-L387 HydrophobicContact CE1-CG 4.07Å; F366-L387 HydrophobicContact CE2-CD2 3.81Å; F366-L387 HydrophobicContact CG-CD2 4.22Å; F366-L387 HydrophobicContact CZ-CD2 3.42Å; F366-L387 VanDerWaalsContact CZ-CD2 3.42Å; F366-L387 HydrophobicContact CZ-CG 4.46Å
367	T	88.9	Confident	70.9	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	145.4	178.6	173.7	0	0	0	0	110.8	T354 Q369 L370 L386	T354-T367 VanDerWaalsContact CG2-OG1 3.26Å; T354-T367 WeakPolarHBondContact CG2-OG1 3.39Å; T367-Q369 PolarHBondContact OG1-O 3.07Å; T367-L370 HydrophobicContact CG2-CD1 3.67Å; T367-L386 HydrophobicContact CG2-CB 4.07Å; T367-L386 HydrophobicContact CG2-CD2 4.44Å; T367-L386 HydrophobicContact CG2-CG 4.48Å; T367-L386 WeakPolarHBondContact CG2-O 3.32Å; T367-L386 PolarHBondContact N-O 2.64Å; T367-L386 PolarHBondContact O-N 3.19Å
368	S	78.7	Confident	68.8	Low	11 Å²	11	56.2 Å²	56.2	8%	0.077	32%	0.317	C	S	.	.	S	Bend	trans	-65.7	-46.8	-179.7	52.4	0	0	0	0	111.4	M306	M306-S368 PolarHBondContact SD-OG 3.43Å
369	Q	65	Low	67.1	Low	106 Å²	106	55.8 Å²	55.8	50%	0.495	32%	0.319	S	S	.	.			trans	-159.7	144.7	176.7	-61.7	-172.1	-0.5	0	0	110.7	T367	T367-Q369 PolarHBondContact OG1-O 3.07Å
370	L	51.1	Low	65.7	Low	69 Å²	69	59.2 Å²	59.2	36%	0.361	35%	0.348	S	S	.	.			trans	-91.1	126.6	163.7	-103.8	89.8	0	0	0	109.8	T367 K372 L386	T367-L370 HydrophobicContact CG2-CD1 3.67Å; L370-K372 PolarHBondContact O-N 3.28Å; L370-L386 HydrophobicContact CD1-CD2 3.97Å
371	P	42.4	Very low	65.3	Low	38 Å²	38	55.5 Å²	55.5	25%	0.247	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	131.2	172.6	-24.5	34.9	0	0	0	111.4	T335 V352	T335-P371 HydrophobicContact CG2-CB 3.59Å; T335-P371 HydrophobicContact CG2-CG 4.03Å; V352-P371 HydrophobicContact CG1-CG 4.33Å
372	K	46.3	Very low	65.2	Low	145 Å²	145	51.8 Å²	51.8	63%	0.63	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	19.8	170.8	-55.1	174.7	175.2	162.8	0	119	E204 L370 P374	E204-K372 IonicContact OE1-NZ 3.28Å; E204-K372 PolarHBondContact OE1-NZ 3.45Å; E204-K372 IonicContact OE2-NZ 3.19Å; L370-K372 PolarHBondContact O-N 3.28Å; K372-P374 WeakPolarHBondContact O-CD 3.3Å
373	E	44.1	Very low	64.9	Low	54 Å²	54	51.8 Å²	51.8	25%	0.252	31%	0.309	S	S	.	.			trans	-91.2	92.2	164.9	-151.4	82.1	-133.1	0	0	109.6	C375 S434 H437	E373-C375 PolarHBondContact O-N 3.47Å; E373-S434 WeakPolarHBondContact OE1-CB 3.35Å; E373-S434 PolarHBondContact OE1-OG 3.49Å; E373-H437 IonicContact OE1-CE1 3.57Å; E373-H437 PolarHBondContact OE1-CE1 3.35Å; E373-H437 VanDerWaalsContact OE1-CE1 3.28Å; E373-H437 IonicContact OE1-ND1 3.38Å
374	P	40.1	Very low	64.6	Low	94 Å²	94	48.9 Å²	48.9	61%	0.61	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-12.4	-179.3	26.9	-36.3	0	0	0	113.3	K372	K372-P374 WeakPolarHBondContact O-CD 3.3Å
375	C	41.7	Very low	64.5	Low	19 Å²	19	48.9 Å²	48.9	13%	0.128	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-15.6	-162.7	-78.8	0	0	0	0	115.6	E373	E373-C375 PolarHBondContact O-N 3.47Å
376	R	47.4	Very low	64.2	Low	81 Å²	81	49.4 Å²	49.4	31%	0.306	30%	0.297	S	S	.	.	S	Bend	trans	-83	124.3	171.3	-92.3	-173.8	-171.6	-111.4	-0.1	107.9	Q239 A378	Q239-R376 PolarHBondContact O-NH1 3.41Å; R376-A378 PolarHBondContact O-N 3.24Å
377	G	46.6	Very low	64	Low	59 Å²	59	50 Å²	50	61%	0.608	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-48.4	142.4	173.6	0	0	0	0	0	110.2
378	A	50	Low	64.1	Low	90 Å²	90	50.4 Å²	50.4	74%	0.744	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-47.3	137.9	179	0	0	0	0	0	109.8	R376 A380	R376-A378 PolarHBondContact O-N 3.24Å; A378-A380 PolarHBondContact O-N 2.96Å; A378-A380 VanDerWaalsContact O-N 3.13Å
379	P	55.5	Low	64.9	Low	48 Å²	48	50.2 Å²	50.2	31%	0.312	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-53.1	125.9	178.3	21.3	-30.9	0	0	0	108.5	S381 D384	P379-S381 PolarHBondContact O-N 3.3Å; P379-D384 HydrophobicContact CB-CB 4.31Å
380	A	58.2	Low	66.2	Low	74 Å²	74	45.8 Å²	45.8	61%	0.612	28%	0.283	S	S	*	.	S	Bend	trans	-67.6	-23.9	-174.8	0	0	0	0	0	111	A378 D384	A378-A380 PolarHBondContact O-N 2.96Å; A378-A380 VanDerWaalsContact O-N 3.13Å; A380-D384 PolarHBondContact N-OD2 2.8Å
381	S	73.1	Confident	68.4	Low	31 Å²	31	43.3 Å²	43.3	22%	0.217	27%	0.27	C	S	.	.	S	Bend	trans	-138.2	153.9	173.6	88.9	0	0	0	0	111.5	P379 T383 D384	P379-S381 PolarHBondContact O-N 3.3Å; S381-T383 PolarHBondContact O-N 2.86Å; S381-T383 VanDerWaalsContact O-N 3.16Å; S381-T383 PolarHBondContact OG-N 3.17Å; S381-T383 PolarHBondContact OG-OG1 2.77Å; S381-D384 PolarHBondContact N-OD2 2.88Å; S381-D384 VanDerWaalsContact N-OD2 3.14Å; S381-D384 PolarHBondContact O-N 2.94Å; S381-D384 VanDerWaalsContact O-N 3.16Å; S381-D384 PolarHBondContact OG-N 3.05Å; S381-D384 PolarHBondContact OG-OD1 2.91Å; S381-D384 PolarHBondContact OG-OD2 2.85Å
382	N	81.1	Confident	70.9	Confident	75 Å²	75	41.6 Å²	41.6	40%	0.401	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-8.9	172.3	-57.4	-26.7	0	0	0	112.9	D301 A302 M303	D301-N382 WeakPolarHBondContact OD2-CB 3.35Å; A302-N382 VanDerWaalsContact CB-O 3.27Å; A302-N382 WeakPolarHBondContact CB-O 3.29Å; A302-N382 PolarHBondContact N-O 2.85Å; M303-N382 HydrophobicContact CE-CB 4.36Å; M303-N382 VanDerWaalsContact CE-CG 3.45Å; M303-N382 WeakPolarHBondContact CE-ND2 3.08Å
383	T	84.9	Confident	73.3	Confident	17 Å²	17	35 Å²	35	10%	0.104	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	0.9	176.4	53.2	0	0	0	0	113	Q243 S381 W385	Q243-T383 WeakPolarHBondContact CG-O 3.26Å; Q243-T383 PolarHBondContact NE2-OG1 2.97Å; S381-T383 PolarHBondContact O-N 2.86Å; S381-T383 VanDerWaalsContact O-N 3.16Å; S381-T383 PolarHBondContact OG-N 3.17Å; S381-T383 PolarHBondContact OG-OG1 2.77Å; T383-W385 VanDerWaalsContact O-CD1 3.27Å
384	D	85.2	Confident	75.7	Confident	5 Å²	5	36.2 Å²	36.2	3%	0.027	23%	0.233	C	C	.	.			trans	-87.6	120.2	178.3	-60.4	-12.3	0	0	0	109.8	W228 Y241 Q243 P379 A380 S381	W228-D384 VanDerWaalsContact CH2-OD1 3.32Å; W228-D384 WeakPolarHBondContact CH2-OD1 3.36Å; Y241-D384 HydrophobicContact CD1-CB 4.04Å; Q243-D384 PolarHBondContact NE2-OD1 3.45Å; P379-D384 HydrophobicContact CB-CB 4.31Å; A380-D384 PolarHBondContact N-OD2 2.8Å; S381-D384 PolarHBondContact N-OD2 2.88Å; S381-D384 VanDerWaalsContact N-OD2 3.14Å; S381-D384 PolarHBondContact O-N 2.94Å; S381-D384 VanDerWaalsContact O-N 3.16Å; S381-D384 PolarHBondContact OG-N 3.05Å; S381-D384 PolarHBondContact OG-OD1 2.91Å; S381-D384 PolarHBondContact OG-OD2 2.85Å
385	W	88.9	Confident	78.4	Confident	0 Å²	0	34 Å²	34	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	139	178.2	-68.4	73	0	0	0	110.2	F215 Y241 G242 I244 L300 A302 V305 I357 F366 T383	F215-W385 HydrophobicContact CZ-CH2 4.43Å; Y241-W385 CarbonylContact C-O 3.46Å; Y241-W385 WeakPolarHBondContact CA-O 3.12Å; Y241-W385 WeakPolarHBondContact CD1-O 3.27Å; G242-W385 PolarHBondContact N-O 2.74Å; G242-W385 PolarHBondContact O-N 2.93Å; I244-W385 HydrophobicContact CD1-CB 3.8Å; I244-W385 VanDerWaalsContact CD1-CD1 3.4Å; I244-W385 HydrophobicContact CD1-CD2 3.36Å; I244-W385 HydrophobicContact CD1-CE3 3.99Å; I244-W385 HydrophobicContact CD1-CG 3.24Å; I244-W385 HydrophobicContact CD1-CZ2 4.44Å; L300-W385 HydrophobicContact CB-CZ2 4.03Å; L300-W385 PolarHBondContact O-NE1 2.62Å; L300-W385 VanDerWaalsContact O-NE1 3.12Å; A302-W385 HydrophobicContact CB-CZ2 4.12Å; V305-W385 HydrophobicContact CB-CH2 3.96Å; V305-W385 HydrophobicContact CB-CZ2 4.26Å; V305-W385 HydrophobicContact CG1-CH2 3.97Å; V305-W385 HydrophobicContact CG2-CH2 3.95Å; V305-W385 HydrophobicContact CG2-CZ2 3.89Å; I357-W385 HydrophobicContact CD1-CE3 4.49Å; I357-W385 HydrophobicContact CD1-CH2 4.02Å; I357-W385 HydrophobicContact CD1-CZ2 4.31Å; I357-W385 HydrophobicContact CD1-CZ3 4.12Å; F366-W385 HydrophobicContact CB-CB 4.07Å; F366-W385 HydrophobicContact CB-CE3 4.14Å; F366-W385 HydrophobicContact CD1-CB 3.76Å; F366-W385 HydrophobicContact CG-CB 4.37Å; T383-W385 VanDerWaalsContact O-CD1 3.27Å
386	L	87.2	Confident	81	Confident	21 Å²	21	33.5 Å²	33.5	11%	0.11	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	136.6	179.1	-178	69.8	0	0	0	110.5	Y241 F366 T367 L370	Y241-L386 HydrophobicContact CD1-CB 4.35Å; Y241-L386 HydrophobicContact CD1-CD1 4.46Å; Y241-L386 HydrophobicContact CE1-CB 4.19Å; Y241-L386 HydrophobicContact CE1-CD1 4.2Å; F366-L386 WeakPolarHBondContact CA-O 3.38Å; T367-L386 HydrophobicContact CG2-CB 4.07Å; T367-L386 HydrophobicContact CG2-CD2 4.44Å; T367-L386 HydrophobicContact CG2-CG 4.48Å; T367-L386 WeakPolarHBondContact CG2-O 3.32Å; T367-L386 PolarHBondContact N-O 2.64Å; T367-L386 PolarHBondContact O-N 3.19Å; L370-L386 HydrophobicContact CD1-CD2 3.97Å
387	L	88.6	Confident	83.3	Confident	13 Å²	13	30 Å²	30	7%	0.068	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	123.2	169.2	-71.4	174.1	0	0	0	110.7	F227 G240 L364 F366 F389	F227-L387 HydrophobicContact CB-CD1 4.01Å; G240-L387 WeakPolarHBondContact O-CB 3.38Å; G240-L387 PolarHBondContact O-N 3.07Å; L364-L387 HydrophobicContact CD1-CB 4.49Å; L364-L387 HydrophobicContact CD1-CD2 4.32Å; L364-L387 HydrophobicContact CD2-CD2 3.84Å; L364-L387 HydrophobicContact CG-CD2 3.97Å; F366-L387 HydrophobicContact CD1-CD2 3.8Å; F366-L387 HydrophobicContact CD1-CG 4.48Å; F366-L387 HydrophobicContact CD2-CD2 4.22Å; F366-L387 HydrophobicContact CE1-CD2 3.38Å; F366-L387 HydrophobicContact CE1-CG 4.07Å; F366-L387 HydrophobicContact CE2-CD2 3.81Å; F366-L387 HydrophobicContact CG-CD2 4.22Å; F366-L387 HydrophobicContact CZ-CD2 3.42Å; F366-L387 VanDerWaalsContact CZ-CD2 3.42Å; F366-L387 HydrophobicContact CZ-CG 4.46Å; L387-F389 HydrophobicContact CB-CE2 4.09Å
388	S	91.1	Very high	85.5	Confident	8 Å²	8	33.9 Å²	33.9	6%	0.056	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	126.3	175.1	179.5	0	0	0	0	111.2	F212 Y365 A390	F212-S388 VanDerWaalsContact CE2-OG 3.3Å; F212-S388 WeakPolarHBondContact CE2-OG 3.33Å; F212-S388 VanDerWaalsContact CZ-OG 3.23Å; F212-S388 WeakPolarHBondContact CZ-OG 3.31Å; Y365-S388 PolarHBondContact N-O 3.31Å; Y365-S388 PolarHBondContact O-N 3.2Å; S388-A390 PolarHBondContact OG-N 2.84Å
389	F	93.6	Very high	87.6	Confident	8 Å²	8	33.6 Å²	33.6	4%	0.035	18%	0.178	C	C	.	.			trans	-99.7	8.8	175.6	-68.4	-91.5	0	0	0	112.9	L364 L387 V391 Y392 E393 H481 F483 V484 L495 V499	L364-F389 HydrophobicContact CD1-CD1 3.72Å; L364-F389 HydrophobicContact CD1-CD2 4.24Å; L364-F389 HydrophobicContact CD1-CE1 3.42Å; L364-F389 VanDerWaalsContact CD1-CE1 3.42Å; L364-F389 HydrophobicContact CD1-CE2 4Å; L364-F389 HydrophobicContact CD1-CG 4.11Å; L364-F389 HydrophobicContact CD1-CZ 3.58Å; L387-F389 HydrophobicContact CB-CE2 4.09Å; F389-V391 PolarHBondContact O-N 3.18Å; F389-V391 VanDerWaalsContact O-N 3.1Å; F389-Y392 HydrophobicContact CD1-CD2 4.03Å; F389-Y392 CarbonylContact O-C 3.42Å; F389-Y392 WeakPolarHBondContact O-CA 3.31Å; F389-Y392 WeakPolarHBondContact O-CB 3.01Å; F389-Y392 PolarHBondContact O-N 3.25Å; F389-E393 HydrophobicContact CB-CG 4.43Å; F389-E393 WeakPolarHBondContact O-CG 3.43Å; F389-E393 PolarHBondContact O-N 2.81Å; F389-H481 AromaticContact CD2-CE1 3.26Å; F389-H481 WeakPolarHBondContact CD2-CE1 3.49Å; F389-H481 AromaticContact CD2-NE2 3.35Å; F389-H481 WeakPolarHBondContact CD2-NE2 3.38Å; F389-H481 AromaticContact CE2-CE1 3.65Å; F389-H481 AromaticContact CE2-NE2 3.95Å; F389-H481 AromaticContact CG-CE1 3.5Å; F389-H481 AromaticContact CG-NE2 3.86Å; F389-F483 HydrophobicContact CB-CD2 3.76Å; F389-F483 HydrophobicContact CB-CE2 4.17Å; F389-F483 HydrophobicContact CD1-CB 3.93Å; F389-F483 AromaticContact CD1-CD2 3.83Å; F389-F483 HydrophobicContact CD1-CD2 3.83Å; F389-F483 HydrophobicContact CD1-CG 4.15Å; F389-F483 HydrophobicContact CE1-CB 4.11Å; F389-F483 HydrophobicContact CG-CD2 4.01Å; F389-V484 HydrophobicContact CE1-CG2 4.48Å; F389-V484 HydrophobicContact CE2-CG2 3.84Å; F389-V484 HydrophobicContact CZ-CG2 3.65Å; F389-L495 HydrophobicContact CD1-CD2 4.44Å; F389-L495 HydrophobicContact CE1-CD2 4.44Å; F389-V499 HydrophobicContact CE1-CG1 3.74Å; F389-V499 HydrophobicContact CE1-CG2 4.5Å; F389-V499 HydrophobicContact CZ-CG1 3.83Å; F389-V499 HydrophobicContact CZ-CG2 4.39Å
390	A	94.4	Very high	89.5	Confident	13 Å²	13	32.2 Å²	32.2	11%	0.107	17%	0.169	C	C	.	.	H	α-helix	trans	-57.8	-33.2	-169.3	0	0	0	0	0	113.9	V194 F212 S388 E393 R394	V194-A390 HydrophobicContact CB-CB 3.86Å; V194-A390 HydrophobicContact CG1-CB 4.01Å; V194-A390 HydrophobicContact CG2-CB 4.41Å; F212-A390 HydrophobicContact CE2-CB 4.15Å; F212-A390 HydrophobicContact CZ-CB 4.23Å; S388-A390 PolarHBondContact OG-N 2.84Å; A390-E393 PolarHBondContact O-N 2.76Å; A390-R394 WeakPolarHBondContact O-CB 3.5Å; A390-R394 PolarHBondContact O-N 3.5Å
391	V	95.6	Very high	91.1	Very high	17 Å²	17	31 Å²	31	10%	0.103	16%	0.159	C	C	.	.	H	α-helix	trans	-68.9	-43.7	175	-176.6	0	0	0	0	111.1	I192 V194 F212 D363 Y365 F389 E393 R394 Q395	I192-V391 HydrophobicContact CG2-CG2 3.91Å; V194-V391 HydrophobicContact CG1-CG2 3.81Å; F212-V391 HydrophobicContact CD2-CG2 4.48Å; D363-V391 HydrophobicContact CB-CB 4.23Å; D363-V391 HydrophobicContact CB-CG1 3.82Å; Y365-V391 HydrophobicContact CD2-CG2 3.86Å; Y365-V391 HydrophobicContact CE2-CB 4.22Å; Y365-V391 HydrophobicContact CE2-CG2 3.64Å; F389-V391 PolarHBondContact O-N 3.18Å; F389-V391 VanDerWaalsContact O-N 3.1Å; V391-E393 PolarHBondContact O-N 3.08Å; V391-R394 PolarHBondContact O-N 3.17Å; V391-Q395 WeakPolarHBondContact O-CB 3.46Å; V391-Q395 PolarHBondContact O-N 3.38Å
392	Y	95.6	Very high	92.1	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-62.2	-40	171.7	-74	-66	0	0	0	112.5	D363 L364 F389 Q395 F396 M493 G494 L495	D363-Y392 HydrophobicContact CB-CD1 4.25Å; D363-Y392 HydrophobicContact CB-CD2 4.26Å; D363-Y392 HydrophobicContact CB-CE1 3.87Å; D363-Y392 HydrophobicContact CB-CE2 3.89Å; D363-Y392 HydrophobicContact CB-CG 4.44Å; D363-Y392 PolarHBondContact N-OH 3.32Å; D363-Y392 WeakPolarHBondContact O-CD2 3.45Å; D363-Y392 WeakPolarHBondContact O-CE2 3.43Å; L364-Y392 HydrophobicContact CB-CE2 3.97Å; F389-Y392 HydrophobicContact CD1-CD2 4.03Å; F389-Y392 CarbonylContact O-C 3.42Å; F389-Y392 WeakPolarHBondContact O-CA 3.31Å; F389-Y392 WeakPolarHBondContact O-CB 3.01Å; F389-Y392 PolarHBondContact O-N 3.25Å; Y392-Q395 PolarHBondContact O-N 3.47Å; Y392-F396 WeakPolarHBondContact O-CB 3.08Å; Y392-F396 PolarHBondContact O-N 3.17Å; Y392-M493 HydrophobicContact CD1-CE 4.03Å; Y392-M493 VanDerWaalsContact CE1-O 3.22Å; Y392-M493 WeakPolarHBondContact CE1-O 3.49Å; Y392-M493 WeakPolarHBondContact O-CE 3.41Å; Y392-G494 PolarHBondContact OH-O 3.27Å; Y392-L495 HydrophobicContact CD1-CD2 3.78Å; Y392-L495 HydrophobicContact CD1-CG 4.33Å; Y392-L495 HydrophobicContact CD2-CD2 3.78Å; Y392-L495 HydrophobicContact CE1-CD2 3.81Å; Y392-L495 HydrophobicContact CE1-CG 4.2Å; Y392-L495 HydrophobicContact CE2-CD2 3.79Å; Y392-L495 HydrophobicContact CG-CD2 3.75Å
393	E	95.9	Very high	92.7	Very high	6 Å²	6	36.9 Å²	36.9	3%	0.028	19%	0.19	C	C	.	.	H	α-helix	trans	-61.9	-46.7	177.3	-64.6	169.8	178.9	0	0	111.1	F389 A390 V391 Q395 F396 L397 Y436 K439 L443 F483	F389-E393 HydrophobicContact CB-CG 4.43Å; F389-E393 WeakPolarHBondContact O-CG 3.43Å; F389-E393 PolarHBondContact O-N 2.81Å; A390-E393 PolarHBondContact O-N 2.76Å; V391-E393 PolarHBondContact O-N 3.08Å; E393-Q395 VanDerWaalsContact C-N 3.33Å; E393-Q395 PolarHBondContact O-N 3.16Å; E393-F396 PolarHBondContact O-N 3.06Å; E393-L397 WeakPolarHBondContact O-CG 3.24Å; E393-L397 PolarHBondContact O-N 2.84Å; E393-Y436 WeakPolarHBondContact OE1-CE2 3.26Å; E393-Y436 PolarHBondContact OE1-OH 2.89Å; E393-K439 VanDerWaalsContact CB-NZ 3.33Å; E393-K439 WeakPolarHBondContact OE2-CE 3.42Å; E393-K439 IonicContact OE2-NZ 3.46Å; E393-K439 PolarHBondContact OE2-NZ 2.89Å; E393-L443 HydrophobicContact CG-CD1 4.29Å; E393-F483 HydrophobicContact CB-CE2 4.39Å; E393-F483 HydrophobicContact CG-CD2 4.42Å; E393-F483 HydrophobicContact CG-CE2 3.59Å; E393-F483 HydrophobicContact CG-CZ 4.45Å
394	R	95.6	Very high	93.3	Very high	80 Å²	80	37 Å²	37	30%	0.302	19%	0.189	S	C	.	.	H	α-helix	trans	-59.9	-44	174.1	179.8	-178.3	174.4	-157	-9.9	111.5	G193 Y198 E199 A390 V391 L397 R398	G193-R394 WeakPolarHBondContact O-CD 3.45Å; G193-R394 PolarHBondContact O-NH1 3.14Å; Y198-R394 PolarHBondContact O-NE 3.45Å; E199-R394 HydrophobicContact CG-CB 3.98Å; E199-R394 HydrophobicContact CG-CG 4.15Å; A390-R394 WeakPolarHBondContact O-CB 3.5Å; A390-R394 PolarHBondContact O-N 3.5Å; V391-R394 PolarHBondContact O-N 3.17Å; R394-L397 PolarHBondContact O-N 3.3Å; R394-R398 WeakPolarHBondContact O-CB 3.5Å; R394-R398 PolarHBondContact O-N 2.85Å
