A0A087YHG7_POEFO Loading...

LON peptidase N-terminal domain and ring finger 2

AlphaFold DB , UniProt , Accession A0A087YHG7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 773 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31	Very low	27	Very low	238 Å²	238	149.5 Å²	149.5	100%	1.172	85%	0.849	S	S	*	*				0	147.1	0	-72.8	164.5	172.4	0	0	107.4
2	E	33	Very low	27.7	Very low	194 Å²	194	150.6 Å²	150.6	91%	0.907	85%	0.849	S	S	*	*			trans	44.2	94.1	160.3	-62.4	178.7	170.7	0	0	118.5
3	T	24.9	Very low	29.4	Very low	135 Å²	135	146 Å²	146	83%	0.828	82%	0.821	S	S	*	*			trans	-114.4	92	145.1	51	0	0	0	0	107.5	V5	T3-V5 PolarHBondContact O-N 3.19Å
4	G	25.6	Very low	31.4	Very low	79 Å²	79	144.2 Å²	144.2	81%	0.814	81%	0.807	S	S	*	*			trans	-69.3	110.1	-177.6	0	0	0	0	0	111.7
5	V	26.5	Very low	34.4	Very low	137 Å²	137	135.3 Å²	135.3	83%	0.83	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-80.5	116.4	168.5	177.7	0	0	0	0	107.9	T3	T3-V5 PolarHBondContact O-N 3.19Å
6	L	25.2	Very low	36.9	Very low	153 Å²	153	132.3 Å²	132.3	80%	0.801	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-62.1	133.7	168	-81.8	152.3	0	0	0	109	Q8	L6-Q8 PolarHBondContact O-N 3.19Å
7	P	23.8	Very low	39.1	Very low	117 Å²	117	126.6 Å²	126.6	76%	0.76	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-63.5	133.9	175.7	27.4	-33.6	0	0	0	109.7
8	Q	25.8	Very low	40.7	Very low	187 Å²	187	124.3 Å²	124.3	87%	0.874	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-62.9	151.1	166.9	-71.4	176.3	-49.5	0	0	109.3	L6 G10	L6-Q8 PolarHBondContact O-N 3.19Å; Q8-G10 PolarHBondContact O-N 3.28Å
9	Q	25.8	Very low	42.1	Very low	194 Å²	194	122.4 Å²	122.4	91%	0.907	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-60.7	121.1	178.5	-66.7	171.9	-78.6	0	0	109
10	G	25.7	Very low	43.2	Very low	65 Å²	65	121.2 Å²	121.2	67%	0.67	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-64.8	140.8	-176	0	0	0	0	0	112.3	Q8 L12	Q8-G10 PolarHBondContact O-N 3.28Å; G10-L12 PolarHBondContact O-N 3.01Å; G10-L12 VanDerWaalsContact O-N 3.11Å
11	D	29.2	Very low	44	Very low	146 Å²	146	118.5 Å²	118.5	78%	0.781	69%	0.689	S	S	*	*			trans	-59.6	111	179.2	-70.7	-68.4	0	0	0	111.5	L13	D11-L13 PolarHBondContact O-N 3.05Å
12	L	36.3	Very low	45.7	Very low	162 Å²	162	108.2 Å²	108.2	85%	0.848	64%	0.642	S	S	*	*			trans	-72	107.5	159	-99	84	0	0	0	108	G10 L14	G10-L12 PolarHBondContact O-N 3.01Å; G10-L12 VanDerWaalsContact O-N 3.11Å; L12-L14 PolarHBondContact O-N 3.35Å
13	L	48.8	Very low	47.2	Very low	91 Å²	91	103.6 Å²	103.6	48%	0.476	64%	0.637	S	S	.	*			trans	-53.5	106	171.1	-67.5	169	0	0	0	109.9	D11 H15 E34	D11-L13 PolarHBondContact O-N 3.05Å; L13-H15 PolarHBondContact O-N 3.45Å; L13-E34 WeakPolarHBondContact CD2-OE1 3.32Å; L13-E34 VanDerWaalsContact CD2-OE2 3.25Å; L13-E34 WeakPolarHBondContact CD2-OE2 3.44Å
14	L	57.7	Low	49.1	Very low	121 Å²	121	98.7 Å²	98.7	63%	0.634	61%	0.614	S	S	*	*	S	Bend	trans	-51.2	-34.2	-173.9	-78	163.1	0	0	0	113.4	L12	L12-L14 PolarHBondContact O-N 3.35Å
15	H	77.3	Confident	51.5	Low	11 Å²	11	96.1 Å²	96.1	5%	0.051	58%	0.581	C	S	.	*	S	Bend	trans	-124.2	99.3	177.2	-53.2	-64.7	0	0	0	109.1	L13 L65 R66 D69 E97	L13-H15 PolarHBondContact O-N 3.45Å; H15-L65 HydrophobicContact CB-CB 3.99Å; H15-R66 HydrophobicContact CB-CG 4.18Å; H15-R66 PolarHBondContact O-NE 3.42Å; H15-R66 PolarHBondContact O-NH2 3.38Å; H15-D69 IonicContact CD2-OD1 2.79Å; H15-D69 IonicContact NE2-OD1 3.53Å; H15-D69 PolarHBondContact NE2-OD1 3.09Å; H15-D69 IonicContact NE2-OD2 3.75Å; H15-D69 PolarHBondContact NE2-OD2 3.26Å; H15-E97 WeakPolarHBondContact CE1-CA 3.45Å; H15-E97 WeakPolarHBondContact CE1-CB 3.48Å; H15-E97 PolarHBondContact CE1-O 3.25Å
16	P	73.9	Confident	54.1	Low	86 Å²	86	92.3 Å²	92.3	56%	0.558	56%	0.56	S	S	*	*			trans	-69.5	148	174.3	28.9	-34.3	0	0	0	110.9	G62	P16-G62 WeakPolarHBondContact O-CA 3.47Å
17	L	74.6	Confident	56.7	Low	37 Å²	37	88.7 Å²	88.7	19%	0.194	55%	0.546	C	S	.	.			trans	-68.5	145.8	172.9	-60.3	175	0	0	0	110.2	P20 L25 L30 L63	L17-P20 HydrophobicContact CB-CB 4.43Å; L17-P20 HydrophobicContact CD1-CB 4.29Å; L17-L25 HydrophobicContact CD1-CD1 4.32Å; L17-L30 HydrophobicContact CD1-CD1 3.87Å; L17-L63 HydrophobicContact CD2-CB 4.09Å; L17-L63 HydrophobicContact CD2-CD1 4.3Å
18	S	68	Low	59.5	Low	85 Å²	85	89.3 Å²	89.3	59%	0.594	54%	0.538	S	S	*	.	S	Bend	trans	-76.3	-33.3	177.1	-48.6	0	0	0	0	111.4	D60	S18-D60 WeakPolarHBondContact CA-OD2 3.35Å; S18-D60 VanDerWaalsContact CB-OD2 3.25Å; S18-D60 WeakPolarHBondContact CB-OD2 3.33Å; S18-D60 PolarHBondContact N-OD1 3.2Å; S18-D60 PolarHBondContact N-OD2 3Å
19	N	67.6	Low	62.3	Low	87 Å²	87	84.3 Å²	84.3	47%	0.465	52%	0.516	S	S	.	.			trans	-140.4	94.6	168.4	-177	5.2	0	0	0	111.8	G21 A22 D60	N19-G21 PolarHBondContact O-N 3.46Å; N19-G21 VanDerWaalsContact O-N 3.11Å; N19-G21 PolarHBondContact OD1-N 3.11Å; N19-A22 HydrophobicContact CB-CB 4.26Å; N19-A22 PolarHBondContact O-N 3.02Å; N19-A22 PolarHBondContact OD1-N 3.04Å; N19-D60 PolarHBondContact N-OD2 3.28Å; N19-D60 VanDerWaalsContact N-OD2 3.07Å
20	P	63.8	Low	65.1	Low	98 Å²	98	75.7 Å²	75.7	64%	0.636	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-3.8	178.3	29.9	-36	0	0	0	114.4	L17	L17-P20 HydrophobicContact CB-CB 4.43Å; L17-P20 HydrophobicContact CD1-CB 4.29Å
21	G	60.4	Low	67.8	Low	65 Å²	65	79.1 Å²	79.1	67%	0.67	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	16.9	175.6	0	0	0	0	0	114.2	N19	N19-G21 PolarHBondContact O-N 3.46Å; N19-G21 VanDerWaalsContact O-N 3.11Å; N19-G21 PolarHBondContact OD1-N 3.11Å
22	A	66.8	Low	70.5	Confident	22 Å²	22	75.3 Å²	75.3	18%	0.182	46%	0.457	C	S	.	.			trans	-69.2	130	179	0	0	0	0	0	111.9	N19 G24 L25 L56	N19-A22 HydrophobicContact CB-CB 4.26Å; N19-A22 PolarHBondContact O-N 3.02Å; N19-A22 PolarHBondContact OD1-N 3.04Å; A22-G24 PolarHBondContact O-N 3.35Å; A22-L25 HydrophobicContact CB-CD1 4.03Å; A22-L25 HydrophobicContact CB-CG 4.41Å; A22-L25 PolarHBondContact O-N 3.05Å; A22-L56 HydrophobicContact CB-CD2 3.66Å
23	A	62.5	Low	72.9	Confident	97 Å²	97	67.6 Å²	67.6	80%	0.802	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	123.9	175.4	0	0	0	0	0	110.4
24	G	66.5	Low	74.5	Confident	33 Å²	33	65.6 Å²	65.6	34%	0.34	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	118.8	-24.6	-172.2	0	0	0	0	0	113.4	A22 Q52	A22-G24 PolarHBondContact O-N 3.35Å; G24-Q52 PolarHBondContact O-NE2 2.81Å
25	L	75.8	Confident	75.9	Confident	25 Å²	25	65.7 Å²	65.7	13%	0.131	40%	0.401	C	S	.	.			trans	-80.8	133.9	175.8	-65.9	177.1	0	0	0	112.4	L17 A22 Q52 L56 L63	L17-L25 HydrophobicContact CD1-CD1 4.32Å; A22-L25 HydrophobicContact CB-CD1 4.03Å; A22-L25 HydrophobicContact CB-CG 4.41Å; A22-L25 PolarHBondContact O-N 3.05Å; L25-Q52 HydrophobicContact CD2-CB 4.43Å; L25-L56 HydrophobicContact CD2-CD1 4.02Å; L25-L56 HydrophobicContact CD2-CD2 4.41Å; L25-L56 HydrophobicContact CD2-CG 4.24Å; L25-L56 HydrophobicContact CG-CD2 4.11Å; L25-L56 HydrophobicContact CG-CG 4.48Å; L25-L63 HydrophobicContact CD2-CD2 3.99Å
26	C	81.8	Confident	76.3	Confident	56 Å²	56	65.6 Å²	65.6	38%	0.378	40%	0.403	S	S	.	.			trans	-114.1	100.4	173.8	-63	0	0	0	0	108.6	E28 M29 L30	C26-E28 VanDerWaalsContact C-N 3.25Å; C26-E28 PolarHBondContact O-N 2.96Å; C26-M29 HydrophobicContact CB-CB 4.08Å; C26-M29 HydrophobicContact CB-CG 3.8Å; C26-M29 WeakPolarHBondContact O-CB 3.42Å; C26-M29 PolarHBondContact O-N 3.39Å; C26-L30 PolarHBondContact O-N 2.84Å
27	P	79.1	Confident	76.8	Confident	78 Å²	78	62.1 Å²	62.1	51%	0.506	38%	0.38	S	S	.	.	H	α-helix	trans	-54.4	-38.1	-175.2	-28.1	36.4	0	0	0	114.1	M29 L30 E31	P27-M29 VanDerWaalsContact C-N 3.28Å; P27-M29 PolarHBondContact O-N 3.26Å; P27-L30 WeakPolarHBondContact O-CB 3.37Å; P27-L30 PolarHBondContact O-N 3.49Å; P27-E31 PolarHBondContact O-N 3.47Å
28	E	82.4	Confident	77.3	Confident	129 Å²	129	68.2 Å²	68.2	60%	0.603	40%	0.401	S	S	*	.	H	α-helix	trans	-61.9	-36.3	178.8	-53.9	89.3	158.3	0	0	111.7	C26 L30 E31 V32	C26-E28 VanDerWaalsContact C-N 3.25Å; C26-E28 PolarHBondContact O-N 2.96Å; E28-L30 VanDerWaalsContact C-N 3.33Å; E28-E31 PolarHBondContact O-N 3.25Å; E28-V32 WeakPolarHBondContact O-CG2 3.42Å; E28-V32 PolarHBondContact O-N 2.93Å
29	M	84.4	Confident	78.1	Confident	83 Å²	83	68.3 Å²	68.3	41%	0.409	41%	0.407	S	S	.	.	H	α-helix	trans	-69.4	-32.8	175.8	-66.1	-60.5	-59.7	0	0	111.6	C26 P27 V32 A33 I48	C26-M29 HydrophobicContact CB-CB 4.08Å; C26-M29 HydrophobicContact CB-CG 3.8Å; C26-M29 WeakPolarHBondContact O-CB 3.42Å; C26-M29 PolarHBondContact O-N 3.39Å; P27-M29 VanDerWaalsContact C-N 3.28Å; P27-M29 PolarHBondContact O-N 3.26Å; M29-V32 PolarHBondContact O-N 3.22Å; M29-A33 WeakPolarHBondContact O-CB 3.47Å; M29-A33 PolarHBondContact O-N 3.45Å; M29-I48 HydrophobicContact CB-CG2 3.96Å; M29-I48 HydrophobicContact CE-CD1 4.28Å; M29-I48 HydrophobicContact CE-CG1 3.98Å; M29-I48 HydrophobicContact CE-CG2 3.93Å; M29-I48 WeakPolarHBondContact O-CG2 3.29Å
30	L	83.7	Confident	78.9	Confident	13 Å²	13	65.9 Å²	65.9	7%	0.068	40%	0.403	C	S	.	.	H	α-helix	trans	-70.6	-39.6	175.9	-57.6	-177.9	0	0	0	111.5	L17 C26 P27 E28 A33 E34 Y49 Q52 L63	L17-L30 HydrophobicContact CD1-CD1 3.87Å; C26-L30 PolarHBondContact O-N 2.84Å; P27-L30 WeakPolarHBondContact O-CB 3.37Å; P27-L30 PolarHBondContact O-N 3.49Å; E28-L30 VanDerWaalsContact C-N 3.33Å; L30-A33 PolarHBondContact O-N 2.83Å; L30-E34 WeakPolarHBondContact O-CG 3.29Å; L30-E34 PolarHBondContact O-N 3.37Å; L30-Y49 HydrophobicContact CD2-CD1 4.19Å; L30-Y49 HydrophobicContact CD2-CE1 4.17Å; L30-Q52 HydrophobicContact CD2-CB 4.3Å; L30-Q52 HydrophobicContact CD2-CG 4.13Å; L30-L63 HydrophobicContact CD2-CD1 3.63Å
31	E	84	Confident	80.1	Confident	136 Å²	136	64.8 Å²	64.8	64%	0.636	39%	0.391	S	S	*	.	H	α-helix	trans	-61.2	-42.9	172.1	-68.8	-175	173.3	0	0	111.6	P27 E28 A33 E34 E35	P27-E31 PolarHBondContact O-N 3.47Å; E28-E31 PolarHBondContact O-N 3.25Å; E31-A33 PolarHBondContact O-N 2.98Å; E31-E34 PolarHBondContact O-N 3.01Å; E31-E35 PolarHBondContact O-N 3.23Å
32	V	86.1	Confident	81.5	Confident	67 Å²	67	64.2 Å²	64.2	41%	0.406	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-38.7	174.2	172.1	0	0	0	0	111.9	E28 M29 E35 A36 I48	E28-V32 WeakPolarHBondContact O-CG2 3.42Å; E28-V32 PolarHBondContact O-N 2.93Å; M29-V32 PolarHBondContact O-N 3.22Å; V32-E35 PolarHBondContact O-N 3.13Å; V32-A36 VanDerWaalsContact O-CB 3.29Å; V32-A36 WeakPolarHBondContact O-CB 3.34Å; V32-A36 PolarHBondContact O-N 2.9Å; V32-I48 HydrophobicContact CG1-CD1 3.88Å
33	A	85.2	Confident	82.6	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-66.7	-36	175.4	0	0	0	0	0	112.6	M29 L30 E31 S37 A45 I48 Y49	M29-A33 WeakPolarHBondContact O-CB 3.47Å; M29-A33 PolarHBondContact O-N 3.45Å; L30-A33 PolarHBondContact O-N 2.83Å; E31-A33 PolarHBondContact O-N 2.98Å; A33-S37 WeakPolarHBondContact O-CB 3.25Å; A33-S37 PolarHBondContact O-N 2.81Å; A33-A45 WeakPolarHBondContact O-CB 3.39Å; A33-I48 HydrophobicContact CB-CB 4.02Å; A33-I48 HydrophobicContact CB-CD1 4.24Å; A33-I48 HydrophobicContact CB-CG2 3.91Å; A33-Y49 HydrophobicContact CB-CD1 4.16Å; A33-Y49 HydrophobicContact CB-CD2 4.44Å; A33-Y49 HydrophobicContact CB-CE1 3.74Å; A33-Y49 HydrophobicContact CB-CE2 4.03Å; A33-Y49 HydrophobicContact CB-CG 4.5Å
34	E	83.9	Confident	83.8	Confident	49 Å²	49	65.8 Å²	65.8	23%	0.229	36%	0.362	C	S	.	.	H	α-helix	trans	-73.3	-33.4	173.9	-72	-176.7	-164.9	0	0	112.7	L13 L30 E31 R38 Y49 R66	L13-E34 WeakPolarHBondContact CD2-OE1 3.32Å; L13-E34 VanDerWaalsContact CD2-OE2 3.25Å; L13-E34 WeakPolarHBondContact CD2-OE2 3.44Å; L30-E34 WeakPolarHBondContact O-CG 3.29Å; L30-E34 PolarHBondContact O-N 3.37Å; E31-E34 PolarHBondContact O-N 3.01Å; E34-R38 WeakPolarHBondContact O-CB 3.33Å; E34-R38 VanDerWaalsContact O-CG 3.31Å; E34-R38 WeakPolarHBondContact O-CG 3.25Å; E34-R38 PolarHBondContact O-N 3.21Å; E34-R38 PolarHBondContact O-NE 3.39Å; E34-Y49 WeakPolarHBondContact CG-OH 3.44Å; E34-R66 IonicContact OE1-CZ 2.81Å; E34-R66 VanDerWaalsContact OE1-CZ 3.28Å; E34-R66 IonicContact OE1-NE 2.74Å; E34-R66 IonicContact OE1-NH1 3.77Å; E34-R66 PolarHBondContact OE1-NH1 3.16Å; E34-R66 IonicContact OE1-NH2 3.84Å
35	E	85.9	Confident	84.8	Confident	122 Å²	122	64.2 Å²	64.2	57%	0.57	35%	0.346	S	S	*	.	H	α-helix	trans	-69.9	-45.7	171.7	-169.7	158.8	-130.7	0	0	112	E31 V32 S37 R38 A39	E31-E35 PolarHBondContact O-N 3.23Å; V32-E35 PolarHBondContact O-N 3.13Å; E35-S37 VanDerWaalsContact C-N 3.29Å; E35-S37 PolarHBondContact O-N 2.94Å; E35-R38 VanDerWaalsContact CA-NH2 3.33Å; E35-R38 CarbonylContact O-C 3.56Å; E35-R38 WeakPolarHBondContact O-CA 3.38Å; E35-R38 PolarHBondContact O-N 2.97Å; E35-A39 WeakPolarHBondContact O-CB 3.49Å; E35-A39 PolarHBondContact O-N 3.43Å
36	A	85.9	Confident	85.5	Confident	10 Å²	10	63.3 Å²	63.3	8%	0.083	34%	0.341	C	S	.	.	H	α-helix	trans	-56.4	-43.8	172.5	0	0	0	0	0	111.4	V32 R38 A39 G40 D41 L44 A45	V32-A36 VanDerWaalsContact O-CB 3.29Å; V32-A36 WeakPolarHBondContact O-CB 3.34Å; V32-A36 PolarHBondContact O-N 2.9Å; A36-R38 VanDerWaalsContact C-N 3.32Å; A36-R38 PolarHBondContact O-N 3.07Å; A36-A39 PolarHBondContact O-N 3.03Å; A36-G40 PolarHBondContact O-N 3.33Å; A36-D41 PolarHBondContact O-N 2.97Å; A36-L44 HydrophobicContact CB-CB 4.37Å; A36-L44 HydrophobicContact CB-CD2 4.11Å; A36-L44 HydrophobicContact CB-CG 4.25Å; A36-A45 HydrophobicContact CB-CB 4.21Å