395	Q	95.6	Very high	93.7	Very high	48 Å²	48	38.8 Å²	38.8	22%	0.224	20%	0.202	C	C	.	.	H	α-helix	trans	-64.9	-42.1	179.1	176.7	57.8	5.1	0	0	111.8	V391 Y392 E393 R398 M399 M493	V391-Q395 WeakPolarHBondContact O-CB 3.46Å; V391-Q395 PolarHBondContact O-N 3.38Å; Y392-Q395 PolarHBondContact O-N 3.47Å; E393-Q395 VanDerWaalsContact C-N 3.33Å; E393-Q395 PolarHBondContact O-N 3.16Å; Q395-R398 PolarHBondContact O-N 2.86Å; Q395-M399 HydrophobicContact CG-CG 4.49Å; Q395-M399 WeakPolarHBondContact O-CB 3.36Å; Q395-M399 WeakPolarHBondContact O-CG 3.27Å; Q395-M399 PolarHBondContact O-N 3.32Å; Q395-M493 HydrophobicContact CB-CE 4.1Å; Q395-M493 HydrophobicContact CG-CE 4.01Å; Q395-M493 HydrophobicContact CG-SD 4.06Å
396	F	96.1	Very high	93.8	Very high	8 Å²	8	48.2 Å²	48.2	4%	0.035	25%	0.245	C	C	.	.	H	α-helix	trans	-61.8	-49.8	175.9	179.1	-90.5	0	0	0	110.9	Y392 E393 R398 M399 T400 L443 L446 L447 F482 F483 M493	Y392-F396 WeakPolarHBondContact O-CB 3.08Å; Y392-F396 PolarHBondContact O-N 3.17Å; E393-F396 PolarHBondContact O-N 3.06Å; F396-R398 VanDerWaalsContact C-N 3.28Å; F396-R398 PolarHBondContact O-N 2.96Å; F396-M399 PolarHBondContact O-N 3.34Å; F396-M399 VanDerWaalsContact O-N 3.16Å; F396-T400 WeakPolarHBondContact CE1-OG1 3.35Å; F396-T400 WeakPolarHBondContact O-CB 3.46Å; F396-T400 PolarHBondContact O-N 2.98Å; F396-T400 PolarHBondContact O-OG1 3.16Å; F396-L443 HydrophobicContact CD1-CD2 3.43Å; F396-L443 VanDerWaalsContact CD1-CD2 3.43Å; F396-L443 HydrophobicContact CE1-CD2 3.73Å; F396-L443 HydrophobicContact CG-CD2 4.49Å; F396-L446 HydrophobicContact CE1-CB 4.14Å; F396-L446 HydrophobicContact CE1-CD1 4.4Å; F396-L446 HydrophobicContact CZ-CB 4.48Å; F396-L447 HydrophobicContact CE2-CD1 4.43Å; F396-F482 HydrophobicContact CD1-CE1 4.04Å; F396-F482 HydrophobicContact CD1-CZ 4.24Å; F396-F482 AromaticContact CD2-CE1 3.73Å; F396-F482 HydrophobicContact CD2-CE1 3.73Å; F396-F482 AromaticContact CD2-CZ 3.99Å; F396-F482 HydrophobicContact CD2-CZ 3.99Å; F396-F482 HydrophobicContact CE1-CE1 4.08Å; F396-F482 AromaticContact CE1-CZ 3.8Å; F396-F482 HydrophobicContact CE1-CZ 3.8Å; F396-F482 AromaticContact CE2-CE1 3.81Å; F396-F482 HydrophobicContact CE2-CE1 3.81Å; F396-F482 AromaticContact CE2-CZ 3.54Å; F396-F482 HydrophobicContact CE2-CZ 3.54Å; F396-F482 AromaticContact CG-CE1 3.84Å; F396-F482 HydrophobicContact CG-CE1 3.84Å; F396-F482 HydrophobicContact CG-CZ 4.31Å; F396-F482 AromaticContact CZ-CE1 3.97Å; F396-F482 HydrophobicContact CZ-CE1 3.97Å; F396-F482 HydrophobicContact CZ-CE2 4.42Å; F396-F482 AromaticContact CZ-CZ 3.43Å; F396-F482 HydrophobicContact CZ-CZ 3.43Å; F396-F482 VanDerWaalsContact CZ-CZ 3.43Å; F396-F483 HydrophobicContact CB-CZ 4.15Å; F396-M493 HydrophobicContact CB-CE 3.75Å; F396-M493 HydrophobicContact CB-SD 4.25Å; F396-M493 HydrophobicContact CD2-SD 4.48Å
397	L	95.9	Very high	93.8	Very high	8 Å²	8	50 Å²	50	4%	0.042	27%	0.269	C	S	.	.	H	α-helix	trans	-58.8	-41.2	177.2	-73.7	171.9	0	0	0	111.6	E199 E393 R394 T400 A401 L443 L446	E199-L397 HydrophobicContact CB-CD1 3.95Å; E199-L397 HydrophobicContact CG-CD1 3.98Å; E393-L397 WeakPolarHBondContact O-CG 3.24Å; E393-L397 PolarHBondContact O-N 2.84Å; R394-L397 PolarHBondContact O-N 3.3Å; L397-T400 PolarHBondContact O-N 3.12Å; L397-A401 WeakPolarHBondContact O-CB 3.39Å; L397-A401 PolarHBondContact O-N 3.34Å; L397-L443 HydrophobicContact CD2-CD2 3.7Å; L397-L443 HydrophobicContact CG-CD2 3.91Å; L397-L446 HydrophobicContact CD2-CD1 3.86Å
398	R	94.5	Very high	94.1	Very high	140 Å²	140	50 Å²	50	53%	0.528	27%	0.271	S	S	.	.	H	α-helix	trans	-63.4	-41.4	176.3	-175.9	173.6	73.8	156.2	-0.2	112.5	R394 Q395 F396 K402	R394-R398 WeakPolarHBondContact O-CB 3.5Å; R394-R398 PolarHBondContact O-N 2.85Å; Q395-R398 PolarHBondContact O-N 2.86Å; F396-R398 VanDerWaalsContact C-N 3.28Å; F396-R398 PolarHBondContact O-N 2.96Å; R398-K402 WeakPolarHBondContact O-CG 3.45Å
399	M	94.1	Very high	94.3	Very high	83 Å²	83	49.7 Å²	49.7	41%	0.409	27%	0.269	S	S	.	.	H	α-helix	trans	-67.2	-48.8	177.6	-73.2	-76.3	-72.3	0	0	110.8	Q395 F396 A401 K402 A403	Q395-M399 HydrophobicContact CG-CG 4.49Å; Q395-M399 WeakPolarHBondContact O-CB 3.36Å; Q395-M399 WeakPolarHBondContact O-CG 3.27Å; Q395-M399 PolarHBondContact O-N 3.32Å; F396-M399 PolarHBondContact O-N 3.34Å; F396-M399 VanDerWaalsContact O-N 3.16Å; M399-A401 PolarHBondContact O-N 2.87Å; M399-K402 WeakPolarHBondContact O-CB 3.23Å; M399-K402 PolarHBondContact O-N 3.11Å; M399-A403 PolarHBondContact O-N 3.45Å
400	T	93.7	Very high	94.4	Very high	20 Å²	20	49.9 Å²	49.9	12%	0.123	27%	0.27	C	S	.	.	H	α-helix	trans	-62	-44.4	179.3	-57.9	0	0	0	0	111.2	F396 L397 K402 A403 L404 L446	F396-T400 WeakPolarHBondContact CE1-OG1 3.35Å; F396-T400 WeakPolarHBondContact O-CB 3.46Å; F396-T400 PolarHBondContact O-N 2.98Å; F396-T400 PolarHBondContact O-OG1 3.16Å; L397-T400 PolarHBondContact O-N 3.12Å; T400-K402 PolarHBondContact O-N 2.92Å; T400-K402 VanDerWaalsContact O-N 3.12Å; T400-A403 WeakPolarHBondContact O-CA 3.39Å; T400-A403 WeakPolarHBondContact O-CB 3.4Å; T400-A403 PolarHBondContact O-N 2.81Å; T400-L404 HydrophobicContact CG2-CD1 4.05Å; T400-L404 HydrophobicContact CG2-CD2 4.35Å; T400-L404 HydrophobicContact CG2-CG 4Å; T400-L404 WeakPolarHBondContact O-CG 3.33Å; T400-L404 PolarHBondContact O-N 3.26Å; T400-L446 HydrophobicContact CG2-CB 4.26Å; T400-L446 HydrophobicContact CG2-CD1 4.4Å; T400-L446 HydrophobicContact CG2-CD2 3.8Å; T400-L446 HydrophobicContact CG2-CG 4.39Å
401	A	93.5	Very high	94.4	Very high	49 Å²	49	50.6 Å²	50.6	41%	0.405	27%	0.272	S	S	.	.	H	α-helix	trans	-58	-28.8	177.9	0	0	0	0	0	113.7	L397 M399	L397-A401 WeakPolarHBondContact O-CB 3.39Å; L397-A401 PolarHBondContact O-N 3.34Å; M399-A401 PolarHBondContact O-N 2.87Å
402	K	94	Very high	94.2	Very high	158 Å²	158	50.6 Å²	50.6	69%	0.687	27%	0.272	S	S	*	.	H	α-helix	trans	-74.4	-26.1	174	-68	173.5	-179.2	-178.1	0	113.2	R398 M399 T400	R398-K402 WeakPolarHBondContact O-CG 3.45Å; M399-K402 WeakPolarHBondContact O-CB 3.23Å; M399-K402 PolarHBondContact O-N 3.11Å; T400-K402 PolarHBondContact O-N 2.92Å; T400-K402 VanDerWaalsContact O-N 3.12Å
403	A	93.6	Very high	94.2	Very high	70 Å²	70	50.6 Å²	50.6	58%	0.579	27%	0.272	S	S	*	.	H	α-helix	trans	-89.3	-20.8	178.4	0	0	0	0	0	112.6	M399 T400 A451	M399-A403 PolarHBondContact O-N 3.45Å; T400-A403 WeakPolarHBondContact O-CA 3.39Å; T400-A403 WeakPolarHBondContact O-CB 3.4Å; T400-A403 PolarHBondContact O-N 2.81Å; A403-A451 WeakPolarHBondContact O-CB 3.44Å
404	L	96.1	Very high	94.1	Very high	19 Å²	19	50.3 Å²	50.3	10%	0.099	27%	0.271	C	S	.	.	S	Bend	trans	-78.5	156.5	178.3	-66.3	-174.9	0	0	0	112.4	T400 A408 H410 L446 A451 W454	T400-L404 HydrophobicContact CG2-CD1 4.05Å; T400-L404 HydrophobicContact CG2-CD2 4.35Å; T400-L404 HydrophobicContact CG2-CG 4Å; T400-L404 WeakPolarHBondContact O-CG 3.33Å; T400-L404 PolarHBondContact O-N 3.26Å; L404-A408 HydrophobicContact CB-CB 3.71Å; L404-A408 HydrophobicContact CD1-CB 3.84Å; L404-A408 HydrophobicContact CG-CB 4.38Å; L404-H410 HydrophobicContact CD1-CB 4.32Å; L404-L446 HydrophobicContact CD1-CD2 3.92Å; L404-A451 HydrophobicContact CD2-CB 3.91Å; L404-W454 HydrophobicContact CD1-CB 4.2Å; L404-W454 HydrophobicContact CD1-CG 4.27Å; L404-W454 HydrophobicContact CD2-CB 3.91Å; L404-W454 HydrophobicContact CD2-CG 3.88Å
405	P	94.3	Very high	94	Very high	44 Å²	44	46.7 Å²	46.7	29%	0.286	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-58.1	152.8	172.2	-22.8	32.9	0	0	0	112.6	G407 A408 A451 K455	P405-G407 PolarHBondContact O-N 2.85Å; P405-A408 VanDerWaalsContact O-CB 3.29Å; P405-A408 WeakPolarHBondContact O-CB 3.39Å; P405-A408 PolarHBondContact O-N 3.31Å; P405-A451 WeakPolarHBondContact CD-O 3.39Å; P405-A451 WeakPolarHBondContact CG-O 3.18Å; P405-K455 HydrophobicContact CG-CG 4.21Å
406	E	90.6	Very high	93.9	Very high	197 Å²	197	44.4 Å²	44.4	92%	0.921	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	133.8	171.9	-69.3	-175.2	177.6	0	0	111	A408	E406-A408 VanDerWaalsContact C-N 3.33Å
407	G	88.4	Confident	93.8	Very high	58 Å²	58	44 Å²	44	60%	0.598	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.4	19.6	-176	0	0	0	0	0	114.7	P405 C409 T456	P405-G407 PolarHBondContact O-N 2.85Å; G407-C409 PolarHBondContact O-N 2.88Å; G407-T456 WeakPolarHBondContact O-CG2 3.32Å
408	A	95	Very high	93.7	Very high	13 Å²	13	43.7 Å²	43.7	11%	0.107	24%	0.243	C	C	.	.			trans	-51.6	137	-178.4	0	0	0	0	0	114.4	L404 P405 E406 H410 W454	L404-A408 HydrophobicContact CB-CB 3.71Å; L404-A408 HydrophobicContact CD1-CB 3.84Å; L404-A408 HydrophobicContact CG-CB 4.38Å; P405-A408 VanDerWaalsContact O-CB 3.29Å; P405-A408 WeakPolarHBondContact O-CB 3.39Å; P405-A408 PolarHBondContact O-N 3.31Å; E406-A408 VanDerWaalsContact C-N 3.33Å; A408-H410 VanDerWaalsContact C-N 3.29Å; A408-H410 PolarHBondContact O-N 3.23Å; A408-H410 PolarHBondContact O-ND1 3.27Å; A408-H410 VanDerWaalsContact O-ND1 3.14Å; A408-W454 CarbonylContact C-O 3.51Å; A408-W454 WeakPolarHBondContact CA-O 3.23Å; A408-W454 HydrophobicContact CB-CB 4.17Å; A408-W454 WeakPolarHBondContact CB-O 3.03Å
409	C	94.2	Very high	93.6	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.02	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-2.1	-169	64.2	0	0	0	0	115.4	G407 L411 S412 C413 W454 K455 L459	G407-C409 PolarHBondContact O-N 2.88Å; C409-L411 PolarHBondContact O-N 2.57Å; C409-S412 CarbonylContact O-C 3.58Å; C409-S412 WeakPolarHBondContact O-CB 3.42Å; C409-S412 PolarHBondContact O-N 3.22Å; C409-S412 VanDerWaalsContact O-N 3.13Å; C409-C413 PolarHBondContact O-N 3.05Å; C409-C413 PolarHBondContact O-SG 2.86Å; C409-W454 PolarHBondContact N-O 2.87Å; C409-W454 PolarHBondContact SG-O 3.09Å; C409-K455 PolarHBondContact SG-O 3.03Å; C409-L459 HydrophobicContact CB-CB 4.04Å; C409-L459 HydrophobicContact CB-CD1 4Å
410	H	95.4	Very high	93.5	Very high	11 Å²	11	34.6 Å²	34.6	5%	0.051	21%	0.206	C	C	.	.	H	α-helix	trans	-54.8	-47.4	-175.8	65.4	-56.6	0	0	0	114.4	L404 A408 C413 L414 L442 L446 W454	L404-H410 HydrophobicContact CD1-CB 4.32Å; A408-H410 VanDerWaalsContact C-N 3.29Å; A408-H410 PolarHBondContact O-N 3.23Å; A408-H410 PolarHBondContact O-ND1 3.27Å; A408-H410 VanDerWaalsContact O-ND1 3.14Å; H410-C413 WeakPolarHBondContact O-CB 3.47Å; H410-C413 PolarHBondContact O-N 2.77Å; H410-L414 PolarHBondContact O-N 3Å; H410-L414 VanDerWaalsContact O-N 3.17Å; H410-L442 HydrophobicContact CB-CD1 4.4Å; H410-L442 HydrophobicContact CB-CD2 4.46Å; H410-L446 HydrophobicContact CB-CD2 3.88Å; H410-W454 HydrophobicContact CB-CD2 4.14Å; H410-W454 HydrophobicContact CB-CE3 3.49Å; H410-W454 VanDerWaalsContact CB-CE3 3.49Å; H410-W454 HydrophobicContact CB-CH2 4.5Å; H410-W454 HydrophobicContact CB-CZ3 3.7Å
411	L	94.2	Very high	93.5	Very high	29 Å²	29	34 Å²	34	15%	0.152	20%	0.202	C	C	.	.	H	α-helix	trans	-68.9	-38.4	177	-59.1	179.2	0	0	0	111.1	N200 W201 C409 C413 L414 Q415	N200-L411 HydrophobicContact CB-CD1 3.86Å; W201-L411 HydrophobicContact CB-CB 4.42Å; W201-L411 HydrophobicContact CB-CD2 4.16Å; C409-L411 PolarHBondContact O-N 2.57Å; L411-C413 VanDerWaalsContact C-N 3.31Å; L411-C413 PolarHBondContact O-N 3.11Å; L411-L414 PolarHBondContact O-N 3.44Å; L411-Q415 WeakPolarHBondContact O-CB 3.22Å; L411-Q415 WeakPolarHBondContact O-CG 3.5Å; L411-Q415 PolarHBondContact O-N 2.84Å; L411-Q415 PolarHBondContact O-OE1 3.2Å
412	S	92.4	Very high	93.4	Very high	17 Å²	17	33.6 Å²	33.6	12%	0.119	20%	0.196	C	C	.	.	H	α-helix	trans	-59.5	-41.7	174.3	-52.6	0	0	0	0	111.8	Y147 C409 Q415 I416	Y147-S412 WeakPolarHBondContact CE2-OG 3.44Å; C409-S412 CarbonylContact O-C 3.58Å; C409-S412 WeakPolarHBondContact O-CB 3.42Å; C409-S412 PolarHBondContact O-N 3.22Å; C409-S412 VanDerWaalsContact O-N 3.13Å; S412-Q415 PolarHBondContact O-N 2.81Å; S412-I416 WeakPolarHBondContact O-CB 3.33Å; S412-I416 WeakPolarHBondContact O-CD1 3.46Å; S412-I416 WeakPolarHBondContact O-CG1 3.5Å; S412-I416 PolarHBondContact O-N 2.74Å
413	C	94.4	Very high	93.3	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.007	17%	0.172	C	C	.	.	H	α-helix	trans	-57.9	-50.7	174.2	-65.3	0	0	0	0	111.1	C409 H410 L411 Q415 I416 A417 L459 R462	C409-C413 PolarHBondContact O-N 3.05Å; C409-C413 PolarHBondContact O-SG 2.86Å; H410-C413 WeakPolarHBondContact O-CB 3.47Å; H410-C413 PolarHBondContact O-N 2.77Å; L411-C413 VanDerWaalsContact C-N 3.31Å; L411-C413 PolarHBondContact O-N 3.11Å; C413-Q415 VanDerWaalsContact C-N 3.34Å; C413-Q415 PolarHBondContact O-N 2.76Å; C413-I416 PolarHBondContact O-N 3.37Å; C413-A417 WeakPolarHBondContact O-CB 3.39Å; C413-A417 PolarHBondContact O-N 3.1Å; C413-L459 VanDerWaalsContact SG-CD1 3.56Å; C413-R462 VanDerWaalsContact SG-CB 3.56Å
414	L	95.1	Very high	93.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.7	-38.8	179.8	-179.2	59.5	0	0	0	112.1	W201 H410 L411 A417 S418 L438 K439 L442	W201-L414 HydrophobicContact CB-CD2 4.18Å; W201-L414 HydrophobicContact CD2-CD2 3.4Å; W201-L414 HydrophobicContact CD2-CG 3.91Å; W201-L414 HydrophobicContact CE3-CD1 4.45Å; W201-L414 HydrophobicContact CE3-CD2 3.7Å; W201-L414 HydrophobicContact CE3-CG 3.68Å; W201-L414 HydrophobicContact CG-CD2 3.61Å; W201-L414 HydrophobicContact CG-CG 4.29Å; W201-L414 HydrophobicContact CZ2-CD2 4.36Å; W201-L414 HydrophobicContact CZ3-CD2 4.3Å; W201-L414 HydrophobicContact CZ3-CG 4.22Å; H410-L414 PolarHBondContact O-N 3Å; H410-L414 VanDerWaalsContact O-N 3.17Å; L411-L414 PolarHBondContact O-N 3.44Å; L414-A417 PolarHBondContact O-N 3.15Å; L414-S418 VanDerWaalsContact O-CB 3.24Å; L414-S418 WeakPolarHBondContact O-CB 3.4Å; L414-S418 PolarHBondContact O-N 3.3Å; L414-S418 PolarHBondContact O-OG 3.35Å; L414-L438 HydrophobicContact CD1-CB 3.73Å; L414-K439 HydrophobicContact CD1-CB 4.4Å; L414-K439 HydrophobicContact CD2-CB 4.32Å; L414-K439 HydrophobicContact CD2-CG 4.43Å; L414-L442 HydrophobicContact CB-CD2 3.89Å; L414-L442 HydrophobicContact CD2-CD2 3.98Å; L414-L442 HydrophobicContact CG-CD2 4.48Å
415	Q	93.5	Very high	93	Very high	5 Å²	5	25.6 Å²	25.6	2%	0.023	15%	0.151	C	C	.	.	H	α-helix	trans	-64.3	-43.1	177.9	-73.1	170	-54.2	0	0	111.8	Y147 I151 W201 V203 L411 S412 C413 F419	Y147-Q415 VanDerWaalsContact CE2-OE1 3.24Å; Y147-Q415 PolarHBondContact OH-OE1 3.12Å; I151-Q415 HydrophobicContact CD1-CB 3.94Å; I151-Q415 HydrophobicContact CG2-CB 4Å; I151-Q415 HydrophobicContact CG2-CG 4.22Å; W201-Q415 HydrophobicContact CB-CG 3.86Å; V203-Q415 HydrophobicContact CG2-CB 4.2Å; V203-Q415 HydrophobicContact CG2-CG 4.14Å; L411-Q415 WeakPolarHBondContact O-CB 3.22Å; L411-Q415 WeakPolarHBondContact O-CG 3.5Å; L411-Q415 PolarHBondContact O-N 2.84Å; L411-Q415 PolarHBondContact O-OE1 3.2Å; S412-Q415 PolarHBondContact O-N 2.81Å; C413-Q415 VanDerWaalsContact C-N 3.34Å; C413-Q415 PolarHBondContact O-N 2.76Å; Q415-F419 VanDerWaalsContact O-CB 3.3Å; Q415-F419 WeakPolarHBondContact O-CB 3.44Å; Q415-F419 PolarHBondContact O-N 2.86Å
416	I	92.7	Very high	92.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.7	-46.4	176.9	-66.2	162.6	0	0	0	110.4	L143 F146 I151 S412 C413 S418 F419 L420 L459 L463 I536	L143-I416 HydrophobicContact CB-CD1 4.5Å; L143-I416 HydrophobicContact CD2-CD1 4.26Å; L143-I416 HydrophobicContact CD2-CG2 4.33Å; F146-I416 HydrophobicContact CD1-CG1 4.11Å; F146-I416 HydrophobicContact CE1-CG1 4.05Å; I151-I416 HydrophobicContact CD1-CG1 3.72Å; S412-I416 WeakPolarHBondContact O-CB 3.33Å; S412-I416 WeakPolarHBondContact O-CD1 3.46Å; S412-I416 WeakPolarHBondContact O-CG1 3.5Å; S412-I416 PolarHBondContact O-N 2.74Å; C413-I416 PolarHBondContact O-N 3.37Å; I416-S418 PolarHBondContact O-N 3.35Å; I416-F419 WeakPolarHBondContact O-CB 3.49Å; I416-F419 PolarHBondContact O-N 2.77Å; I416-L420 HydrophobicContact CG2-CD1 4.2Å; I416-L420 WeakPolarHBondContact O-CG 3.38Å; I416-L420 PolarHBondContact O-N 3.16Å; I416-L459 HydrophobicContact CD1-CD1 4.1Å; I416-L459 HydrophobicContact CD1-CD2 4.11Å; I416-L459 HydrophobicContact CD1-CG 4.47Å; I416-L463 HydrophobicContact CB-CD1 4.44Å; I416-L463 HydrophobicContact CG2-CD1 4.26Å; I416-L463 HydrophobicContact CG2-CD2 3.75Å; I416-I536 HydrophobicContact CG2-CD1 4.01Å
417	A	94.8	Very high	92.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.8	-44.2	179.1	0	0	0	0	0	112.1	C413 L414 L420 L421 L438 L463 L466 F467	C413-A417 WeakPolarHBondContact O-CB 3.39Å; C413-A417 PolarHBondContact O-N 3.1Å; L414-A417 PolarHBondContact O-N 3.15Å; A417-L420 PolarHBondContact O-N 2.9Å; A417-L421 WeakPolarHBondContact O-CB 3.29Å; A417-L421 PolarHBondContact O-N 3.32Å; A417-L438 HydrophobicContact CB-CD1 3.95Å; A417-L438 HydrophobicContact CB-CD2 4.3Å; A417-L463 HydrophobicContact CB-CD1 4.28Å; A417-L466 HydrophobicContact CB-CD2 3.74Å; A417-F467 HydrophobicContact CB-CE1 4.09Å; A417-F467 HydrophobicContact CB-CZ 4.03Å