37	S	84	Confident	85.9	Confident	12 Å²	12	66.9 Å²	66.9	8%	0.084	35%	0.352	C	S	.	.	H	α-helix	trans	-66.8	-27.3	174.7	-176.8	0	0	0	0	114.1	A33 E35 F42 T70	A33-S37 WeakPolarHBondContact O-CB 3.25Å; A33-S37 PolarHBondContact O-N 2.81Å; E35-S37 VanDerWaalsContact C-N 3.29Å; E35-S37 PolarHBondContact O-N 2.94Å; S37-F42 WeakPolarHBondContact O-CE1 3.25Å; S37-T70 WeakPolarHBondContact OG-CG2 3.28Å
38	R	85.3	Confident	86.3	Confident	165 Å²	165	63.9 Å²	63.9	62%	0.623	33%	0.332	S	S	*	.	H	α-helix	trans	-78.5	-33.9	173.4	-77.9	173.8	-70.8	151.5	-0.2	111.7	E34 E35 A36 G40	E34-R38 WeakPolarHBondContact O-CB 3.33Å; E34-R38 VanDerWaalsContact O-CG 3.31Å; E34-R38 WeakPolarHBondContact O-CG 3.25Å; E34-R38 PolarHBondContact O-N 3.21Å; E34-R38 PolarHBondContact O-NE 3.39Å; E35-R38 VanDerWaalsContact CA-NH2 3.33Å; E35-R38 CarbonylContact O-C 3.56Å; E35-R38 WeakPolarHBondContact O-CA 3.38Å; E35-R38 PolarHBondContact O-N 2.97Å; A36-R38 VanDerWaalsContact C-N 3.32Å; A36-R38 PolarHBondContact O-N 3.07Å; R38-G40 VanDerWaalsContact C-N 3.26Å; R38-G40 PolarHBondContact O-N 3.29Å
39	A	85.6	Confident	86.6	Confident	87 Å²	87	58 Å²	58	72%	0.719	30%	0.304	S	S	*	.	H	α-helix	trans	-73.3	-15.8	173.5	0	0	0	0	0	113.6	E35 A36	E35-A39 WeakPolarHBondContact O-CB 3.49Å; E35-A39 PolarHBondContact O-N 3.43Å; A36-A39 PolarHBondContact O-N 3.03Å
40	G	84.1	Confident	86.7	Confident	37 Å²	37	55.8 Å²	55.8	38%	0.381	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.4	2.7	-179.8	0	0	0	0	0	114.8	A36 R38 F42	A36-G40 PolarHBondContact O-N 3.33Å; R38-G40 VanDerWaalsContact C-N 3.26Å; R38-G40 PolarHBondContact O-N 3.29Å; G40-F42 VanDerWaalsContact C-N 3.26Å; G40-F42 WeakPolarHBondContact O-CD2 3.32Å; G40-F42 PolarHBondContact O-N 3.14Å
41	D	88.9	Confident	86.9	Confident	74 Å²	74	58.1 Å²	58.1	40%	0.396	31%	0.314	S	S	.	.			trans	-81.4	77.5	169	-166.2	-16.4	0	0	0	110.2	A36 N43 L44 A45	A36-D41 PolarHBondContact O-N 2.97Å; D41-N43 PolarHBondContact O-N 3.46Å; D41-N43 PolarHBondContact OD1-N 2.9Å; D41-L44 HydrophobicContact CB-CB 4.31Å; D41-L44 VanDerWaalsContact CG-CB 3.49Å; D41-L44 PolarHBondContact OD1-N 3.07Å; D41-A45 PolarHBondContact O-N 3.45Å
42	F	90.2	Very high	87	Confident	53 Å²	53	52 Å²	52	23%	0.232	29%	0.286	C	S	.	.	H	α-helix	trans	-69.8	-19.2	178	-51	-58.4	0	0	0	112.8	S37 G40 V46 R73 A74	S37-F42 WeakPolarHBondContact O-CE1 3.25Å; G40-F42 VanDerWaalsContact C-N 3.26Å; G40-F42 WeakPolarHBondContact O-CD2 3.32Å; G40-F42 PolarHBondContact O-N 3.14Å; F42-V46 VanDerWaalsContact O-CB 3.3Å; F42-V46 WeakPolarHBondContact O-CB 3.2Å; F42-V46 WeakPolarHBondContact O-CG2 3.31Å; F42-V46 PolarHBondContact O-N 3.2Å; F42-V46 VanDerWaalsContact O-N 3.09Å; F42-R73 HydrophobicContact CD1-CB 3.72Å; F42-R73 HydrophobicContact CD2-CB 4.16Å; F42-R73 HydrophobicContact CE1-CB 3.58Å; F42-R73 HydrophobicContact CE1-CG 4.27Å; F42-R73 HydrophobicContact CE2-CB 4.02Å; F42-R73 HydrophobicContact CG-CB 4.02Å; F42-R73 HydrophobicContact CZ-CB 3.74Å; F42-A74 HydrophobicContact CB-CB 3.7Å; F42-A74 HydrophobicContact CG-CB 4.44Å
43	N	88.5	Confident	87	Confident	83 Å²	83	50.4 Å²	50.4	44%	0.444	28%	0.275	S	S	.	.	H	α-helix	trans	-76.3	-48.7	179	-71.4	-48.2	0	0	0	110.5	D41 A45 V46 E47 R76	D41-N43 PolarHBondContact O-N 3.46Å; D41-N43 PolarHBondContact OD1-N 2.9Å; N43-A45 VanDerWaalsContact C-N 3.31Å; N43-A45 PolarHBondContact O-N 3.27Å; N43-V46 PolarHBondContact O-N 3.2Å; N43-V46 VanDerWaalsContact O-N 3.14Å; N43-E47 WeakPolarHBondContact O-CG 3.5Å; N43-E47 PolarHBondContact O-N 3.48Å; N43-R76 PolarHBondContact OD1-NH1 2.85Å
44	L	88.9	Confident	87	Confident	70 Å²	70	54.2 Å²	54.2	37%	0.366	31%	0.306	S	S	.	.	H	α-helix	trans	-57.5	-44.5	174.2	179.3	60.1	0	0	0	111.5	A36 D41 V46 E47 I48	A36-L44 HydrophobicContact CB-CB 4.37Å; A36-L44 HydrophobicContact CB-CD2 4.11Å; A36-L44 HydrophobicContact CB-CG 4.25Å; D41-L44 HydrophobicContact CB-CB 4.31Å; D41-L44 VanDerWaalsContact CG-CB 3.49Å; D41-L44 PolarHBondContact OD1-N 3.07Å; L44-V46 PolarHBondContact O-N 2.73Å; L44-E47 PolarHBondContact O-N 2.97Å; L44-I48 HydrophobicContact CD1-CD1 4.02Å; L44-I48 HydrophobicContact CD1-CG1 4.34Å; L44-I48 HydrophobicContact CG-CD1 3.98Å; L44-I48 VanDerWaalsContact O-CG1 3.29Å; L44-I48 WeakPolarHBondContact O-CG1 3.37Å; L44-I48 PolarHBondContact O-N 2.61Å
45	A	88.1	Confident	86.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.1	-44.2	175.6	0	0	0	0	0	112.5	A33 A36 D41 N43 I48 Y49 T70	A33-A45 WeakPolarHBondContact O-CB 3.39Å; A36-A45 HydrophobicContact CB-CB 4.21Å; D41-A45 PolarHBondContact O-N 3.45Å; N43-A45 VanDerWaalsContact C-N 3.31Å; N43-A45 PolarHBondContact O-N 3.27Å; A45-I48 PolarHBondContact O-N 3Å; A45-Y49 HydrophobicContact CB-CE2 4.37Å; A45-Y49 WeakPolarHBondContact O-CD2 3.06Å; A45-Y49 PolarHBondContact O-N 2.99Å; A45-T70 HydrophobicContact CB-CG2 4.2Å
46	V	89.6	Confident	86.7	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.03	30%	0.295	C	S	.	.	H	α-helix	trans	-67.7	-36.6	178.6	163.4	0	0	0	0	112.4	F42 N43 L44 S50 L71	F42-V46 VanDerWaalsContact O-CB 3.3Å; F42-V46 WeakPolarHBondContact O-CB 3.2Å; F42-V46 WeakPolarHBondContact O-CG2 3.31Å; F42-V46 PolarHBondContact O-N 3.2Å; F42-V46 VanDerWaalsContact O-N 3.09Å; N43-V46 PolarHBondContact O-N 3.2Å; N43-V46 VanDerWaalsContact O-N 3.14Å; L44-V46 PolarHBondContact O-N 2.73Å; V46-S50 VanDerWaalsContact O-CB 3.25Å; V46-S50 WeakPolarHBondContact O-CB 3.49Å; V46-S50 PolarHBondContact O-N 2.93Å; V46-S50 PolarHBondContact O-OG 2.83Å; V46-L71 HydrophobicContact CB-CD2 4.4Å; V46-L71 HydrophobicContact CG1-CD2 3.64Å; V46-L71 HydrophobicContact CG1-CG 4.11Å; V46-L71 HydrophobicContact CG2-CD2 3.85Å; V46-L71 HydrophobicContact CG2-CG 3.76Å
47	E	89.6	Confident	86.2	Confident	132 Å²	132	60.3 Å²	60.3	62%	0.617	34%	0.336	S	S	*	.	H	α-helix	trans	-64	-47.6	174.3	-74.9	178.6	-173.9	0	0	111.1	N43 L44 S50 S51	N43-E47 WeakPolarHBondContact O-CG 3.5Å; N43-E47 PolarHBondContact O-N 3.48Å; L44-E47 PolarHBondContact O-N 2.97Å; E47-S50 WeakPolarHBondContact O-CB 3.49Å; E47-S50 PolarHBondContact O-N 2.99Å; E47-S50 VanDerWaalsContact O-N 3.07Å; E47-S51 PolarHBondContact O-N 3.02Å
48	I	87.4	Confident	85.8	Confident	14 Å²	14	67.4 Å²	67.4	7%	0.072	37%	0.368	C	S	.	.	H	α-helix	trans	-61.7	-49	178	-62.5	163	0	0	0	111.1	M29 V32 A33 L44 A45 S50 S51 Q52	M29-I48 HydrophobicContact CB-CG2 3.96Å; M29-I48 HydrophobicContact CE-CD1 4.28Å; M29-I48 HydrophobicContact CE-CG1 3.98Å; M29-I48 HydrophobicContact CE-CG2 3.93Å; M29-I48 WeakPolarHBondContact O-CG2 3.29Å; V32-I48 HydrophobicContact CG1-CD1 3.88Å; A33-I48 HydrophobicContact CB-CB 4.02Å; A33-I48 HydrophobicContact CB-CD1 4.24Å; A33-I48 HydrophobicContact CB-CG2 3.91Å; L44-I48 HydrophobicContact CD1-CD1 4.02Å; L44-I48 HydrophobicContact CD1-CG1 4.34Å; L44-I48 HydrophobicContact CG-CD1 3.98Å; L44-I48 VanDerWaalsContact O-CG1 3.29Å; L44-I48 WeakPolarHBondContact O-CG1 3.37Å; L44-I48 PolarHBondContact O-N 2.61Å; A45-I48 PolarHBondContact O-N 3Å; I48-S50 PolarHBondContact O-N 3.05Å; I48-S51 PolarHBondContact O-N 3.39Å; I48-Q52 HydrophobicContact CG2-CG 4.36Å; I48-Q52 WeakPolarHBondContact O-CG 3.45Å; I48-Q52 PolarHBondContact O-N 3.36Å
49	Y	88.2	Confident	85.6	Confident	5 Å²	5	62.2 Å²	62.2	2%	0.02	36%	0.356	C	S	.	.	H	α-helix	trans	-61.4	-27.1	175.1	-69	-46.6	0	0	0	113	L30 A33 E34 A45 L53 L63 R66 T70	L30-Y49 HydrophobicContact CD2-CD1 4.19Å; L30-Y49 HydrophobicContact CD2-CE1 4.17Å; A33-Y49 HydrophobicContact CB-CD1 4.16Å; A33-Y49 HydrophobicContact CB-CD2 4.44Å; A33-Y49 HydrophobicContact CB-CE1 3.74Å; A33-Y49 HydrophobicContact CB-CE2 4.03Å; A33-Y49 HydrophobicContact CB-CG 4.5Å; E34-Y49 WeakPolarHBondContact CG-OH 3.44Å; A45-Y49 HydrophobicContact CB-CE2 4.37Å; A45-Y49 WeakPolarHBondContact O-CD2 3.06Å; A45-Y49 PolarHBondContact O-N 2.99Å; Y49-L53 WeakPolarHBondContact O-CB 3.32Å; Y49-L53 WeakPolarHBondContact O-CD1 3.37Å; Y49-L53 WeakPolarHBondContact O-CG 3.3Å; Y49-L53 PolarHBondContact O-N 3.32Å; Y49-L53 VanDerWaalsContact O-N 3.16Å; Y49-L63 HydrophobicContact CD1-CD1 3.58Å; Y49-L63 HydrophobicContact CE1-CD1 4.02Å; Y49-R66 HydrophobicContact CE1-CB 4.01Å; Y49-R66 HydrophobicContact CE2-CB 4.08Å; Y49-T70 HydrophobicContact CD2-CG2 4.45Å; Y49-T70 HydrophobicContact CE2-CG2 3.85Å
50	S	87.8	Confident	85.6	Confident	38 Å²	38	58.6 Å²	58.6	27%	0.266	33%	0.325	S	S	.	.	H	α-helix	trans	-77.1	-38.1	176.8	-60.5	0	0	0	0	112.7	V46 E47 I48 A54 K67	V46-S50 VanDerWaalsContact O-CB 3.25Å; V46-S50 WeakPolarHBondContact O-CB 3.49Å; V46-S50 PolarHBondContact O-N 2.93Å; V46-S50 PolarHBondContact O-OG 2.83Å; E47-S50 WeakPolarHBondContact O-CB 3.49Å; E47-S50 PolarHBondContact O-N 2.99Å; E47-S50 VanDerWaalsContact O-N 3.07Å; I48-S50 PolarHBondContact O-N 3.05Å; S50-A54 PolarHBondContact O-N 3.09Å; S50-K67 WeakPolarHBondContact OG-CE 3.48Å; S50-K67 PolarHBondContact OG-NZ 3.38Å
51	S	88.5	Confident	85.7	Confident	61 Å²	61	58.8 Å²	58.8	43%	0.427	31%	0.314	S	S	.	.	H	α-helix	trans	-61.3	-52.5	170.3	-168	0	0	0	0	110.1	E47 I48 L53 A54 D55	E47-S51 PolarHBondContact O-N 3.02Å; I48-S51 PolarHBondContact O-N 3.39Å; S51-L53 PolarHBondContact O-N 2.7Å; S51-L53 VanDerWaalsContact O-N 3.13Å; S51-A54 CarbonylContact O-C 3.57Å; S51-A54 WeakPolarHBondContact O-CA 3.34Å; S51-A54 WeakPolarHBondContact O-CB 3.41Å; S51-A54 PolarHBondContact O-N 3.39Å; S51-D55 VanDerWaalsContact C-OD2 3.25Å; S51-D55 VanDerWaalsContact O-CG 3.29Å; S51-D55 PolarHBondContact O-N 2.63Å; S51-D55 PolarHBondContact OG-OD2 2.77Å; S51-D55 VanDerWaalsContact OG-OD2 3.09Å
52	Q	86.1	Confident	85.5	Confident	9 Å²	9	55.4 Å²	55.4	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-64.9	-21.7	-175.9	-65	-72.3	-88	0	0	113.8	G24 L25 L30 I48 D55 L56 L63	G24-Q52 PolarHBondContact O-NE2 2.81Å; L25-Q52 HydrophobicContact CD2-CB 4.43Å; L30-Q52 HydrophobicContact CD2-CB 4.3Å; L30-Q52 HydrophobicContact CD2-CG 4.13Å; I48-Q52 HydrophobicContact CG2-CG 4.36Å; I48-Q52 WeakPolarHBondContact O-CG 3.45Å; I48-Q52 PolarHBondContact O-N 3.36Å; Q52-D55 PolarHBondContact NE2-OD2 3.23Å; Q52-L56 WeakPolarHBondContact O-CG 3.13Å; Q52-L63 HydrophobicContact CB-CD2 4.01Å
53	L	85.1	Confident	85.3	Confident	32 Å²	32	52.9 Å²	52.9	17%	0.168	29%	0.285	C	S	.	.	H	α-helix	trans	-80.7	-26.1	167.9	-81.1	168.1	0	0	0	113.8	Y49 S51 P59 L63 K67	Y49-L53 WeakPolarHBondContact O-CB 3.32Å; Y49-L53 WeakPolarHBondContact O-CD1 3.37Å; Y49-L53 WeakPolarHBondContact O-CG 3.3Å; Y49-L53 PolarHBondContact O-N 3.32Å; Y49-L53 VanDerWaalsContact O-N 3.16Å; S51-L53 PolarHBondContact O-N 2.7Å; S51-L53 VanDerWaalsContact O-N 3.13Å; L53-P59 HydrophobicContact CD2-CB 4.1Å; L53-L63 HydrophobicContact CD2-CB 4.11Å; L53-L63 HydrophobicContact CD2-CD2 3.83Å; L53-L63 HydrophobicContact CD2-CG 4.09Å; L53-L63 HydrophobicContact CG-CB 4.48Å; L53-L63 HydrophobicContact CG-CD2 3.73Å; L53-L63 HydrophobicContact CG-CG 3.95Å; L53-K67 HydrophobicContact CD1-CB 4.42Å; L53-K67 HydrophobicContact CD1-CD 3.67Å
54	A	84.3	Confident	85.3	Confident	80 Å²	80	49 Å²	49	66%	0.661	27%	0.265	S	S	*	.	H	α-helix	trans	-83.6	-28	177	0	0	0	0	0	112.9	S50 S51 L56	S50-A54 PolarHBondContact O-N 3.09Å; S51-A54 CarbonylContact O-C 3.57Å; S51-A54 WeakPolarHBondContact O-CA 3.34Å; S51-A54 WeakPolarHBondContact O-CB 3.41Å; S51-A54 PolarHBondContact O-N 3.39Å; A54-L56 PolarHBondContact O-N 3.07Å
55	D	83.3	Confident	85.2	Confident	83 Å²	83	45.8 Å²	45.8	44%	0.444	25%	0.247	S	C	.	.	S	Bend	trans	-73.2	-10.3	175	-62.3	-48.7	0	0	0	112.8	S51 Q52	S51-D55 VanDerWaalsContact C-OD2 3.25Å; S51-D55 VanDerWaalsContact O-CG 3.29Å; S51-D55 PolarHBondContact O-N 2.63Å; S51-D55 PolarHBondContact OG-OD2 2.77Å; S51-D55 VanDerWaalsContact OG-OD2 3.09Å; Q52-D55 PolarHBondContact NE2-OD2 3.23Å
56	L	82	Confident	85.2	Confident	24 Å²	24	46.7 Å²	46.7	13%	0.126	25%	0.251	C	S	.	.	S	Bend	trans	-95.2	141	-179.8	-81.3	174.5	0	0	0	113.4	A22 L25 Q52 A54 Q58 D60 L63	A22-L56 HydrophobicContact CB-CD2 3.66Å; L25-L56 HydrophobicContact CD2-CD1 4.02Å; L25-L56 HydrophobicContact CD2-CD2 4.41Å; L25-L56 HydrophobicContact CD2-CG 4.24Å; L25-L56 HydrophobicContact CG-CD2 4.11Å; L25-L56 HydrophobicContact CG-CG 4.48Å; Q52-L56 WeakPolarHBondContact O-CG 3.13Å; A54-L56 PolarHBondContact O-N 3.07Å; L56-Q58 VanDerWaalsContact C-N 3.31Å; L56-Q58 WeakPolarHBondContact CB-O 3.38Å; L56-Q58 PolarHBondContact O-N 3.41Å; L56-D60 HydrophobicContact CD1-CB 4.02Å; L56-L63 HydrophobicContact CD1-CD2 4.12Å
57	Q	73.9	Confident	85.2	Confident	202 Å²	202	48.8 Å²	48.8	94%	0.944	26%	0.26	S	S	*	.	S	Bend	trans	-71.5	-22.1	173.6	-66.2	-173.5	0.4	0	0	114.2
58	Q	76.3	Confident	85.1	Confident	161 Å²	161	42.5 Å²	42.5	75%	0.752	23%	0.23	S	C	*	.	S	Bend	trans	-143.1	137.8	173.2	-68.3	-173.9	-11.7	0	0	108.6	L56 D60	L56-Q58 VanDerWaalsContact C-N 3.31Å; L56-Q58 WeakPolarHBondContact CB-O 3.38Å; L56-Q58 PolarHBondContact O-N 3.41Å; Q58-D60 PolarHBondContact O-N 3.18Å
59	P	81.2	Confident	85.1	Confident	57 Å²	57	42.1 Å²	42.1	37%	0.37	23%	0.229	S	C	.	.			trans	-64	132.6	-178.7	24.7	-32.6	0	0	0	111.6	L53 T86 L90	L53-P59 HydrophobicContact CD2-CB 4.1Å; P59-T86 HydrophobicContact CB-CG2 4.44Å; P59-L90 HydrophobicContact CB-CD1 4.24Å; P59-L90 HydrophobicContact CG-CD1 4.15Å; P59-L90 HydrophobicContact CG-CD2 4.38Å; P59-L90 WeakPolarHBondContact O-CD1 3.37Å