418	S	93.4	Very high	92.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-68.6	-36.4	178.7	-52.2	0	0	0	0	111.4	V203 L414 I416 L421 S422 D435	V203-S418 VanDerWaalsContact CG2-CB 3.42Å; L414-S418 VanDerWaalsContact O-CB 3.24Å; L414-S418 WeakPolarHBondContact O-CB 3.4Å; L414-S418 PolarHBondContact O-N 3.3Å; L414-S418 PolarHBondContact O-OG 3.35Å; I416-S418 PolarHBondContact O-N 3.35Å; S418-L421 PolarHBondContact O-N 3.39Å; S418-S422 VanDerWaalsContact O-CB 3.3Å; S418-S422 WeakPolarHBondContact O-CB 3.47Å; S418-S422 PolarHBondContact O-N 2.88Å; S418-D435 WeakPolarHBondContact CB-OD1 3.29Å
419	F	91.8	Very high	92.3	Very high	32 Å²	32	27.8 Å²	27.8	14%	0.14	15%	0.145	C	C	.	.	H	α-helix	trans	-59	-48.6	171.8	171.3	-90.4	0	0	0	111.2	F146 Q415 I416 S422 K423 Y539	F146-F419 HydrophobicContact CE1-CD1 4.26Å; F146-F419 HydrophobicContact CE1-CG 4.5Å; F146-F419 HydrophobicContact CE2-CD1 4.32Å; F146-F419 AromaticContact CE2-CE1 3.87Å; F146-F419 HydrophobicContact CE2-CE1 3.87Å; F146-F419 HydrophobicContact CE2-CE2 4.47Å; F146-F419 AromaticContact CE2-CZ 3.95Å; F146-F419 HydrophobicContact CE2-CZ 3.95Å; F146-F419 AromaticContact CZ-CD1 3.51Å; F146-F419 HydrophobicContact CZ-CD1 3.51Å; F146-F419 HydrophobicContact CZ-CD2 4.1Å; F146-F419 AromaticContact CZ-CE1 3.53Å; F146-F419 HydrophobicContact CZ-CE1 3.53Å; F146-F419 HydrophobicContact CZ-CE2 4.1Å; F146-F419 AromaticContact CZ-CG 3.81Å; F146-F419 HydrophobicContact CZ-CG 3.81Å; F146-F419 AromaticContact CZ-CZ 3.83Å; F146-F419 HydrophobicContact CZ-CZ 3.83Å; Q415-F419 VanDerWaalsContact O-CB 3.3Å; Q415-F419 WeakPolarHBondContact O-CB 3.44Å; Q415-F419 PolarHBondContact O-N 2.86Å; I416-F419 WeakPolarHBondContact O-CB 3.49Å; I416-F419 PolarHBondContact O-N 2.77Å; F419-S422 PolarHBondContact O-N 3.46Å; F419-K423 HydrophobicContact CD1-CG 4.28Å; F419-K423 HydrophobicContact CE1-CG 3.91Å; F419-K423 HydrophobicContact CE2-CD 4.45Å; F419-K423 HydrophobicContact CE2-CG 4.17Å; F419-K423 HydrophobicContact CZ-CD 4.29Å; F419-K423 HydrophobicContact CZ-CG 3.85Å; F419-K423 VanDerWaalsContact O-CG 3.31Å; F419-K423 WeakPolarHBondContact O-CG 3.47Å; F419-K423 PolarHBondContact O-N 2.94Å; F419-Y539 HydrophobicContact CE2-CD1 4.28Å; F419-Y539 HydrophobicContact CE2-CE1 4.27Å; F419-Y539 AromaticContact CZ-CD1 3.83Å; F419-Y539 HydrophobicContact CZ-CD1 3.83Å; F419-Y539 HydrophobicContact CZ-CD2 4.12Å; F419-Y539 AromaticContact CZ-CE1 3.96Å; F419-Y539 HydrophobicContact CZ-CE1 3.96Å; F419-Y539 HydrophobicContact CZ-CE2 4.25Å; F419-Y539 AromaticContact CZ-CG 3.9Å; F419-Y539 HydrophobicContact CZ-CG 3.9Å
420	L	92.6	Very high	91.9	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-61.6	-44.9	178.5	-70.9	172.1	0	0	0	111.5	I416 A417 S422 K423 Q424 F467 M528 A532 L535 I536	I416-L420 HydrophobicContact CG2-CD1 4.2Å; I416-L420 WeakPolarHBondContact O-CG 3.38Å; I416-L420 PolarHBondContact O-N 3.16Å; A417-L420 PolarHBondContact O-N 2.9Å; L420-S422 PolarHBondContact O-N 3.33Å; L420-K423 PolarHBondContact O-N 3.48Å; L420-Q424 WeakPolarHBondContact O-CB 3.45Å; L420-Q424 PolarHBondContact O-N 3.13Å; L420-F467 HydrophobicContact CD1-CE2 4.28Å; L420-F467 HydrophobicContact CD1-CZ 3.87Å; L420-M528 HydrophobicContact CB-CG 3.9Å; L420-M528 HydrophobicContact CB-SD 3.87Å; L420-A532 HydrophobicContact CD1-CB 3.79Å; L420-A532 HydrophobicContact CD2-CB 3.81Å; L420-A532 HydrophobicContact CG-CB 4.46Å; L420-L535 HydrophobicContact CD2-CB 4.48Å; L420-L535 HydrophobicContact CD2-CD1 4.4Å; L420-I536 HydrophobicContact CD1-CD1 4.08Å; L420-I536 HydrophobicContact CD2-CD1 4.1Å; L420-I536 HydrophobicContact CD2-CG1 4.14Å; L420-I536 HydrophobicContact CG-CD1 4.39Å
421	L	93.8	Very high	91.6	Very high	7 Å²	7	32.4 Å²	32.4	4%	0.037	18%	0.176	C	C	.	.	H	α-helix	trans	-62.1	-42.9	177.4	179.5	62.1	0	0	0	111.8	A417 S418 Q424 S425 L433 L438 M528	A417-L421 WeakPolarHBondContact O-CB 3.29Å; A417-L421 PolarHBondContact O-N 3.32Å; S418-L421 PolarHBondContact O-N 3.39Å; L421-Q424 PolarHBondContact O-N 3.03Å; L421-S425 WeakPolarHBondContact O-CB 3.43Å; L421-S425 PolarHBondContact O-N 2.86Å; L421-S425 PolarHBondContact O-OG 3.49Å; L421-L433 HydrophobicContact CD1-CB 3.94Å; L421-L433 HydrophobicContact CD2-CB 4.31Å; L421-L438 HydrophobicContact CB-CD1 3.99Å; L421-L438 HydrophobicContact CD2-CD1 3.68Å; L421-L438 HydrophobicContact CD2-CG 4.07Å; L421-L438 HydrophobicContact CG-CD1 4.48Å; L421-M528 HydrophobicContact CB-SD 4.15Å
422	S	91.2	Very high	91.3	Very high	41 Å²	41	31.1 Å²	31.1	29%	0.287	17%	0.17	S	C	.	.	H	α-helix	trans	-63.5	-42.4	177.2	-172	0	0	0	0	111.8	S418 F419 L420 S425 R426	S418-S422 VanDerWaalsContact O-CB 3.3Å; S418-S422 WeakPolarHBondContact O-CB 3.47Å; S418-S422 PolarHBondContact O-N 2.88Å; F419-S422 PolarHBondContact O-N 3.46Å; L420-S422 PolarHBondContact O-N 3.33Å; S422-S425 PolarHBondContact O-N 3.48Å; S422-R426 WeakPolarHBondContact O-CG 3.45Å; S422-R426 PolarHBondContact O-N 2.76Å; S422-R426 VanDerWaalsContact O-N 3.17Å
423	K	90.8	Very high	91.3	Very high	44 Å²	44	30.9 Å²	30.9	19%	0.191	17%	0.167	C	C	.	.	H	α-helix	trans	-66.5	-44.2	176.1	-68.1	-65.2	176.1	177.8	0	111.5	F419 L420 S425 R426 L427 L535 Y539	F419-K423 HydrophobicContact CD1-CG 4.28Å; F419-K423 HydrophobicContact CE1-CG 3.91Å; F419-K423 HydrophobicContact CE2-CD 4.45Å; F419-K423 HydrophobicContact CE2-CG 4.17Å; F419-K423 HydrophobicContact CZ-CD 4.29Å; F419-K423 HydrophobicContact CZ-CG 3.85Å; F419-K423 VanDerWaalsContact O-CG 3.31Å; F419-K423 WeakPolarHBondContact O-CG 3.47Å; F419-K423 PolarHBondContact O-N 2.94Å; L420-K423 PolarHBondContact O-N 3.48Å; K423-S425 VanDerWaalsContact C-N 3.33Å; K423-S425 PolarHBondContact O-N 2.84Å; K423-R426 PolarHBondContact O-N 3.34Å; K423-L427 WeakPolarHBondContact O-CG 3.17Å; K423-L427 PolarHBondContact O-N 2.91Å; K423-L535 HydrophobicContact CB-CD1 4.43Å; K423-Y539 WeakPolarHBondContact CE-OH 3.39Å; K423-Y539 PolarHBondContact NZ-OH 3.14Å
424	Q	92.8	Very high	91.2	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-61.7	-43.9	176.7	-173.7	64.7	33.8	0	0	111.2	L420 L421 R426 L427 T428 S524 M528	L420-Q424 WeakPolarHBondContact O-CB 3.45Å; L420-Q424 PolarHBondContact O-N 3.13Å; L421-Q424 PolarHBondContact O-N 3.03Å; Q424-R426 PolarHBondContact O-N 3.36Å; Q424-L427 PolarHBondContact O-N 3.35Å; Q424-T428 PolarHBondContact NE2-OG1 2.87Å; Q424-T428 VanDerWaalsContact NE2-OG1 3.09Å; Q424-T428 PolarHBondContact O-N 2.86Å; Q424-T428 PolarHBondContact O-OG1 2.91Å; Q424-T428 VanDerWaalsContact O-OG1 3.1Å; Q424-S524 WeakPolarHBondContact CG-OG 3.23Å; Q424-M528 HydrophobicContact CB-CB 3.95Å; Q424-M528 HydrophobicContact CB-CG 4.03Å; Q424-M528 HydrophobicContact CG-CB 3.85Å; Q424-M528 HydrophobicContact CG-CG 4.48Å
425	S	90.9	Very high	91.1	Very high	33 Å²	33	33.5 Å²	33.5	23%	0.231	18%	0.183	C	C	.	.	H	α-helix	trans	-62.8	-27.8	178.7	-59.8	0	0	0	0	112.9	L421 S422 K423 G429	L421-S425 WeakPolarHBondContact O-CB 3.43Å; L421-S425 PolarHBondContact O-N 2.86Å; L421-S425 PolarHBondContact O-OG 3.49Å; S422-S425 PolarHBondContact O-N 3.48Å; K423-S425 VanDerWaalsContact C-N 3.33Å; K423-S425 PolarHBondContact O-N 2.84Å; S425-G429 WeakPolarHBondContact CA-O 3.41Å; S425-G429 CarbonylContact O-C 3.55Å; S425-G429 WeakPolarHBondContact O-CA 3.37Å; S425-G429 PolarHBondContact O-N 3.01Å
426	R	90.1	Very high	91.1	Very high	177 Å²	177	35.8 Å²	35.8	67%	0.668	19%	0.192	S	C	*	.	H	α-helix	trans	-76.4	-26.3	172.5	-70	172.6	-175	-135.3	1	113.2	S422 K423 Q424	S422-R426 WeakPolarHBondContact O-CG 3.45Å; S422-R426 PolarHBondContact O-N 2.76Å; S422-R426 VanDerWaalsContact O-N 3.17Å; K423-R426 PolarHBondContact O-N 3.34Å; Q424-R426 PolarHBondContact O-N 3.36Å
427	L	89.5	Confident	91.2	Very high	113 Å²	113	36 Å²	36	59%	0.592	19%	0.193	S	C	*	.	H	α-helix	trans	-85.6	-49.9	-178.9	-69.1	171	0	0	0	111.8	K423 Q424	K423-L427 WeakPolarHBondContact O-CG 3.17Å; K423-L427 PolarHBondContact O-N 2.91Å; Q424-L427 PolarHBondContact O-N 3.35Å
428	T	87.6	Confident	91.3	Very high	44 Å²	44	36.1 Å²	36.1	27%	0.27	19%	0.193	S	C	.	.	H	α-helix	trans	-102.2	-2.7	-175.7	51.5	0	0	0	0	113.9	Q424 S524 E527	Q424-T428 PolarHBondContact NE2-OG1 2.87Å; Q424-T428 VanDerWaalsContact NE2-OG1 3.09Å; Q424-T428 PolarHBondContact O-N 2.86Å; Q424-T428 PolarHBondContact O-OG1 2.91Å; Q424-T428 VanDerWaalsContact O-OG1 3.1Å; T428-S524 PolarHBondContact OG1-OG 3.45Å; T428-E527 WeakPolarHBondContact CG2-OE2 3.39Å
429	G	87.1	Confident	91.5	Very high	24 Å²	24	36.5 Å²	36.5	25%	0.247	20%	0.195	C	C	.	.			trans	86.2	173	-170	0	0	0	0	0	112.4	S425 S431	S425-G429 WeakPolarHBondContact CA-O 3.41Å; S425-G429 CarbonylContact O-C 3.55Å; S425-G429 WeakPolarHBondContact O-CA 3.37Å; S425-G429 PolarHBondContact O-N 3.01Å; G429-S431 PolarHBondContact O-N 3.47Å
430	P	85.4	Confident	91.7	Very high	107 Å²	107	35 Å²	35	70%	0.695	19%	0.188	S	C	*	.			trans	-61.3	129.9	-177.3	26.1	-33.7	0	0	0	110.7	H520	P430-H520 PolarHBondContact O-CE1 3.27Å
431	S	88.9	Confident	92	Very high	5 Å²	5	35 Å²	35	4%	0.035	19%	0.188	C	C	.	.			trans	-92.7	177.7	170.3	80.8	0	0	0	0	110.3	G429 L433	G429-S431 PolarHBondContact O-N 3.47Å; S431-L433 PolarHBondContact O-N 3.39Å; S431-L433 PolarHBondContact OG-N 2.96Å; S431-L433 VanDerWaalsContact OG-N 3.07Å; S431-L433 PolarHBondContact OG-O 3.34Å
432	G	88.7	Confident	92.2	Very high	2 Å²	2	34.7 Å²	34.7	2%	0.021	19%	0.187	C	C	.	.	S	Bend	trans	-75.4	-6.5	170.1	0	0	0	0	0	114.5	T521	G432-T521 WeakPolarHBondContact CA-OG1 3.45Å; G432-T521 PolarHBondContact N-OG1 2.9Å
433	L	93.4	Very high	92.5	Very high	11 Å²	11	32.8 Å²	32.8	6%	0.058	17%	0.173	C	C	.	.			trans	-87.8	143.7	172.9	-69.3	169.2	0	0	0	110.7	L421 S431 H437 L470 L474 F508 T521 F525	L421-L433 HydrophobicContact CD1-CB 3.94Å; L421-L433 HydrophobicContact CD2-CB 4.31Å; S431-L433 PolarHBondContact O-N 3.39Å; S431-L433 PolarHBondContact OG-N 2.96Å; S431-L433 VanDerWaalsContact OG-N 3.07Å; S431-L433 PolarHBondContact OG-O 3.34Å; L433-H437 HydrophobicContact CD2-CB 4.22Å; L433-L470 HydrophobicContact CD1-CD2 4.07Å; L433-L470 HydrophobicContact CD2-CD1 3.97Å; L433-L470 HydrophobicContact CD2-CD2 4.2Å; L433-L470 HydrophobicContact CD2-CG 4.36Å; L433-L474 HydrophobicContact CD1-CD1 4.22Å; L433-L474 HydrophobicContact CD2-CD2 4.15Å; L433-F508 HydrophobicContact CD2-CE1 3.86Å; L433-F508 HydrophobicContact CD2-CZ 3.63Å; L433-T521 HydrophobicContact CB-CG2 4.42Å; L433-T521 HydrophobicContact CD1-CG2 4.05Å; L433-T521 HydrophobicContact CG-CG2 3.61Å; L433-F525 HydrophobicContact CD1-CB 4.21Å; L433-F525 HydrophobicContact CD1-CD2 4.06Å
434	S	92	Very high	92.8	Very high	21 Å²	21	32.2 Å²	32.2	15%	0.147	17%	0.172	C	C	.	.			trans	-134.8	165.9	177.5	68.8	0	0	0	0	109.6	E373 Y436 H437 L438	E373-S434 WeakPolarHBondContact OE1-CB 3.35Å; E373-S434 PolarHBondContact OE1-OG 3.49Å; S434-Y436 PolarHBondContact O-N 2.82Å; S434-Y436 VanDerWaalsContact O-N 3.16Å; S434-Y436 PolarHBondContact OG-N 2.78Å; S434-H437 PolarHBondContact N-ND1 2.81Å; S434-H437 WeakPolarHBondContact O-CB 3.45Å; S434-H437 PolarHBondContact O-N 3.42Å; S434-H437 PolarHBondContact OG-CE1 3.26Å; S434-H437 PolarHBondContact OG-ND1 3Å; S434-L438 PolarHBondContact O-N 2.85Å
435	D	92.4	Very high	93	Very high	36 Å²	36	32.7 Å²	32.7	19%	0.193	17%	0.174	C	C	.	.	H	α-helix	trans	-60.1	-25.4	175.8	-63.2	-31.3	0	0	0	111.8	W201 S418 H437 L438 K439	W201-D435 HydrophobicContact CH2-CB 3.88Å; W201-D435 HydrophobicContact CZ3-CB 4.05Å; S418-D435 WeakPolarHBondContact CB-OD1 3.29Å; D435-H437 VanDerWaalsContact C-N 3.34Å; D435-H437 PolarHBondContact O-N 3.11Å; D435-L438 PolarHBondContact O-N 3.44Å; D435-K439 VanDerWaalsContact O-CB 3.32Å; D435-K439 WeakPolarHBondContact O-CB 3.23Å; D435-K439 PolarHBondContact O-N 2.85Å
436	Y	93	Very high	93.3	Very high	52 Å²	52	31.7 Å²	31.7	20%	0.204	17%	0.166	C	C	.	.	H	α-helix	trans	-63.1	-38.7	173.4	-171.6	-106.3	0	0	0	112.5	E393 S434 T440 H481 L507	E393-Y436 WeakPolarHBondContact OE1-CE2 3.26Å; E393-Y436 PolarHBondContact OE1-OH 2.89Å; S434-Y436 PolarHBondContact O-N 2.82Å; S434-Y436 VanDerWaalsContact O-N 3.16Å; S434-Y436 PolarHBondContact OG-N 2.78Å; Y436-T440 WeakPolarHBondContact O-CB 3.4Å; Y436-T440 PolarHBondContact O-N 3.04Å; Y436-T440 PolarHBondContact O-OG1 2.91Å; Y436-H481 PolarHBondContact OH-CD2 2.74Å; Y436-H481 VanDerWaalsContact OH-CD2 3.32Å; Y436-H481 PolarHBondContact OH-NE2 3.36Å; Y436-H481 VanDerWaalsContact OH-NE2 3.08Å; Y436-L507 HydrophobicContact CD1-CD1 4.29Å; Y436-L507 HydrophobicContact CE1-CD1 3.85Å; Y436-L507 HydrophobicContact CE1-CD2 4.39Å
437	H	95.6	Very high	93.6	Very high	6 Å²	6	25.7 Å²	25.7	3%	0.028	15%	0.147	C	C	.	.	H	α-helix	trans	-69.3	-40.9	176.5	-60.1	103.5	0	0	0	111.5	E373 L433 S434 D435 T440 A441 L479 F508	E373-H437 IonicContact OE1-CE1 3.57Å; E373-H437 PolarHBondContact OE1-CE1 3.35Å; E373-H437 VanDerWaalsContact OE1-CE1 3.28Å; E373-H437 IonicContact OE1-ND1 3.38Å; L433-H437 HydrophobicContact CD2-CB 4.22Å; S434-H437 PolarHBondContact N-ND1 2.81Å; S434-H437 WeakPolarHBondContact O-CB 3.45Å; S434-H437 PolarHBondContact O-N 3.42Å; S434-H437 PolarHBondContact OG-CE1 3.26Å; S434-H437 PolarHBondContact OG-ND1 3Å; D435-H437 VanDerWaalsContact C-N 3.34Å; D435-H437 PolarHBondContact O-N 3.11Å; H437-T440 PolarHBondContact O-N 3.41Å; H437-A441 WeakPolarHBondContact O-CB 3.36Å; H437-A441 PolarHBondContact O-N 2.93Å; H437-L479 HydrophobicContact CB-CD2 4.08Å; H437-F508 HydrophobicContact CB-CE1 4.29Å; H437-F508 AromaticContact CD2-CD1 3.87Å; H437-F508 AromaticContact CD2-CE1 3.32Å; H437-F508 WeakPolarHBondContact CD2-CE1 3.44Å; H437-F508 AromaticContact CG-CE1 3.82Å; H437-F508 AromaticContact NE2-CD1 3.99Å; H437-F508 AromaticContact NE2-CE1 3.79Å
438	L	96.6	Very high	93.8	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-45.5	174.4	-65	-179.6	0	0	0	111.5	L414 A417 L421 S434 D435 A441 L442 L470	L414-L438 HydrophobicContact CD1-CB 3.73Å; A417-L438 HydrophobicContact CB-CD1 3.95Å; A417-L438 HydrophobicContact CB-CD2 4.3Å; L421-L438 HydrophobicContact CB-CD1 3.99Å; L421-L438 HydrophobicContact CD2-CD1 3.68Å; L421-L438 HydrophobicContact CD2-CG 4.07Å; L421-L438 HydrophobicContact CG-CD1 4.48Å; S434-L438 PolarHBondContact O-N 2.85Å; D435-L438 PolarHBondContact O-N 3.44Å; L438-A441 PolarHBondContact O-N 3.1Å; L438-L442 PolarHBondContact O-N 3.42Å; L438-L470 HydrophobicContact CD2-CD2 3.65Å
439	K	96.6	Very high	94.2	Very high	7 Å²	7	26.2 Å²	26.2	3%	0.03	15%	0.149	C	C	.	.	H	α-helix	trans	-58.7	-49.3	174.3	-178.8	-175.4	178.8	-177.6	0	110.8	E199 W201 E393 L414 D435 A441 L442 L443	E199-K439 IonicContact OE1-NZ 3.43Å; E199-K439 PolarHBondContact OE1-NZ 2.94Å; E199-K439 WeakPolarHBondContact OE2-CE 3.39Å; E199-K439 IonicContact OE2-NZ 2.88Å; E199-K439 PolarHBondContact OE2-NZ 3.36Å; W201-K439 HydrophobicContact CZ2-CD 4.07Å; E393-K439 VanDerWaalsContact CB-NZ 3.33Å; E393-K439 WeakPolarHBondContact OE2-CE 3.42Å; E393-K439 IonicContact OE2-NZ 3.46Å; E393-K439 PolarHBondContact OE2-NZ 2.89Å; L414-K439 HydrophobicContact CD1-CB 4.4Å; L414-K439 HydrophobicContact CD2-CB 4.32Å; L414-K439 HydrophobicContact CD2-CG 4.43Å; D435-K439 VanDerWaalsContact O-CB 3.32Å; D435-K439 WeakPolarHBondContact O-CB 3.23Å; D435-K439 PolarHBondContact O-N 2.85Å; K439-A441 VanDerWaalsContact C-N 3.32Å; K439-A441 PolarHBondContact O-N 2.98Å; K439-L442 WeakPolarHBondContact O-CB 3.35Å; K439-L442 PolarHBondContact O-N 2.98Å; K439-L442 VanDerWaalsContact O-N 3.11Å; K439-L443 HydrophobicContact CG-CD1 4.28Å; K439-L443 HydrophobicContact CG-CG 4.41Å; K439-L443 VanDerWaalsContact O-CG 3.29Å; K439-L443 WeakPolarHBondContact O-CG 3.3Å; K439-L443 PolarHBondContact O-N 2.81Å
440	T	97.3	Very high	94.5	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-58.5	-43.7	178.7	-60.9	0	0	0	0	111.8	Y436 H437 L443 H444 L479 F482 L507	Y436-T440 WeakPolarHBondContact O-CB 3.4Å; Y436-T440 PolarHBondContact O-N 3.04Å; Y436-T440 PolarHBondContact O-OG1 2.91Å; H437-T440 PolarHBondContact O-N 3.41Å; T440-L443 PolarHBondContact O-N 3.11Å; T440-H444 PolarHBondContact O-CD2 3.33Å; T440-H444 PolarHBondContact O-N 3.42Å; T440-H444 VanDerWaalsContact O-N 3.09Å; T440-L479 HydrophobicContact CG2-CD1 4.18Å; T440-L479 HydrophobicContact CG2-CD2 4.43Å; T440-L479 HydrophobicContact CG2-CG 4.26Å; T440-F482 HydrophobicContact CG2-CB 4.38Å; T440-L507 HydrophobicContact CG2-CD1 3.9Å