60	D	86.4	Confident	85.2	Confident	11 Å²	11	42.1 Å²	42.1	6%	0.059	23%	0.229	C	C	.	.			trans	-82.3	127.7	174.8	-176.9	-72.4	0	0	0	110.8	S18 N19 L56 Q58 G62 L63 C64	S18-D60 WeakPolarHBondContact CA-OD2 3.35Å; S18-D60 VanDerWaalsContact CB-OD2 3.25Å; S18-D60 WeakPolarHBondContact CB-OD2 3.33Å; S18-D60 PolarHBondContact N-OD1 3.2Å; S18-D60 PolarHBondContact N-OD2 3Å; N19-D60 PolarHBondContact N-OD2 3.28Å; N19-D60 VanDerWaalsContact N-OD2 3.07Å; L56-D60 HydrophobicContact CD1-CB 4.02Å; Q58-D60 PolarHBondContact O-N 3.18Å; D60-G62 VanDerWaalsContact C-N 3.33Å; D60-G62 PolarHBondContact O-N 3.19Å; D60-G62 WeakPolarHBondContact OD1-CA 3.41Å; D60-G62 PolarHBondContact OD1-N 2.96Å; D60-L63 HydrophobicContact CB-CB 3.88Å; D60-L63 PolarHBondContact O-N 3.41Å; D60-L63 PolarHBondContact OD1-N 3.03Å; D60-L63 VanDerWaalsContact OD1-N 3.1Å; D60-C64 PolarHBondContact O-N 2.84Å; D60-C64 PolarHBondContact O-SG 3.11Å; D60-C64 VanDerWaalsContact O-SG 3.41Å
61	R	85.9	Confident	85.1	Confident	41 Å²	41	40.4 Å²	40.4	16%	0.155	22%	0.217	C	C	.	.	H	α-helix	trans	-59.2	-40.7	-177.1	-174.6	-178.2	178.9	-82.2	4.5	113	L65 A87 L90 G91 K92 E97	R61-L65 HydrophobicContact CG-CD1 4.44Å; R61-L65 WeakPolarHBondContact O-CG 3.44Å; R61-L65 PolarHBondContact O-N 3.1Å; R61-A87 HydrophobicContact CG-CB 4.2Å; R61-L90 HydrophobicContact CB-CB 3.97Å; R61-L90 HydrophobicContact CB-CD1 4.03Å; R61-L90 HydrophobicContact CG-CB 4.16Å; R61-G91 PolarHBondContact NE-O 2.8Å; R61-G91 PolarHBondContact NH2-O 2.97Å; R61-K92 PolarHBondContact NH2-O 3.29Å; R61-K92 VanDerWaalsContact NH2-O 3.08Å; R61-E97 IonicContact CZ-OE1 2.65Å; R61-E97 IonicContact CZ-OE2 2.94Å; R61-E97 IonicContact NH1-OE1 3.86Å; R61-E97 PolarHBondContact NH1-OE1 3.29Å; R61-E97 IonicContact NH1-OE2 2.77Å; R61-E97 IonicContact NH2-OE1 2.66Å; R61-E97 PolarHBondContact NH2-OE1 3.46Å; R61-E97 IonicContact NH2-OE2 3.56Å; R61-E97 PolarHBondContact NH2-OE2 2.9Å
62	G	84.6	Confident	85	Confident	2 Å²	2	37.5 Å²	37.5	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-68.8	-39.4	178.7	0	0	0	0	0	111.6	P16 D60 L65 R66	P16-G62 WeakPolarHBondContact O-CA 3.47Å; D60-G62 VanDerWaalsContact C-N 3.33Å; D60-G62 PolarHBondContact O-N 3.19Å; D60-G62 WeakPolarHBondContact OD1-CA 3.41Å; D60-G62 PolarHBondContact OD1-N 2.96Å; G62-L65 PolarHBondContact O-N 3.35Å; G62-R66 WeakPolarHBondContact O-CG 3.35Å; G62-R66 PolarHBondContact O-N 3.06Å
63	L	85.9	Confident	85	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.8	-40.6	176	-162	64.2	0	0	0	111.9	L17 L25 L30 Y49 Q52 L53 L56 D60 L65 R66 K67	L17-L63 HydrophobicContact CD2-CB 4.09Å; L17-L63 HydrophobicContact CD2-CD1 4.3Å; L25-L63 HydrophobicContact CD2-CD2 3.99Å; L30-L63 HydrophobicContact CD2-CD1 3.63Å; Y49-L63 HydrophobicContact CD1-CD1 3.58Å; Y49-L63 HydrophobicContact CE1-CD1 4.02Å; Q52-L63 HydrophobicContact CB-CD2 4.01Å; L53-L63 HydrophobicContact CD2-CB 4.11Å; L53-L63 HydrophobicContact CD2-CD2 3.83Å; L53-L63 HydrophobicContact CD2-CG 4.09Å; L53-L63 HydrophobicContact CG-CB 4.48Å; L53-L63 HydrophobicContact CG-CD2 3.73Å; L53-L63 HydrophobicContact CG-CG 3.95Å; L56-L63 HydrophobicContact CD1-CD2 4.12Å; D60-L63 HydrophobicContact CB-CB 3.88Å; D60-L63 PolarHBondContact O-N 3.41Å; D60-L63 PolarHBondContact OD1-N 3.03Å; D60-L63 VanDerWaalsContact OD1-N 3.1Å; L63-L65 VanDerWaalsContact C-N 3.35Å; L63-L65 PolarHBondContact O-N 3.4Å; L63-R66 PolarHBondContact O-N 3.11Å; L63-K67 WeakPolarHBondContact O-CB 3.45Å; L63-K67 PolarHBondContact O-N 2.99Å
64	C	87.3	Confident	85	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.02	22%	0.217	C	C	.	.	H	α-helix	trans	-59.7	-41.3	170.8	-71.4	0	0	0	0	112.5	D60 K67 G68 A87	D60-C64 PolarHBondContact O-N 2.84Å; D60-C64 PolarHBondContact O-SG 3.11Å; D60-C64 VanDerWaalsContact O-SG 3.41Å; C64-K67 PolarHBondContact O-N 2.75Å; C64-G68 PolarHBondContact O-N 3.47Å; C64-A87 HydrophobicContact CB-CB 3.92Å
65	L	87.4	Confident	84.8	Confident	1 Å²	1	40 Å²	40	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-67	-42.9	176.8	-71.1	169.6	0	0	0	112.2	H15 R61 G62 L63 K67 G68 D69 Y84 A87 L93 E97	H15-L65 HydrophobicContact CB-CB 3.99Å; R61-L65 HydrophobicContact CG-CD1 4.44Å; R61-L65 WeakPolarHBondContact O-CG 3.44Å; R61-L65 PolarHBondContact O-N 3.1Å; G62-L65 PolarHBondContact O-N 3.35Å; L63-L65 VanDerWaalsContact C-N 3.35Å; L63-L65 PolarHBondContact O-N 3.4Å; L65-K67 VanDerWaalsContact C-N 3.3Å; L65-K67 PolarHBondContact O-N 3.08Å; L65-G68 PolarHBondContact O-N 2.8Å; L65-G68 VanDerWaalsContact O-N 3.11Å; L65-D69 WeakPolarHBondContact O-CB 3.49Å; L65-D69 PolarHBondContact O-N 3.25Å; L65-Y84 HydrophobicContact CD2-CD1 3.58Å; L65-Y84 HydrophobicContact CD2-CE1 3.78Å; L65-A87 HydrophobicContact CD2-CB 3.68Å; L65-A87 HydrophobicContact CG-CB 3.72Å; L65-L93 HydrophobicContact CD2-CD2 3.98Å; L65-E97 HydrophobicContact CD1-CB 4.49Å; L65-E97 HydrophobicContact CD1-CG 4.47Å
66	R	89.1	Confident	84.8	Confident	20 Å²	20	40 Å²	40	8%	0.075	20%	0.201	C	C	.	.	H	α-helix	trans	-60.8	-37.4	173.7	-66.5	171.4	-168.6	-150.5	-7.1	112.6	H15 E34 Y49 G62 L63 T70	H15-R66 HydrophobicContact CB-CG 4.18Å; H15-R66 PolarHBondContact O-NE 3.42Å; H15-R66 PolarHBondContact O-NH2 3.38Å; E34-R66 IonicContact OE1-CZ 2.81Å; E34-R66 VanDerWaalsContact OE1-CZ 3.28Å; E34-R66 IonicContact OE1-NE 2.74Å; E34-R66 IonicContact OE1-NH1 3.77Å; E34-R66 PolarHBondContact OE1-NH1 3.16Å; E34-R66 IonicContact OE1-NH2 3.84Å; Y49-R66 HydrophobicContact CE1-CB 4.01Å; Y49-R66 HydrophobicContact CE2-CB 4.08Å; G62-R66 WeakPolarHBondContact O-CG 3.35Å; G62-R66 PolarHBondContact O-N 3.06Å; L63-R66 PolarHBondContact O-N 3.11Å; R66-T70 PolarHBondContact O-N 2.89Å; R66-T70 VanDerWaalsContact O-N 3.08Å; R66-T70 PolarHBondContact O-OG1 3.38Å
67	K	88.4	Confident	84.9	Confident	49 Å²	49	40.4 Å²	40.4	21%	0.213	20%	0.203	C	C	.	.	H	α-helix	trans	-66.7	-40.5	172.2	-179.7	169.1	169.6	170.4	0	112	S50 L53 L63 C64 L65 T70 L71 A83	S50-K67 WeakPolarHBondContact OG-CE 3.48Å; S50-K67 PolarHBondContact OG-NZ 3.38Å; L53-K67 HydrophobicContact CD1-CB 4.42Å; L53-K67 HydrophobicContact CD1-CD 3.67Å; L63-K67 WeakPolarHBondContact O-CB 3.45Å; L63-K67 PolarHBondContact O-N 2.99Å; C64-K67 PolarHBondContact O-N 2.75Å; L65-K67 VanDerWaalsContact C-N 3.3Å; L65-K67 PolarHBondContact O-N 3.08Å; K67-T70 WeakPolarHBondContact CA-OG1 3.43Å; K67-T70 PolarHBondContact O-N 3.05Å; K67-T70 PolarHBondContact O-OG1 3.06Å; K67-L71 HydrophobicContact CD-CD1 4.47Å; K67-L71 HydrophobicContact CG-CD1 3.74Å; K67-L71 HydrophobicContact CG-CG 4.37Å; K67-L71 VanDerWaalsContact O-CB 3.31Å; K67-L71 WeakPolarHBondContact O-CB 3.31Å; K67-L71 WeakPolarHBondContact O-CD1 3.45Å; K67-L71 VanDerWaalsContact O-CG 3.28Å; K67-L71 WeakPolarHBondContact O-CG 3.49Å; K67-L71 PolarHBondContact O-N 3.08Å; K67-A83 HydrophobicContact CG-CB 4.35Å
68	G	87.3	Confident	85.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-45.3	174.7	0	0	0	0	0	113	C64 L65 T70 A72	C64-G68 PolarHBondContact O-N 3.47Å; L65-G68 PolarHBondContact O-N 2.8Å; L65-G68 VanDerWaalsContact O-N 3.11Å; G68-T70 VanDerWaalsContact C-N 3.34Å; G68-T70 PolarHBondContact O-N 2.91Å; G68-A72 VanDerWaalsContact O-CB 3.29Å; G68-A72 WeakPolarHBondContact O-CB 3.43Å; G68-A72 PolarHBondContact O-N 3.48Å
69	D	88.8	Confident	85.6	Confident	6 Å²	6	30 Å²	30	3%	0.032	16%	0.162	C	C	.	.	H	α-helix	trans	-55.7	-45.8	173.6	-110.7	61.5	0	0	0	111.8	H15 L65 R73 Y84 V100	H15-D69 IonicContact CD2-OD1 2.79Å; H15-D69 IonicContact NE2-OD1 3.53Å; H15-D69 PolarHBondContact NE2-OD1 3.09Å; H15-D69 IonicContact NE2-OD2 3.75Å; H15-D69 PolarHBondContact NE2-OD2 3.26Å; L65-D69 WeakPolarHBondContact O-CB 3.49Å; L65-D69 PolarHBondContact O-N 3.25Å; D69-R73 VanDerWaalsContact O-CG 3.27Å; D69-R73 WeakPolarHBondContact O-CG 3.45Å; D69-R73 PolarHBondContact O-N 3.43Å; D69-R73 IonicContact OD2-CZ 2.7Å; D69-R73 IonicContact OD2-NE 3.25Å; D69-R73 IonicContact OD2-NH2 3.41Å; D69-R73 PolarHBondContact OD2-NH2 3.36Å; D69-Y84 PolarHBondContact N-OH 2.91Å; D69-Y84 PolarHBondContact OD1-OH 2.93Å; D69-V100 HydrophobicContact CB-CG1 4.43Å; D69-V100 WeakPolarHBondContact OD2-CG2 3.46Å
70	T	88.8	Confident	85.8	Confident	4 Å²	4	27.2 Å²	27.2	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-77	-40	-177.3	44.3	0	0	0	0	113	S37 A45 Y49 R66 K67 G68 A72 R73 A74	S37-T70 WeakPolarHBondContact OG-CG2 3.28Å; A45-T70 HydrophobicContact CB-CG2 4.2Å; Y49-T70 HydrophobicContact CD2-CG2 4.45Å; Y49-T70 HydrophobicContact CE2-CG2 3.85Å; R66-T70 PolarHBondContact O-N 2.89Å; R66-T70 VanDerWaalsContact O-N 3.08Å; R66-T70 PolarHBondContact O-OG1 3.38Å; K67-T70 WeakPolarHBondContact CA-OG1 3.43Å; K67-T70 PolarHBondContact O-N 3.05Å; K67-T70 PolarHBondContact O-OG1 3.06Å; G68-T70 VanDerWaalsContact C-N 3.34Å; G68-T70 PolarHBondContact O-N 2.91Å; T70-A72 VanDerWaalsContact C-N 3.3Å; T70-A72 PolarHBondContact O-N 3.18Å; T70-R73 PolarHBondContact O-N 3.45Å; T70-A74 WeakPolarHBondContact O-CB 3.27Å; T70-A74 PolarHBondContact O-N 3.45Å
71	L	87.1	Confident	85.7	Confident	2 Å²	2	28.6 Å²	28.6	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-59.9	-39.3	170.1	-76.6	166	0	0	0	112	V46 K67 A74 G75 R76 E79 A80 A83	V46-L71 HydrophobicContact CB-CD2 4.4Å; V46-L71 HydrophobicContact CG1-CD2 3.64Å; V46-L71 HydrophobicContact CG1-CG 4.11Å; V46-L71 HydrophobicContact CG2-CD2 3.85Å; V46-L71 HydrophobicContact CG2-CG 3.76Å; K67-L71 HydrophobicContact CD-CD1 4.47Å; K67-L71 HydrophobicContact CG-CD1 3.74Å; K67-L71 HydrophobicContact CG-CG 4.37Å; K67-L71 VanDerWaalsContact O-CB 3.31Å; K67-L71 WeakPolarHBondContact O-CB 3.31Å; K67-L71 WeakPolarHBondContact O-CD1 3.45Å; K67-L71 VanDerWaalsContact O-CG 3.28Å; K67-L71 WeakPolarHBondContact O-CG 3.49Å; K67-L71 PolarHBondContact O-N 3.08Å; L71-A74 WeakPolarHBondContact O-CB 3.49Å; L71-A74 PolarHBondContact O-N 3.3Å; L71-G75 PolarHBondContact O-N 3.43Å; L71-R76 HydrophobicContact CB-CB 4.48Å; L71-R76 HydrophobicContact CD2-CB 3.95Å; L71-R76 WeakPolarHBondContact O-CA 3.49Å; L71-R76 PolarHBondContact O-N 2.97Å; L71-E79 HydrophobicContact CD1-CB 3.92Å; L71-E79 WeakPolarHBondContact CD1-O 2.85Å; L71-E79 HydrophobicContact CD2-CB 3.95Å; L71-E79 HydrophobicContact CG-CB 4.45Å; L71-A80 HydrophobicContact CB-CB 3.69Å; L71-A83 HydrophobicContact CD1-CB 4.3Å
72	A	86.1	Confident	85.6	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-62.8	-49.8	173.7	0	0	0	0	0	111	G68 T70 A74 G75 A80 V100 T104	G68-A72 VanDerWaalsContact O-CB 3.29Å; G68-A72 WeakPolarHBondContact O-CB 3.43Å; G68-A72 PolarHBondContact O-N 3.48Å; T70-A72 VanDerWaalsContact C-N 3.3Å; T70-A72 PolarHBondContact O-N 3.18Å; A72-A74 PolarHBondContact O-N 2.87Å; A72-G75 WeakPolarHBondContact O-CA 3.5Å; A72-G75 PolarHBondContact O-N 3.25Å; A72-A80 HydrophobicContact CB-CB 4.08Å; A72-V100 HydrophobicContact CB-CG1 4.33Å; A72-T104 HydrophobicContact CB-CG2 4.16Å; A72-T104 WeakPolarHBondContact O-CG2 3.3Å
73	R	86.1	Confident	85.6	Confident	95 Å²	95	32.6 Å²	32.6	36%	0.358	17%	0.173	S	C	.	.	H	α-helix	trans	-59.7	-32.4	176.6	-67.7	170.2	-160.8	-167.2	8.6	113	F42 D69 T70 G75 V100	F42-R73 HydrophobicContact CD1-CB 3.72Å; F42-R73 HydrophobicContact CD2-CB 4.16Å; F42-R73 HydrophobicContact CE1-CB 3.58Å; F42-R73 HydrophobicContact CE1-CG 4.27Å; F42-R73 HydrophobicContact CE2-CB 4.02Å; F42-R73 HydrophobicContact CG-CB 4.02Å; F42-R73 HydrophobicContact CZ-CB 3.74Å; D69-R73 VanDerWaalsContact O-CG 3.27Å; D69-R73 WeakPolarHBondContact O-CG 3.45Å; D69-R73 PolarHBondContact O-N 3.43Å; D69-R73 IonicContact OD2-CZ 2.7Å; D69-R73 IonicContact OD2-NE 3.25Å; D69-R73 IonicContact OD2-NH2 3.41Å; D69-R73 PolarHBondContact OD2-NH2 3.36Å; T70-R73 PolarHBondContact O-N 3.45Å; R73-G75 PolarHBondContact O-N 3.37Å; R73-V100 HydrophobicContact CG-CG1 3.86Å
74	A	84.7	Confident	85.5	Confident	34 Å²	34	32.6 Å²	32.6	28%	0.281	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-6.8	171.8	0	0	0	0	0	114.7	F42 T70 L71 A72 R76	F42-A74 HydrophobicContact CB-CB 3.7Å; F42-A74 HydrophobicContact CG-CB 4.44Å; T70-A74 WeakPolarHBondContact O-CB 3.27Å; T70-A74 PolarHBondContact O-N 3.45Å; L71-A74 WeakPolarHBondContact O-CB 3.49Å; L71-A74 PolarHBondContact O-N 3.3Å; A72-A74 PolarHBondContact O-N 2.87Å; A74-R76 VanDerWaalsContact C-N 3.26Å; A74-R76 HydrophobicContact CB-CG 4.17Å; A74-R76 PolarHBondContact O-N 3.36Å
75	G	79.9	Confident	85.4	Confident	44 Å²	44	33.8 Å²	33.8	45%	0.454	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	5.9	-173.3	0	0	0	0	0	114.6	L71 A72 R73 I77	L71-G75 PolarHBondContact O-N 3.43Å; A72-G75 WeakPolarHBondContact O-CA 3.5Å; A72-G75 PolarHBondContact O-N 3.25Å; R73-G75 PolarHBondContact O-N 3.37Å; G75-I77 PolarHBondContact O-N 3.41Å
76	R	84.4	Confident	85.2	Confident	83 Å²	83	36.4 Å²	36.4	31%	0.313	20%	0.196	S	C	.	.			trans	-85.4	57	-178.8	-67	166.6	69.6	171.4	-3.3	110.6	N43 L71 A74 S78 E79 A80	N43-R76 PolarHBondContact OD1-NH1 2.85Å; L71-R76 HydrophobicContact CB-CB 4.48Å; L71-R76 HydrophobicContact CD2-CB 3.95Å; L71-R76 WeakPolarHBondContact O-CA 3.49Å; L71-R76 PolarHBondContact O-N 2.97Å; A74-R76 VanDerWaalsContact C-N 3.26Å; A74-R76 HydrophobicContact CB-CG 4.17Å; A74-R76 PolarHBondContact O-N 3.36Å; R76-S78 VanDerWaalsContact C-N 3.33Å; R76-S78 PolarHBondContact O-N 3.25Å; R76-E79 IonicContact CZ-OE1 3.99Å; R76-E79 IonicContact CZ-OE2 3.28Å; R76-E79 IonicContact NE-OE1 3.52Å; R76-E79 PolarHBondContact NE-OE1 3.03Å; R76-E79 IonicContact NE-OE2 3.32Å; R76-E79 IonicContact NH2-OE1 2.61Å; R76-E79 PolarHBondContact NH2-OE1 2.79Å; R76-E79 IonicContact NH2-OE2 3.48Å; R76-E79 PolarHBondContact NH2-OE2 2.94Å; R76-E79 PolarHBondContact O-N 3.23Å; R76-A80 PolarHBondContact O-N 2.91Å
77	I	83.6	Confident	85.1	Confident	33 Å²	33	35.4 Å²	35.4	17%	0.169	19%	0.193	C	C	.	.	H	α-helix	trans	-57.8	-39.6	-167.5	-60	177.6	0	0	0	112.9	G75 A80 L81 T104 I105 T108	G75-I77 PolarHBondContact O-N 3.41Å; I77-A80 WeakPolarHBondContact O-CB 3.21Å; I77-A80 PolarHBondContact O-N 2.02Å; I77-L81 HydrophobicContact CG2-CD1 4.19Å; I77-L81 HydrophobicContact CG2-CG 4.41Å; I77-L81 WeakPolarHBondContact O-CG 3.09Å; I77-L81 PolarHBondContact O-N 2.75Å; I77-T104 HydrophobicContact CD1-CG2 4.18Å; I77-T104 HydrophobicContact CG1-CG2 4.09Å; I77-I105 HydrophobicContact CD1-CG1 4.37Å; I77-I105 HydrophobicContact CG2-CG1 4.12Å; I77-T108 HydrophobicContact CD1-CG2 4.06Å
78	S	79.9	Confident	84.9	Confident	69 Å²	69	33.5 Å²	33.5	48%	0.483	19%	0.186	S	C	.	.	H	α-helix	trans	-60.9	-48.7	179.4	-48.5	0	0	0	0	112.1	R76 A80 L81 E82	R76-S78 VanDerWaalsContact C-N 3.33Å; R76-S78 PolarHBondContact O-N 3.25Å; S78-A80 VanDerWaalsContact C-N 3.31Å; S78-A80 PolarHBondContact O-N 3.29Å; S78-L81 WeakPolarHBondContact O-CB 3.49Å; S78-L81 PolarHBondContact O-N 3.08Å; S78-E82 PolarHBondContact O-N 3.01Å; S78-E82 VanDerWaalsContact O-N 3.13Å
79	E	84.7	Confident	84.7	Confident	74 Å²	74	38.5 Å²	38.5	35%	0.346	21%	0.213	S	C	.	.	H	α-helix	trans	-68.4	-33	178.1	-60.1	173.2	-100.3	0	0	111.4	L71 R76 E82 A83	L71-E79 HydrophobicContact CD1-CB 3.92Å; L71-E79 WeakPolarHBondContact CD1-O 2.85Å; L71-E79 HydrophobicContact CD2-CB 3.95Å; L71-E79 HydrophobicContact CG-CB 4.45Å; R76-E79 IonicContact CZ-OE1 3.99Å; R76-E79 IonicContact CZ-OE2 3.28Å; R76-E79 IonicContact NE-OE1 3.52Å; R76-E79 PolarHBondContact NE-OE1 3.03Å; R76-E79 IonicContact NE-OE2 3.32Å; R76-E79 IonicContact NH2-OE1 2.61Å; R76-E79 PolarHBondContact NH2-OE1 2.79Å; R76-E79 IonicContact NH2-OE2 3.48Å; R76-E79 PolarHBondContact NH2-OE2 2.94Å; R76-E79 PolarHBondContact O-N 3.23Å; E79-E82 PolarHBondContact O-N 2.71Å; E79-A83 PolarHBondContact O-N 2.99Å
80	A	84.8	Confident	84.5	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.1	-48.1	172.2	0	0	0	0	0	110.7	L71 A72 R76 I77 S78 E82 A83 Y84	L71-A80 HydrophobicContact CB-CB 3.69Å; A72-A80 HydrophobicContact CB-CB 4.08Å; R76-A80 PolarHBondContact O-N 2.91Å; I77-A80 WeakPolarHBondContact O-CB 3.21Å; I77-A80 PolarHBondContact O-N 2.02Å; S78-A80 VanDerWaalsContact C-N 3.31Å; S78-A80 PolarHBondContact O-N 3.29Å; A80-E82 VanDerWaalsContact C-N 3.31Å; A80-E82 PolarHBondContact O-N 2.53Å; A80-A83 WeakPolarHBondContact O-CB 3.42Å; A80-A83 PolarHBondContact O-N 3.35Å; A80-A83 VanDerWaalsContact O-N 3.08Å; A80-Y84 HydrophobicContact CB-CE2 4.37Å; A80-Y84 WeakPolarHBondContact O-CD2 3.02Å; A80-Y84 PolarHBondContact O-N 2.87Å
81	L	84.5	Confident	84.2	Confident	40 Å²	40	43.1 Å²	43.1	21%	0.209	24%	0.244	C	C	.	.	H	α-helix	trans	-59.2	-39.7	177.1	-70.5	168.7	0	0	0	112	I77 S78 A83 Y84 C85 L101 F330	I77-L81 HydrophobicContact CG2-CD1 4.19Å; I77-L81 HydrophobicContact CG2-CG 4.41Å; I77-L81 WeakPolarHBondContact O-CG 3.09Å; I77-L81 PolarHBondContact O-N 2.75Å; S78-L81 WeakPolarHBondContact O-CB 3.49Å; S78-L81 PolarHBondContact O-N 3.08Å; L81-A83 VanDerWaalsContact C-N 3.35Å; L81-A83 PolarHBondContact O-N 3.19Å; L81-Y84 PolarHBondContact O-N 3.17Å; L81-C85 PolarHBondContact O-N 3.29Å; L81-C85 PolarHBondContact O-SG 3.19Å; L81-C85 VanDerWaalsContact O-SG 3.36Å; L81-L101 HydrophobicContact CD2-CD1 4.13Å; L81-L101 HydrophobicContact CD2-CD2 3.85Å; L81-F330 HydrophobicContact CD2-CZ 4.05Å
82	E	83.3	Confident	84	Confident	119 Å²	119	49.1 Å²	49.1	56%	0.556	27%	0.27	S	S	*	.	H	α-helix	trans	-61.5	-40.3	173.5	-68.9	171.7	-173.8	0	0	112.2	S78 E79 A80 C85 T86	S78-E82 PolarHBondContact O-N 3.01Å; S78-E82 VanDerWaalsContact O-N 3.13Å; E79-E82 PolarHBondContact O-N 2.71Å; A80-E82 VanDerWaalsContact C-N 3.31Å; A80-E82 PolarHBondContact O-N 2.53Å; E82-C85 PolarHBondContact O-N 2.99Å; E82-T86 PolarHBondContact O-N 2.84Å; E82-T86 PolarHBondContact O-OG1 3.21Å
83	A	85.6	Confident	84	Confident	8 Å²	8	49.2 Å²	49.2	7%	0.066	27%	0.27	C	S	.	.	H	α-helix	trans	-66.8	-39.4	174.5	0	0	0	0	0	112.8	K67 L71 E79 A80 L81 T86 A87	K67-A83 HydrophobicContact CG-CB 4.35Å; L71-A83 HydrophobicContact CD1-CB 4.3Å; E79-A83 PolarHBondContact O-N 2.99Å; A80-A83 WeakPolarHBondContact O-CB 3.42Å; A80-A83 PolarHBondContact O-N 3.35Å; A80-A83 VanDerWaalsContact O-N 3.08Å; L81-A83 VanDerWaalsContact C-N 3.35Å; L81-A83 PolarHBondContact O-N 3.19Å; A83-T86 WeakPolarHBondContact O-CB 3.4Å; A83-T86 PolarHBondContact O-N 3.25Å; A83-A87 PolarHBondContact O-N 2.87Å
84	Y	84.3	Confident	84	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-67.9	-39.3	173.1	-72.5	-77	0	0	0	112.2	L65 D69 A80 L81 T86 A87 A88 L93 L98 L101	L65-Y84 HydrophobicContact CD2-CD1 3.58Å; L65-Y84 HydrophobicContact CD2-CE1 3.78Å; D69-Y84 PolarHBondContact N-OH 2.91Å; D69-Y84 PolarHBondContact OD1-OH 2.93Å; A80-Y84 HydrophobicContact CB-CE2 4.37Å; A80-Y84 WeakPolarHBondContact O-CD2 3.02Å; A80-Y84 PolarHBondContact O-N 2.87Å; L81-Y84 PolarHBondContact O-N 3.17Å; Y84-T86 VanDerWaalsContact C-N 3.29Å; Y84-T86 PolarHBondContact O-N 3.46Å; Y84-A87 PolarHBondContact O-N 3.42Å; Y84-A88 WeakPolarHBondContact O-CB 3.29Å; Y84-A88 PolarHBondContact O-N 3.44Å; Y84-L93 HydrophobicContact CD1-CD1 4.36Å; Y84-L98 HydrophobicContact CD1-CD2 3.96Å; Y84-L98 HydrophobicContact CE1-CD2 4.11Å; Y84-L101 HydrophobicContact CD2-CB 4.48Å; Y84-L101 HydrophobicContact CD2-CD1 4.3Å; Y84-L101 HydrophobicContact CD2-CD2 3.69Å; Y84-L101 HydrophobicContact CD2-CG 4.38Å; Y84-L101 HydrophobicContact CE2-CB 3.77Å; Y84-L101 HydrophobicContact CE2-CD1 4.02Å; Y84-L101 HydrophobicContact CE2-CD2 3.85Å; Y84-L101 HydrophobicContact CE2-CG 4.09Å; Y84-L101 HydrophobicContact CG-CD2 4.18Å
85	C	83.8	Confident	84.1	Confident	28 Å²	28	50.2 Å²	50.2	19%	0.189	27%	0.269	C	S	.	.	H	α-helix	trans	-57.4	-43.5	170.1	-74.7	0	0	0	0	111.4	L81 E82 A87 A88 N89	L81-C85 PolarHBondContact O-N 3.29Å; L81-C85 PolarHBondContact O-SG 3.19Å; L81-C85 VanDerWaalsContact O-SG 3.36Å; E82-C85 PolarHBondContact O-N 2.99Å; C85-A87 VanDerWaalsContact C-N 3.33Å; C85-A87 PolarHBondContact O-N 2.96Å; C85-A88 WeakPolarHBondContact O-CB 3.28Å; C85-A88 PolarHBondContact O-N 2.83Å; C85-N89 PolarHBondContact O-N 3.32Å
86	T	84.6	Confident	84.4	Confident	55 Å²	55	53.7 Å²	53.7	34%	0.337	27%	0.274	S	S	.	.	H	α-helix	trans	-63.1	-39.7	177.3	-51.9	0	0	0	0	111.5	P59 E82 A83 Y84 L90	P59-T86 HydrophobicContact CB-CG2 4.44Å; E82-T86 PolarHBondContact O-N 2.84Å; E82-T86 PolarHBondContact O-OG1 3.21Å; A83-T86 WeakPolarHBondContact O-CB 3.4Å; A83-T86 PolarHBondContact O-N 3.25Å; Y84-T86 VanDerWaalsContact C-N 3.29Å; Y84-T86 PolarHBondContact O-N 3.46Å; T86-L90 WeakPolarHBondContact O-CG 3.47Å
87	A	85.8	Confident	84.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68.6	-34.7	173.2	0	0	0	0	0	113.4	R61 C64 L65 A83 Y84 C85 L90 G91 L93	R61-A87 HydrophobicContact CG-CB 4.2Å; C64-A87 HydrophobicContact CB-CB 3.92Å; L65-A87 HydrophobicContact CD2-CB 3.68Å; L65-A87 HydrophobicContact CG-CB 3.72Å; A83-A87 PolarHBondContact O-N 2.87Å; Y84-A87 PolarHBondContact O-N 3.42Å; C85-A87 VanDerWaalsContact C-N 3.33Å; C85-A87 PolarHBondContact O-N 2.96Å; A87-L90 PolarHBondContact O-N 3.05Å; A87-G91 PolarHBondContact O-N 2.95Å; A87-L93 HydrophobicContact CB-CD2 3.99Å
88	A	84.8	Confident	84.8	Confident	9 Å²	9	48.3 Å²	48.3	7%	0.074	25%	0.252	C	S	.	.	H	α-helix	trans	-65.9	-41.9	178.3	0	0	0	0	0	112.2	Y84 C85 L90 G91 L93 F330 F334	Y84-A88 WeakPolarHBondContact O-CB 3.29Å; Y84-A88 PolarHBondContact O-N 3.44Å; C85-A88 WeakPolarHBondContact O-CB 3.28Å; C85-A88 PolarHBondContact O-N 2.83Å; A88-L90 PolarHBondContact O-N 2.69Å; A88-G91 CarbonylContact O-C 3.58Å; A88-G91 PolarHBondContact O-N 3.24Å; A88-L93 HydrophobicContact CB-CD1 4.03Å; A88-L93 HydrophobicContact CB-CD2 4.34Å; A88-L93 HydrophobicContact CB-CG 3.81Å; A88-F330 HydrophobicContact CB-CB 4.4Å; A88-F330 HydrophobicContact CB-CD1 4.49Å; A88-F334 HydrophobicContact CB-CD2 4.33Å; A88-F334 HydrophobicContact CB-CE2 3.66Å
89	N	83.6	Confident	85.2	Confident	104 Å²	104	46.6 Å²	46.6	56%	0.556	24%	0.239	S	C	*	.	H	α-helix	trans	-55.1	-31.2	173.1	-75.1	-24.1	0	0	0	113.1	C85 F334	C85-N89 PolarHBondContact O-N 3.32Å; N89-F334 VanDerWaalsContact OD1-CD1 3.28Å; N89-F334 WeakPolarHBondContact OD1-CD1 3.29Å; N89-F334 WeakPolarHBondContact OD1-CE1 3.06Å; N89-F334 VanDerWaalsContact OD1-CZ 3.29Å; N89-F334 WeakPolarHBondContact OD1-CZ 3.07Å
90	L	84	Confident	85.3	Confident	79 Å²	79	44.3 Å²	44.3	41%	0.414	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-7.8	-179.7	-61.5	166.8	0	0	0	113.1	P59 R61 T86 A87 A88	P59-L90 HydrophobicContact CB-CD1 4.24Å; P59-L90 HydrophobicContact CG-CD1 4.15Å; P59-L90 HydrophobicContact CG-CD2 4.38Å; P59-L90 WeakPolarHBondContact O-CD1 3.37Å; R61-L90 HydrophobicContact CB-CB 3.97Å; R61-L90 HydrophobicContact CB-CD1 4.03Å; R61-L90 HydrophobicContact CG-CB 4.16Å; T86-L90 WeakPolarHBondContact O-CG 3.47Å; A87-L90 PolarHBondContact O-N 3.05Å; A88-L90 PolarHBondContact O-N 2.69Å
91	G	82.3	Confident	85.4	Confident	28 Å²	28	44.3 Å²	44.3	29%	0.289	23%	0.23	S	C	.	.	S	Bend	trans	155.2	128.2	177.1	0	0	0	0	0	112.6	R61 A87 A88 L93	R61-G91 PolarHBondContact NE-O 2.8Å; R61-G91 PolarHBondContact NH2-O 2.97Å; A87-G91 PolarHBondContact O-N 2.95Å; A88-G91 CarbonylContact O-C 3.58Å; A88-G91 PolarHBondContact O-N 3.24Å; G91-L93 PolarHBondContact O-N 3.39Å
92	K	83	Confident	85.5	Confident	129 Å²	129	42.4 Å²	42.4	56%	0.561	22%	0.22	S	C	*	.			trans	-34.6	120.6	-178.1	-168.5	152.3	-176.7	141.6	0	112.9	R61 S331 E335	R61-K92 PolarHBondContact NH2-O 3.29Å; R61-K92 VanDerWaalsContact NH2-O 3.08Å; K92-S331 WeakPolarHBondContact CE-OG 3Å; K92-S331 WeakPolarHBondContact CG-OG 3.32Å; K92-S331 PolarHBondContact NZ-OG 3.3Å; K92-E335 IonicContact NZ-OE1 3.29Å; K92-E335 PolarHBondContact NZ-OE1 2.94Å
93	L	85.8	Confident	85.7	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.01	21%	0.21	C	C	.	.			trans	-67.8	139	-179.4	-61.3	-174	0	0	0	110.7	L65 Y84 A87 A88 G91 L98 S327 F330	L65-L93 HydrophobicContact CD2-CD2 3.98Å; Y84-L93 HydrophobicContact CD1-CD1 4.36Å; A87-L93 HydrophobicContact CB-CD2 3.99Å; A88-L93 HydrophobicContact CB-CD1 4.03Å; A88-L93 HydrophobicContact CB-CD2 4.34Å; A88-L93 HydrophobicContact CB-CG 3.81Å; G91-L93 PolarHBondContact O-N 3.39Å; L93-L98 HydrophobicContact CD1-CD2 4.08Å; L93-S327 WeakPolarHBondContact O-CB 3.31Å; L93-S327 PolarHBondContact O-OG 3.35Å; L93-F330 HydrophobicContact CD1-CB 4.24Å; L93-F330 HydrophobicContact CD1-CD1 4.36Å; L93-F330 HydrophobicContact CD1-CD2 3.7Å; L93-F330 HydrophobicContact CD1-CE2 4.05Å; L93-F330 HydrophobicContact CD1-CG 3.88Å
94	R	86.2	Confident	85.7	Confident	126 Å²	126	40.2 Å²	40.2	48%	0.475	21%	0.208	S	C	.	.			trans	-98.3	151.6	178.8	-57	177.2	-71.7	156.9	1.6	110.4	E96 E97	R94-E96 WeakPolarHBondContact CB-OE2 3.48Å; R94-E96 PolarHBondContact O-N 3.36Å; R94-E97 HydrophobicContact CB-CG 4.18Å; R94-E97 IonicContact CZ-OE1 2.76Å; R94-E97 VanDerWaalsContact CZ-OE1 3.25Å; R94-E97 PolarHBondContact N-OE2 3.18Å; R94-E97 IonicContact NE-OE1 3.46Å; R94-E97 PolarHBondContact NE-OE1 3.02Å; R94-E97 IonicContact NE-OE2 2.71Å; R94-E97 IonicContact NH2-OE1 3.6Å; R94-E97 PolarHBondContact NH2-OE1 3.18Å; R94-E97 WeakPolarHBondContact O-CB 3.12Å; R94-E97 PolarHBondContact O-N 3.04Å
95	P	86.6	Confident	85.8	Confident	24 Å²	24	41 Å²	41	16%	0.156	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-54.6	-38.4	-179.4	-26.3	35.4	0	0	0	113.1	E97 L98 L320 Q323 K324	P95-E97 PolarHBondContact O-N 3.47Å; P95-L98 PolarHBondContact O-N 3.13Å; P95-L98 VanDerWaalsContact O-N 3.14Å; P95-L320 HydrophobicContact CB-CD1 4.15Å; P95-Q323 HydrophobicContact CB-CB 3.82Å; P95-Q323 WeakPolarHBondContact O-CB 3.37Å; P95-Q323 VanDerWaalsContact O-CD 3.32Å; P95-Q323 WeakPolarHBondContact O-CG 3.35Å; P95-Q323 PolarHBondContact O-NE2 3.3Å; P95-K324 HydrophobicContact CB-CG 4.21Å; P95-K324 HydrophobicContact CG-CG 3.78Å
96	E	87	Confident	85.9	Confident	117 Å²	117	39.9 Å²	39.9	55%	0.547	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-64.7	-20	-178.7	-55.6	71.1	-149.4	0	0	112.9	R94 P99	R94-E96 WeakPolarHBondContact CB-OE2 3.48Å; R94-E96 PolarHBondContact O-N 3.36Å; E96-P99 WeakPolarHBondContact O-CD 3.44Å
97	E	87.4	Confident	85.9	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.019	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-88.4	-5.8	-179.6	-60.1	170.9	152.3	0	0	112.7	H15 R61 L65 R94 P95	H15-E97 WeakPolarHBondContact CE1-CA 3.45Å; H15-E97 WeakPolarHBondContact CE1-CB 3.48Å; H15-E97 PolarHBondContact CE1-O 3.25Å; R61-E97 IonicContact CZ-OE1 2.65Å; R61-E97 IonicContact CZ-OE2 2.94Å; R61-E97 IonicContact NH1-OE1 3.86Å; R61-E97 PolarHBondContact NH1-OE1 3.29Å; R61-E97 IonicContact NH1-OE2 2.77Å; R61-E97 IonicContact NH2-OE1 2.66Å; R61-E97 PolarHBondContact NH2-OE1 3.46Å; R61-E97 IonicContact NH2-OE2 3.56Å; R61-E97 PolarHBondContact NH2-OE2 2.9Å; L65-E97 HydrophobicContact CD1-CB 4.49Å; L65-E97 HydrophobicContact CD1-CG 4.47Å; R94-E97 HydrophobicContact CB-CG 4.18Å; R94-E97 IonicContact CZ-OE1 2.76Å; R94-E97 VanDerWaalsContact CZ-OE1 3.25Å; R94-E97 PolarHBondContact N-OE2 3.18Å; R94-E97 IonicContact NE-OE1 3.46Å; R94-E97 PolarHBondContact NE-OE1 3.02Å; R94-E97 IonicContact NE-OE2 2.71Å; R94-E97 IonicContact NH2-OE1 3.6Å; R94-E97 PolarHBondContact NH2-OE1 3.18Å; R94-E97 WeakPolarHBondContact O-CB 3.12Å; R94-E97 PolarHBondContact O-N 3.04Å; P95-E97 PolarHBondContact O-N 3.47Å