441	A	97.9	Very high	94.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.5	-43.5	174.6	0	0	0	0	0	112	H437 L438 K439 L443 H444 L445 L466 F469	H437-A441 WeakPolarHBondContact O-CB 3.36Å; H437-A441 PolarHBondContact O-N 2.93Å; L438-A441 PolarHBondContact O-N 3.1Å; K439-A441 VanDerWaalsContact C-N 3.32Å; K439-A441 PolarHBondContact O-N 2.98Å; A441-L443 PolarHBondContact O-N 2.8Å; A441-H444 PolarHBondContact O-N 3.39Å; A441-L445 PolarHBondContact O-N 3.43Å; A441-L466 HydrophobicContact CB-CD1 3.68Å; A441-F469 HydrophobicContact CB-CD1 3.63Å; A441-F469 HydrophobicContact CB-CE1 3.93Å
442	L	97.9	Very high	95.2	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-61.2	-43.8	174.7	-178.1	75.3	0	0	0	111.6	H410 L414 L438 K439 H444 L445 L446 W454 L466	H410-L442 HydrophobicContact CB-CD1 4.4Å; H410-L442 HydrophobicContact CB-CD2 4.46Å; L414-L442 HydrophobicContact CB-CD2 3.89Å; L414-L442 HydrophobicContact CD2-CD2 3.98Å; L414-L442 HydrophobicContact CG-CD2 4.48Å; L438-L442 PolarHBondContact O-N 3.42Å; K439-L442 WeakPolarHBondContact O-CB 3.35Å; K439-L442 PolarHBondContact O-N 2.98Å; K439-L442 VanDerWaalsContact O-N 3.11Å; L442-H444 VanDerWaalsContact C-N 3.32Å; L442-H444 PolarHBondContact O-N 3.38Å; L442-L445 PolarHBondContact O-N 2.87Å; L442-L445 VanDerWaalsContact O-N 3.14Å; L442-L446 HydrophobicContact CD2-CD1 4.08Å; L442-L446 HydrophobicContact CG-CD1 3.93Å; L442-L446 HydrophobicContact CG-CG 4.24Å; L442-L446 WeakPolarHBondContact O-CB 3.42Å; L442-L446 WeakPolarHBondContact O-CG 3.41Å; L442-L446 PolarHBondContact O-N 3.27Å; L442-W454 HydrophobicContact CD1-CH2 3.56Å; L442-W454 HydrophobicContact CD1-CZ3 3.78Å; L442-L466 HydrophobicContact CB-CD1 4.27Å
443	L	98.1	Very high	95.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60	-42.7	179.5	-65.9	175.3	0	0	0	111.4	E393 F396 L397 K439 T440 A441 L446 L447 F482	E393-L443 HydrophobicContact CG-CD1 4.29Å; F396-L443 HydrophobicContact CD1-CD2 3.43Å; F396-L443 VanDerWaalsContact CD1-CD2 3.43Å; F396-L443 HydrophobicContact CE1-CD2 3.73Å; F396-L443 HydrophobicContact CG-CD2 4.49Å; L397-L443 HydrophobicContact CD2-CD2 3.7Å; L397-L443 HydrophobicContact CG-CD2 3.91Å; K439-L443 HydrophobicContact CG-CD1 4.28Å; K439-L443 HydrophobicContact CG-CG 4.41Å; K439-L443 VanDerWaalsContact O-CG 3.29Å; K439-L443 WeakPolarHBondContact O-CG 3.3Å; K439-L443 PolarHBondContact O-N 2.81Å; T440-L443 PolarHBondContact O-N 3.11Å; A441-L443 PolarHBondContact O-N 2.8Å; L443-L446 HydrophobicContact CD2-CD1 4.48Å; L443-L446 PolarHBondContact O-N 2.8Å; L443-L447 PolarHBondContact O-N 3.12Å; L443-F482 HydrophobicContact CB-CB 4.33Å; L443-F482 HydrophobicContact CB-CD1 4.03Å; L443-F482 HydrophobicContact CB-CD2 3.48Å; L443-F482 VanDerWaalsContact CB-CD2 3.48Å; L443-F482 HydrophobicContact CB-CE1 4.21Å; L443-F482 HydrophobicContact CB-CE2 3.7Å; L443-F482 HydrophobicContact CB-CG 3.66Å; L443-F482 HydrophobicContact CB-CZ 4.06Å; L443-F482 HydrophobicContact CD1-CB 4.1Å; L443-F482 HydrophobicContact CD1-CD1 3.92Å; L443-F482 HydrophobicContact CD1-CG 3.95Å; L443-F482 HydrophobicContact CG-CD1 4.49Å; L443-F482 HydrophobicContact CG-CG 4.43Å; L443-F482 VanDerWaalsContact O-CE2 3.22Å; L443-F482 WeakPolarHBondContact O-CE2 3.49Å
444	H	97.9	Very high	95.7	Very high	33 Å²	33	32.4 Å²	32.4	15%	0.153	18%	0.177	C	C	.	.	H	α-helix	trans	-62.1	-41	173.5	-78.4	-64.4	0	0	0	112.6	T440 A441 L442 L447 S448 F469 H480 F482	T440-H444 PolarHBondContact O-CD2 3.33Å; T440-H444 PolarHBondContact O-N 3.42Å; T440-H444 VanDerWaalsContact O-N 3.09Å; A441-H444 PolarHBondContact O-N 3.39Å; L442-H444 VanDerWaalsContact C-N 3.32Å; L442-H444 PolarHBondContact O-N 3.38Å; H444-L447 PolarHBondContact O-N 2.84Å; H444-S448 PolarHBondContact O-N 3.38Å; H444-S448 VanDerWaalsContact O-N 3.07Å; H444-S448 PolarHBondContact O-OG 3.32Å; H444-F469 HydrophobicContact CB-CE1 4.26Å; H444-F469 HydrophobicContact CB-CE2 4.04Å; H444-F469 HydrophobicContact CB-CZ 3.61Å; H444-F469 AromaticContact CG-CZ 3.98Å; H444-H480 PolarHBondContact NE2-O 3.16Å; H444-F482 AromaticContact CE1-CD2 3.92Å; H444-F482 AromaticContact ND1-CD2 3.85Å
445	L	97.3	Very high	95.8	Very high	11 Å²	11	36.3 Å²	36.3	6%	0.058	19%	0.191	C	C	.	.	H	α-helix	trans	-66.2	-39.1	175	-72.2	179	0	0	0	112.7	A441 L442 L447 S448 R449 W454 E465 L466 F469	A441-L445 PolarHBondContact O-N 3.43Å; L442-L445 PolarHBondContact O-N 2.87Å; L442-L445 VanDerWaalsContact O-N 3.14Å; L445-L447 PolarHBondContact O-N 3.1Å; L445-S448 PolarHBondContact O-N 3.14Å; L445-S448 PolarHBondContact O-OG 2.79Å; L445-R449 WeakPolarHBondContact O-CB 3.27Å; L445-R449 WeakPolarHBondContact O-CG 3.19Å; L445-R449 PolarHBondContact O-N 2.81Å; L445-W454 HydrophobicContact CB-CH2 4.04Å; L445-W454 HydrophobicContact CB-CZ2 3.98Å; L445-E465 HydrophobicContact CD1-CB 4.36Å; L445-L466 HydrophobicContact CD1-CB 4Å; L445-L466 HydrophobicContact CD1-CD1 4.06Å; L445-F469 HydrophobicContact CD2-CB 4.36Å; L445-F469 HydrophobicContact CD2-CD2 4.11Å; L445-F469 HydrophobicContact CD2-CG 4.44Å
446	L	97.3	Very high	95.8	Very high	12 Å²	12	38.2 Å²	38.2	6%	0.063	21%	0.205	C	C	.	.	H	α-helix	trans	-63.2	-31.5	176.3	-77.4	167.5	0	0	0	111.8	F396 L397 T400 L404 H410 L442 L443 W454	F396-L446 HydrophobicContact CE1-CB 4.14Å; F396-L446 HydrophobicContact CE1-CD1 4.4Å; F396-L446 HydrophobicContact CZ-CB 4.48Å; L397-L446 HydrophobicContact CD2-CD1 3.86Å; T400-L446 HydrophobicContact CG2-CB 4.26Å; T400-L446 HydrophobicContact CG2-CD1 4.4Å; T400-L446 HydrophobicContact CG2-CD2 3.8Å; T400-L446 HydrophobicContact CG2-CG 4.39Å; L404-L446 HydrophobicContact CD1-CD2 3.92Å; H410-L446 HydrophobicContact CB-CD2 3.88Å; L442-L446 HydrophobicContact CD2-CD1 4.08Å; L442-L446 HydrophobicContact CG-CD1 3.93Å; L442-L446 HydrophobicContact CG-CG 4.24Å; L442-L446 WeakPolarHBondContact O-CB 3.42Å; L442-L446 WeakPolarHBondContact O-CG 3.41Å; L442-L446 PolarHBondContact O-N 3.27Å; L443-L446 HydrophobicContact CD2-CD1 4.48Å; L443-L446 PolarHBondContact O-N 2.8Å; L446-W454 HydrophobicContact CB-CZ2 4.46Å; L446-W454 HydrophobicContact CD2-CD2 3.92Å; L446-W454 VanDerWaalsContact CD2-CE2 3.5Å; L446-W454 HydrophobicContact CD2-CE3 4.43Å; L446-W454 HydrophobicContact CD2-CG 4.42Å; L446-W454 HydrophobicContact CD2-CH2 4.18Å; L446-W454 HydrophobicContact CD2-CZ2 3.65Å; L446-W454 HydrophobicContact CG-CH2 4.3Å; L446-W454 HydrophobicContact CG-CZ2 3.9Å
447	L	95.2	Very high	95.7	Very high	50 Å²	50	37.7 Å²	37.7	26%	0.262	21%	0.209	S	C	.	.	H	α-helix	trans	-78	-32.5	176.7	-169	63.9	0	0	0	112.7	F396 L443 H444 L445 F482 K488	F396-L447 HydrophobicContact CE2-CD1 4.43Å; L443-L447 PolarHBondContact O-N 3.12Å; H444-L447 PolarHBondContact O-N 2.84Å; L445-L447 PolarHBondContact O-N 3.1Å; L447-F482 HydrophobicContact CB-CE2 4.08Å; L447-F482 HydrophobicContact CB-CZ 4.35Å; L447-F482 HydrophobicContact CD2-CE2 3.89Å; L447-F482 HydrophobicContact CD2-CZ 4.14Å; L447-K488 HydrophobicContact CD2-CB 3.65Å; L447-K488 HydrophobicContact CG-CB 4.36Å
448	S	94.3	Very high	95.7	Very high	83 Å²	83	40.6 Å²	40.6	58%	0.58	22%	0.222	S	C	*	.	H	α-helix	trans	-90.9	-23.1	-175.9	67.2	0	0	0	0	114.6	H444 L445	H444-S448 PolarHBondContact O-N 3.38Å; H444-S448 VanDerWaalsContact O-N 3.07Å; H444-S448 PolarHBondContact O-OG 3.32Å; L445-S448 PolarHBondContact O-N 3.14Å; L445-S448 PolarHBondContact O-OG 2.79Å
449	R	94.7	Very high	95.6	Very high	86 Å²	86	40.7 Å²	40.7	33%	0.325	22%	0.223	S	C	.	.	S	Bend	trans	-98	151.6	-178.4	-65.6	-59.9	-160.5	-167.9	0.8	111.9	L445 W454 E465	L445-R449 WeakPolarHBondContact O-CB 3.27Å; L445-R449 WeakPolarHBondContact O-CG 3.19Å; L445-R449 PolarHBondContact O-N 2.81Å; R449-W454 HydrophobicContact CB-CZ2 4.4Å; R449-E465 IonicContact CZ-OE1 2.9Å; R449-E465 IonicContact CZ-OE2 3.28Å; R449-E465 IonicContact NE-OE1 2.74Å; R449-E465 IonicContact NE-OE2 3.36Å; R449-E465 PolarHBondContact NE-OE2 3.28Å; R449-E465 IonicContact NH2-OE1 2.68Å; R449-E465 PolarHBondContact NH2-OE1 3.24Å; R449-E465 IonicContact NH2-OE2 2.93Å; R449-E465 PolarHBondContact NH2-OE2 3.03Å
450	Q	94.5	Very high	95.4	Very high	139 Å²	139	42.8 Å²	42.8	65%	0.65	23%	0.234	S	C	*	.			trans	-76.4	153.3	176.4	-65.2	-178.3	49.8	0	0	110.4	A452 D453	Q450-A452 PolarHBondContact O-N 2.98Å; Q450-A452 VanDerWaalsContact O-N 3.14Å; Q450-D453 PolarHBondContact N-OD2 3.37Å; Q450-D453 VanDerWaalsContact N-OD2 3.1Å; Q450-D453 WeakPolarHBondContact O-CB 3.42Å; Q450-D453 PolarHBondContact O-N 3Å
451	A	94.5	Very high	95.3	Very high	38 Å²	38	45.2 Å²	45.2	31%	0.314	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-55.4	-36	179.4	0	0	0	0	0	113	A403 L404 P405 D453 W454	A403-A451 WeakPolarHBondContact O-CB 3.44Å; L404-A451 HydrophobicContact CD2-CB 3.91Å; P405-A451 WeakPolarHBondContact CD-O 3.39Å; P405-A451 WeakPolarHBondContact CG-O 3.18Å; A451-D453 PolarHBondContact O-N 3.5Å; A451-D453 VanDerWaalsContact O-N 3.17Å; A451-W454 PolarHBondContact O-N 2.72Å
452	A	93.8	Very high	95.2	Very high	51 Å²	51	46 Å²	46	42%	0.421	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-63.6	-19.1	179.6	0	0	0	0	0	114.1	Q450 W454 K455	Q450-A452 PolarHBondContact O-N 2.98Å; Q450-A452 VanDerWaalsContact O-N 3.14Å; A452-W454 VanDerWaalsContact C-N 3.34Å; A452-K455 WeakPolarHBondContact O-CD 3.02Å; A452-K455 VanDerWaalsContact O-CE 3.27Å; A452-K455 WeakPolarHBondContact O-CE 3.5Å; A452-K455 WeakPolarHBondContact O-CG 3.39Å
453	D	95.9	Very high	95.1	Very high	50 Å²	50	46 Å²	46	27%	0.267	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-82.4	-14.7	-178	-53.2	-31.2	0	0	0	112.9	Q450 A451 K455 Q458 R462	Q450-D453 PolarHBondContact N-OD2 3.37Å; Q450-D453 VanDerWaalsContact N-OD2 3.1Å; Q450-D453 WeakPolarHBondContact O-CB 3.42Å; Q450-D453 PolarHBondContact O-N 3Å; A451-D453 PolarHBondContact O-N 3.5Å; A451-D453 VanDerWaalsContact O-N 3.17Å; D453-K455 VanDerWaalsContact C-N 3.31Å; D453-K455 PolarHBondContact O-N 2.73Å; D453-Q458 VanDerWaalsContact O-CB 3.29Å; D453-Q458 WeakPolarHBondContact O-CB 3.46Å; D453-Q458 WeakPolarHBondContact O-CG 3.11Å; D453-R462 IonicContact OD2-NH1 3.71Å
454	W	96.8	Very high	95	Very high	1 Å²	1	50.3 Å²	50.3	0%	0.004	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-92.1	17.8	-176.5	-66.9	98.3	0	0	0	113.8	L404 A408 C409 H410 L442 L445 L446 R449 A451 A452 R462	L404-W454 HydrophobicContact CD1-CB 4.2Å; L404-W454 HydrophobicContact CD1-CG 4.27Å; L404-W454 HydrophobicContact CD2-CB 3.91Å; L404-W454 HydrophobicContact CD2-CG 3.88Å; A408-W454 CarbonylContact C-O 3.51Å; A408-W454 WeakPolarHBondContact CA-O 3.23Å; A408-W454 HydrophobicContact CB-CB 4.17Å; A408-W454 WeakPolarHBondContact CB-O 3.03Å; C409-W454 PolarHBondContact N-O 2.87Å; C409-W454 PolarHBondContact SG-O 3.09Å; H410-W454 HydrophobicContact CB-CD2 4.14Å; H410-W454 HydrophobicContact CB-CE3 3.49Å; H410-W454 VanDerWaalsContact CB-CE3 3.49Å; H410-W454 HydrophobicContact CB-CH2 4.5Å; H410-W454 HydrophobicContact CB-CZ3 3.7Å; L442-W454 HydrophobicContact CD1-CH2 3.56Å; L442-W454 HydrophobicContact CD1-CZ3 3.78Å; L445-W454 HydrophobicContact CB-CH2 4.04Å; L445-W454 HydrophobicContact CB-CZ2 3.98Å; L446-W454 HydrophobicContact CB-CZ2 4.46Å; L446-W454 HydrophobicContact CD2-CD2 3.92Å; L446-W454 VanDerWaalsContact CD2-CE2 3.5Å; L446-W454 HydrophobicContact CD2-CE3 4.43Å; L446-W454 HydrophobicContact CD2-CG 4.42Å; L446-W454 HydrophobicContact CD2-CH2 4.18Å; L446-W454 HydrophobicContact CD2-CZ2 3.65Å; L446-W454 HydrophobicContact CG-CH2 4.3Å; L446-W454 HydrophobicContact CG-CZ2 3.9Å; R449-W454 HydrophobicContact CB-CZ2 4.4Å; A451-W454 PolarHBondContact O-N 2.72Å; A452-W454 VanDerWaalsContact C-N 3.34Å; W454-R462 HydrophobicContact CE3-CB 4.37Å; W454-R462 HydrophobicContact CE3-CG 3.89Å; W454-R462 HydrophobicContact CZ3-CB 4.01Å; W454-R462 HydrophobicContact CZ3-CG 3.98Å
455	K	94.8	Very high	94.9	Very high	102 Å²	102	50.3 Å²	50.3	44%	0.443	27%	0.272	S	S	.	.	S	Bend	trans	-58.3	151.1	175.9	-68.9	168.6	-174.3	173.3	0	110.8	P405 C409 A452 D453 S457 Q458	P405-K455 HydrophobicContact CG-CG 4.21Å; C409-K455 PolarHBondContact SG-O 3.03Å; A452-K455 WeakPolarHBondContact O-CD 3.02Å; A452-K455 VanDerWaalsContact O-CE 3.27Å; A452-K455 WeakPolarHBondContact O-CE 3.5Å; A452-K455 WeakPolarHBondContact O-CG 3.39Å; D453-K455 VanDerWaalsContact C-N 3.31Å; D453-K455 PolarHBondContact O-N 2.73Å; K455-S457 PolarHBondContact O-N 2.65Å; K455-Q458 HydrophobicContact CB-CG 4.48Å; K455-Q458 PolarHBondContact O-N 3.24Å
456	T	92	Very high	94.9	Very high	77 Å²	77	49.8 Å²	49.8	47%	0.472	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-47.2	-36.7	172.1	49	0	0	0	0	112.6	G407 Q458 L459	G407-T456 WeakPolarHBondContact O-CG2 3.32Å; T456-Q458 PolarHBondContact O-N 3.3Å; T456-L459 PolarHBondContact O-N 2.73Å
457	S	91.8	Very high	94.9	Very high	41 Å²	41	49.2 Å²	49.2	29%	0.287	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-68.5	-11.6	-178.3	64.5	0	0	0	0	115.8	R140 K455	R140-S457 VanDerWaalsContact CZ-CA 3.43Å; R140-S457 VanDerWaalsContact NH1-CB 3.32Å; K455-S457 PolarHBondContact O-N 2.65Å
458	Q	94.1	Very high	94.9	Very high	67 Å²	67	48.1 Å²	48.1	31%	0.313	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-105.6	11.8	-176	-62.4	-63.9	-19.8	0	0	112.6	D453 K455 T456 D460 V461 R462	D453-Q458 VanDerWaalsContact O-CB 3.29Å; D453-Q458 WeakPolarHBondContact O-CB 3.46Å; D453-Q458 WeakPolarHBondContact O-CG 3.11Å; K455-Q458 HydrophobicContact CB-CG 4.48Å; K455-Q458 PolarHBondContact O-N 3.24Å; T456-Q458 PolarHBondContact O-N 3.3Å; Q458-D460 VanDerWaalsContact C-N 3.33Å; Q458-D460 PolarHBondContact O-N 3.3Å; Q458-V461 PolarHBondContact O-N 3.1Å; Q458-R462 HydrophobicContact CB-CG 4.17Å; Q458-R462 WeakPolarHBondContact O-CB 3.47Å; Q458-R462 VanDerWaalsContact O-CG 3.3Å; Q458-R462 WeakPolarHBondContact O-CG 3.41Å; Q458-R462 PolarHBondContact O-N 3.17Å
459	L	94	Very high	95.1	Very high	4 Å²	4	46.8 Å²	46.8	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-55.1	-44.6	-173.6	173.1	63.7	0	0	0	113.3	L143 D144 C409 C413 I416 T456 L463	L143-L459 HydrophobicContact CB-CD2 3.75Å; L143-L459 HydrophobicContact CB-CG 4.36Å; L143-L459 HydrophobicContact CD1-CG 4.24Å; D144-L459 WeakPolarHBondContact OD1-CD2 3.39Å; C409-L459 HydrophobicContact CB-CB 4.04Å; C409-L459 HydrophobicContact CB-CD1 4Å; C413-L459 VanDerWaalsContact SG-CD1 3.56Å; I416-L459 HydrophobicContact CD1-CD1 4.1Å; I416-L459 HydrophobicContact CD1-CD2 4.11Å; I416-L459 HydrophobicContact CD1-CG 4.47Å; T456-L459 PolarHBondContact O-N 2.73Å; L459-L463 WeakPolarHBondContact O-CB 3.49Å; L459-L463 PolarHBondContact O-N 2.79Å
460	D	94.2	Very high	95.2	Very high	51 Å²	51	42.7 Å²	42.7	27%	0.273	23%	0.231	S	C	.	.	H	α-helix	trans	-64.1	-47.1	178	54.3	-21.4	0	0	0	112.1	R140 L143 Q458 L463 Q464	R140-D460 HydrophobicContact CB-CB 4.23Å; L143-D460 HydrophobicContact CD1-CB 3.89Å; Q458-D460 VanDerWaalsContact C-N 3.33Å; Q458-D460 PolarHBondContact O-N 3.3Å; D460-L463 PolarHBondContact O-N 2.75Å; D460-Q464 WeakPolarHBondContact O-CB 3.44Å; D460-Q464 PolarHBondContact O-N 3.17Å
461	V	94.4	Very high	95.2	Very high	51 Å²	51	36.8 Å²	36.8	31%	0.309	20%	0.203	S	C	.	.	H	α-helix	trans	-63	-45.3	177.7	-176.4	0	0	0	0	111	Q458 Q464 E465	Q458-V461 PolarHBondContact O-N 3.1Å; V461-Q464 PolarHBondContact O-N 2.89Å; V461-E465 WeakPolarHBondContact O-CG 3.03Å; V461-E465 PolarHBondContact O-N 3.32Å
462	R	95.7	Very high	95.3	Very high	17 Å²	17	42 Å²	42	6%	0.064	22%	0.215	C	C	.	.	H	α-helix	trans	-67.3	-37.4	179.4	-67.2	-53.4	93.1	151	6.9	112.5	C413 D453 W454 Q458 E465 L466	C413-R462 VanDerWaalsContact SG-CB 3.56Å; D453-R462 IonicContact OD2-NH1 3.71Å; W454-R462 HydrophobicContact CE3-CB 4.37Å; W454-R462 HydrophobicContact CE3-CG 3.89Å; W454-R462 HydrophobicContact CZ3-CB 4.01Å; W454-R462 HydrophobicContact CZ3-CG 3.98Å; Q458-R462 HydrophobicContact CB-CG 4.17Å; Q458-R462 WeakPolarHBondContact O-CB 3.47Å; Q458-R462 VanDerWaalsContact O-CG 3.3Å; Q458-R462 WeakPolarHBondContact O-CG 3.41Å; Q458-R462 PolarHBondContact O-N 3.17Å; R462-E465 IonicContact CZ-OE1 2.69Å; R462-E465 IonicContact CZ-OE2 2.73Å; R462-E465 IonicContact NE-OE1 3.06Å; R462-E465 IonicContact NE-OE2 3.08Å; R462-E465 PolarHBondContact NE-OE2 3.2Å; R462-E465 IonicContact NH1-OE1 3.28Å; R462-E465 IonicContact NH1-OE2 3.94Å; R462-E465 PolarHBondContact NH1-OE2 3.37Å; R462-E465 VanDerWaalsContact NH2-CD 3.33Å; R462-E465 IonicContact NH2-OE1 3.21Å; R462-E465 PolarHBondContact NH2-OE1 2.82Å; R462-E465 IonicContact NH2-OE2 2.92Å; R462-E465 PolarHBondContact NH2-OE2 2.97Å; R462-E465 PolarHBondContact O-N 3.19Å; R462-L466 WeakPolarHBondContact O-CB 3.35Å; R462-L466 PolarHBondContact O-N 3.4Å
463	L	95.8	Very high	95.5	Very high	1 Å²	1	40 Å²	40	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-65.7	-41.1	174.4	-176.9	64.5	0	0	0	111.2	L143 I416 A417 L459 D460 L466 F467	L143-L463 HydrophobicContact CD1-CD2 3.92Å; L143-L463 HydrophobicContact CD2-CD2 3.86Å; I416-L463 HydrophobicContact CB-CD1 4.44Å; I416-L463 HydrophobicContact CG2-CD1 4.26Å; I416-L463 HydrophobicContact CG2-CD2 3.75Å; A417-L463 HydrophobicContact CB-CD1 4.28Å; L459-L463 WeakPolarHBondContact O-CB 3.49Å; L459-L463 PolarHBondContact O-N 2.79Å; D460-L463 PolarHBondContact O-N 2.75Å; L463-L466 WeakPolarHBondContact O-CB 3.33Å; L463-L466 PolarHBondContact O-N 3.25Å; L463-F467 HydrophobicContact CD1-CD2 4.25Å; L463-F467 HydrophobicContact CD1-CE2 3.58Å; L463-F467 HydrophobicContact CD1-CZ 3.97Å; L463-F467 HydrophobicContact CD2-CE2 4.23Å; L463-F467 HydrophobicContact CG-CD2 4.11Å; L463-F467 HydrophobicContact CG-CE2 3.66Å; L463-F467 VanDerWaalsContact O-CD2 3.24Å; L463-F467 WeakPolarHBondContact O-CD2 3.33Å; L463-F467 PolarHBondContact O-N 2.92Å; L463-F467 VanDerWaalsContact O-N 3.14Å
464	Q	95.3	Very high	95.4	Very high	92 Å²	92	37.8 Å²	37.8	43%	0.43	19%	0.186	S	C	.	.	H	α-helix	trans	-61.1	-46.4	173.4	-178.7	174.3	-7.7	0	0	111.5	L132 L137 D460 V461 L466 F467 C468	L132-Q464 HydrophobicContact CD1-CG 4.17Å; L137-Q464 VanDerWaalsContact CD1-CA 3.47Å; L137-Q464 HydrophobicContact CD1-CB 3.61Å; L137-Q464 HydrophobicContact CD1-CG 3.86Å; D460-Q464 WeakPolarHBondContact O-CB 3.44Å; D460-Q464 PolarHBondContact O-N 3.17Å; V461-Q464 PolarHBondContact O-N 2.89Å; Q464-L466 VanDerWaalsContact C-N 3.32Å; Q464-L466 PolarHBondContact O-N 3.48Å; Q464-F467 PolarHBondContact O-N 3.26Å; Q464-C468 WeakPolarHBondContact O-CB 3.33Å; Q464-C468 PolarHBondContact O-N 3.14Å; Q464-C468 PolarHBondContact O-SG 3Å
465	E	95.7	Very high	95.4	Very high	32 Å²	32	42.3 Å²	42.3	15%	0.15	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-39.3	176.4	-75	178.3	-172.1	0	0	112.9	L445 R449 V461 R462 F467 C468 F469	L445-E465 HydrophobicContact CD1-CB 4.36Å; R449-E465 IonicContact CZ-OE1 2.9Å; R449-E465 IonicContact CZ-OE2 3.28Å; R449-E465 IonicContact NE-OE1 2.74Å; R449-E465 IonicContact NE-OE2 3.36Å; R449-E465 PolarHBondContact NE-OE2 3.28Å; R449-E465 IonicContact NH2-OE1 2.68Å; R449-E465 PolarHBondContact NH2-OE1 3.24Å; R449-E465 IonicContact NH2-OE2 2.93Å; R449-E465 PolarHBondContact NH2-OE2 3.03Å; V461-E465 WeakPolarHBondContact O-CG 3.03Å; V461-E465 PolarHBondContact O-N 3.32Å; R462-E465 IonicContact CZ-OE1 2.69Å; R462-E465 IonicContact CZ-OE2 2.73Å; R462-E465 IonicContact NE-OE1 3.06Å; R462-E465 IonicContact NE-OE2 3.08Å; R462-E465 PolarHBondContact NE-OE2 3.2Å; R462-E465 IonicContact NH1-OE1 3.28Å; R462-E465 IonicContact NH1-OE2 3.94Å; R462-E465 PolarHBondContact NH1-OE2 3.37Å; R462-E465 VanDerWaalsContact NH2-CD 3.33Å; R462-E465 IonicContact NH2-OE1 3.21Å; R462-E465 PolarHBondContact NH2-OE1 2.82Å; R462-E465 IonicContact NH2-OE2 2.92Å; R462-E465 PolarHBondContact NH2-OE2 2.97Å; R462-E465 PolarHBondContact O-N 3.19Å; E465-F467 VanDerWaalsContact C-N 3.34Å; E465-F467 PolarHBondContact O-N 2.84Å; E465-C468 PolarHBondContact O-N 2.85Å; E465-F469 VanDerWaalsContact O-CB 3.28Å; E465-F469 WeakPolarHBondContact O-CB 3.35Å; E465-F469 PolarHBondContact O-N 2.77Å
466	L	97.4	Very high	95.4	Very high	1 Å²	1	43 Å²	43	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-58.8	-45.8	174.5	-179.3	63.5	0	0	0	111.5	A417 A441 L442 L445 R462 L463 Q464 L470	A417-L466 HydrophobicContact CB-CD2 3.74Å; A441-L466 HydrophobicContact CB-CD1 3.68Å; L442-L466 HydrophobicContact CB-CD1 4.27Å; L445-L466 HydrophobicContact CD1-CB 4Å; L445-L466 HydrophobicContact CD1-CD1 4.06Å; R462-L466 WeakPolarHBondContact O-CB 3.35Å; R462-L466 PolarHBondContact O-N 3.4Å; L463-L466 WeakPolarHBondContact O-CB 3.33Å; L463-L466 PolarHBondContact O-N 3.25Å; Q464-L466 VanDerWaalsContact C-N 3.32Å; Q464-L466 PolarHBondContact O-N 3.48Å; L466-L470 WeakPolarHBondContact O-CB 3.44Å; L466-L470 PolarHBondContact O-N 2.99Å
467	F	97.4	Very high	95.5	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-70.9	-37.1	176.9	-67.7	-49.6	0	0	0	112.9	L132 L137 A417 L420 L463 Q464 E465 F469 L470 E471 F525 M528 L529	L132-F467 HydrophobicContact CD1-CB 4.1Å; L132-F467 HydrophobicContact CD2-CB 3.84Å; L137-F467 HydrophobicContact CD1-CD2 3.99Å; L137-F467 HydrophobicContact CD2-CD2 3.86Å; L137-F467 HydrophobicContact CD2-CE2 3.99Å; A417-F467 HydrophobicContact CB-CE1 4.09Å; A417-F467 HydrophobicContact CB-CZ 4.03Å; L420-F467 HydrophobicContact CD1-CE2 4.28Å; L420-F467 HydrophobicContact CD1-CZ 3.87Å; L463-F467 HydrophobicContact CD1-CD2 4.25Å; L463-F467 HydrophobicContact CD1-CE2 3.58Å; L463-F467 HydrophobicContact CD1-CZ 3.97Å; L463-F467 HydrophobicContact CD2-CE2 4.23Å; L463-F467 HydrophobicContact CG-CD2 4.11Å; L463-F467 HydrophobicContact CG-CE2 3.66Å; L463-F467 VanDerWaalsContact O-CD2 3.24Å; L463-F467 WeakPolarHBondContact O-CD2 3.33Å; L463-F467 PolarHBondContact O-N 2.92Å; L463-F467 VanDerWaalsContact O-N 3.14Å; Q464-F467 PolarHBondContact O-N 3.26Å; E465-F467 VanDerWaalsContact C-N 3.34Å; E465-F467 PolarHBondContact O-N 2.84Å; F467-F469 VanDerWaalsContact C-N 3.35Å; F467-L470 PolarHBondContact O-N 3.05Å; F467-E471 WeakPolarHBondContact O-CB 3.44Å; F467-E471 PolarHBondContact O-N 2.9Å; F467-F525 HydrophobicContact CB-CZ 4.43Å; F467-F525 HydrophobicContact CD1-CE2 4.06Å; F467-M528 HydrophobicContact CD1-CE 4.2Å; F467-M528 HydrophobicContact CE1-CE 3.62Å; F467-M528 HydrophobicContact CZ-CE 4.3Å; F467-L529 HydrophobicContact CB-CD2 4.06Å; F467-L529 HydrophobicContact CD1-CD2 3.9Å; F467-L529 HydrophobicContact CD2-CD2 3.76Å; F467-L529 HydrophobicContact CE1-CD2 4.26Å; F467-L529 HydrophobicContact CE2-CD2 4.11Å; F467-L529 HydrophobicContact CG-CD2 3.64Å; F467-L529 HydrophobicContact CZ-CD2 4.36Å
468	C	96.5	Very high	95.6	Very high	26 Å²	26	44.4 Å²	44.4	18%	0.176	21%	0.209	C	C	.	.	H	α-helix	trans	-64	-41.7	175	-71.7	0	0	0	0	111.3	Q464 E465 E471 R472	Q464-C468 WeakPolarHBondContact O-CB 3.33Å; Q464-C468 PolarHBondContact O-N 3.14Å; Q464-C468 PolarHBondContact O-SG 3Å; E465-C468 PolarHBondContact O-N 2.85Å; C468-E471 PolarHBondContact O-N 2.98Å; C468-R472 WeakPolarHBondContact O-CG 3.48Å; C468-R472 PolarHBondContact O-N 3.4Å
469	F	96.9	Very high	95.7	Very high	55 Å²	55	41.3 Å²	41.3	24%	0.241	19%	0.194	C	C	.	.	H	α-helix	trans	-60.8	-47.8	174.7	-175.8	-83.7	0	0	0	110.3	A441 H444 L445 E465 F467 E471 R472 S473 L479	A441-F469 HydrophobicContact CB-CD1 3.63Å; A441-F469 HydrophobicContact CB-CE1 3.93Å; H444-F469 HydrophobicContact CB-CE1 4.26Å; H444-F469 HydrophobicContact CB-CE2 4.04Å; H444-F469 HydrophobicContact CB-CZ 3.61Å; H444-F469 AromaticContact CG-CZ 3.98Å; L445-F469 HydrophobicContact CD2-CB 4.36Å; L445-F469 HydrophobicContact CD2-CD2 4.11Å; L445-F469 HydrophobicContact CD2-CG 4.44Å; E465-F469 VanDerWaalsContact O-CB 3.28Å; E465-F469 WeakPolarHBondContact O-CB 3.35Å; E465-F469 PolarHBondContact O-N 2.77Å; F467-F469 VanDerWaalsContact C-N 3.35Å; F469-E471 PolarHBondContact O-N 3.49Å; F469-R472 PolarHBondContact O-N 3.14Å; F469-S473 PolarHBondContact O-N 2.85Å; F469-S473 PolarHBondContact O-OG 3.1Å; F469-L479 HydrophobicContact CE1-CD1 3.78Å; F469-L479 HydrophobicContact CZ-CD1 4.47Å
470	L	96.7	Very high	95.6	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-64.6	-40.2	178.9	-166.9	65	0	0	0	112.5	L433 L438 L466 F467 S473 L474 F508 F525	L433-L470 HydrophobicContact CD1-CD2 4.07Å; L433-L470 HydrophobicContact CD2-CD1 3.97Å; L433-L470 HydrophobicContact CD2-CD2 4.2Å; L433-L470 HydrophobicContact CD2-CG 4.36Å; L438-L470 HydrophobicContact CD2-CD2 3.65Å; L466-L470 WeakPolarHBondContact O-CB 3.44Å; L466-L470 PolarHBondContact O-N 2.99Å; F467-L470 PolarHBondContact O-N 3.05Å; L470-S473 PolarHBondContact O-N 3.41Å; L470-L474 HydrophobicContact CG-CD1 4.3Å; L470-L474 WeakPolarHBondContact O-CB 3.23Å; L470-L474 VanDerWaalsContact O-CG 3.27Å; L470-L474 WeakPolarHBondContact O-CG 3.14Å; L470-L474 PolarHBondContact O-N 3.41Å; L470-F508 HydrophobicContact CD1-CE2 4.42Å; L470-F508 HydrophobicContact CD1-CZ 3.93Å; L470-F525 HydrophobicContact CB-CE2 4.36Å; L470-F525 HydrophobicContact CD2-CD2 4.1Å; L470-F525 HydrophobicContact CD2-CE2 3.75Å; L470-F525 HydrophobicContact CG-CE2 4.24Å
471	E	96.2	Very high	95.6	Very high	15 Å²	15	42.1 Å²	42.1	7%	0.07	20%	0.196	C	C	.	.	H	α-helix	trans	-58.8	-50.9	175.2	-178	-178.9	-136.3	0	0	110.8	L132 F467 C468 F469 S473 L474 L475 F525 Y526	L132-E471 WeakPolarHBondContact CA-OE1 3.26Å; L132-E471 WeakPolarHBondContact CA-OE2 3.33Å; L132-E471 HydrophobicContact CD2-CB 4.13Å; L132-E471 PolarHBondContact N-OE1 3.33Å; L132-E471 PolarHBondContact N-OE2 3.49Å; F467-E471 WeakPolarHBondContact O-CB 3.44Å; F467-E471 PolarHBondContact O-N 2.9Å; C468-E471 PolarHBondContact O-N 2.98Å; F469-E471 PolarHBondContact O-N 3.49Å; E471-S473 VanDerWaalsContact C-N 3.35Å; E471-S473 PolarHBondContact O-N 2.85Å; E471-L474 WeakPolarHBondContact O-CB 3.25Å; E471-L474 PolarHBondContact O-N 2.99Å; E471-L474 VanDerWaalsContact O-N 3.15Å; E471-L475 HydrophobicContact CG-CD1 4Å; E471-L475 HydrophobicContact CG-CG 4.39Å; E471-L475 VanDerWaalsContact O-CG 3.31Å; E471-L475 WeakPolarHBondContact O-CG 3.12Å; E471-L475 PolarHBondContact O-N 2.98Å; E471-F525 HydrophobicContact CB-CE1 3.79Å; E471-F525 HydrophobicContact CB-CZ 4.04Å; E471-F525 HydrophobicContact CG-CE1 4.17Å; E471-Y526 WeakPolarHBondContact OE1-CE1 3.43Å; E471-Y526 PolarHBondContact OE1-OH 2.95Å
472	R	95.8	Very high	95.7	Very high	146 Å²	146	39.7 Å²	39.7	55%	0.551	18%	0.182	S	C	*	.	H	α-helix	trans	-56.9	-49	176.3	-72.4	172.4	61.7	170.6	3.2	111.1	C468 F469 L474 L475 E476	C468-R472 WeakPolarHBondContact O-CG 3.48Å; C468-R472 PolarHBondContact O-N 3.4Å; F469-R472 PolarHBondContact O-N 3.14Å; R472-L474 VanDerWaalsContact C-N 3.29Å; R472-L474 PolarHBondContact O-N 3.22Å; R472-L475 PolarHBondContact O-N 3.02Å; R472-E476 WeakPolarHBondContact O-CB 3.44Å; R472-E476 WeakPolarHBondContact O-CG 3.44Å; R472-E476 PolarHBondContact O-N 3.38Å
473	S	97.1	Very high	95.6	Very high	10 Å²	10	38.9 Å²	38.9	7%	0.07	18%	0.179	C	C	.	.	H	α-helix	trans	-59.5	-38	176.8	-66.5	0	0	0	0	112.9	F469 L470 E471 K477 K478 F508	F469-S473 PolarHBondContact O-N 2.85Å; F469-S473 PolarHBondContact O-OG 3.1Å; L470-S473 PolarHBondContact O-N 3.41Å; E471-S473 VanDerWaalsContact C-N 3.35Å; E471-S473 PolarHBondContact O-N 2.85Å; S473-K477 CarbonylContact O-C 3.59Å; S473-K477 WeakPolarHBondContact O-CA 3.33Å; S473-K477 PolarHBondContact O-N 2.94Å; S473-K478 VanDerWaalsContact CA-O 3.29Å; S473-K478 WeakPolarHBondContact CA-O 3.21Å; S473-K478 WeakPolarHBondContact CB-O 3.39Å; S473-K478 PolarHBondContact O-N 3.28Å; S473-K478 PolarHBondContact OG-O 3.14Å; S473-F508 WeakPolarHBondContact O-CD2 3.49Å
474	L	95.7	Very high	95.4	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.016	18%	0.181	C	C	.	.	H	α-helix	trans	-67	-48.3	175.8	-76.5	167.9	0	0	0	111.5	L433 L470 E471 R472 E476 K477 F508 F511 Y518 T521 F525	L433-L474 HydrophobicContact CD1-CD1 4.22Å; L433-L474 HydrophobicContact CD2-CD2 4.15Å; L470-L474 HydrophobicContact CG-CD1 4.3Å; L470-L474 WeakPolarHBondContact O-CB 3.23Å; L470-L474 VanDerWaalsContact O-CG 3.27Å; L470-L474 WeakPolarHBondContact O-CG 3.14Å; L470-L474 PolarHBondContact O-N 3.41Å; E471-L474 WeakPolarHBondContact O-CB 3.25Å; E471-L474 PolarHBondContact O-N 2.99Å; E471-L474 VanDerWaalsContact O-N 3.15Å; R472-L474 VanDerWaalsContact C-N 3.29Å; R472-L474 PolarHBondContact O-N 3.22Å; L474-E476 VanDerWaalsContact C-N 3.32Å; L474-E476 PolarHBondContact O-N 3.29Å; L474-K477 WeakPolarHBondContact O-CA 3.2Å; L474-K477 PolarHBondContact O-N 3.18Å; L474-F508 HydrophobicContact CD2-CD2 4.49Å; L474-F508 HydrophobicContact CD2-CE2 3.9Å; L474-F508 HydrophobicContact CD2-CZ 4.02Å; L474-F508 HydrophobicContact CG-CE2 4.07Å; L474-F508 HydrophobicContact CG-CZ 4.41Å; L474-F511 HydrophobicContact CD2-CD2 4.11Å; L474-F511 HydrophobicContact CD2-CE2 3.59Å; L474-F511 HydrophobicContact CD2-CZ 4.48Å; L474-Y518 VanDerWaalsContact O-CE2 3.26Å; L474-Y518 WeakPolarHBondContact O-CE2 3.37Å; L474-T521 HydrophobicContact CD2-CG2 4.12Å; L474-F525 HydrophobicContact CD1-CB 3.98Å; L474-F525 HydrophobicContact CD1-CD1 3.77Å; L474-F525 HydrophobicContact CD1-CD2 4Å; L474-F525 HydrophobicContact CD1-CE1 4.23Å; L474-F525 HydrophobicContact CD1-CE2 4.45Å; L474-F525 HydrophobicContact CD1-CG 3.63Å
475	L	94.8	Very high	95	Very high	96 Å²	96	35.4 Å²	35.4	50%	0.503	17%	0.166	S	C	.	.	H	α-helix	trans	-61.6	-40.7	-179.8	-67.9	174.5	0	0	0	111.8	E471 R472 K477	E471-L475 HydrophobicContact CG-CD1 4Å; E471-L475 HydrophobicContact CG-CG 4.39Å; E471-L475 VanDerWaalsContact O-CG 3.31Å; E471-L475 WeakPolarHBondContact O-CG 3.12Å; E471-L475 PolarHBondContact O-N 2.98Å; R472-L475 PolarHBondContact O-N 3.02Å; L475-K477 PolarHBondContact O-N 3.23Å
476	E	95	Very high	94.9	Very high	117 Å²	117	34.8 Å²	34.8	55%	0.547	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-10.3	174.3	-66.8	173.5	-156.6	0	0	113	R472 L474 K478	R472-E476 WeakPolarHBondContact O-CB 3.44Å; R472-E476 WeakPolarHBondContact O-CG 3.44Å; R472-E476 PolarHBondContact O-N 3.38Å; L474-E476 VanDerWaalsContact C-N 3.32Å; L474-E476 PolarHBondContact O-N 3.29Å; E476-K478 HydrophobicContact CB-CB 4.06Å; E476-K478 PolarHBondContact O-N 2.98Å
477	K	94.8	Very high	94.5	Very high	57 Å²	57	40.6 Å²	40.6	25%	0.248	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	36.2	-171.5	-55.6	176.3	177.4	-170.7	0	112.4	S473 L474 L475 N506 F508 F511 V512 Y518	S473-K477 CarbonylContact O-C 3.59Å; S473-K477 WeakPolarHBondContact O-CA 3.33Å; S473-K477 PolarHBondContact O-N 2.94Å; L474-K477 WeakPolarHBondContact O-CA 3.2Å; L474-K477 PolarHBondContact O-N 3.18Å; L475-K477 PolarHBondContact O-N 3.23Å; K477-N506 PolarHBondContact O-ND2 3.41Å; K477-F508 WeakPolarHBondContact O-CB 3.36Å; K477-F511 HydrophobicContact CB-CB 4.36Å; K477-F511 HydrophobicContact CG-CB 4.34Å; K477-F511 PolarHBondContact NZ-O 3.36Å; K477-V512 HydrophobicContact CB-CG2 3.97Å; K477-V512 HydrophobicContact CD-CG2 4.33Å; K477-Y518 HydrophobicContact CD-CD2 4.46Å; K477-Y518 HydrophobicContact CD-CE2 4.38Å; K477-Y518 VanDerWaalsContact CE-CE1 3.42Å; K477-Y518 HydrophobicContact CG-CD2 4.11Å; K477-Y518 HydrophobicContact CG-CE2 3.77Å
478	K	93.9	Very high	94.2	Very high	91 Å²	91	45.8 Å²	45.8	40%	0.396	21%	0.213	S	C	.	.			trans	-140.9	111.2	-169.3	-167.6	174.7	175.2	-176.3	0	110.8	S473 E476 H480 N506	S473-K478 VanDerWaalsContact CA-O 3.29Å; S473-K478 WeakPolarHBondContact CA-O 3.21Å; S473-K478 WeakPolarHBondContact CB-O 3.39Å; S473-K478 PolarHBondContact O-N 3.28Å; S473-K478 PolarHBondContact OG-O 3.14Å; E476-K478 HydrophobicContact CB-CB 4.06Å; E476-K478 PolarHBondContact O-N 2.98Å; K478-H480 WeakPolarHBondContact CE-CE1 3.27Å; K478-H480 WeakPolarHBondContact CE-NE2 3.27Å; K478-N506 WeakPolarHBondContact CA-OD1 3.49Å
479	L	95.6	Very high	94	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	21%	0.207	C	C	.	.			trans	-131.7	107.6	168.9	176.4	58.5	0	0	0	107.8	H437 T440 F469 N506 L507 F508	H437-L479 HydrophobicContact CB-CD2 4.08Å; T440-L479 HydrophobicContact CG2-CD1 4.18Å; T440-L479 HydrophobicContact CG2-CD2 4.43Å; T440-L479 HydrophobicContact CG2-CG 4.26Å; F469-L479 HydrophobicContact CE1-CD1 3.78Å; F469-L479 HydrophobicContact CZ-CD1 4.47Å; L479-N506 PolarHBondContact N-OD1 3.3Å; L479-N506 CarbonylContact O-C 3.59Å; L479-N506 PolarHBondContact O-OD1 2.9Å; L479-L507 HydrophobicContact CB-CB 4.47Å; L479-L507 HydrophobicContact CD2-CD1 4.38Å; L479-L507 HydrophobicContact CG-CD1 4.35Å; L479-L507 WeakPolarHBondContact O-CB 3.48Å; L479-L507 PolarHBondContact O-N 2.94Å; L479-F508 HydrophobicContact CB-CD1 4.19Å; L479-F508 HydrophobicContact CB-CD2 3.54Å; L479-F508 HydrophobicContact CB-CE1 4.31Å; L479-F508 HydrophobicContact CB-CE2 3.66Å; L479-F508 HydrophobicContact CB-CG 3.82Å; L479-F508 HydrophobicContact CB-CZ 4.05Å; L479-F508 HydrophobicContact CD2-CE1 3.93Å; L479-F508 HydrophobicContact CD2-CE2 4.1Å; L479-F508 HydrophobicContact CD2-CZ 3.69Å
480	H	93.7	Very high	93.7	Very high	65 Å²	65	45.3 Å²	45.3	30%	0.301	22%	0.215	S	C	.	.	B	Isolated β-bridge	trans	-70.9	138.6	178.5	-63.9	140.4	0	0	0	111.1	H444 K478 F482 P504 L505	H444-H480 PolarHBondContact NE2-O 3.16Å; K478-H480 WeakPolarHBondContact CE-CE1 3.27Å; K478-H480 WeakPolarHBondContact CE-NE2 3.27Å; H480-F482 PolarHBondContact O-N 2.93Å; H480-P504 HydrophobicContact CB-CB 4.47Å; H480-L505 CarbonylContact C-O 3.58Å; H480-L505 VanDerWaalsContact CA-O 3.29Å; H480-L505 WeakPolarHBondContact CA-O 3.32Å