98	L	88.5	Confident	85.8	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.			trans	-107.9	4.4	-175	-64.6	169.6	0	0	0	118	Y84 L93 P95 V100 L101 V102 Q323 L326 F330	Y84-L98 HydrophobicContact CD1-CD2 3.96Å; Y84-L98 HydrophobicContact CE1-CD2 4.11Å; L93-L98 HydrophobicContact CD1-CD2 4.08Å; P95-L98 PolarHBondContact O-N 3.13Å; P95-L98 VanDerWaalsContact O-N 3.14Å; L98-V100 VanDerWaalsContact C-N 3.35Å; L98-V100 PolarHBondContact O-N 3.31Å; L98-L101 HydrophobicContact CD2-CD2 4.22Å; L98-L101 PolarHBondContact O-N 2.81Å; L98-V102 WeakPolarHBondContact O-CG2 3.22Å; L98-V102 PolarHBondContact O-N 3.3Å; L98-V102 VanDerWaalsContact O-N 3.14Å; L98-Q323 HydrophobicContact CB-CB 4.43Å; L98-Q323 HydrophobicContact CB-CG 4.14Å; L98-Q323 WeakPolarHBondContact CD1-O 3.37Å; L98-L326 HydrophobicContact CD1-CB 4.13Å; L98-L326 HydrophobicContact CD1-CD2 4.27Å; L98-L326 HydrophobicContact CD1-CG 4.07Å; L98-L326 HydrophobicContact CD2-CD2 4.3Å; L98-F330 HydrophobicContact CD2-CD2 4.42Å; L98-F330 HydrophobicContact CD2-CE2 4.03Å
99	P	88.5	Confident	85.6	Confident	33 Å²	33	44 Å²	44	21%	0.214	22%	0.218	C	C	.	.	H	α-helix	trans	-65.9	-34.9	-170.3	25.9	-33	0	0	0	113.4	E96 E103	E96-P99 WeakPolarHBondContact O-CD 3.44Å; P99-E103 VanDerWaalsContact O-CB 3.22Å; P99-E103 WeakPolarHBondContact O-CB 3.19Å; P99-E103 PolarHBondContact O-N 2.64Å
100	V	87	Confident	85.5	Confident	25 Å²	25	40.3 Å²	40.3	15%	0.152	20%	0.196	C	C	.	.	H	α-helix	trans	-72.1	-38.8	-176.9	176.4	0	0	0	0	111.5	D69 A72 R73 L98 T104	D69-V100 HydrophobicContact CB-CG1 4.43Å; D69-V100 WeakPolarHBondContact OD2-CG2 3.46Å; A72-V100 HydrophobicContact CB-CG1 4.33Å; R73-V100 HydrophobicContact CG-CG1 3.86Å; L98-V100 VanDerWaalsContact C-N 3.35Å; L98-V100 PolarHBondContact O-N 3.31Å; V100-T104 WeakPolarHBondContact O-CB 3.2Å; V100-T104 PolarHBondContact O-N 3.17Å; V100-T104 PolarHBondContact O-OG1 3.4Å
101	L	86.1	Confident	85.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.9	-52.9	172.8	179.9	61.8	0	0	0	111.3	L81 Y84 L98 E103 T104 I105 L326 F330	L81-L101 HydrophobicContact CD2-CD1 4.13Å; L81-L101 HydrophobicContact CD2-CD2 3.85Å; Y84-L101 HydrophobicContact CD2-CB 4.48Å; Y84-L101 HydrophobicContact CD2-CD1 4.3Å; Y84-L101 HydrophobicContact CD2-CD2 3.69Å; Y84-L101 HydrophobicContact CD2-CG 4.38Å; Y84-L101 HydrophobicContact CE2-CB 3.77Å; Y84-L101 HydrophobicContact CE2-CD1 4.02Å; Y84-L101 HydrophobicContact CE2-CD2 3.85Å; Y84-L101 HydrophobicContact CE2-CG 4.09Å; Y84-L101 HydrophobicContact CG-CD2 4.18Å; L98-L101 HydrophobicContact CD2-CD2 4.22Å; L98-L101 PolarHBondContact O-N 2.81Å; L101-E103 PolarHBondContact O-N 3.5Å; L101-T104 PolarHBondContact O-N 2.96Å; L101-I105 HydrophobicContact CD1-CD1 3.82Å; L101-I105 HydrophobicContact CD1-CG1 4.27Å; L101-I105 HydrophobicContact CG-CD1 3.89Å; L101-I105 WeakPolarHBondContact O-CG1 3.09Å; L101-I105 PolarHBondContact O-N 2.99Å; L101-L326 HydrophobicContact CD2-CD2 3.84Å; L101-L326 HydrophobicContact CG-CD2 4.39Å; L101-F330 HydrophobicContact CD2-CE2 4.25Å; L101-F330 HydrophobicContact CD2-CZ 4.36Å
102	V	87.3	Confident	84.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.5	-46.2	-178.3	170.4	0	0	0	0	111.5	L98 I105 A106 F306 L309 K319 A322 Q323 L326	L98-V102 WeakPolarHBondContact O-CG2 3.22Å; L98-V102 PolarHBondContact O-N 3.3Å; L98-V102 VanDerWaalsContact O-N 3.14Å; V102-I105 PolarHBondContact O-N 3.14Å; V102-A106 WeakPolarHBondContact O-CB 3.02Å; V102-A106 PolarHBondContact O-N 3.42Å; V102-A106 VanDerWaalsContact O-N 3.08Å; V102-F306 HydrophobicContact CB-CE1 4.31Å; V102-F306 HydrophobicContact CG1-CD1 4.4Å; V102-F306 HydrophobicContact CG1-CE1 4.12Å; V102-F306 HydrophobicContact CG2-CE1 4.17Å; V102-L309 HydrophobicContact CG1-CD1 3.6Å; V102-K319 HydrophobicContact CG1-CG 4.14Å; V102-A322 HydrophobicContact CG1-CB 4.06Å; V102-Q323 HydrophobicContact CG2-CG 3.93Å; V102-L326 HydrophobicContact CG2-CD2 3.74Å
103	E	87.6	Confident	84.2	Confident	77 Å²	77	43.6 Å²	43.6	36%	0.36	20%	0.203	S	C	.	.	H	α-helix	trans	-67.8	-36.9	179	-166.7	-175.7	128.5	0	0	112.5	P99 L101 R107 K319	P99-E103 VanDerWaalsContact O-CB 3.22Å; P99-E103 WeakPolarHBondContact O-CB 3.19Å; P99-E103 PolarHBondContact O-N 2.64Å; L101-E103 PolarHBondContact O-N 3.5Å; E103-R107 WeakPolarHBondContact O-CB 3.18Å; E103-R107 PolarHBondContact O-N 3.03Å; E103-R107 IonicContact OE1-CZ 3.51Å; E103-R107 IonicContact OE1-NH2 2.02Å; E103-R107 PolarHBondContact OE1-NH2 3.44Å; E103-K319 IonicContact OE2-NZ 2.67Å; E103-K319 PolarHBondContact OE2-NZ 3.43Å
104	T	86.3	Confident	83.4	Confident	4 Å²	4	46 Å²	46	3%	0.025	22%	0.216	C	C	.	.	H	α-helix	trans	-66	-42.5	176.7	-65.3	0	0	0	0	111.9	A72 I77 V100 L101 R107 T108	A72-T104 HydrophobicContact CB-CG2 4.16Å; A72-T104 WeakPolarHBondContact O-CG2 3.3Å; I77-T104 HydrophobicContact CD1-CG2 4.18Å; I77-T104 HydrophobicContact CG1-CG2 4.09Å; V100-T104 WeakPolarHBondContact O-CB 3.2Å; V100-T104 PolarHBondContact O-N 3.17Å; V100-T104 PolarHBondContact O-OG1 3.4Å; L101-T104 PolarHBondContact O-N 2.96Å; T104-R107 PolarHBondContact O-N 2.86Å; T104-T108 VanDerWaalsContact O-CB 3.3Å; T104-T108 WeakPolarHBondContact O-CB 3.37Å; T104-T108 PolarHBondContact O-N 2.73Å; T104-T108 PolarHBondContact O-OG1 3.43Å
105	I	85.8	Confident	82.5	Confident	16 Å²	16	43 Å²	43	8%	0.082	22%	0.224	C	C	.	.	H	α-helix	trans	-62.3	-50.3	176.2	-67.1	166.5	0	0	0	109.7	I77 L101 V102 R107 T108 L109 F306	I77-I105 HydrophobicContact CD1-CG1 4.37Å; I77-I105 HydrophobicContact CG2-CG1 4.12Å; L101-I105 HydrophobicContact CD1-CD1 3.82Å; L101-I105 HydrophobicContact CD1-CG1 4.27Å; L101-I105 HydrophobicContact CG-CD1 3.89Å; L101-I105 WeakPolarHBondContact O-CG1 3.09Å; L101-I105 PolarHBondContact O-N 2.99Å; V102-I105 PolarHBondContact O-N 3.14Å; I105-R107 PolarHBondContact O-N 3.4Å; I105-T108 PolarHBondContact O-N 2.92Å; I105-T108 VanDerWaalsContact O-N 3.14Å; I105-L109 HydrophobicContact CG2-CD1 4.06Å; I105-L109 WeakPolarHBondContact O-CG 3.33Å; I105-L109 PolarHBondContact O-N 2.69Å; I105-F306 HydrophobicContact CB-CD1 4.16Å; I105-F306 HydrophobicContact CB-CE1 4.18Å; I105-F306 HydrophobicContact CB-CG 4.49Å; I105-F306 HydrophobicContact CD1-CE1 4.06Å; I105-F306 HydrophobicContact CD1-CE2 4.22Å; I105-F306 HydrophobicContact CD1-CZ 3.73Å; I105-F306 HydrophobicContact CG2-CB 4.13Å; I105-F306 HydrophobicContact CG2-CD1 3.8Å; I105-F306 HydrophobicContact CG2-CD2 3.73Å; I105-F306 HydrophobicContact CG2-CE1 4.09Å; I105-F306 HydrophobicContact CG2-CE2 4.02Å; I105-F306 HydrophobicContact CG2-CG 3.63Å; I105-F306 HydrophobicContact CG2-CZ 4.2Å
106	A	85.9	Confident	81.7	Confident	5 Å²	5	44.8 Å²	44.8	4%	0.041	23%	0.232	C	C	.	.	H	α-helix	trans	-58.3	-45.5	177.5	0	0	0	0	0	112.8	V102 T108 L109 R110 L309 A310	V102-A106 WeakPolarHBondContact O-CB 3.02Å; V102-A106 PolarHBondContact O-N 3.42Å; V102-A106 VanDerWaalsContact O-N 3.08Å; A106-T108 VanDerWaalsContact C-N 3.3Å; A106-T108 PolarHBondContact O-N 3.41Å; A106-L109 PolarHBondContact O-N 3.05Å; A106-R110 WeakPolarHBondContact O-CB 3.4Å; A106-R110 PolarHBondContact O-N 3.21Å; A106-L309 HydrophobicContact CB-CB 3.57Å; A106-A310 WeakPolarHBondContact O-CB 3.12Å
107	R	84.5	Confident	80.6	Confident	102 Å²	102	43.9 Å²	43.9	39%	0.385	24%	0.236	S	C	.	.	H	α-helix	trans	-62.5	-37	176.3	-165.1	-170.8	-53	116.6	-2.3	111.9	E103 T104 I105 L111	E103-R107 WeakPolarHBondContact O-CB 3.18Å; E103-R107 PolarHBondContact O-N 3.03Å; E103-R107 IonicContact OE1-CZ 3.51Å; E103-R107 IonicContact OE1-NH2 2.02Å; E103-R107 PolarHBondContact OE1-NH2 3.44Å; T104-R107 PolarHBondContact O-N 2.86Å; I105-R107 PolarHBondContact O-N 3.4Å; R107-L111 HydrophobicContact CG-CD1 4.21Å; R107-L111 WeakPolarHBondContact O-CG 3.46Å; R107-L111 PolarHBondContact O-N 2.96Å
108	T	83.3	Confident	79.1	Confident	35 Å²	35	47.5 Å²	47.5	22%	0.215	26%	0.259	C	S	.	.	H	α-helix	trans	-70.1	-43.5	179	-59.5	0	0	0	0	111.6	I77 T104 I105 A106 L111 K112	I77-T108 HydrophobicContact CD1-CG2 4.06Å; T104-T108 VanDerWaalsContact O-CB 3.3Å; T104-T108 WeakPolarHBondContact O-CB 3.37Å; T104-T108 PolarHBondContact O-N 2.73Å; T104-T108 PolarHBondContact O-OG1 3.43Å; I105-T108 PolarHBondContact O-N 2.92Å; I105-T108 VanDerWaalsContact O-N 3.14Å; A106-T108 VanDerWaalsContact C-N 3.3Å; A106-T108 PolarHBondContact O-N 3.41Å; T108-L111 PolarHBondContact O-N 3.14Å; T108-K112 HydrophobicContact CG2-CD 3.78Å; T108-K112 HydrophobicContact CG2-CG 4.33Å; T108-K112 WeakPolarHBondContact O-CB 3.23Å; T108-K112 PolarHBondContact O-N 3.48Å
109	L	81.3	Confident	77.5	Confident	14 Å²	14	51.9 Å²	51.9	7%	0.073	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-43.4	174	-69.4	166.8	0	0	0	111.7	I105 A106 L111 E113 L114 F306 A310 L361 L364	I105-L109 HydrophobicContact CG2-CD1 4.06Å; I105-L109 WeakPolarHBondContact O-CG 3.33Å; I105-L109 PolarHBondContact O-N 2.69Å; A106-L109 PolarHBondContact O-N 3.05Å; L109-L111 VanDerWaalsContact C-N 3.27Å; L109-L111 PolarHBondContact O-N 3.38Å; L109-E113 HydrophobicContact CD2-CG 3.99Å; L109-E113 WeakPolarHBondContact O-CB 3.36Å; L109-E113 PolarHBondContact O-N 3.36Å; L109-L114 PolarHBondContact O-N 3.41Å; L109-F306 HydrophobicContact CD1-CB 3.61Å; L109-A310 HydrophobicContact CB-CB 4.04Å; L109-L361 HydrophobicContact CD2-CD2 4.34Å; L109-L364 HydrophobicContact CD2-CD1 4.21Å
110	R	81.8	Confident	75.2	Confident	27 Å²	27	57.6 Å²	57.6	10%	0.102	31%	0.309	C	S	.	.	H	α-helix	trans	-55.1	-42.7	176.6	-173.6	-178	179.5	91.4	-1.4	112.4	A106 G115 L116 P117 A310 L311	A106-R110 WeakPolarHBondContact O-CB 3.4Å; A106-R110 PolarHBondContact O-N 3.21Å; R110-G115 PolarHBondContact O-N 2.97Å; R110-L116 HydrophobicContact CG-CB 3.73Å; R110-L116 PolarHBondContact O-N 2.74Å; R110-P117 PolarHBondContact NE-O 2.75Å; R110-P117 PolarHBondContact NH2-O 3.14Å; R110-A310 HydrophobicContact CB-CB 4.09Å; R110-A310 VanDerWaalsContact CD-O 3.28Å; R110-A310 WeakPolarHBondContact CD-O 3.49Å; R110-A310 VanDerWaalsContact CG-O 3.27Å; R110-A310 WeakPolarHBondContact CG-O 3.32Å; R110-A310 PolarHBondContact NH1-O 3.19Å; R110-L311 PolarHBondContact NH1-O 2.94Å
111	L	80.4	Confident	72.7	Confident	78 Å²	78	63.2 Å²	63.2	41%	0.408	34%	0.338	S	S	.	.	H	α-helix	trans	-85.8	-37.9	-174.8	-68.2	169.9	0	0	0	114.1	R107 T108 L109 V118	R107-L111 HydrophobicContact CG-CD1 4.21Å; R107-L111 WeakPolarHBondContact O-CG 3.46Å; R107-L111 PolarHBondContact O-N 2.96Å; T108-L111 PolarHBondContact O-N 3.14Å; L109-L111 VanDerWaalsContact C-N 3.27Å; L109-L111 PolarHBondContact O-N 3.38Å; L111-V118 HydrophobicContact CD1-CG2 4.19Å; L111-V118 HydrophobicContact CD2-CG2 3.67Å; L111-V118 HydrophobicContact CG-CG2 4.49Å
112	K	72.5	Confident	70.4	Confident	152 Å²	152	66.6 Å²	66.6	66%	0.661	37%	0.373	S	S	*	.	H	α-helix	trans	-90.1	-41.1	-175	-64.7	-173.8	-178.7	176.1	0	113.4	T108	T108-K112 HydrophobicContact CG2-CD 3.78Å; T108-K112 HydrophobicContact CG2-CG 4.33Å; T108-K112 WeakPolarHBondContact O-CB 3.23Å; T108-K112 PolarHBondContact O-N 3.48Å
113	E	68.1	Low	67.7	Low	74 Å²	74	75.6 Å²	75.6	35%	0.346	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-42.2	-173.3	-52.8	-51.6	107.7	0	0	112.4	L109 L361 L364	L109-E113 HydrophobicContact CD2-CG 3.99Å; L109-E113 WeakPolarHBondContact O-CB 3.36Å; L109-E113 PolarHBondContact O-N 3.36Å; E113-L361 HydrophobicContact CG-CD2 3.64Å; E113-L361 WeakPolarHBondContact OE1-CD2 3.4Å; E113-L364 HydrophobicContact CB-CD1 4.49Å; E113-L364 HydrophobicContact CG-CD1 4.39Å
114	L	69.2	Low	64.8	Low	53 Å²	53	78.5 Å²	78.5	28%	0.277	44%	0.438	S	S	.	.	S	Bend	trans	-90.9	-14.3	-177.5	-57	178.8	0	0	0	113.8	L109 L116 L307 A310 L311	L109-L114 PolarHBondContact O-N 3.41Å; L114-L116 HydrophobicContact CB-CD1 3.99Å; L114-L116 HydrophobicContact CB-CG 3.96Å; L114-L116 HydrophobicContact CD1-CD1 4.11Å; L114-L116 PolarHBondContact O-N 2.92Å; L114-L116 VanDerWaalsContact O-N 3.12Å; L114-L307 HydrophobicContact CD1-CD1 4.03Å; L114-L307 HydrophobicContact CD2-CD1 4.25Å; L114-A310 HydrophobicContact CD1-CB 3.97Å; L114-L311 HydrophobicContact CD1-CD2 3.81Å; L114-L311 HydrophobicContact CD1-CG 4.15Å
115	G	67.6	Low	62.1	Low	63 Å²	63	88.4 Å²	88.4	65%	0.649	48%	0.481	S	S	*	.			trans	61.2	16.3	-177.5	0	0	0	0	0	114.9	R110	R110-G115 PolarHBondContact O-N 2.97Å
116	L	70.1	Confident	59.4	Low	61 Å²	61	93 Å²	93	32%	0.319	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-83.2	137.1	-173.6	-69.4	173.6	0	0	0	111	R110 L114 L311	R110-L116 HydrophobicContact CG-CB 3.73Å; R110-L116 PolarHBondContact O-N 2.74Å; L114-L116 HydrophobicContact CB-CD1 3.99Å; L114-L116 HydrophobicContact CB-CG 3.96Å; L114-L116 HydrophobicContact CD1-CD1 4.11Å; L114-L116 PolarHBondContact O-N 2.92Å; L114-L116 VanDerWaalsContact O-N 3.12Å; L116-L311 HydrophobicContact CD1-CD2 4.17Å