481	H	93.6	Very high	93.3	Very high	7 Å²	7	52.7 Å²	52.7	3%	0.032	25%	0.25	C	C	.	.			trans	-55.3	138.6	166.8	-176.8	-89.1	0	0	0	109.6	F389 Y436 F483 V484 L505 L507	F389-H481 AromaticContact CD2-CE1 3.26Å; F389-H481 WeakPolarHBondContact CD2-CE1 3.49Å; F389-H481 AromaticContact CD2-NE2 3.35Å; F389-H481 WeakPolarHBondContact CD2-NE2 3.38Å; F389-H481 AromaticContact CE2-CE1 3.65Å; F389-H481 AromaticContact CE2-NE2 3.95Å; F389-H481 AromaticContact CG-CE1 3.5Å; F389-H481 AromaticContact CG-NE2 3.86Å; Y436-H481 PolarHBondContact OH-CD2 2.74Å; Y436-H481 VanDerWaalsContact OH-CD2 3.32Å; Y436-H481 PolarHBondContact OH-NE2 3.36Å; Y436-H481 VanDerWaalsContact OH-NE2 3.08Å; H481-F483 VanDerWaalsContact C-N 3.31Å; H481-F483 PolarHBondContact ND1-N 2.93Å; H481-F483 VanDerWaalsContact ND1-N 3.17Å; H481-F483 PolarHBondContact O-N 2.8Å; H481-V484 HydrophobicContact CB-CB 4.26Å; H481-V484 HydrophobicContact CB-CG2 4.47Å; H481-V484 WeakPolarHBondContact ND1-CG2 3.4Å; H481-V484 PolarHBondContact ND1-N 2.93Å; H481-L505 HydrophobicContact CB-CB 3.94Å; H481-L505 HydrophobicContact CB-CD2 4.28Å; H481-L505 HydrophobicContact CB-CG 4.32Å; H481-L505 PolarHBondContact N-O 3.37Å; H481-L507 HydrophobicContact CB-CD2 4.16Å; H481-L507 HydrophobicContact CB-CG 4.34Å
482	F	95.7	Very high	92.9	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	-63.1	-34.8	-170	-177.1	-109.9	0	0	0	113.7	F396 T440 L443 H444 L447 H480 N486 V489	F396-F482 HydrophobicContact CD1-CE1 4.04Å; F396-F482 HydrophobicContact CD1-CZ 4.24Å; F396-F482 AromaticContact CD2-CE1 3.73Å; F396-F482 HydrophobicContact CD2-CE1 3.73Å; F396-F482 AromaticContact CD2-CZ 3.99Å; F396-F482 HydrophobicContact CD2-CZ 3.99Å; F396-F482 HydrophobicContact CE1-CE1 4.08Å; F396-F482 AromaticContact CE1-CZ 3.8Å; F396-F482 HydrophobicContact CE1-CZ 3.8Å; F396-F482 AromaticContact CE2-CE1 3.81Å; F396-F482 HydrophobicContact CE2-CE1 3.81Å; F396-F482 AromaticContact CE2-CZ 3.54Å; F396-F482 HydrophobicContact CE2-CZ 3.54Å; F396-F482 AromaticContact CG-CE1 3.84Å; F396-F482 HydrophobicContact CG-CE1 3.84Å; F396-F482 HydrophobicContact CG-CZ 4.31Å; F396-F482 AromaticContact CZ-CE1 3.97Å; F396-F482 HydrophobicContact CZ-CE1 3.97Å; F396-F482 HydrophobicContact CZ-CE2 4.42Å; F396-F482 AromaticContact CZ-CZ 3.43Å; F396-F482 HydrophobicContact CZ-CZ 3.43Å; F396-F482 VanDerWaalsContact CZ-CZ 3.43Å; T440-F482 HydrophobicContact CG2-CB 4.38Å; L443-F482 HydrophobicContact CB-CB 4.33Å; L443-F482 HydrophobicContact CB-CD1 4.03Å; L443-F482 HydrophobicContact CB-CD2 3.48Å; L443-F482 VanDerWaalsContact CB-CD2 3.48Å; L443-F482 HydrophobicContact CB-CE1 4.21Å; L443-F482 HydrophobicContact CB-CE2 3.7Å; L443-F482 HydrophobicContact CB-CG 3.66Å; L443-F482 HydrophobicContact CB-CZ 4.06Å; L443-F482 HydrophobicContact CD1-CB 4.1Å; L443-F482 HydrophobicContact CD1-CD1 3.92Å; L443-F482 HydrophobicContact CD1-CG 3.95Å; L443-F482 HydrophobicContact CG-CD1 4.49Å; L443-F482 HydrophobicContact CG-CG 4.43Å; L443-F482 VanDerWaalsContact O-CE2 3.22Å; L443-F482 WeakPolarHBondContact O-CE2 3.49Å; H444-F482 AromaticContact CE1-CD2 3.92Å; H444-F482 AromaticContact ND1-CD2 3.85Å; L447-F482 HydrophobicContact CB-CE2 4.08Å; L447-F482 HydrophobicContact CB-CZ 4.35Å; L447-F482 HydrophobicContact CD2-CE2 3.89Å; L447-F482 HydrophobicContact CD2-CZ 4.14Å; H480-F482 PolarHBondContact O-N 2.93Å; F482-N486 WeakPolarHBondContact O-CB 3.45Å; F482-N486 PolarHBondContact O-ND2 3.22Å; F482-V489 HydrophobicContact CD1-CG2 4.48Å; F482-V489 HydrophobicContact CE1-CG2 4.03Å; F482-V489 HydrophobicContact CZ-CG2 4.11Å
483	F	94	Very high	92.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.258	C	S	.	.	S	Bend	trans	-102.7	-27.3	-175.6	-64	-64.8	0	0	0	116	F389 E393 F396 H481 G485 V489 M493 L495	F389-F483 HydrophobicContact CB-CD2 3.76Å; F389-F483 HydrophobicContact CB-CE2 4.17Å; F389-F483 HydrophobicContact CD1-CB 3.93Å; F389-F483 AromaticContact CD1-CD2 3.83Å; F389-F483 HydrophobicContact CD1-CD2 3.83Å; F389-F483 HydrophobicContact CD1-CG 4.15Å; F389-F483 HydrophobicContact CE1-CB 4.11Å; F389-F483 HydrophobicContact CG-CD2 4.01Å; E393-F483 HydrophobicContact CB-CE2 4.39Å; E393-F483 HydrophobicContact CG-CD2 4.42Å; E393-F483 HydrophobicContact CG-CE2 3.59Å; E393-F483 HydrophobicContact CG-CZ 4.45Å; F396-F483 HydrophobicContact CB-CZ 4.15Å; H481-F483 VanDerWaalsContact C-N 3.31Å; H481-F483 PolarHBondContact ND1-N 2.93Å; H481-F483 VanDerWaalsContact ND1-N 3.17Å; H481-F483 PolarHBondContact O-N 2.8Å; F483-G485 PolarHBondContact O-N 2.81Å; F483-V489 HydrophobicContact CD1-CG1 3.92Å; F483-V489 HydrophobicContact CD1-CG2 4.03Å; F483-V489 HydrophobicContact CE1-CG1 3.88Å; F483-V489 HydrophobicContact CE1-CG2 4.46Å; F483-M493 HydrophobicContact CE1-CE 4.04Å; F483-M493 HydrophobicContact CZ-CE 4.14Å; F483-L495 HydrophobicContact CB-CD1 4.29Å; F483-L495 HydrophobicContact CB-CD2 4.25Å; F483-L495 HydrophobicContact CD1-CD1 3.56Å; F483-L495 HydrophobicContact CD1-CD2 4.1Å; F483-L495 HydrophobicContact CD1-CG 4.41Å; F483-L495 HydrophobicContact CE1-CD1 4.26Å; F483-L495 HydrophobicContact CG-CD1 4.28Å; F483-L495 HydrophobicContact CG-CD2 4.22Å
484	V	90.8	Very high	92.3	Very high	8 Å²	8	51.7 Å²	51.7	5%	0.048	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	118.3	-168.3	175.3	0	0	0	0	107.6	F389 H481 N486 V499 A502 P504 L505	F389-V484 HydrophobicContact CE1-CG2 4.48Å; F389-V484 HydrophobicContact CE2-CG2 3.84Å; F389-V484 HydrophobicContact CZ-CG2 3.65Å; H481-V484 HydrophobicContact CB-CB 4.26Å; H481-V484 HydrophobicContact CB-CG2 4.47Å; H481-V484 WeakPolarHBondContact ND1-CG2 3.4Å; H481-V484 PolarHBondContact ND1-N 2.93Å; V484-N486 PolarHBondContact O-N 3.45Å; V484-V499 HydrophobicContact CG2-CG1 4.03Å; V484-A502 HydrophobicContact CG1-CB 3.83Å; V484-P504 WeakPolarHBondContact O-CA 3.22Å; V484-L505 HydrophobicContact CB-CB 4.12Å; V484-L505 HydrophobicContact CG1-CB 3.94Å
485	G	88.3	Confident	92.1	Very high	12 Å²	12	52 Å²	52	12%	0.124	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	12.4	-176.1	0	0	0	0	0	115.1	F483 V499 R500 A502	F483-G485 PolarHBondContact O-N 2.81Å; G485-V499 PolarHBondContact N-O 3.09Å; G485-R500 WeakPolarHBondContact CA-O 3.4Å; G485-A502 WeakPolarHBondContact CA-O 3.28Å
486	N	92.4	Very high	91.8	Very high	20 Å²	20	48.9 Å²	48.9	11%	0.107	27%	0.266	C	S	.	.			trans	-96.9	99.3	179.6	-171.5	0.6	0	0	0	111.2	F482 V484 K488 V489	F482-N486 WeakPolarHBondContact O-CB 3.45Å; F482-N486 PolarHBondContact O-ND2 3.22Å; V484-N486 PolarHBondContact O-N 3.45Å; N486-K488 PolarHBondContact O-N 3.19Å; N486-K488 WeakPolarHBondContact OD1-CB 3.48Å; N486-K488 PolarHBondContact OD1-N 3.24Å; N486-V489 HydrophobicContact CB-CG2 4.06Å
487	H	89.6	Confident	91.3	Very high	123 Å²	123	46.8 Å²	46.8	57%	0.569	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-11.8	178.3	59	-94.4	0	0	0	113.8
488	K	91	Very high	90.8	Very high	109 Å²	109	47 Å²	47	47%	0.474	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-15.2	179.9	-60.7	-176	179.3	-176.2	0	112.9	L447 N486	L447-K488 HydrophobicContact CD2-CB 3.65Å; L447-K488 HydrophobicContact CG-CB 4.36Å; N486-K488 PolarHBondContact O-N 3.19Å; N486-K488 WeakPolarHBondContact OD1-CB 3.48Å; N486-K488 PolarHBondContact OD1-N 3.24Å
489	V	92.8	Very high	90.4	Very high	6 Å²	6	42.7 Å²	42.7	4%	0.036	24%	0.243	C	C	.	.	S	Bend	trans	-68.4	131.9	177.5	179.7	0	0	0	0	109.4	F482 F483 N486 E491 M493 L495	F482-V489 HydrophobicContact CD1-CG2 4.48Å; F482-V489 HydrophobicContact CE1-CG2 4.03Å; F482-V489 HydrophobicContact CZ-CG2 4.11Å; F483-V489 HydrophobicContact CD1-CG1 3.92Å; F483-V489 HydrophobicContact CD1-CG2 4.03Å; F483-V489 HydrophobicContact CE1-CG1 3.88Å; F483-V489 HydrophobicContact CE1-CG2 4.46Å; N486-V489 HydrophobicContact CB-CG2 4.06Å; V489-E491 PolarHBondContact O-N 3.38Å; V489-M493 HydrophobicContact CG1-CB 4.3Å; V489-M493 HydrophobicContact CG1-CG 3.85Å; V489-L495 HydrophobicContact CB-CD1 4.31Å; V489-L495 HydrophobicContact CG1-CD1 3.8Å
490	P	89.9	Confident	90	Very high	65 Å²	65	45 Å²	45	42%	0.422	25%	0.252	S	S	.	.			trans	-56	133.3	-178.5	-26.4	34.1	0	0	0	113.1	A492 M493	P490-A492 PolarHBondContact O-N 3.43Å; P490-A492 VanDerWaalsContact O-N 3.14Å; P490-M493 VanDerWaalsContact O-CB 3.28Å; P490-M493 WeakPolarHBondContact O-CB 3.38Å; P490-M493 WeakPolarHBondContact O-CG 3.32Å; P490-M493 PolarHBondContact O-N 3.39Å
491	E	88	Confident	89.6	Confident	155 Å²	155	50.9 Å²	50.9	72%	0.724	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-59.1	-27.7	178	-64.9	-174.4	166.1	0	0	112.9	V489 M493 G494	V489-E491 PolarHBondContact O-N 3.38Å; E491-M493 PolarHBondContact O-N 3.35Å; E491-G494 PolarHBondContact O-N 3.31Å
492	A	88.8	Confident	89.2	Confident	88 Å²	88	51.1 Å²	51.1	73%	0.727	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-57.7	-14.7	174	0	0	0	0	0	113.9	P490 G494	P490-A492 PolarHBondContact O-N 3.43Å; P490-A492 VanDerWaalsContact O-N 3.14Å; A492-G494 PolarHBondContact O-N 3.4Å
493	M	90.1	Very high	88.7	Confident	14 Å²	14	56.2 Å²	56.2	7%	0.069	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-68.6	-19.1	172	-72	-65.7	-65.9	0	0	113.1	Y392 Q395 F396 F483 V489 P490 E491 L495	Y392-M493 HydrophobicContact CD1-CE 4.03Å; Y392-M493 VanDerWaalsContact CE1-O 3.22Å; Y392-M493 WeakPolarHBondContact CE1-O 3.49Å; Y392-M493 WeakPolarHBondContact O-CE 3.41Å; Q395-M493 HydrophobicContact CB-CE 4.1Å; Q395-M493 HydrophobicContact CG-CE 4.01Å; Q395-M493 HydrophobicContact CG-SD 4.06Å; F396-M493 HydrophobicContact CB-CE 3.75Å; F396-M493 HydrophobicContact CB-SD 4.25Å; F396-M493 HydrophobicContact CD2-SD 4.48Å; F483-M493 HydrophobicContact CE1-CE 4.04Å; F483-M493 HydrophobicContact CZ-CE 4.14Å; V489-M493 HydrophobicContact CG1-CB 4.3Å; V489-M493 HydrophobicContact CG1-CG 3.85Å; P490-M493 VanDerWaalsContact O-CB 3.28Å; P490-M493 WeakPolarHBondContact O-CB 3.38Å; P490-M493 WeakPolarHBondContact O-CG 3.32Å; P490-M493 PolarHBondContact O-N 3.39Å; E491-M493 PolarHBondContact O-N 3.35Å; M493-L495 HydrophobicContact CB-CD1 4.4Å; M493-L495 HydrophobicContact CB-CG 4.3Å; M493-L495 PolarHBondContact O-N 3.44Å
494	G	90	Very high	88.4	Confident	49 Å²	49	58.1 Å²	58.1	51%	0.505	31%	0.311	S	S	.	.			trans	68.7	31.9	178.2	0	0	0	0	0	114	Y392 E491 A492	Y392-G494 PolarHBondContact OH-O 3.27Å; E491-G494 PolarHBondContact O-N 3.31Å; A492-G494 PolarHBondContact O-N 3.4Å
495	L	90.8	Very high	88.3	Confident	9 Å²	9	58.4 Å²	58.4	5%	0.047	31%	0.312	C	S	.	.			trans	-69.1	138.4	176.1	-71.8	161.5	0	0	0	110.9	F389 Y392 F483 V489 M493 E497 R500	F389-L495 HydrophobicContact CD1-CD2 4.44Å; F389-L495 HydrophobicContact CE1-CD2 4.44Å; Y392-L495 HydrophobicContact CD1-CD2 3.78Å; Y392-L495 HydrophobicContact CD1-CG 4.33Å; Y392-L495 HydrophobicContact CD2-CD2 3.78Å; Y392-L495 HydrophobicContact CE1-CD2 3.81Å; Y392-L495 HydrophobicContact CE1-CG 4.2Å; Y392-L495 HydrophobicContact CE2-CD2 3.79Å; Y392-L495 HydrophobicContact CG-CD2 3.75Å; F483-L495 HydrophobicContact CB-CD1 4.29Å; F483-L495 HydrophobicContact CB-CD2 4.25Å; F483-L495 HydrophobicContact CD1-CD1 3.56Å; F483-L495 HydrophobicContact CD1-CD2 4.1Å; F483-L495 HydrophobicContact CD1-CG 4.41Å; F483-L495 HydrophobicContact CE1-CD1 4.26Å; F483-L495 HydrophobicContact CG-CD1 4.28Å; F483-L495 HydrophobicContact CG-CD2 4.22Å; V489-L495 HydrophobicContact CB-CD1 4.31Å; V489-L495 HydrophobicContact CG1-CD1 3.8Å; M493-L495 HydrophobicContact CB-CD1 4.4Å; M493-L495 HydrophobicContact CB-CG 4.3Å; M493-L495 PolarHBondContact O-N 3.44Å; L495-E497 PolarHBondContact O-N 3.22Å; L495-R500 PolarHBondContact O-NH2 3.37Å
496	P	88.9	Confident	88.4	Confident	31 Å²	31	59.5 Å²	59.5	20%	0.201	32%	0.315	C	S	.	.			trans	-56.1	138.2	174.5	-25.3	34.2	0	0	0	112.2	L364 V498 V499 R500	L364-P496 HydrophobicContact CD2-CG 4.48Å; P496-V498 PolarHBondContact O-N 3.42Å; P496-V498 VanDerWaalsContact O-N 3.16Å; P496-V499 HydrophobicContact CB-CG2 4.3Å; P496-V499 WeakPolarHBondContact O-CB 3.34Å; P496-V499 PolarHBondContact O-N 3.01Å; P496-R500 PolarHBondContact O-N 2.91Å
497	E	85.5	Confident	88.3	Confident	73 Å²	73	59.8 Å²	59.8	34%	0.341	32%	0.316	S	S	.	.	H	α-helix	trans	-56.8	-37.5	-174.7	-168.5	63	-160.2	0	0	112.9	L495 V499 R500 R501	L495-E497 PolarHBondContact O-N 3.22Å; E497-V499 VanDerWaalsContact C-N 3.27Å; E497-V499 PolarHBondContact O-N 3.43Å; E497-R500 PolarHBondContact O-N 3.32Å; E497-R500 IonicContact OE1-NH1 3.28Å; E497-R500 IonicContact OE2-CZ 3.67Å; E497-R500 VanDerWaalsContact OE2-CZ 3.28Å; E497-R500 IonicContact OE2-NH1 3.82Å; E497-R500 PolarHBondContact OE2-NH1 2.92Å; E497-R500 IonicContact OE2-NH2 2.77Å; E497-R500 PolarHBondContact OE2-NH2 3.12Å; E497-R501 HydrophobicContact CG-CG 4.32Å; E497-R501 WeakPolarHBondContact O-CG 3.35Å; E497-R501 PolarHBondContact O-N 3.12Å; E497-R501 IonicContact OE1-CZ 3.72Å; E497-R501 IonicContact OE1-NE 2.82Å; E497-R501 PolarHBondContact OE1-NE 3.37Å; E497-R501 IonicContact OE1-NH2 3.44Å; E497-R501 PolarHBondContact OE1-NH2 2.96Å
498	V	82.8	Confident	88.5	Confident	61 Å²	61	53.9 Å²	53.9	37%	0.37	29%	0.289	S	S	.	.	H	α-helix	trans	-64.6	-33.4	-179.7	-170	0	0	0	0	111.4	F227 C229 P496 A502	F227-V498 HydrophobicContact CD2-CG1 4.43Å; F227-V498 HydrophobicContact CE2-CB 3.58Å; F227-V498 HydrophobicContact CE2-CG1 3.36Å; F227-V498 HydrophobicContact CE2-CG2 4.4Å; F227-V498 HydrophobicContact CZ-CB 3.65Å; F227-V498 HydrophobicContact CZ-CG1 3.81Å; F227-V498 HydrophobicContact CZ-CG2 4.02Å; C229-V498 HydrophobicContact CB-CG1 4.3Å; P496-V498 PolarHBondContact O-N 3.42Å; P496-V498 VanDerWaalsContact O-N 3.16Å; V498-A502 WeakPolarHBondContact O-CB 3.47Å; V498-A502 PolarHBondContact O-N 3.46Å
499	V	86.4	Confident	88.3	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-71.4	-41.4	174.9	175.4	0	0	0	0	110.6	L364 F389 V484 G485 P496 E497 R501 A502	L364-V499 HydrophobicContact CD2-CG2 4.16Å; F389-V499 HydrophobicContact CE1-CG1 3.74Å; F389-V499 HydrophobicContact CE1-CG2 4.5Å; F389-V499 HydrophobicContact CZ-CG1 3.83Å; F389-V499 HydrophobicContact CZ-CG2 4.39Å; V484-V499 HydrophobicContact CG2-CG1 4.03Å; G485-V499 PolarHBondContact N-O 3.09Å; P496-V499 HydrophobicContact CB-CG2 4.3Å; P496-V499 WeakPolarHBondContact O-CB 3.34Å; P496-V499 PolarHBondContact O-N 3.01Å; E497-V499 VanDerWaalsContact C-N 3.27Å; E497-V499 PolarHBondContact O-N 3.43Å; V499-R501 PolarHBondContact O-N 3.46Å; V499-A502 WeakPolarHBondContact O-CB 3.44Å; V499-A502 PolarHBondContact O-N 3.23Å
500	R	87.1	Confident	87.9	Confident	51 Å²	51	52.3 Å²	52.3	19%	0.192	28%	0.281	C	S	.	.	H	α-helix	trans	-66.5	-36.8	-179.2	-157.8	-176	-48.4	124	16.9	112.3	G485 L495 P496 E497	G485-R500 WeakPolarHBondContact CA-O 3.4Å; L495-R500 PolarHBondContact O-NH2 3.37Å; P496-R500 PolarHBondContact O-N 2.91Å; E497-R500 PolarHBondContact O-N 3.32Å; E497-R500 IonicContact OE1-NH1 3.28Å; E497-R500 IonicContact OE2-CZ 3.67Å; E497-R500 VanDerWaalsContact OE2-CZ 3.28Å; E497-R500 IonicContact OE2-NH1 3.82Å; E497-R500 PolarHBondContact OE2-NH1 2.92Å; E497-R500 IonicContact OE2-NH2 2.77Å; E497-R500 PolarHBondContact OE2-NH2 3.12Å
501	R	85.1	Confident	87.9	Confident	188 Å²	188	49.2 Å²	49.2	71%	0.709	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-1.5	178.7	-64.2	-173.2	-171.8	172.7	8.3	114.7	E497 V499	E497-R501 HydrophobicContact CG-CG 4.32Å; E497-R501 WeakPolarHBondContact O-CG 3.35Å; E497-R501 PolarHBondContact O-N 3.12Å; E497-R501 IonicContact OE1-CZ 3.72Å; E497-R501 IonicContact OE1-NE 2.82Å; E497-R501 PolarHBondContact OE1-NE 3.37Å; E497-R501 IonicContact OE1-NH2 3.44Å; E497-R501 PolarHBondContact OE1-NH2 2.96Å; V499-R501 PolarHBondContact O-N 3.46Å
502	A	85.2	Confident	87.8	Confident	11 Å²	11	46.1 Å²	46.1	9%	0.091	25%	0.253	C	S	.	.	S	Bend	trans	-66.4	160.6	178.9	0	0	0	0	0	111.4	C229 V484 G485 V498 V499	C229-A502 HydrophobicContact CB-CB 3.96Å; V484-A502 HydrophobicContact CG1-CB 3.83Å; G485-A502 WeakPolarHBondContact CA-O 3.28Å; V498-A502 WeakPolarHBondContact O-CB 3.47Å; V498-A502 PolarHBondContact O-N 3.46Å; V499-A502 WeakPolarHBondContact O-CB 3.44Å; V499-A502 PolarHBondContact O-N 3.23Å
503	E	84.9	Confident	87.6	Confident	107 Å²	107	46.9 Å²	46.9	50%	0.5	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-65.2	136.3	167.1	-173.6	177.3	-167.5	0	0	109.9	R105 L505	R105-E503 IonicContact NH1-OE1 3.65Å; E503-L505 PolarHBondContact O-N 2.67Å; E503-L505 VanDerWaalsContact O-N 3.17Å
504	P	89.1	Confident	87.5	Confident	41 Å²	41	51.1 Å²	51.1	27%	0.266	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-55.2	120.2	178.3	-27.8	35.4	0	0	0	112.9	H480 V484 N506	H480-P504 HydrophobicContact CB-CB 4.47Å; V484-P504 WeakPolarHBondContact O-CA 3.22Å; P504-N506 PolarHBondContact O-N 2.97Å
505	L	87.2	Confident	87.5	Confident	14 Å²	14	58.7 Å²	58.7	7%	0.073	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-76.4	119.9	-178	174.7	60.7	0	0	0	111	Q239 H480 H481 V484 E503 L507	Q239-L505 HydrophobicContact CB-CD1 3.6Å; H480-L505 CarbonylContact C-O 3.58Å; H480-L505 VanDerWaalsContact CA-O 3.29Å; H480-L505 WeakPolarHBondContact CA-O 3.32Å; H481-L505 HydrophobicContact CB-CB 3.94Å; H481-L505 HydrophobicContact CB-CD2 4.28Å; H481-L505 HydrophobicContact CB-CG 4.32Å; H481-L505 PolarHBondContact N-O 3.37Å; V484-L505 HydrophobicContact CB-CB 4.12Å; V484-L505 HydrophobicContact CG1-CB 3.94Å; E503-L505 PolarHBondContact O-N 2.67Å; E503-L505 VanDerWaalsContact O-N 3.17Å; L505-L507 PolarHBondContact O-N 2.88Å
506	N	90.6	Very high	87.5	Confident	35 Å²	35	63.8 Å²	63.8	19%	0.187	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-83.9	111.9	174.2	-177.2	11.7	0	0	0	112	K477 K478 L479 P504 F508 R509	K477-N506 PolarHBondContact O-ND2 3.41Å; K478-N506 WeakPolarHBondContact CA-OD1 3.49Å; L479-N506 PolarHBondContact N-OD1 3.3Å; L479-N506 CarbonylContact O-C 3.59Å; L479-N506 PolarHBondContact O-OD1 2.9Å; P504-N506 PolarHBondContact O-N 2.97Å; N506-F508 VanDerWaalsContact C-N 3.3Å; N506-F508 PolarHBondContact O-N 2.78Å; N506-F508 PolarHBondContact OD1-N 3.14Å; N506-R509 WeakPolarHBondContact O-CB 3.26Å; N506-R509 PolarHBondContact O-N 3.25Å
507	L	90.8	Very high	87.6	Confident	25 Å²	25	64 Å²	64	13%	0.131	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-27.5	175.3	-59.6	-178.6	0	0	0	113	Y436 T440 L479 H481 L505 R509	Y436-L507 HydrophobicContact CD1-CD1 4.29Å; Y436-L507 HydrophobicContact CE1-CD1 3.85Å; Y436-L507 HydrophobicContact CE1-CD2 4.39Å; T440-L507 HydrophobicContact CG2-CD1 3.9Å; L479-L507 HydrophobicContact CB-CB 4.47Å; L479-L507 HydrophobicContact CD2-CD1 4.38Å; L479-L507 HydrophobicContact CG-CD1 4.35Å; L479-L507 WeakPolarHBondContact O-CB 3.48Å; L479-L507 PolarHBondContact O-N 2.94Å; H481-L507 HydrophobicContact CB-CD2 4.16Å; H481-L507 HydrophobicContact CB-CG 4.34Å; L505-L507 PolarHBondContact O-N 2.88Å; L507-R509 VanDerWaalsContact C-N 3.26Å; L507-R509 PolarHBondContact O-N 2.68Å
508	F	92.8	Very high	88	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	17.7	178.5	-71.7	-14.3	0	0	0	114.1	L433 H437 L470 S473 L474 K477 L479 N506 S510 F511	L433-F508 HydrophobicContact CD2-CE1 3.86Å; L433-F508 HydrophobicContact CD2-CZ 3.63Å; H437-F508 HydrophobicContact CB-CE1 4.29Å; H437-F508 AromaticContact CD2-CD1 3.87Å; H437-F508 AromaticContact CD2-CE1 3.32Å; H437-F508 WeakPolarHBondContact CD2-CE1 3.44Å; H437-F508 AromaticContact CG-CE1 3.82Å; H437-F508 AromaticContact NE2-CD1 3.99Å; H437-F508 AromaticContact NE2-CE1 3.79Å; L470-F508 HydrophobicContact CD1-CE2 4.42Å; L470-F508 HydrophobicContact CD1-CZ 3.93Å; S473-F508 WeakPolarHBondContact O-CD2 3.49Å; L474-F508 HydrophobicContact CD2-CD2 4.49Å; L474-F508 HydrophobicContact CD2-CE2 3.9Å; L474-F508 HydrophobicContact CD2-CZ 4.02Å; L474-F508 HydrophobicContact CG-CE2 4.07Å; L474-F508 HydrophobicContact CG-CZ 4.41Å; K477-F508 WeakPolarHBondContact O-CB 3.36Å; L479-F508 HydrophobicContact CB-CD1 4.19Å; L479-F508 HydrophobicContact CB-CD2 3.54Å; L479-F508 HydrophobicContact CB-CE1 4.31Å; L479-F508 HydrophobicContact CB-CE2 3.66Å; L479-F508 HydrophobicContact CB-CG 3.82Å; L479-F508 HydrophobicContact CB-CZ 4.05Å; L479-F508 HydrophobicContact CD2-CE1 3.93Å; L479-F508 HydrophobicContact CD2-CE2 4.1Å; L479-F508 HydrophobicContact CD2-CZ 3.69Å; N506-F508 VanDerWaalsContact C-N 3.3Å; N506-F508 PolarHBondContact O-N 2.78Å; N506-F508 PolarHBondContact OD1-N 3.14Å; F508-S510 PolarHBondContact O-N 2.97Å; F508-F511 HydrophobicContact CB-CD2 3.68Å; F508-F511 HydrophobicContact CB-CE2 4.14Å; F508-F511 HydrophobicContact CB-CG 4.43Å; F508-F511 AromaticContact CD1-CD2 3.83Å; F508-F511 HydrophobicContact CD1-CD2 3.83Å; F508-F511 AromaticContact CD1-CE2 3.32Å; F508-F511 HydrophobicContact CD1-CE2 3.32Å; F508-F511 HydrophobicContact CD1-CZ 4.07Å; F508-F511 HydrophobicContact CD2-CD2 4.11Å; F508-F511 HydrophobicContact CD2-CE2 4.09Å; F508-F511 HydrophobicContact CE1-CD2 4.45Å; F508-F511 AromaticContact CE1-CE2 3.58Å; F508-F511 HydrophobicContact CE1-CE2 3.58Å; F508-F511 HydrophobicContact CE1-CZ 4.23Å; F508-F511 HydrophobicContact CE2-CE2 4.32Å; F508-F511 AromaticContact CG-CD2 3.62Å; F508-F511 HydrophobicContact CG-CD2 3.62Å; F508-F511 AromaticContact CG-CE2 3.6Å; F508-F511 HydrophobicContact CG-CE2 3.6Å; F508-F511 HydrophobicContact CZ-CE2 4.09Å; F508-F511 WeakPolarHBondContact O-CB 3.46Å; F508-F511 PolarHBondContact O-N 3.44Å
509	R	86.6	Confident	88.5	Confident	69 Å²	69	68 Å²	68	26%	0.26	31%	0.313	S	S	.	.	H	α-helix	trans	-54.6	-37.7	176.4	-172.4	-175.6	-171	89.5	22.2	112.8	L236 N506 L507 F511 V512 L513	L236-R509 VanDerWaalsContact CB-NH1 3.31Å; N506-R509 WeakPolarHBondContact O-CB 3.26Å; N506-R509 PolarHBondContact O-N 3.25Å; L507-R509 VanDerWaalsContact C-N 3.26Å; L507-R509 PolarHBondContact O-N 2.68Å; R509-F511 PolarHBondContact O-N 2.8Å; R509-V512 WeakPolarHBondContact O-CB 3.33Å; R509-V512 PolarHBondContact O-N 2.92Å; R509-L513 HydrophobicContact CG-CD1 4.37Å; R509-L513 PolarHBondContact O-N 3.4Å
510	S	85.3	Confident	88.9	Confident	12 Å²	12	71.6 Å²	71.6	8%	0.084	33%	0.33	C	S	.	.	H	α-helix	trans	-58	-30.7	176.9	58.3	0	0	0	0	112.5	F508 V512 L513 Q514	F508-S510 PolarHBondContact O-N 2.97Å; S510-V512 VanDerWaalsContact C-N 3.3Å; S510-V512 PolarHBondContact O-N 3.38Å; S510-L513 PolarHBondContact O-N 2.86Å; S510-Q514 WeakPolarHBondContact O-CB 3.47Å; S510-Q514 PolarHBondContact O-N 3.05Å
511	F	89.2	Confident	89.3	Confident	1 Å²	1	69.2 Å²	69.2	0%	0.004	32%	0.321	C	S	.	.	H	α-helix	trans	-74.4	-20.2	176.6	-59.4	-19	0	0	0	113.8	L474 K477 F508 R509 L517 Y518 T521	L474-F511 HydrophobicContact CD2-CD2 4.11Å; L474-F511 HydrophobicContact CD2-CE2 3.59Å; L474-F511 HydrophobicContact CD2-CZ 4.48Å; K477-F511 HydrophobicContact CB-CB 4.36Å; K477-F511 HydrophobicContact CG-CB 4.34Å; K477-F511 PolarHBondContact NZ-O 3.36Å; F508-F511 HydrophobicContact CB-CD2 3.68Å; F508-F511 HydrophobicContact CB-CE2 4.14Å; F508-F511 HydrophobicContact CB-CG 4.43Å; F508-F511 AromaticContact CD1-CD2 3.83Å; F508-F511 HydrophobicContact CD1-CD2 3.83Å; F508-F511 AromaticContact CD1-CE2 3.32Å; F508-F511 HydrophobicContact CD1-CE2 3.32Å; F508-F511 HydrophobicContact CD1-CZ 4.07Å; F508-F511 HydrophobicContact CD2-CD2 4.11Å; F508-F511 HydrophobicContact CD2-CE2 4.09Å; F508-F511 HydrophobicContact CE1-CD2 4.45Å; F508-F511 AromaticContact CE1-CE2 3.58Å; F508-F511 HydrophobicContact CE1-CE2 3.58Å; F508-F511 HydrophobicContact CE1-CZ 4.23Å; F508-F511 HydrophobicContact CE2-CE2 4.32Å; F508-F511 AromaticContact CG-CD2 3.62Å; F508-F511 HydrophobicContact CG-CD2 3.62Å; F508-F511 AromaticContact CG-CE2 3.6Å; F508-F511 HydrophobicContact CG-CE2 3.6Å; F508-F511 HydrophobicContact CZ-CE2 4.09Å; F508-F511 WeakPolarHBondContact O-CB 3.46Å; F508-F511 PolarHBondContact O-N 3.44Å; R509-F511 PolarHBondContact O-N 2.8Å; F511-L517 HydrophobicContact CD1-CD2 4.14Å; F511-L517 HydrophobicContact CD1-CG 4.1Å; F511-L517 HydrophobicContact CE1-CD2 4.06Å; F511-L517 HydrophobicContact CE1-CG 3.96Å; F511-Y518 HydrophobicContact CB-CD2 3.7Å; F511-Y518 HydrophobicContact CB-CG 4.14Å; F511-Y518 HydrophobicContact CD2-CD2 4.25Å; F511-Y518 AromaticContact CG-CD2 4Å; F511-Y518 HydrophobicContact CG-CD2 4Å; F511-T521 HydrophobicContact CE1-CG2 4.27Å; F511-T521 HydrophobicContact CE2-CG2 4.23Å; F511-T521 HydrophobicContact CZ-CG2 3.71Å
512	V	87.5	Confident	89.8	Confident	90 Å²	90	60.9 Å²	60.9	55%	0.545	29%	0.291	S	S	.	.	H	α-helix	trans	-75.7	-43.7	170.1	-176.4	0	0	0	0	109.7	K477 R509 S510	K477-V512 HydrophobicContact CB-CG2 3.97Å; K477-V512 HydrophobicContact CD-CG2 4.33Å; R509-V512 WeakPolarHBondContact O-CB 3.33Å; R509-V512 PolarHBondContact O-N 2.92Å; S510-V512 VanDerWaalsContact C-N 3.3Å; S510-V512 PolarHBondContact O-N 3.38Å
513	L	83.5	Confident	90.2	Very high	103 Å²	103	64.1 Å²	64.1	54%	0.539	31%	0.307	S	S	.	.	H	α-helix	trans	-78.9	-36.8	-175.8	-59.7	175.9	0	0	0	113.2	R509 S510	R509-L513 HydrophobicContact CG-CD1 4.37Å; R509-L513 PolarHBondContact O-N 3.4Å; S510-L513 PolarHBondContact O-N 2.86Å
514	Q	87.5	Confident	90.7	Very high	103 Å²	103	59.2 Å²	59.2	48%	0.481	28%	0.284	S	S	.	.			trans	-118	95.1	-171.6	-59.3	-177.8	14.7	0	0	111.2	S510 T516 L517 Y518	S510-Q514 WeakPolarHBondContact O-CB 3.47Å; S510-Q514 PolarHBondContact O-N 3.05Å; Q514-T516 VanDerWaalsContact C-N 3.32Å; Q514-T516 PolarHBondContact O-N 3.49Å; Q514-L517 HydrophobicContact CB-CB 3.84Å; Q514-L517 HydrophobicContact CB-CD2 4.43Å; Q514-L517 PolarHBondContact O-N 2.94Å; Q514-Y518 PolarHBondContact O-N 3.07Å
515	R	90.2	Very high	91.1	Very high	208 Å²	208	57.4 Å²	57.4	79%	0.785	27%	0.272	S	S	*	.	H	α-helix	trans	-62.9	-34.9	-176.9	-172.6	174.4	-178	157.7	0.9	113.7	R519	R515-R519 WeakPolarHBondContact O-CB 3.46Å; R515-R519 PolarHBondContact O-N 3.13Å
516	T	91.7	Very high	91.5	Very high	116 Å²	116	57.6 Å²	57.6	71%	0.712	27%	0.272	S	S	*	.	H	α-helix	trans	-68.3	-47.2	178.8	47	0	0	0	0	111.4	Q514 Y518 R519 H520	Q514-T516 VanDerWaalsContact C-N 3.32Å; Q514-T516 PolarHBondContact O-N 3.49Å; T516-Y518 VanDerWaalsContact C-N 3.34Å; T516-Y518 PolarHBondContact O-N 2.91Å; T516-R519 PolarHBondContact O-N 2.91Å; T516-H520 WeakPolarHBondContact O-CB 3.33Å; T516-H520 PolarHBondContact O-N 3.38Å
517	L	90.9	Very high	91.6	Very high	35 Å²	35	59.9 Å²	59.9	18%	0.183	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-46.8	174.8	177.4	64.8	0	0	0	111.2	F511 Q514 H520 T521	F511-L517 HydrophobicContact CD1-CD2 4.14Å; F511-L517 HydrophobicContact CD1-CG 4.1Å; F511-L517 HydrophobicContact CE1-CD2 4.06Å; F511-L517 HydrophobicContact CE1-CG 3.96Å; Q514-L517 HydrophobicContact CB-CB 3.84Å; Q514-L517 HydrophobicContact CB-CD2 4.43Å; Q514-L517 PolarHBondContact O-N 2.94Å; L517-H520 PolarHBondContact O-N 3.48Å; L517-T521 WeakPolarHBondContact O-CB 3.44Å; L517-T521 PolarHBondContact O-N 2.63Å; L517-T521 PolarHBondContact O-OG1 3.4Å
518	Y	94.2	Very high	91.8	Very high	43 Å²	43	58.9 Å²	58.9	17%	0.169	28%	0.276	C	S	.	.	H	α-helix	trans	-56.8	-52.3	176.3	171	-114.5	0	0	0	111.8	L474 K477 F511 Q514 T516 H520 T521 V522	L474-Y518 VanDerWaalsContact O-CE2 3.26Å; L474-Y518 WeakPolarHBondContact O-CE2 3.37Å; K477-Y518 HydrophobicContact CD-CD2 4.46Å; K477-Y518 HydrophobicContact CD-CE2 4.38Å; K477-Y518 VanDerWaalsContact CE-CE1 3.42Å; K477-Y518 HydrophobicContact CG-CD2 4.11Å; K477-Y518 HydrophobicContact CG-CE2 3.77Å; F511-Y518 HydrophobicContact CB-CD2 3.7Å; F511-Y518 HydrophobicContact CB-CG 4.14Å; F511-Y518 HydrophobicContact CD2-CD2 4.25Å; F511-Y518 AromaticContact CG-CD2 4Å; F511-Y518 HydrophobicContact CG-CD2 4Å; Q514-Y518 PolarHBondContact O-N 3.07Å; T516-Y518 VanDerWaalsContact C-N 3.34Å; T516-Y518 PolarHBondContact O-N 2.91Å; Y518-H520 PolarHBondContact O-N 2.63Å; Y518-T521 PolarHBondContact O-N 3.19Å; Y518-V522 HydrophobicContact CD2-CG2 3.87Å; Y518-V522 HydrophobicContact CE1-CG2 4.3Å; Y518-V522 HydrophobicContact CE2-CG2 3.35Å; Y518-V522 WeakPolarHBondContact O-CG2 3.36Å; Y518-V522 PolarHBondContact O-N 3.23Å
519	R	93.7	Very high	91.9	Very high	175 Å²	175	58.9 Å²	58.9	66%	0.66	28%	0.276	S	S	*	.	H	α-helix	trans	-59.5	-48.3	-178.9	-177.7	176	179.6	157.3	1.9	111.6	R515 T516 T521 V522 D523	R515-R519 WeakPolarHBondContact O-CB 3.46Å; R515-R519 PolarHBondContact O-N 3.13Å; T516-R519 PolarHBondContact O-N 2.91Å; R519-T521 VanDerWaalsContact C-N 3.27Å; R519-T521 PolarHBondContact O-N 2.8Å; R519-V522 PolarHBondContact O-N 3.34Å; R519-D523 IonicContact NE-OD2 2.74Å; R519-D523 WeakPolarHBondContact O-CB 3.48Å; R519-D523 VanDerWaalsContact O-CG 3.29Å; R519-D523 PolarHBondContact O-N 2.81Å
520	H	94.1	Very high	92.2	Very high	77 Å²	77	62.4 Å²	62.4	36%	0.356	29%	0.294	S	S	.	.	H	α-helix	trans	-58.3	-41.1	177.2	179.4	-103.2	0	0	0	112	P430 T516 L517 Y518 D523 S524	P430-H520 PolarHBondContact O-CE1 3.27Å; T516-H520 WeakPolarHBondContact O-CB 3.33Å; T516-H520 PolarHBondContact O-N 3.38Å; L517-H520 PolarHBondContact O-N 3.48Å; Y518-H520 PolarHBondContact O-N 2.63Å; H520-D523 PolarHBondContact O-N 2.66Å; H520-S524 WeakPolarHBondContact O-CB 3.38Å; H520-S524 PolarHBondContact O-N 3.26Å
521	T	95.5	Very high	92.5	Very high	0 Å²	0	64 Å²	64	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-67.3	-42.8	179.5	-56.1	0	0	0	0	112.1	G432 L433 L474 F511 L517 Y518 R519 S524 F525	G432-T521 WeakPolarHBondContact CA-OG1 3.45Å; G432-T521 PolarHBondContact N-OG1 2.9Å; L433-T521 HydrophobicContact CB-CG2 4.42Å; L433-T521 HydrophobicContact CD1-CG2 4.05Å; L433-T521 HydrophobicContact CG-CG2 3.61Å; L474-T521 HydrophobicContact CD2-CG2 4.12Å; F511-T521 HydrophobicContact CE1-CG2 4.27Å; F511-T521 HydrophobicContact CE2-CG2 4.23Å; F511-T521 HydrophobicContact CZ-CG2 3.71Å; L517-T521 WeakPolarHBondContact O-CB 3.44Å; L517-T521 PolarHBondContact O-N 2.63Å; L517-T521 PolarHBondContact O-OG1 3.4Å; Y518-T521 PolarHBondContact O-N 3.19Å; R519-T521 VanDerWaalsContact C-N 3.27Å; R519-T521 PolarHBondContact O-N 2.8Å; T521-S524 PolarHBondContact O-N 3.21Å; T521-F525 VanDerWaalsContact O-CB 3.31Å; T521-F525 WeakPolarHBondContact O-CB 3.27Å; T521-F525 PolarHBondContact O-N 2.94Å
522	V	95.4	Very high	92.7	Very high	13 Å²	13	63.9 Å²	63.9	8%	0.079	30%	0.301	C	S	.	.	H	α-helix	trans	-64.5	-45.5	176.1	172.2	0	0	0	0	111.1	Y518 R519 F525 Y526	Y518-V522 HydrophobicContact CD2-CG2 3.87Å; Y518-V522 HydrophobicContact CE1-CG2 4.3Å; Y518-V522 HydrophobicContact CE2-CG2 3.35Å; Y518-V522 WeakPolarHBondContact O-CG2 3.36Å; Y518-V522 PolarHBondContact O-N 3.23Å; R519-V522 PolarHBondContact O-N 3.34Å; V522-F525 PolarHBondContact O-N 2.81Å; V522-Y526 HydrophobicContact CG1-CD2 3.76Å; V522-Y526 HydrophobicContact CG1-CE2 3.62Å; V522-Y526 VanDerWaalsContact O-CD2 3.22Å; V522-Y526 WeakPolarHBondContact O-CD2 3.34Å; V522-Y526 PolarHBondContact O-N 3.43Å; V522-Y526 VanDerWaalsContact O-N 3.09Å
523	D	94.2	Very high	92.8	Very high	80 Å²	80	61.3 Å²	61.3	43%	0.428	29%	0.286	S	S	.	.	H	α-helix	trans	-61.6	-46	178.4	-69.1	-21.6	0	0	0	110.5	R519 H520 F525 Y526 E527	R519-D523 IonicContact NE-OD2 2.74Å; R519-D523 WeakPolarHBondContact O-CB 3.48Å; R519-D523 VanDerWaalsContact O-CG 3.29Å; R519-D523 PolarHBondContact O-N 2.81Å; H520-D523 PolarHBondContact O-N 2.66Å; D523-F525 PolarHBondContact O-N 3.2Å; D523-Y526 PolarHBondContact O-N 2.8Å; D523-E527 WeakPolarHBondContact O-CB 3.15Å; D523-E527 PolarHBondContact O-N 3.18Å
524	S	95.1	Very high	93.1	Very high	4 Å²	4	60.8 Å²	60.8	3%	0.028	29%	0.287	C	S	.	.	H	α-helix	trans	-62.3	-39.2	175.9	-179.8	0	0	0	0	112.9	Q424 T428 H520 T521 E527 M528	Q424-S524 WeakPolarHBondContact CG-OG 3.23Å; T428-S524 PolarHBondContact OG1-OG 3.45Å; H520-S524 WeakPolarHBondContact O-CB 3.38Å; H520-S524 PolarHBondContact O-N 3.26Å; T521-S524 PolarHBondContact O-N 3.21Å; S524-E527 PolarHBondContact O-N 3.26Å; S524-M528 WeakPolarHBondContact O-CB 3.46Å; S524-M528 PolarHBondContact O-N 3.07Å
525	F	96.1	Very high	93.2	Very high	3 Å²	3	57 Å²	57	1%	0.013	27%	0.27	C	S	.	.	H	α-helix	trans	-62.5	-48.4	176.6	172.8	-104.8	0	0	0	112	L132 L433 F467 L470 E471 L474 T521 V522 D523 E527 M528 L529	L132-F525 HydrophobicContact CD2-CZ 4.45Å; L433-F525 HydrophobicContact CD1-CB 4.21Å; L433-F525 HydrophobicContact CD1-CD2 4.06Å; F467-F525 HydrophobicContact CB-CZ 4.43Å; F467-F525 HydrophobicContact CD1-CE2 4.06Å; L470-F525 HydrophobicContact CB-CE2 4.36Å; L470-F525 HydrophobicContact CD2-CD2 4.1Å; L470-F525 HydrophobicContact CD2-CE2 3.75Å; L470-F525 HydrophobicContact CG-CE2 4.24Å; E471-F525 HydrophobicContact CB-CE1 3.79Å; E471-F525 HydrophobicContact CB-CZ 4.04Å; E471-F525 HydrophobicContact CG-CE1 4.17Å; L474-F525 HydrophobicContact CD1-CB 3.98Å; L474-F525 HydrophobicContact CD1-CD1 3.77Å; L474-F525 HydrophobicContact CD1-CD2 4Å; L474-F525 HydrophobicContact CD1-CE1 4.23Å; L474-F525 HydrophobicContact CD1-CE2 4.45Å; L474-F525 HydrophobicContact CD1-CG 3.63Å; T521-F525 VanDerWaalsContact O-CB 3.31Å; T521-F525 WeakPolarHBondContact O-CB 3.27Å; T521-F525 PolarHBondContact O-N 2.94Å; V522-F525 PolarHBondContact O-N 2.81Å; D523-F525 PolarHBondContact O-N 3.2Å; F525-E527 VanDerWaalsContact C-N 3.33Å; F525-E527 PolarHBondContact O-N 2.86Å; F525-M528 HydrophobicContact CD2-CE 3.83Å; F525-M528 HydrophobicContact CE2-CE 4.05Å; F525-M528 WeakPolarHBondContact O-CB 3.36Å; F525-M528 PolarHBondContact O-N 3.43Å; F525-L529 HydrophobicContact CD1-CD1 4.19Å; F525-L529 HydrophobicContact CE1-CD1 3.58Å; F525-L529 HydrophobicContact CE1-CG 4.48Å; F525-L529 HydrophobicContact CE2-CD1 4.22Å; F525-L529 HydrophobicContact CE2-CG 4.4Å; F525-L529 HydrophobicContact CZ-CD1 3.61Å; F525-L529 HydrophobicContact CZ-CG 4.26Å; F525-L529 WeakPolarHBondContact O-CG 3.37Å; F525-L529 PolarHBondContact O-N 2.86Å; F525-L529 VanDerWaalsContact O-N 3.11Å