117	P	62.5	Low	56.5	Low	98 Å²	98	96.3 Å²	96.3	64%	0.636	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-64.2	155	-176.3	25.2	-34.1	0	0	0	113.2	R110 I119	R110-P117 PolarHBondContact NE-O 2.75Å; R110-P117 PolarHBondContact NH2-O 3.14Å; P117-I119 PolarHBondContact O-N 2.63Å
118	V	57.2	Low	53.8	Low	81 Å²	81	97.4 Å²	97.4	49%	0.491	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-63.1	123.6	172.8	-178.3	0	0	0	0	109.3	L111 L120	L111-V118 HydrophobicContact CD1-CG2 4.19Å; L111-V118 HydrophobicContact CD2-CG2 3.67Å; L111-V118 HydrophobicContact CG-CG2 4.49Å; V118-L120 HydrophobicContact CG1-CD2 4.06Å; V118-L120 HydrophobicContact CG1-CG 4.29Å; V118-L120 PolarHBondContact O-N 3.41Å
119	I	55.6	Low	51	Low	92 Å²	92	99.1 Å²	99.1	47%	0.472	60%	0.597	S	S	.	*			trans	-80.4	111.7	162.7	-58.2	175.4	0	0	0	106.1	P117	P117-I119 PolarHBondContact O-N 2.63Å
120	L	39	Very low	48.5	Very low	152 Å²	152	108 Å²	108	80%	0.796	64%	0.639	S	S	*	*			trans	-80.8	125.8	172.4	-71.5	171	0	0	0	108.8	V118 G122	V118-L120 HydrophobicContact CG1-CD2 4.06Å; V118-L120 HydrophobicContact CG1-CG 4.29Å; V118-L120 PolarHBondContact O-N 3.41Å; L120-G122 PolarHBondContact O-N 2.74Å
121	N	35.2	Very low	45.9	Very low	143 Å²	143	115.2 Å²	115.2	77%	0.765	68%	0.679	S	S	*	*	S	Bend	trans	-62.1	130.4	-174.5	-76.6	-1.9	0	0	0	112.4
122	G	36.9	Very low	43.2	Very low	71 Å²	71	114.9 Å²	114.9	73%	0.732	69%	0.694	S	S	*	*	S	Bend	trans	98.8	48.1	149.1	0	0	0	0	0	118.6	L120	L120-G122 PolarHBondContact O-N 2.74Å
123	Q	30.8	Very low	41	Very low	189 Å²	189	112 Å²	112	88%	0.883	70%	0.699	S	S	*	*			trans	-153.8	75.2	151.3	-129	169	91.9	0	0	116.8
124	T	26.2	Very low	39.2	Very low	138 Å²	138	117.5 Å²	117.5	85%	0.847	72%	0.724	S	S	*	*			trans	-128.7	112.6	155.6	39.9	0	0	0	0	109.6	S126	T124-S126 PolarHBondContact O-N 2.85Å
125	K	31.2	Very low	37.3	Very low	212 Å²	212	122.2 Å²	122.2	92%	0.922	75%	0.75	S	S	*	*			trans	-82.8	94	172.3	-75	-176.2	177.2	178.7	0	109.7
126	S	28.7	Very low	35.6	Very low	113 Å²	113	124.4 Å²	124.4	79%	0.79	75%	0.746	S	S	*	*			trans	-84.8	155.4	157.3	49.6	0	0	0	0	110.4	T124	T124-S126 PolarHBondContact O-N 2.85Å
127	G	25.4	Very low	33.9	Very low	75 Å²	75	124.1 Å²	124.1	77%	0.773	76%	0.758	S	S	*	*			trans	-73.3	160.3	-172	0	0	0	0	0	114.7	G129	G127-G129 PolarHBondContact O-N 3.27Å
128	S	26.3	Very low	32.9	Very low	125 Å²	125	124.4 Å²	124.4	87%	0.874	75%	0.751	S	S	*	*			trans	-64.8	113.1	-177.4	52.5	0	0	0	0	114.5
129	G	25.8	Very low	31.7	Very low	70 Å²	70	124.7 Å²	124.7	72%	0.722	76%	0.756	S	S	*	*				63.9	121.3	121.2	0	0	0	0	0	120.9	G127	G127-G129 PolarHBondContact O-N 3.27Å
130	Q	27.4	Very low	31.4	Very low	202 Å²	202	122.9 Å²	122.9	94%	0.944	75%	0.745	S	S	*	*				-158.2	140.6	114.6	-107.6	174.8	17.1	0	0	110.2
131	D	27	Very low	31.7	Very low	177 Å²	177	123.5 Å²	123.5	95%	0.947	74%	0.744	S	S	*	*			trans	-79.5	134.5	178.5	-70.8	-70.5	0	0	0	112
132	G	23.6	Very low	32	Very low	71 Å²	71	124.9 Å²	124.9	73%	0.732	75%	0.751	S	S	*	*			trans	-169.1	100.6	179.7	0	0	0	0	0	112.8
133	A	27.2	Very low	32.9	Very low	91 Å²	91	126.9 Å²	126.9	75%	0.752	74%	0.742	S	S	*	*	S	Bend	trans	11.9	121	166.9	0	0	0	0	0	120.2
134	H	30.5	Very low	34.5	Very low	191 Å²	191	120.8 Å²	120.8	88%	0.884	72%	0.724	S	S	*	*			trans	55.5	76.6	153.3	-69.8	-79.9	0	0	0	118.6
135	N	29.7	Very low	37	Very low	152 Å²	152	116.4 Å²	116.4	81%	0.813	70%	0.695	S	S	*	*			trans	-150.2	112	131.5	-142.2	-14.6	0	0	0	110.5	G137	N135-G137 PolarHBondContact O-N 3.11Å; N135-G137 VanDerWaalsContact O-N 3.15Å
136	D	31.6	Very low	39.7	Very low	109 Å²	109	107.4 Å²	107.4	58%	0.583	66%	0.657	S	S	*	*			trans	-73.6	105.1	175.9	-81	-43.7	0	0	0	108.7	E138 K317	D136-E138 PolarHBondContact O-N 3.43Å; D136-K317 IonicContact OD1-NZ 3.57Å; D136-K317 PolarHBondContact OD1-NZ 3.03Å; D136-K317 IonicContact OD2-NZ 3.93Å; D136-K317 PolarHBondContact OD2-NZ 3.15Å
137	G	34.4	Very low	42.6	Very low	55 Å²	55	104 Å²	104	57%	0.567	63%	0.63	S	S	*	*			trans	-50.5	127.2	-161.8	0	0	0	0	0	116	N135 C139	N135-G137 PolarHBondContact O-N 3.11Å; N135-G137 VanDerWaalsContact O-N 3.15Å; G137-C139 PolarHBondContact O-N 2.94Å
138	E	41.2	Very low	45.8	Very low	103 Å²	103	100.6 Å²	100.6	48%	0.481	59%	0.594	S	S	.	*			trans	-59.1	97.9	169.5	-68.6	-170.6	151.5	0	0	110.3	D136 E140 K154 R249	D136-E138 PolarHBondContact O-N 3.43Å; E138-E140 PolarHBondContact O-N 3.33Å; E138-E140 VanDerWaalsContact O-N 3.09Å; E138-K154 WeakPolarHBondContact OE2-CE 3.47Å; E138-K154 IonicContact OE2-NZ 2.69Å; E138-K154 PolarHBondContact OE2-NZ 2.91Å; E138-R249 IonicContact OE1-CZ 3.92Å; E138-R249 IonicContact OE1-NH1 3.18Å; E138-R249 PolarHBondContact OE1-NH1 2.93Å; E138-R249 VanDerWaalsContact OE1-NH1 3.16Å; E138-R249 IonicContact OE1-NH2 2.85Å; E138-R249 PolarHBondContact OE1-NH2 3.39Å; E138-R249 IonicContact OE2-NH2 3.41Å
139	C	33	Very low	49	Very low	88 Å²	88	95.1 Å²	95.1	60%	0.595	56%	0.556	S	S	*	*			trans	-80.7	60.1	156.1	-59.8	0	0	0	0	109	G137 K312	G137-C139 PolarHBondContact O-N 2.94Å; C139-K312 PolarHBondContact SG-NZ 3.07Å
140	E	48.4	Very low	52.2	Low	53 Å²	53	91.8 Å²	91.8	25%	0.248	52%	0.521	C	S	.	.			trans	-92.2	137.3	156.1	-61.9	-161.4	155.7	0	0	107.1	E138 R249 W281	E138-E140 PolarHBondContact O-N 3.33Å; E138-E140 VanDerWaalsContact O-N 3.09Å; E140-R249 IonicContact OE1-NH2 2.69Å; E140-R249 IonicContact OE2-CZ 3.76Å; E140-R249 IonicContact OE2-NE 2.82Å; E140-R249 IonicContact OE2-NH2 2.65Å; E140-R249 PolarHBondContact OE2-NH2 2.91Å; E140-W281 WeakPolarHBondContact OE1-CZ2 3.45Å; E140-W281 PolarHBondContact OE1-NE1 3.36Å
141	E	44.8	Very low	55.1	Low	166 Å²	166	88.7 Å²	88.7	78%	0.776	50%	0.501	S	S	*	.			trans	-60.5	157.2	176.2	-61	172.4	141	0	0	109.6	E143	E141-E143 PolarHBondContact O-N 2.93Å
142	D	42.3	Very low	58.2	Low	171 Å²	171	82.8 Å²	82.8	91%	0.914	47%	0.469	S	S	*	.			trans	-70.8	64.6	172.5	-87.5	-50.7	0	0	0	110.5	A144	D142-A144 PolarHBondContact O-N 2.95Å; D142-A144 VanDerWaalsContact O-N 3.12Å
143	E	55.5	Low	61.3	Low	113 Å²	113	80.6 Å²	80.6	53%	0.528	44%	0.442	S	S	.	.			trans	-54.2	116	161.2	-74.6	-174.9	174.8	0	0	107	E141 L145 K278	E141-E143 PolarHBondContact O-N 2.93Å; E143-L145 VanDerWaalsContact C-N 3.32Å; E143-L145 PolarHBondContact O-N 3.34Å; E143-K278 IonicContact OE1-NZ 3.65Å; E143-K278 PolarHBondContact OE1-NZ 2.82Å; E143-K278 IonicContact OE2-NZ 2.65Å; E143-K278 PolarHBondContact OE2-NZ 2.69Å
144	A	64.8	Low	64.2	Low	62 Å²	62	79.5 Å²	79.5	51%	0.512	42%	0.42	S	S	.	.			trans	-67.2	88	-169.3	0	0	0	0	0	111	D142 D146	D142-A144 PolarHBondContact O-N 2.95Å; D142-A144 VanDerWaalsContact O-N 3.12Å; A144-D146 PolarHBondContact O-N 3.34Å
145	L	78.9	Confident	67.1	Low	45 Å²	45	71 Å²	71	24%	0.236	38%	0.382	C	S	.	.			trans	-45.1	124.7	-173.6	-65.4	175	0	0	0	111.4	E143 R151 K154	E143-L145 VanDerWaalsContact C-N 3.32Å; E143-L145 PolarHBondContact O-N 3.34Å; L145-R151 PolarHBondContact O-NH2 3.36Å; L145-K154 HydrophobicContact CD1-CG 4.18Å; L145-K154 HydrophobicContact CD2-CB 3.97Å; L145-K154 HydrophobicContact CD2-CG 4.07Å
146	D	86.8	Confident	70.1	Confident	23 Å²	23	63.8 Å²	63.8	12%	0.123	34%	0.344	C	S	.	.			trans	-67.4	174.4	-178.2	70.3	35.3	0	0	0	112.7	A144 F148 S149 R466	A144-D146 PolarHBondContact O-N 3.34Å; D146-F148 PolarHBondContact O-N 3.18Å; D146-F148 PolarHBondContact OD1-N 2.96Å; D146-S149 VanDerWaalsContact CG-OG 3.23Å; D146-S149 PolarHBondContact O-N 3.47Å; D146-S149 WeakPolarHBondContact OD1-CB 3.44Å; D146-S149 PolarHBondContact OD1-N 3.09Å; D146-S149 PolarHBondContact OD1-OG 3.49Å; D146-R466 VanDerWaalsContact CG-NH1 3.28Å; D146-R466 IonicContact OD1-NH1 2.72Å; D146-R466 PolarHBondContact OD1-NH1 3.02Å; D146-R466 VanDerWaalsContact OD2-CB 3.28Å; D146-R466 WeakPolarHBondContact OD2-CB 3.31Å; D146-R466 WeakPolarHBondContact OD2-CG 3.05Å; D146-R466 IonicContact OD2-CZ 2.87Å; D146-R466 PolarHBondContact OD2-N 3.46Å; D146-R466 IonicContact OD2-NH1 3.14Å; D146-R466 PolarHBondContact OD2-NH1 3.27Å
147	L	90	Very high	73.1	Confident	43 Å²	43	58.8 Å²	58.8	23%	0.225	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-29.5	-174.8	-175.9	55.7	0	0	0	113.2	L535 E538 V539 Y543	L147-L535 HydrophobicContact CD1-CD1 3.5Å; L147-L535 VanDerWaalsContact CD1-CD1 3.5Å; L147-L535 HydrophobicContact CD2-CD1 4.49Å; L147-L535 HydrophobicContact CG-CD1 3.59Å; L147-L535 WeakPolarHBondContact O-CD1 3.36Å; L147-E538 HydrophobicContact CD1-CB 3.56Å; L147-E538 HydrophobicContact CD1-CG 4.2Å; L147-E538 HydrophobicContact CD2-CB 4.09Å; L147-E538 HydrophobicContact CG-CB 4.48Å; L147-V539 HydrophobicContact CD2-CG2 3.71Å; L147-V539 HydrophobicContact CG-CG2 4.33Å; L147-Y543 HydrophobicContact CD2-CE2 4.34Å
148	F	93.4	Very high	76	Confident	2 Å²	2	57 Å²	57	1%	0.009	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	3.5	-174.9	-54.6	-77.3	0	0	0	112.9	D146 L156 L157 L203 L204 L207 F208 V468 V539 Y543	D146-F148 PolarHBondContact O-N 3.18Å; D146-F148 PolarHBondContact OD1-N 2.96Å; F148-L156 HydrophobicContact CB-CD1 3.99Å; F148-L157 VanDerWaalsContact O-CG 3.31Å; F148-L157 WeakPolarHBondContact O-CG 3.43Å; F148-L157 PolarHBondContact O-N 3.19Å; F148-L203 HydrophobicContact CE1-CD2 4.43Å; F148-L204 HydrophobicContact CB-CD2 3.92Å; F148-L204 HydrophobicContact CD1-CD2 3.68Å; F148-L204 HydrophobicContact CG-CD2 4.13Å; F148-L207 HydrophobicContact CE1-CD1 4.35Å; F148-L207 HydrophobicContact CZ-CD1 4.09Å; F148-F208 HydrophobicContact CB-CE2 3.96Å; F148-F208 HydrophobicContact CD1-CE2 4.08Å; F148-F208 AromaticContact CD2-CE2 3.57Å; F148-F208 HydrophobicContact CD2-CE2 3.57Å; F148-F208 AromaticContact CD2-CZ 3.6Å; F148-F208 HydrophobicContact CD2-CZ 3.6Å; F148-F208 HydrophobicContact CE1-CE2 4.47Å; F148-F208 HydrophobicContact CE2-CE2 4.03Å; F148-F208 AromaticContact CE2-CZ 3.93Å; F148-F208 HydrophobicContact CE2-CZ 3.93Å; F148-F208 AromaticContact CG-CE2 3.59Å; F148-F208 HydrophobicContact CG-CE2 3.59Å; F148-F208 HydrophobicContact CG-CZ 4.11Å; F148-F208 HydrophobicContact CZ-CE2 4.44Å; F148-V468 HydrophobicContact CD2-CG2 4.48Å; F148-V468 HydrophobicContact CE2-CG2 3.62Å; F148-V468 HydrophobicContact CZ-CG2 4.13Å; F148-V539 HydrophobicContact CE1-CG2 3.66Å; F148-V539 HydrophobicContact CZ-CG2 3.84Å; F148-Y543 HydrophobicContact CE2-CE2 4.27Å; F148-Y543 HydrophobicContact CZ-CE2 4.07Å
149	S	92.8	Very high	78.6	Confident	11 Å²	11	56.5 Å²	56.5	8%	0.077	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-85.2	129.4	177.7	-62.8	0	0	0	0	111.9	D146 R151 C155 R466	D146-S149 VanDerWaalsContact CG-OG 3.23Å; D146-S149 PolarHBondContact O-N 3.47Å; D146-S149 WeakPolarHBondContact OD1-CB 3.44Å; D146-S149 PolarHBondContact OD1-N 3.09Å; D146-S149 PolarHBondContact OD1-OG 3.49Å; S149-R151 PolarHBondContact O-N 3.03Å; S149-C155 WeakPolarHBondContact CA-O 3.19Å; S149-R466 PolarHBondContact OG-NH1 2.99Å
150	C	92.9	Very high	81.6	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.264	C	S	.	.			trans	-67.4	122	173.2	-177.6	0	0	0	0	110.7	L152 K154 C155 L157 C170	C150-L152 PolarHBondContact O-N 2.87Å; C150-K154 VanDerWaalsContact O-CA 3.3Å; C150-K154 WeakPolarHBondContact O-CA 3.45Å; C150-K154 PolarHBondContact O-N 3.26Å; C150-C155 PolarHBondContact N-O 3.14Å; C150-L157 HydrophobicContact CB-CD2 3.83Å; C150-L157 HydrophobicContact CB-CG 4.35Å; C150-C170 WeakPolarHBondContact CB-SG 3.29Å; C150-C170 PolarHBondContact SG-N 3.35Å; C150-C170 VanDerWaalsContact SG-N 3.42Å; C150-C170 VanDerWaalsContact SG-SG 3.65Å
151	R	89.6	Confident	83.9	Confident	137 Å²	137	49.9 Å²	49.9	52%	0.517	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	4	179.5	-62	-69	173.8	158.8	-10.8	114.9	L145 S149 F169	L145-R151 PolarHBondContact O-NH2 3.36Å; S149-R151 PolarHBondContact O-N 3.03Å; R151-F169 HydrophobicContact CB-CE1 4.09Å
152	L	90.3	Very high	86.3	Confident	52 Å²	52	43.2 Å²	43.2	27%	0.272	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-58.8	174.8	-65.3	168.1	0	0	0	111.4	C150 F169 C173 V174 V179 T183	C150-L152 PolarHBondContact O-N 2.87Å; L152-F169 HydrophobicContact CD1-CB 4.2Å; L152-F169 HydrophobicContact CD1-CD1 3.61Å; L152-F169 HydrophobicContact CD1-CE1 4.23Å; L152-F169 HydrophobicContact CD1-CG 4.06Å; L152-F169 HydrophobicContact CG-CD1 3.75Å; L152-F169 HydrophobicContact CG-CE1 4.11Å; L152-C173 HydrophobicContact CB-CB 3.98Å; L152-C173 HydrophobicContact CD1-CB 3.72Å; L152-C173 WeakPolarHBondContact CD1-O 3.21Å; L152-V174 HydrophobicContact CD1-CG1 3.93Å; L152-V179 HydrophobicContact CD1-CG1 4.24Å; L152-V179 HydrophobicContact CD2-CG1 4.35Å; L152-V179 HydrophobicContact CD2-CG2 4.38Å; L152-T183 HydrophobicContact CD2-CG2 3.55Å
153	C	89.6	Confident	88.6	Confident	26 Å²	26	36 Å²	36	18%	0.176	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-2.2	-177	64.1	0	0	0	0	115.2	C155	C153-C155 PolarHBondContact O-N 3.3Å; C153-C155 PolarHBondContact O-SG 2.91Å
154	K	88.6	Confident	90.2	Very high	67 Å²	67	35 Å²	35	29%	0.291	18%	0.18	S	C	.	.	S	Bend	trans	62.1	-2.5	-177.7	-57.9	176.9	172.2	174.5	0	115.8	E138 L145 C150	E138-K154 WeakPolarHBondContact OE2-CE 3.47Å; E138-K154 IonicContact OE2-NZ 2.69Å; E138-K154 PolarHBondContact OE2-NZ 2.91Å; L145-K154 HydrophobicContact CD1-CG 4.18Å; L145-K154 HydrophobicContact CD2-CB 3.97Å; L145-K154 HydrophobicContact CD2-CG 4.07Å; C150-K154 VanDerWaalsContact O-CA 3.3Å; C150-K154 WeakPolarHBondContact O-CA 3.45Å; C150-K154 PolarHBondContact O-N 3.26Å