526	Y	95.6	Very high	93.1	Very high	18 Å²	18	47.1 Å²	47.1	7%	0.071	23%	0.232	C	C	.	.	H	α-helix	trans	-68.9	-33	177.9	-75.9	-65.1	0	0	0	112.9	R133 L135 E471 V522 D523 L529 K530	R133-Y526 HydrophobicContact CB-CE1 4.36Å; R133-Y526 HydrophobicContact CG-CD1 4.11Å; R133-Y526 HydrophobicContact CG-CE1 3.57Å; R133-Y526 VanDerWaalsContact NE-CZ 3.27Å; L135-Y526 HydrophobicContact CD1-CD1 4.27Å; E471-Y526 WeakPolarHBondContact OE1-CE1 3.43Å; E471-Y526 PolarHBondContact OE1-OH 2.95Å; V522-Y526 HydrophobicContact CG1-CD2 3.76Å; V522-Y526 HydrophobicContact CG1-CE2 3.62Å; V522-Y526 VanDerWaalsContact O-CD2 3.22Å; V522-Y526 WeakPolarHBondContact O-CD2 3.34Å; V522-Y526 PolarHBondContact O-N 3.43Å; V522-Y526 VanDerWaalsContact O-N 3.09Å; D523-Y526 PolarHBondContact O-N 2.8Å; Y526-L529 HydrophobicContact CD1-CD1 4.34Å; Y526-L529 PolarHBondContact O-N 3.29Å; Y526-K530 WeakPolarHBondContact O-CB 3.26Å; Y526-K530 PolarHBondContact O-N 3.44Å
527	E	93.8	Very high	92.8	Very high	82 Å²	82	43.9 Å²	43.9	38%	0.383	22%	0.215	S	C	.	.	H	α-helix	trans	-65.4	-42.1	173.5	-168.4	178.9	160.3	0	0	111.6	T428 D523 S524 F525 L529 K530 N531	T428-E527 WeakPolarHBondContact CG2-OE2 3.39Å; D523-E527 WeakPolarHBondContact O-CB 3.15Å; D523-E527 PolarHBondContact O-N 3.18Å; S524-E527 PolarHBondContact O-N 3.26Å; F525-E527 VanDerWaalsContact C-N 3.33Å; F525-E527 PolarHBondContact O-N 2.86Å; E527-L529 VanDerWaalsContact C-N 3.34Å; E527-L529 PolarHBondContact O-N 2.95Å; E527-K530 PolarHBondContact O-N 3Å; E527-N531 WeakPolarHBondContact O-CB 3.44Å; E527-N531 VanDerWaalsContact O-CG 3.23Å; E527-N531 PolarHBondContact O-N 2.93Å; E527-N531 PolarHBondContact O-ND2 2.77Å
528	M	95.2	Very high	92.6	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.02	23%	0.228	C	C	.	.	H	α-helix	trans	-55.9	-48.5	173	-177.6	-173.8	68.4	0	0	111.3	L420 L421 Q424 F467 S524 F525 K530 N531 A532	L420-M528 HydrophobicContact CB-CG 3.9Å; L420-M528 HydrophobicContact CB-SD 3.87Å; L421-M528 HydrophobicContact CB-SD 4.15Å; Q424-M528 HydrophobicContact CB-CB 3.95Å; Q424-M528 HydrophobicContact CB-CG 4.03Å; Q424-M528 HydrophobicContact CG-CB 3.85Å; Q424-M528 HydrophobicContact CG-CG 4.48Å; F467-M528 HydrophobicContact CD1-CE 4.2Å; F467-M528 HydrophobicContact CE1-CE 3.62Å; F467-M528 HydrophobicContact CZ-CE 4.3Å; S524-M528 WeakPolarHBondContact O-CB 3.46Å; S524-M528 PolarHBondContact O-N 3.07Å; F525-M528 HydrophobicContact CD2-CE 3.83Å; F525-M528 HydrophobicContact CE2-CE 4.05Å; F525-M528 WeakPolarHBondContact O-CB 3.36Å; F525-M528 PolarHBondContact O-N 3.43Å; M528-K530 PolarHBondContact O-N 3.05Å; M528-N531 PolarHBondContact O-N 2.84Å; M528-A532 WeakPolarHBondContact O-CB 3.48Å; M528-A532 PolarHBondContact O-N 2.82Å
529	L	94.9	Very high	92	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-63	-41.6	178.9	-66.6	178.1	0	0	0	112.1	L132 L135 L137 F467 F525 Y526 E527 N531 A532	L132-L529 HydrophobicContact CB-CD1 4.22Å; L132-L529 HydrophobicContact CD2-CD1 3.85Å; L132-L529 HydrophobicContact CG-CD1 4.49Å; L135-L529 HydrophobicContact CD1-CB 3.76Å; L137-L529 HydrophobicContact CD2-CD2 4.17Å; F467-L529 HydrophobicContact CB-CD2 4.06Å; F467-L529 HydrophobicContact CD1-CD2 3.9Å; F467-L529 HydrophobicContact CD2-CD2 3.76Å; F467-L529 HydrophobicContact CE1-CD2 4.26Å; F467-L529 HydrophobicContact CE2-CD2 4.11Å; F467-L529 HydrophobicContact CG-CD2 3.64Å; F467-L529 HydrophobicContact CZ-CD2 4.36Å; F525-L529 HydrophobicContact CD1-CD1 4.19Å; F525-L529 HydrophobicContact CE1-CD1 3.58Å; F525-L529 HydrophobicContact CE1-CG 4.48Å; F525-L529 HydrophobicContact CE2-CD1 4.22Å; F525-L529 HydrophobicContact CE2-CG 4.4Å; F525-L529 HydrophobicContact CZ-CD1 3.61Å; F525-L529 HydrophobicContact CZ-CG 4.26Å; F525-L529 WeakPolarHBondContact O-CG 3.37Å; F525-L529 PolarHBondContact O-N 2.86Å; F525-L529 VanDerWaalsContact O-N 3.11Å; Y526-L529 HydrophobicContact CD1-CD1 4.34Å; Y526-L529 PolarHBondContact O-N 3.29Å; E527-L529 VanDerWaalsContact C-N 3.34Å; E527-L529 PolarHBondContact O-N 2.95Å; L529-N531 VanDerWaalsContact C-N 3.29Å; L529-N531 PolarHBondContact O-N 2.82Å; L529-A532 PolarHBondContact O-N 3.44Å
530	K	92.9	Very high	91.1	Very high	143 Å²	143	40.8 Å²	40.8	62%	0.622	21%	0.207	S	C	*	.	H	α-helix	trans	-62.5	-37.9	176.6	-176.6	-176.3	176.5	-173.4	0	111.9	L135 Y526 E527 M528	L135-K530 HydrophobicContact CD1-CB 4.3Å; L135-K530 HydrophobicContact CD2-CB 4.19Å; L135-K530 HydrophobicContact CD2-CG 4.39Å; Y526-K530 WeakPolarHBondContact O-CB 3.26Å; Y526-K530 PolarHBondContact O-N 3.44Å; E527-K530 PolarHBondContact O-N 3Å; M528-K530 PolarHBondContact O-N 3.05Å
531	N	92	Very high	90	Very high	44 Å²	44	43.8 Å²	43.8	24%	0.235	23%	0.225	C	C	.	.	H	α-helix	trans	-83.3	-19.7	-178.4	-66.9	-24.6	0	0	0	113.2	E527 M528 L529 T534 L535	E527-N531 WeakPolarHBondContact O-CB 3.44Å; E527-N531 VanDerWaalsContact O-CG 3.23Å; E527-N531 PolarHBondContact O-N 2.93Å; E527-N531 PolarHBondContact O-ND2 2.77Å; M528-N531 PolarHBondContact O-N 2.84Å; L529-N531 VanDerWaalsContact C-N 3.29Å; L529-N531 PolarHBondContact O-N 2.82Å; N531-T534 PolarHBondContact O-N 3.46Å; N531-L535 HydrophobicContact CB-CD1 3.94Å; N531-L535 HydrophobicContact CB-CG 4.37Å; N531-L535 WeakPolarHBondContact O-CG 3.47Å; N531-L535 PolarHBondContact O-N 2.86Å
532	A	92.6	Very high	88.1	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-54.9	-46.7	-171.5	0	0	0	0	0	114.7	L420 M528 L529 T534 L535 I536	L420-A532 HydrophobicContact CD1-CB 3.79Å; L420-A532 HydrophobicContact CD2-CB 3.81Å; L420-A532 HydrophobicContact CG-CB 4.46Å; M528-A532 WeakPolarHBondContact O-CB 3.48Å; M528-A532 PolarHBondContact O-N 2.82Å; L529-A532 PolarHBondContact O-N 3.44Å; A532-T534 VanDerWaalsContact C-N 3.34Å; A532-T534 PolarHBondContact O-N 3.26Å; A532-L535 PolarHBondContact O-N 3.36Å; A532-I536 WeakPolarHBondContact O-CB 3.32Å; A532-I536 VanDerWaalsContact O-CG1 3.29Å; A532-I536 WeakPolarHBondContact O-CG1 3.39Å; A532-I536 PolarHBondContact O-N 2.76Å
533	P	90.7	Very high	86	Confident	36 Å²	36	55.1 Å²	55.1	23%	0.234	29%	0.285	C	S	.	.	H	α-helix	trans	-60.7	-41.3	178.4	-24.5	35.2	0	0	0	113.5	P136 S537	P136-P533 WeakPolarHBondContact O-CG 3.46Å; P533-S537 WeakPolarHBondContact O-CB 3.42Å; P533-S537 PolarHBondContact O-N 2.68Å; P533-S537 PolarHBondContact O-OG 2.64Å
534	T	89.1	Confident	83.6	Confident	92 Å²	92	56 Å²	56	56%	0.564	30%	0.295	S	S	*	.	H	α-helix	trans	-69.1	-46.3	179.6	-49.3	0	0	0	0	110.5	N531 A532 I536 S537 E538	N531-T534 PolarHBondContact O-N 3.46Å; A532-T534 VanDerWaalsContact C-N 3.34Å; A532-T534 PolarHBondContact O-N 3.26Å; T534-I536 PolarHBondContact O-N 2.73Å; T534-S537 PolarHBondContact O-N 2.91Å; T534-S537 PolarHBondContact O-OG 2.73Å; T534-E538 WeakPolarHBondContact O-CB 3.14Å; T534-E538 PolarHBondContact O-N 3.48Å
535	L	88.4	Confident	80.9	Confident	23 Å²	23	60.8 Å²	60.8	12%	0.12	33%	0.328	C	S	.	.	H	α-helix	trans	-63.3	-44.9	179.2	-73.6	172	0	0	0	111.6	L420 K423 N531 A532 E538 Y539	L420-L535 HydrophobicContact CD2-CB 4.48Å; L420-L535 HydrophobicContact CD2-CD1 4.4Å; K423-L535 HydrophobicContact CB-CD1 4.43Å; N531-L535 HydrophobicContact CB-CD1 3.94Å; N531-L535 HydrophobicContact CB-CG 4.37Å; N531-L535 WeakPolarHBondContact O-CG 3.47Å; N531-L535 PolarHBondContact O-N 2.86Å; A532-L535 PolarHBondContact O-N 3.36Å; L535-E538 PolarHBondContact O-N 3.35Å; L535-Y539 VanDerWaalsContact O-CD2 3.22Å; L535-Y539 WeakPolarHBondContact O-CD2 3.2Å; L535-Y539 PolarHBondContact O-N 3.01Å; L535-Y539 VanDerWaalsContact O-N 3.14Å
536	I	88.8	Confident	78.2	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-68.1	-39.2	-178.2	-70.3	172	0	0	0	110.8	P138 T142 L143 F146 I416 L420 A532 T534 S540	P138-I536 HydrophobicContact CB-CD1 4.47Å; P138-I536 HydrophobicContact CB-CG2 4.32Å; P138-I536 HydrophobicContact CG-CB 4.17Å; P138-I536 HydrophobicContact CG-CD1 3.43Å; P138-I536 VanDerWaalsContact CG-CD1 3.43Å; P138-I536 HydrophobicContact CG-CG1 4.33Å; P138-I536 HydrophobicContact CG-CG2 4.29Å; T142-I536 HydrophobicContact CG2-CG2 3.9Å; L143-I536 HydrophobicContact CD2-CD1 3.92Å; L143-I536 HydrophobicContact CD2-CG2 4.32Å; F146-I536 HydrophobicContact CB-CG2 3.64Å; F146-I536 HydrophobicContact CD1-CG2 4.31Å; F146-I536 HydrophobicContact CD2-CG2 4.13Å; F146-I536 HydrophobicContact CG-CG2 3.77Å; I416-I536 HydrophobicContact CG2-CD1 4.01Å; L420-I536 HydrophobicContact CD1-CD1 4.08Å; L420-I536 HydrophobicContact CD2-CD1 4.1Å; L420-I536 HydrophobicContact CD2-CG1 4.14Å; L420-I536 HydrophobicContact CG-CD1 4.39Å; A532-I536 WeakPolarHBondContact O-CB 3.32Å; A532-I536 VanDerWaalsContact O-CG1 3.29Å; A532-I536 WeakPolarHBondContact O-CG1 3.39Å; A532-I536 PolarHBondContact O-N 2.76Å; T534-I536 PolarHBondContact O-N 2.73Å; I536-S540 VanDerWaalsContact O-CB 3.24Å; I536-S540 WeakPolarHBondContact O-CB 3.28Å; I536-S540 PolarHBondContact O-N 3.46Å; I536-S540 PolarHBondContact O-OG 3.48Å
537	S	86.6	Confident	75.3	Confident	48 Å²	48	76.6 Å²	76.6	34%	0.336	40%	0.4	S	S	.	.	H	α-helix	trans	-68.5	-40.5	176.5	56.7	0	0	0	0	112.9	P533 T534 S540 L541	P533-S537 WeakPolarHBondContact O-CB 3.42Å; P533-S537 PolarHBondContact O-N 2.68Å; P533-S537 PolarHBondContact O-OG 2.64Å; T534-S537 PolarHBondContact O-N 2.91Å; T534-S537 PolarHBondContact O-OG 2.73Å; S537-S540 WeakPolarHBondContact O-CB 3.23Å; S537-S540 PolarHBondContact O-N 3.28Å; S537-L541 WeakPolarHBondContact O-CG 3.29Å; S537-L541 PolarHBondContact O-N 2.9Å; S537-L541 VanDerWaalsContact O-N 3.08Å
538	E	86.1	Confident	72.4	Confident	98 Å²	98	76.9 Å²	76.9	46%	0.458	42%	0.417	S	S	.	.	H	α-helix	trans	-62.2	-47.6	178.2	-173.2	-175.2	173.8	0	0	111.9	T534 L535 S540 L541 H542	T534-E538 WeakPolarHBondContact O-CB 3.14Å; T534-E538 PolarHBondContact O-N 3.48Å; L535-E538 PolarHBondContact O-N 3.35Å; E538-S540 VanDerWaalsContact C-N 3.27Å; E538-S540 PolarHBondContact O-N 3.16Å; E538-L541 PolarHBondContact O-N 3.09Å; E538-H542 PolarHBondContact O-N 2.97Å
539	Y	81.6	Confident	69.3	Low	78 Å²	78	81.8 Å²	81.8	31%	0.306	45%	0.451	S	S	.	.	H	α-helix	trans	-70.7	-24.9	177.7	-82.1	-101.8	0	0	0	112.6	F146 C150 F419 K423 L535	F146-Y539 HydrophobicContact CE2-CG 4.45Å; C150-Y539 PolarHBondContact SG-O 3.07Å; F419-Y539 HydrophobicContact CE2-CD1 4.28Å; F419-Y539 HydrophobicContact CE2-CE1 4.27Å; F419-Y539 AromaticContact CZ-CD1 3.83Å; F419-Y539 HydrophobicContact CZ-CD1 3.83Å; F419-Y539 HydrophobicContact CZ-CD2 4.12Å; F419-Y539 AromaticContact CZ-CE1 3.96Å; F419-Y539 HydrophobicContact CZ-CE1 3.96Å; F419-Y539 HydrophobicContact CZ-CE2 4.25Å; F419-Y539 AromaticContact CZ-CG 3.9Å; F419-Y539 HydrophobicContact CZ-CG 3.9Å; K423-Y539 WeakPolarHBondContact CE-OH 3.39Å; K423-Y539 PolarHBondContact NZ-OH 3.14Å; L535-Y539 VanDerWaalsContact O-CD2 3.22Å; L535-Y539 WeakPolarHBondContact O-CD2 3.2Å; L535-Y539 PolarHBondContact O-N 3.01Å; L535-Y539 VanDerWaalsContact O-N 3.14Å
540	S	75.2	Confident	66.5	Low	13 Å²	13	87.2 Å²	87.2	9%	0.091	49%	0.487	C	S	.	.	H	α-helix	trans	-67.8	-36	170.9	-68.9	0	0	0	0	112.3	H145 F146 I536 S537 E538	H145-S540 PolarHBondContact CE1-O 3.42Å; H145-S540 WeakPolarHBondContact ND1-CB 3.36Å; F146-S540 WeakPolarHBondContact CA-OG 3.44Å; F146-S540 WeakPolarHBondContact CB-OG 2.96Å; I536-S540 VanDerWaalsContact O-CB 3.24Å; I536-S540 WeakPolarHBondContact O-CB 3.28Å; I536-S540 PolarHBondContact O-N 3.46Å; I536-S540 PolarHBondContact O-OG 3.48Å; S537-S540 WeakPolarHBondContact O-CB 3.23Å; S537-S540 PolarHBondContact O-N 3.28Å; E538-S540 VanDerWaalsContact C-N 3.27Å; E538-S540 PolarHBondContact O-N 3.16Å
541	L	70.7	Confident	63.8	Low	139 Å²	139	85.8 Å²	85.8	73%	0.728	49%	0.492	S	S	*	.	H	α-helix	trans	-84.3	-35.7	-177.5	-68	168.9	0	0	0	112.9	S537 E538 V543	S537-L541 WeakPolarHBondContact O-CG 3.29Å; S537-L541 PolarHBondContact O-N 2.9Å; S537-L541 VanDerWaalsContact O-N 3.08Å; E538-L541 PolarHBondContact O-N 3.09Å; L541-V543 PolarHBondContact O-N 2.06Å
542	H	56.2	Low	61.4	Low	130 Å²	130	89.8 Å²	89.8	60%	0.602	52%	0.52	S	S	*	.			trans	-88.5	103.6	-177.2	-80.6	-68.7	0	0	0	112.1	E538 P544	E538-H542 PolarHBondContact O-N 2.97Å; H542-P544 WeakPolarHBondContact O-CD 3.48Å
543	V	49.4	Very low	58.9	Low	122 Å²	122	99.3 Å²	99.3	74%	0.739	56%	0.561	S	S	*	*			trans	-62	119.7	163.6	-178.6	0	0	0	0	108.4	L541 S545	L541-V543 PolarHBondContact O-N 2.06Å; V543-S545 PolarHBondContact O-N 2.99Å
544	P	44.9	Very low	56.6	Low	97 Å²	97	102.3 Å²	102.3	63%	0.63	59%	0.59	S	S	*	*			trans	-62.5	113.4	174.6	-17.2	29.7	0	0	0	109.1	H542 D546	H542-P544 WeakPolarHBondContact O-CD 3.48Å; P544-D546 PolarHBondContact O-N 3.08Å
545	S	37.9	Very low	54.6	Low	105 Å²	105	104.3 Å²	104.3	73%	0.734	60%	0.601	S	S	*	*			trans	-70.6	10.1	178.7	-75.7	0	0	0	0	114.4	V543 R547 A548	V543-S545 PolarHBondContact O-N 2.99Å; S545-R547 PolarHBondContact O-N 3.18Å; S545-A548 PolarHBondContact O-N 3.35Å
546	D	39.5	Very low	52.8	Low	166 Å²	166	107.7 Å²	107.7	89%	0.888	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	12.5	-179.1	-108.7	1.3	0	0	0	114.5	P544	P544-D546 PolarHBondContact O-N 3.08Å
547	R	34.7	Very low	51	Low	188 Å²	188	119.2 Å²	119.2	71%	0.709	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.1	21.5	172.5	-67.1	-166.1	176.5	-171.6	0	113.9	D157 S545 S549	D157-R547 IonicContact OD2-NH2 3.57Å; D157-R547 PolarHBondContact OD2-NH2 3Å; S545-R547 PolarHBondContact O-N 3.18Å; R547-S549 VanDerWaalsContact C-N 3.27Å; R547-S549 PolarHBondContact O-N 2.81Å
548	A	32.3	Very low	49.2	Very low	88 Å²	88	122.8 Å²	122.8	73%	0.727	71%	0.711	S	S	*	*			trans	-70.5	88.1	165.1	0	0	0	0	0	109.4	S545	S545-A548 PolarHBondContact O-N 3.35Å
549	S	31.1	Very low	47.3	Very low	106 Å²	106	124.1 Å²	124.1	74%	0.741	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-49.4	133.7	164.1	1.4	0	0	0	0	108.8	R547	R547-S549 VanDerWaalsContact C-N 3.27Å; R547-S549 PolarHBondContact O-N 2.81Å
550	P	35.9	Very low	45.3	Very low	116 Å²	116	126.6 Å²	126.6	75%	0.753	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-62.7	144.3	-176.7	25.6	-32.2	0	0	0	110.1
551	P	37.5	Very low	43.6	Very low	113 Å²	113	133.3 Å²	133.3	73%	0.734	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-61.9	148.1	-173.6	25.5	-33	0	0	0	110.9	K553	P551-K553 PolarHBondContact O-N 3.12Å
552	P	41	Very low	41.9	Very low	128 Å²	128	132.9 Å²	132.9	83%	0.831	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-60.4	128.3	-175.6	24.8	-32.2	0	0	0	109.7	A554	P552-A554 PolarHBondContact O-N 2.84Å; P552-A554 VanDerWaalsContact O-N 3.12Å
553	K	39.1	Very low	40.9	Very low	199 Å²	199	133.1 Å²	133.1	87%	0.865	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-54.8	118.5	175.4	-73.9	179.6	176.2	178.5	0	108.7	P551 V555	P551-K553 PolarHBondContact O-N 3.12Å; K553-V555 PolarHBondContact O-N 3.01Å; K553-V555 VanDerWaalsContact O-N 3.09Å
554	A	42.9	Very low	40.3	Very low	100 Å²	100	133.9 Å²	133.9	83%	0.826	81%	0.807	S	S	*	*			trans	-59.6	113.1	169.7	0	0	0	0	0	108.3	P552 A556	P552-A554 PolarHBondContact O-N 2.84Å; P552-A554 VanDerWaalsContact O-N 3.12Å; A554-A556 PolarHBondContact O-N 3.15Å; A554-A556 VanDerWaalsContact O-N 3.14Å
555	V	47.6	Very low	40	Very low	133 Å²	133	136.8 Å²	136.8	81%	0.806	82%	0.82	S	S	*	*			trans	-70.9	103.3	167.6	176.9	0	0	0	0	105.8	K553 L557	K553-V555 PolarHBondContact O-N 3.01Å; K553-V555 VanDerWaalsContact O-N 3.09Å; V555-L557 PolarHBondContact O-N 2.8Å
556	A	49.1	Very low	40.2	Very low	95 Å²	95	139.4 Å²	139.4	79%	0.785	83%	0.827	S	S	*	*			trans	-68.4	118.9	163.8	0	0	0	0	0	107.2	A554	A554-A556 PolarHBondContact O-N 3.15Å; A554-A556 VanDerWaalsContact O-N 3.14Å
557	L	51.5	Low	40.2	Very low	241 Å²	241	137 Å²	137	100%	1.262	82%	0.822	S	S	*	*			trans	-62.1	0	169.4	-83.6	160.3	0	0	0	111.4	V555	V555-L557 PolarHBondContact O-N 2.8Å

Retrieved 557 of 557 residues in 441.8 ms (Link to these results)

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