155	C	90.1	Very high	91.4	Very high	13 Å²	13	32.6 Å²	32.6	9%	0.088	16%	0.159	C	C	.	.	S	Bend	trans	-84.4	169.8	174.6	-58	0	0	0	0	112.6	S149 C150 C153 L157 W218	S149-C155 WeakPolarHBondContact CA-O 3.19Å; C150-C155 PolarHBondContact N-O 3.14Å; C153-C155 PolarHBondContact O-N 3.3Å; C153-C155 PolarHBondContact O-SG 2.91Å; C155-L157 PolarHBondContact O-N 2.8Å; C155-W218 VanDerWaalsContact SG-CH2 3.53Å
156	L	92.8	Very high	92.1	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-48.2	137.6	165	-176.8	64.4	0	0	0	110.4	F148 Q158 L204 F208 E211 R466	F148-L156 HydrophobicContact CB-CD1 3.99Å; L156-Q158 PolarHBondContact O-N 3.11Å; L156-L204 HydrophobicContact CD1-CD2 3.87Å; L156-F208 HydrophobicContact CD1-CD2 3.82Å; L156-F208 HydrophobicContact CD1-CE2 4.32Å; L156-F208 HydrophobicContact CD1-CG 4.29Å; L156-F208 HydrophobicContact CD2-CB 3.94Å; L156-E211 HydrophobicContact CD2-CB 3.96Å; L156-E211 HydrophobicContact CD2-CG 3.88Å; L156-R466 VanDerWaalsContact N-NH2 3.19Å
157	L	95.2	Very high	92.4	Very high	4 Å²	4	31.5 Å²	31.5	2%	0.021	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-56.8	119.1	173.8	-78.6	164.2	0	0	0	110.6	F148 C150 C155 P160 T168 L204 L535	F148-L157 VanDerWaalsContact O-CG 3.31Å; F148-L157 WeakPolarHBondContact O-CG 3.43Å; F148-L157 PolarHBondContact O-N 3.19Å; C150-L157 HydrophobicContact CB-CD2 3.83Å; C150-L157 HydrophobicContact CB-CG 4.35Å; C155-L157 PolarHBondContact O-N 2.8Å; L157-P160 HydrophobicContact CB-CB 4.38Å; L157-T168 HydrophobicContact CD1-CG2 4.33Å; L157-T168 HydrophobicContact CD2-CG2 4.37Å; L157-L204 HydrophobicContact CB-CD1 3.64Å; L157-L535 HydrophobicContact CD1-CD2 3.4Å
158	Q	95.1	Very high	92.7	Very high	18 Å²	18	30.3 Å²	30.3	8%	0.084	15%	0.146	C	C	.	.	S	Bend	trans	-117.1	128.5	173.4	-179.8	50.8	46.6	0	0	108.4	L156 C170 R215 I219	L156-Q158 PolarHBondContact O-N 3.11Å; Q158-C170 PolarHBondContact N-SG 3Å; Q158-C170 VanDerWaalsContact O-CA 3.3Å; Q158-C170 WeakPolarHBondContact O-CA 3.47Å; Q158-C170 VanDerWaalsContact O-CB 3.25Å; Q158-C170 WeakPolarHBondContact O-CB 3.48Å; Q158-R215 HydrophobicContact CB-CG 3.87Å; Q158-R215 HydrophobicContact CG-CG 4.31Å; Q158-I219 HydrophobicContact CB-CD1 4.06Å; Q158-I219 HydrophobicContact CG-CD1 3.76Å
159	E	95.4	Very high	92.8	Very high	92 Å²	92	30.3 Å²	30.3	43%	0.43	15%	0.146	S	C	.	.	S	Bend	trans	48.5	65.9	-168.1	-72.2	-176.5	-163.1	0	0	111.3	A161 K171 V196	E159-A161 PolarHBondContact O-N 3.48Å; E159-K171 HydrophobicContact CB-CB 3.96Å; E159-K171 WeakPolarHBondContact O-CB 3.43Å; E159-K171 PolarHBondContact O-N 3.17Å; E159-V196 HydrophobicContact CB-CG1 4.35Å; E159-V196 HydrophobicContact CB-CG2 3.75Å; E159-V196 HydrophobicContact CG-CG2 4.05Å
160	P	97.2	Very high	92.9	Very high	1 Å²	1	30 Å²	30	1%	0.006	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	109.3	-174.1	27.1	-37.7	0	0	0	111.5	L157 T168 F169 V196 N197 L200 L204	L157-P160 HydrophobicContact CB-CB 4.38Å; P160-T168 HydrophobicContact CB-CG2 3.64Å; P160-F169 CarbonylContact C-O 3.42Å; P160-F169 WeakPolarHBondContact CA-O 3.23Å; P160-V196 HydrophobicContact CG-CG1 4.39Å; P160-N197 WeakPolarHBondContact O-CB 3.33Å; P160-N197 PolarHBondContact O-N 3.08Å; P160-L200 HydrophobicContact CB-CB 4.09Å; P160-L200 HydrophobicContact CG-CB 3.74Å; P160-L204 HydrophobicContact CB-CD1 4.12Å; P160-L204 HydrophobicContact CG-CD1 3.78Å
161	A	95.4	Very high	92.9	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.008	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.6	173.2	0	0	0	0	0	110.3	E159 T168 F169 K171 V174 P194 K195	E159-A161 PolarHBondContact O-N 3.48Å; A161-T168 WeakPolarHBondContact O-CA 2.99Å; A161-F169 PolarHBondContact N-O 3Å; A161-F169 PolarHBondContact O-N 3.22Å; A161-K171 HydrophobicContact CB-CB 4.18Å; A161-V174 HydrophobicContact CB-CG2 4.31Å; A161-P194 HydrophobicContact CB-CB 4Å; A161-K195 WeakPolarHBondContact CA-O 3.45Å; A161-K195 WeakPolarHBondContact CB-O 3.48Å
162	T	94.6	Very high	93.1	Very high	25 Å²	25	30.3 Å²	30.3	15%	0.153	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	120.6	174.3	-54.5	0	0	0	0	109.3	H167 T168 N197 A492 T533	T162-H167 WeakPolarHBondContact CA-O 3.32Å; T162-T168 PolarHBondContact OG1-OG1 3.38Å; T162-N197 PolarHBondContact OG1-ND2 3.41Å; T162-A492 HydrophobicContact CG2-CB 3.86Å; T162-T533 HydrophobicContact CG2-CG2 3.9Å
163	L	92	Very high	93.1	Very high	20 Å²	20	29 Å²	29	11%	0.105	14%	0.141	C	C	.	.	P	Polyproline II helix	trans	-76.5	159.4	176.6	-57.3	-177.7	0	0	0	111.2	C165 G166 H167 F169 V174 C182 P189	L163-C165 PolarHBondContact O-N 3.27Å; L163-G166 PolarHBondContact O-N 2.96Å; L163-H167 PolarHBondContact N-O 2.97Å; L163-F169 HydrophobicContact CD1-CD2 3.88Å; L163-F169 HydrophobicContact CD1-CE2 3.72Å; L163-F169 HydrophobicContact CG-CD2 4.15Å; L163-F169 HydrophobicContact CG-CE2 4.34Å; L163-V174 HydrophobicContact CD1-CG1 4.44Å; L163-V174 HydrophobicContact CD2-CB 4.43Å; L163-V174 HydrophobicContact CD2-CG1 4.44Å; L163-V174 HydrophobicContact CD2-CG2 4.35Å; L163-C182 HydrophobicContact CD1-CB 4.08Å; L163-P189 HydrophobicContact CD1-CB 4.49Å; L163-P189 HydrophobicContact CD2-CB 4.29Å
164	E	88.1	Confident	93.1	Very high	93 Å²	93	28.8 Å²	28.8	44%	0.435	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-22.3	175.5	-64.7	-175.7	166.9	0	0	114	G166 S190 K531	E164-G166 VanDerWaalsContact C-N 3.26Å; E164-G166 PolarHBondContact O-N 3.37Å; E164-S190 VanDerWaalsContact CD-CB 3.49Å; E164-S190 VanDerWaalsContact OE1-CB 3.28Å; E164-S190 WeakPolarHBondContact OE1-CB 3.28Å; E164-K531 VanDerWaalsContact O-CB 3.29Å; E164-K531 WeakPolarHBondContact O-CB 3.26Å; E164-K531 WeakPolarHBondContact O-CG 3.45Å
165	C	90.6	Very high	93.1	Very high	11 Å²	11	30.1 Å²	30.1	7%	0.074	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	3.1	175.4	70	0	0	0	0	114.6	L163 H167 C182 C185 Q187 F534	L163-C165 PolarHBondContact O-N 3.27Å; C165-H167 PolarHBondContact O-ND1 3.31Å; C165-C182 VanDerWaalsContact SG-SG 3.61Å; C165-C185 VanDerWaalsContact SG-SG 3.65Å; C165-Q187 HydrophobicContact CB-CB 4.29Å; C165-F534 VanDerWaalsContact O-CE2 3.3Å; C165-F534 WeakPolarHBondContact O-CE2 3.28Å
166	G	92.9	Very high	92.8	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.01	17%	0.165	C	C	.	.	S	Bend	trans	88.3	-9.3	178.4	0	0	0	0	0	115.9	L163 E164 K532 F534	L163-G166 PolarHBondContact O-N 2.96Å; E164-G166 VanDerWaalsContact C-N 3.26Å; E164-G166 PolarHBondContact O-N 3.37Å; G166-K532 WeakPolarHBondContact CA-O 3.34Å; G166-F534 PolarHBondContact O-N 2.97Å
167	H	94.3	Very high	91.8	Very high	43 Å²	43	40.9 Å²	40.9	20%	0.199	20%	0.202	C	C	.	.			trans	-87.3	145.7	-178.5	-66.5	86.1	0	0	0	112.1	T162 L163 C165 F169 S184 F534	T162-H167 WeakPolarHBondContact CA-O 3.32Å; L163-H167 PolarHBondContact N-O 2.97Å; C165-H167 PolarHBondContact O-ND1 3.31Å; H167-F169 HydrophobicContact CB-CE2 3.64Å; H167-F169 HydrophobicContact CB-CZ 4.11Å; H167-S184 WeakPolarHBondContact CD2-CB 3.49Å; H167-S184 VanDerWaalsContact NE2-CB 3.34Å; H167-S184 WeakPolarHBondContact NE2-CB 3.47Å; H167-F534 AromaticContact CE1-CD2 3.65Å; H167-F534 AromaticContact CE1-CE2 3.47Å; H167-F534 VanDerWaalsContact CE1-CE2 3.47Å; H167-F534 WeakPolarHBondContact CE1-CE2 3.42Å; H167-F534 AromaticContact ND1-CD2 3.83Å; H167-F534 AromaticContact ND1-CE2 3.79Å; H167-F534 AromaticContact NE2-CD2 3.81Å
168	T	95.6	Very high	91	Very high	18 Å²	18	44.3 Å²	44.3	11%	0.11	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	137.5	-178.8	-57.9	0	0	0	0	111.9	L157 P160 A161 T162 L200 L535	L157-T168 HydrophobicContact CD1-CG2 4.33Å; L157-T168 HydrophobicContact CD2-CG2 4.37Å; P160-T168 HydrophobicContact CB-CG2 3.64Å; A161-T168 WeakPolarHBondContact O-CA 2.99Å; T162-T168 PolarHBondContact OG1-OG1 3.38Å; T168-L200 HydrophobicContact CG2-CD1 3.9Å; T168-L535 HydrophobicContact CG2-CD2 4.02Å
169	F	95.3	Very high	90.1	Very high	3 Å²	3	45.1 Å²	45.1	1%	0.013	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	170.3	179.6	-57.4	-89.1	0	0	0	109.7	R151 L152 P160 A161 L163 H167 V174 T183	R151-F169 HydrophobicContact CB-CE1 4.09Å; L152-F169 HydrophobicContact CD1-CB 4.2Å; L152-F169 HydrophobicContact CD1-CD1 3.61Å; L152-F169 HydrophobicContact CD1-CE1 4.23Å; L152-F169 HydrophobicContact CD1-CG 4.06Å; L152-F169 HydrophobicContact CG-CD1 3.75Å; L152-F169 HydrophobicContact CG-CE1 4.11Å; P160-F169 CarbonylContact C-O 3.42Å; P160-F169 WeakPolarHBondContact CA-O 3.23Å; A161-F169 PolarHBondContact N-O 3Å; A161-F169 PolarHBondContact O-N 3.22Å; L163-F169 HydrophobicContact CD1-CD2 3.88Å; L163-F169 HydrophobicContact CD1-CE2 3.72Å; L163-F169 HydrophobicContact CG-CD2 4.15Å; L163-F169 HydrophobicContact CG-CE2 4.34Å; H167-F169 HydrophobicContact CB-CE2 3.64Å; H167-F169 HydrophobicContact CB-CZ 4.11Å; F169-V174 HydrophobicContact CB-CG1 3.62Å; F169-V174 HydrophobicContact CD2-CG1 3.87Å; F169-V174 HydrophobicContact CG-CG1 3.82Å; F169-T183 WeakPolarHBondContact CE1-OG1 3.4Å
170	C	95.2	Very high	89.3	Confident	3 Å²	3	48 Å²	48	2%	0.02	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	135.2	166.7	-55	0	0	0	0	109.4	C150 Q158 R172 C173 V174	C150-C170 WeakPolarHBondContact CB-SG 3.29Å; C150-C170 PolarHBondContact SG-N 3.35Å; C150-C170 VanDerWaalsContact SG-N 3.42Å; C150-C170 VanDerWaalsContact SG-SG 3.65Å; Q158-C170 PolarHBondContact N-SG 3Å; Q158-C170 VanDerWaalsContact O-CA 3.3Å; Q158-C170 WeakPolarHBondContact O-CA 3.47Å; Q158-C170 VanDerWaalsContact O-CB 3.25Å; Q158-C170 WeakPolarHBondContact O-CB 3.48Å; C170-R172 PolarHBondContact O-N 3.19Å; C170-C173 HydrophobicContact CB-CB 4.15Å; C170-C173 WeakPolarHBondContact O-CB 3.46Å; C170-C173 PolarHBondContact O-N 2.89Å; C170-V174 PolarHBondContact O-N 3.5Å
171	K	93.8	Very high	88.8	Confident	28 Å²	28	51 Å²	51	12%	0.122	27%	0.265	C	S	.	.	H	α-helix	trans	-47.3	-57.5	178.6	174.8	175.2	164.8	59.7	0	112.1	E159 A161 C173 V174 E175 D193 P194 V196	E159-K171 HydrophobicContact CB-CB 3.96Å; E159-K171 WeakPolarHBondContact O-CB 3.43Å; E159-K171 PolarHBondContact O-N 3.17Å; A161-K171 HydrophobicContact CB-CB 4.18Å; K171-C173 PolarHBondContact O-N 3.12Å; K171-V174 WeakPolarHBondContact O-CG2 3.36Å; K171-V174 PolarHBondContact O-N 3.44Å; K171-E175 WeakPolarHBondContact CE-OE1 3.03Å; K171-E175 HydrophobicContact CG-CG 4.27Å; K171-E175 IonicContact NZ-OE1 3Å; K171-E175 PolarHBondContact NZ-OE1 3.02Å; K171-E175 WeakPolarHBondContact O-CG 3.12Å; K171-E175 PolarHBondContact O-N 2.84Å; K171-E175 VanDerWaalsContact O-N 3.1Å; K171-D193 IonicContact NZ-OD1 3.98Å; K171-D193 PolarHBondContact NZ-OD1 2.97Å; K171-P194 WeakPolarHBondContact CD-O 3.37Å; K171-P194 HydrophobicContact CG-CG 4.4Å; K171-P194 PolarHBondContact NZ-O 3.35Å; K171-V196 HydrophobicContact CD-CG2 4.08Å
172	R	92.1	Very high	88.4	Confident	116 Å²	116	51 Å²	51	44%	0.438	27%	0.265	S	S	.	.	H	α-helix	trans	-56.5	-23.4	178.2	178.2	170.7	161.2	-143.5	-20.3	114.8	C170 E175 E222	C170-R172 PolarHBondContact O-N 3.19Å; R172-E175 VanDerWaalsContact CA-OE2 3.31Å; R172-E175 WeakPolarHBondContact CA-OE2 3.13Å; R172-E175 PolarHBondContact N-OE2 3.13Å; R172-E222 IonicContact CZ-OE2 2.69Å; R172-E222 IonicContact NH1-OE2 2.81Å; R172-E222 PolarHBondContact NH1-OE2 3.47Å; R172-E222 IonicContact NH2-OE2 3.18Å; R172-E222 PolarHBondContact NH2-OE2 2.74Å
173	C	91.8	Very high	88.1	Confident	24 Å²	24	52.4 Å²	52.4	16%	0.162	27%	0.273	C	S	.	.	H	α-helix	trans	-84.8	-17.4	177.9	-62.2	0	0	0	0	113.5	L152 C170 K171 V179	L152-C173 HydrophobicContact CB-CB 3.98Å; L152-C173 HydrophobicContact CD1-CB 3.72Å; L152-C173 WeakPolarHBondContact CD1-O 3.21Å; C170-C173 HydrophobicContact CB-CB 4.15Å; C170-C173 WeakPolarHBondContact O-CB 3.46Å; C170-C173 PolarHBondContact O-N 2.89Å; K171-C173 PolarHBondContact O-N 3.12Å; C173-V179 WeakPolarHBondContact O-CG2 3.33Å
174	V	89.9	Confident	87.8	Confident	22 Å²	22	54.3 Å²	54.3	13%	0.133	29%	0.289	C	S	.	.	H	α-helix	trans	-103.8	-5.1	173.2	-69.3	0	0	0	0	113.2	L152 A161 L163 F169 C170 K171 D176 P194	L152-V174 HydrophobicContact CD1-CG1 3.93Å; A161-V174 HydrophobicContact CB-CG2 4.31Å; L163-V174 HydrophobicContact CD1-CG1 4.44Å; L163-V174 HydrophobicContact CD2-CB 4.43Å; L163-V174 HydrophobicContact CD2-CG1 4.44Å; L163-V174 HydrophobicContact CD2-CG2 4.35Å; F169-V174 HydrophobicContact CB-CG1 3.62Å; F169-V174 HydrophobicContact CD2-CG1 3.87Å; F169-V174 HydrophobicContact CG-CG1 3.82Å; C170-V174 PolarHBondContact O-N 3.5Å; K171-V174 WeakPolarHBondContact O-CG2 3.36Å; K171-V174 PolarHBondContact O-N 3.44Å; V174-D176 VanDerWaalsContact C-N 3.33Å; V174-P194 HydrophobicContact CG2-CB 4.03Å; V174-P194 HydrophobicContact CG2-CG 3.98Å
175	E	88.5	Confident	87.9	Confident	95 Å²	95	52 Å²	52	44%	0.444	28%	0.282	S	S	.	.	S	Bend	trans	-83.4	-7.5	166	-68.3	175.1	131.9	0	0	113.3	K171 R172 P194	K171-E175 WeakPolarHBondContact CE-OE1 3.03Å; K171-E175 HydrophobicContact CG-CG 4.27Å; K171-E175 IonicContact NZ-OE1 3Å; K171-E175 PolarHBondContact NZ-OE1 3.02Å; K171-E175 WeakPolarHBondContact O-CG 3.12Å; K171-E175 PolarHBondContact O-N 2.84Å; K171-E175 VanDerWaalsContact O-N 3.1Å; R172-E175 VanDerWaalsContact CA-OE2 3.31Å; R172-E175 WeakPolarHBondContact CA-OE2 3.13Å; R172-E175 PolarHBondContact N-OE2 3.13Å; E175-P194 HydrophobicContact CG-CG 3.72Å
176	D	82.4	Confident	87.8	Confident	90 Å²	90	58.5 Å²	58.5	48%	0.481	31%	0.309	S	S	.	.	S	Bend	trans	-75.8	122.4	179.1	-170.4	-38.3	0	0	0	110.8	V174 A178 V179	V174-D176 VanDerWaalsContact C-N 3.33Å; D176-A178 PolarHBondContact O-N 2.89Å; D176-A178 VanDerWaalsContact OD1-CB 3.23Å; D176-A178 WeakPolarHBondContact OD1-CB 3.35Å; D176-A178 PolarHBondContact OD1-N 3.16Å; D176-V179 HydrophobicContact CB-CG2 4.3Å; D176-V179 PolarHBondContact O-N 2.94Å
177	D	73.3	Confident	87.4	Confident	150 Å²	150	63.1 Å²	63.1	80%	0.802	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-17.1	179.5	-84.6	-45.7	0	0	0	114.2	V179 K180	D177-V179 VanDerWaalsContact C-N 3.34Å; D177-K180 WeakPolarHBondContact O-CE 3.32Å
178	A	76.4	Confident	86.7	Confident	77 Å²	77	68.7 Å²	68.7	64%	0.636	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-30	171	0	0	0	0	0	112.9	D176 K180	D176-A178 PolarHBondContact O-N 2.89Å; D176-A178 VanDerWaalsContact OD1-CB 3.23Å; D176-A178 WeakPolarHBondContact OD1-CB 3.35Å; D176-A178 PolarHBondContact OD1-N 3.16Å; A178-K180 PolarHBondContact O-N 2.94Å; A178-K180 VanDerWaalsContact O-N 3.14Å
179	V	76.9	Confident	85.6	Confident	34 Å²	34	70 Å²	70	21%	0.206	36%	0.363	C	S	.	.			trans	-92.3	72.2	-170.1	-172.2	0	0	0	0	111.4	L152 C173 D176 D177	L152-V179 HydrophobicContact CD1-CG1 4.24Å; L152-V179 HydrophobicContact CD2-CG1 4.35Å; L152-V179 HydrophobicContact CD2-CG2 4.38Å; C173-V179 WeakPolarHBondContact O-CG2 3.33Å; D176-V179 HydrophobicContact CB-CG2 4.3Å; D176-V179 PolarHBondContact O-N 2.94Å; D177-V179 VanDerWaalsContact C-N 3.34Å
180	K	78.4	Confident	84.4	Confident	152 Å²	152	72.1 Å²	72.1	66%	0.661	38%	0.378	S	S	*	.			trans	-78.1	-20.2	-174.2	-64.8	173.9	-175.1	170.6	0	115.1	D177 A178 P189	D177-K180 WeakPolarHBondContact O-CE 3.32Å; A178-K180 PolarHBondContact O-N 2.94Å; A178-K180 VanDerWaalsContact O-N 3.14Å; K180-P189 WeakPolarHBondContact O-CD 3.42Å
181	D	86.5	Confident	83.1	Confident	64 Å²	64	82.4 Å²	82.4	34%	0.342	42%	0.422	S	S	.	.	S	Bend	trans	-137.4	145.3	179.1	-57	-68.1	0	0	0	109.2	T183 K188	D181-T183 PolarHBondContact O-N 3.44Å; D181-K188 WeakPolarHBondContact OD1-CE 3.27Å; D181-K188 WeakPolarHBondContact OD1-CG 3.3Å
182	C	88.1	Confident	82	Confident	2 Å²	2	84 Å²	84	1%	0.014	44%	0.437	C	S	.	.			trans	-56.8	121.1	173.2	172.5	0	0	0	0	110.3	L163 C165 S184 C185 K186 Q187	L163-C182 HydrophobicContact CD1-CB 4.08Å; C165-C182 VanDerWaalsContact SG-SG 3.61Å; C182-S184 PolarHBondContact O-N 3.32Å; C182-C185 PolarHBondContact O-N 2.99Å; C182-K186 VanDerWaalsContact O-CA 3.25Å; C182-K186 WeakPolarHBondContact O-CA 3.39Å; C182-K186 PolarHBondContact O-N 3.42Å; C182-Q187 VanDerWaalsContact CB-O 3.31Å; C182-Q187 WeakPolarHBondContact CB-O 3.26Å; C182-Q187 PolarHBondContact N-O 3.4Å
183	T	87.3	Confident	81.6	Confident	54 Å²	54	82.2 Å²	82.2	33%	0.331	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.9	-173.2	46.8	0	0	0	0	113.4	L152 F169 D181 K186	L152-T183 HydrophobicContact CD2-CG2 3.55Å; F169-T183 WeakPolarHBondContact CE1-OG1 3.4Å; D181-T183 PolarHBondContact O-N 3.44Å; T183-K186 WeakPolarHBondContact O-CE 3.39Å; T183-K186 PolarHBondContact O-NZ 3.26Å
184	S	86.5	Confident	81.5	Confident	61 Å²	61	82.4 Å²	82.4	43%	0.427	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-40.7	-179.8	-49.4	0	0	0	0	114.5	H167 C182	H167-S184 WeakPolarHBondContact CD2-CB 3.49Å; H167-S184 VanDerWaalsContact NE2-CB 3.34Å; H167-S184 WeakPolarHBondContact NE2-CB 3.47Å; C182-S184 PolarHBondContact O-N 3.32Å
185	C	89.9	Confident	81.6	Confident	43 Å²	43	85.2 Å²	85.2	29%	0.291	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.1	0.8	-172.6	67.9	0	0	0	0	115.5	C165 C182 Q187	C165-C185 VanDerWaalsContact SG-SG 3.65Å; C182-C185 PolarHBondContact O-N 2.99Å; C185-Q187 PolarHBondContact O-N 2.92Å; C185-Q187 VanDerWaalsContact O-N 3.09Å
186	K	88.1	Confident	82	Confident	148 Å²	148	82.6 Å²	82.6	64%	0.643	44%	0.438	S	S	*	.			trans	55.9	20.6	-179.3	-46	-51.2	-173.7	-165	0	115.1	C182 T183	C182-K186 VanDerWaalsContact O-CA 3.25Å; C182-K186 WeakPolarHBondContact O-CA 3.39Å; C182-K186 PolarHBondContact O-N 3.42Å; T183-K186 WeakPolarHBondContact O-CE 3.39Å; T183-K186 PolarHBondContact O-NZ 3.26Å
187	Q	85.1	Confident	82.7	Confident	98 Å²	98	78.3 Å²	78.3	46%	0.458	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-84.9	140.3	170.4	-65.6	177.3	-2.5	0	0	109.9	C165 C182 C185	C165-Q187 HydrophobicContact CB-CB 4.29Å; C182-Q187 VanDerWaalsContact CB-O 3.31Å; C182-Q187 WeakPolarHBondContact CB-O 3.26Å; C182-Q187 PolarHBondContact N-O 3.4Å; C185-Q187 PolarHBondContact O-N 2.92Å; C185-Q187 VanDerWaalsContact O-N 3.09Å
188	K	79.7	Confident	83.8	Confident	160 Å²	160	75 Å²	75	70%	0.696	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-67.3	134	174.9	-73.1	-179.9	177.1	177.9	0	110.2	D181	D181-K188 WeakPolarHBondContact OD1-CE 3.27Å; D181-K188 WeakPolarHBondContact OD1-CG 3.3Å
189	P	73.4	Confident	84.8	Confident	47 Å²	47	73.1 Å²	73.1	31%	0.305	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-64.1	156.4	165.9	30.3	-33.5	0	0	0	109.8	L163 K180	L163-P189 HydrophobicContact CD1-CB 4.49Å; L163-P189 HydrophobicContact CD2-CB 4.29Å; K180-P189 WeakPolarHBondContact O-CD 3.42Å
190	S	69.5	Low	85.8	Confident	47 Å²	47	71.5 Å²	71.5	33%	0.329	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-63.4	159.9	167.1	-178.5	0	0	0	0	110.8	E164 S192	E164-S190 VanDerWaalsContact CD-CB 3.49Å; E164-S190 VanDerWaalsContact OE1-CB 3.28Å; E164-S190 WeakPolarHBondContact OE1-CB 3.28Å; S190-S192 PolarHBondContact O-N 3.47Å; S190-S192 PolarHBondContact OG-OG 3.12Å
191	K	66.5	Low	86.6	Confident	218 Å²	218	65.5 Å²	65.5	95%	0.948	35%	0.348	S	S	*	.	S	Bend	trans	-75.8	-0.2	177.5	-64.7	-177.1	177.7	-179	0	113.5
192	S	72.4	Confident	87	Confident	63 Å²	63	64.5 Å²	64.5	44%	0.441	35%	0.353	S	S	.	.	S	Bend	trans	-73.7	138.3	176.7	56.1	0	0	0	0	112.1	S190	S190-S192 PolarHBondContact O-N 3.47Å; S190-S192 PolarHBondContact OG-OG 3.12Å
193	D	83.8	Confident	87.3	Confident	78 Å²	78	64.8 Å²	64.8	42%	0.417	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-50.4	117.1	169.1	166.1	31.8	0	0	0	111.5	K171 K195	K171-D193 IonicContact NZ-OD1 3.98Å; K171-D193 PolarHBondContact NZ-OD1 2.97Å; D193-K195 WeakPolarHBondContact O-CE 3.22Å; D193-K195 PolarHBondContact O-N 3.22Å; D193-K195 WeakPolarHBondContact OD2-CE 3.27Å; D193-K195 IonicContact OD2-NZ 2.68Å; D193-K195 PolarHBondContact OD2-NZ 3.32Å
194	P	88.3	Confident	87.7	Confident	27 Å²	27	62.4 Å²	62.4	18%	0.175	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-66.7	122.2	-174.7	25.2	-32.9	0	0	0	111.6	A161 K171 V174 E175	A161-P194 HydrophobicContact CB-CB 4Å; K171-P194 WeakPolarHBondContact CD-O 3.37Å; K171-P194 HydrophobicContact CG-CG 4.4Å; K171-P194 PolarHBondContact NZ-O 3.35Å; V174-P194 HydrophobicContact CG2-CB 4.03Å; V174-P194 HydrophobicContact CG2-CG 3.98Å; E175-P194 HydrophobicContact CG-CG 3.72Å
195	K	93.5	Very high	88	Confident	82 Å²	82	62 Å²	62	36%	0.357	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-94.1	150.9	-179.9	-52	-57.6	-177.6	176.5	0	112.2	A161 D193 N197 P494	A161-K195 WeakPolarHBondContact CA-O 3.45Å; A161-K195 WeakPolarHBondContact CB-O 3.48Å; D193-K195 WeakPolarHBondContact O-CE 3.22Å; D193-K195 PolarHBondContact O-N 3.22Å; D193-K195 WeakPolarHBondContact OD2-CE 3.27Å; D193-K195 IonicContact OD2-NZ 2.68Å; D193-K195 PolarHBondContact OD2-NZ 3.32Å; K195-N197 PolarHBondContact O-N 2.94Å; K195-P494 VanDerWaalsContact CB-O 3.28Å; K195-P494 WeakPolarHBondContact CB-O 3.34Å; K195-P494 WeakPolarHBondContact CG-O 2.85Å
196	V	96.6	Very high	88.2	Confident	39 Å²	39	63.8 Å²	63.8	24%	0.236	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-72	126.1	179.4	-173.8	0	0	0	0	110.2	E159 P160 K171 V198 G496	E159-V196 HydrophobicContact CB-CG1 4.35Å; E159-V196 HydrophobicContact CB-CG2 3.75Å; E159-V196 HydrophobicContact CG-CG2 4.05Å; P160-V196 HydrophobicContact CG-CG1 4.39Å; K171-V196 HydrophobicContact CD-CG2 4.08Å; V196-V198 PolarHBondContact O-N 3.44Å; V196-V198 VanDerWaalsContact O-N 3.1Å; V196-G496 VanDerWaalsContact O-CA 3.23Å; V196-G496 WeakPolarHBondContact O-CA 3.39Å
197	N	97.3	Very high	88.4	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	31%	0.308	C	S	.	.			trans	-67.9	103.2	170.3	-173.7	-29.7	0	0	0	109.1	P160 T162 K195 V199 L200 S201 G496 T498	P160-N197 WeakPolarHBondContact O-CB 3.33Å; P160-N197 PolarHBondContact O-N 3.08Å; T162-N197 PolarHBondContact OG1-ND2 3.41Å; K195-N197 PolarHBondContact O-N 2.94Å; N197-V199 VanDerWaalsContact C-N 3.29Å; N197-V199 PolarHBondContact O-N 3.3Å; N197-V199 PolarHBondContact OD1-N 3.48Å; N197-L200 HydrophobicContact CB-CB 4.14Å; N197-L200 HydrophobicContact CB-CD1 4.23Å; N197-L200 HydrophobicContact CB-CG 4.46Å; N197-L200 PolarHBondContact O-N 3.41Å; N197-L200 PolarHBondContact OD1-N 3.49Å; N197-S201 PolarHBondContact O-N 3.1Å; N197-G496 CarbonylContact C-O 3.6Å; N197-G496 VanDerWaalsContact CA-O 3.3Å; N197-G496 WeakPolarHBondContact CA-O 3.39Å; N197-T498 PolarHBondContact ND2-OG1 3.36Å; N197-T498 VanDerWaalsContact ND2-OG1 3.15Å; N197-T498 PolarHBondContact OD1-OG1 3.29Å
198	V	96.4	Very high	88.7	Confident	80 Å²	80	53.6 Å²	53.6	49%	0.485	29%	0.29	S	S	.	.	H	α-helix	trans	-59.3	-39.8	-171	-179.9	0	0	0	0	111.7	V196 S201 G202 G496	V196-V198 PolarHBondContact O-N 3.44Å; V196-V198 VanDerWaalsContact O-N 3.1Å; V198-S201 PolarHBondContact O-N 3.4Å; V198-G202 PolarHBondContact O-N 2.84Å; V198-G496 PolarHBondContact N-O 3.01Å
199	V	96.8	Very high	89.3	Confident	37 Å²	37	50.9 Å²	50.9	22%	0.224	28%	0.28	C	S	.	.	H	α-helix	trans	-66.7	-48.1	-180	-178.6	0	0	0	0	110.5	N197 S201 G202 L203 L478 F487 M536	N197-V199 VanDerWaalsContact C-N 3.29Å; N197-V199 PolarHBondContact O-N 3.3Å; N197-V199 PolarHBondContact OD1-N 3.48Å; V199-S201 VanDerWaalsContact C-N 3.32Å; V199-S201 PolarHBondContact O-N 2.96Å; V199-G202 PolarHBondContact O-N 3.42Å; V199-L203 VanDerWaalsContact O-CB 3.29Å; V199-L203 WeakPolarHBondContact O-CB 3.42Å; V199-L203 PolarHBondContact O-N 2.92Å; V199-L478 HydrophobicContact CG1-CD2 4.11Å; V199-F487 HydrophobicContact CG1-CE2 3.97Å; V199-F487 HydrophobicContact CG2-CE2 4.42Å; V199-F487 HydrophobicContact CG2-CZ 4.17Å; V199-M536 HydrophobicContact CB-CE 4.2Å; V199-M536 HydrophobicContact CG1-CE 3.66Å
200	L	96.8	Very high	90.2	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-65.6	-34.9	177.5	-73.8	177.4	0	0	0	112.4	P160 T168 N197 L203 L204 T533 L535 M536	P160-L200 HydrophobicContact CB-CB 4.09Å; P160-L200 HydrophobicContact CG-CB 3.74Å; T168-L200 HydrophobicContact CG2-CD1 3.9Å; N197-L200 HydrophobicContact CB-CB 4.14Å; N197-L200 HydrophobicContact CB-CD1 4.23Å; N197-L200 HydrophobicContact CB-CG 4.46Å; N197-L200 PolarHBondContact O-N 3.41Å; N197-L200 PolarHBondContact OD1-N 3.49Å; L200-L203 HydrophobicContact CD2-CD2 4Å; L200-L203 PolarHBondContact O-N 3.1Å; L200-L204 WeakPolarHBondContact O-CB 3.34Å; L200-L204 WeakPolarHBondContact O-CD1 3.38Å; L200-L204 WeakPolarHBondContact O-CG 3.46Å; L200-L204 PolarHBondContact O-N 3.36Å; L200-T533 HydrophobicContact CD1-CG2 4.02Å; L200-L535 HydrophobicContact CD1-CB 4.45Å; L200-L535 HydrophobicContact CD1-CD2 3.85Å; L200-L535 HydrophobicContact CD1-CG 4.2Å; L200-L535 HydrophobicContact CD2-CD2 4.2Å; L200-L535 HydrophobicContact CD2-CG 4.09Å; L200-M536 HydrophobicContact CD1-CG 4.15Å; L200-M536 HydrophobicContact CD1-SD 4.42Å; L200-M536 HydrophobicContact CD2-CG 3.53Å; L200-M536 HydrophobicContact CD2-SD 4.2Å; L200-M536 HydrophobicContact CG-CG 3.85Å; L200-M536 HydrophobicContact CG-SD 3.94Å
201	S	96.3	Very high	91.2	Very high	26 Å²	26	53.1 Å²	53.1	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-66.5	-43.7	176.9	-162	0	0	0	0	111.8	N197 V198 V199 D205	N197-S201 PolarHBondContact O-N 3.1Å; V198-S201 PolarHBondContact O-N 3.4Å; V199-S201 VanDerWaalsContact C-N 3.32Å; V199-S201 PolarHBondContact O-N 2.96Å; S201-D205 WeakPolarHBondContact O-CB 3.48Å; S201-D205 PolarHBondContact O-N 2.79Å; S201-D205 VanDerWaalsContact O-N 3.11Å
202	G	95.2	Very high	92.5	Very high	43 Å²	43	42.8 Å²	42.8	44%	0.443	24%	0.242	S	C	.	.	H	α-helix	trans	-65.7	-39.6	174.8	0	0	0	0	0	112.7	V198 V199 D205 K206	V198-G202 PolarHBondContact O-N 2.84Å; V199-G202 PolarHBondContact O-N 3.42Å; G202-D205 PolarHBondContact O-N 2.91Å; G202-K206 PolarHBondContact O-N 3.02Å
203	L	94.8	Very high	93.6	Very high	8 Å²	8	45 Å²	45	4%	0.042	24%	0.241	C	C	.	.	H	α-helix	trans	-59.9	-48.8	175	-180	69.1	0	0	0	111.9	F148 V199 L200 D205 K206 L207 L473 V539	F148-L203 HydrophobicContact CE1-CD2 4.43Å; V199-L203 VanDerWaalsContact O-CB 3.29Å; V199-L203 WeakPolarHBondContact O-CB 3.42Å; V199-L203 PolarHBondContact O-N 2.92Å; L200-L203 HydrophobicContact CD2-CD2 4Å; L200-L203 PolarHBondContact O-N 3.1Å; L203-D205 VanDerWaalsContact C-N 3.31Å; L203-D205 PolarHBondContact O-N 3.27Å; L203-K206 PolarHBondContact O-N 2.84Å; L203-L207 HydrophobicContact CD1-CD1 3.76Å; L203-L207 HydrophobicContact CD1-CG 4Å; L203-L207 HydrophobicContact CG-CD1 3.97Å; L203-L207 HydrophobicContact CG-CG 4.36Å; L203-L207 WeakPolarHBondContact O-CB 3.33Å; L203-L207 WeakPolarHBondContact O-CG 3.4Å; L203-L207 PolarHBondContact O-N 3.38Å; L203-L473 HydrophobicContact CD1-CD1 3.46Å; L203-L473 VanDerWaalsContact CD1-CD1 3.46Å; L203-V539 HydrophobicContact CD2-CG1 4.2Å
204	L	94.6	Very high	94.1	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-64.5	-37	179.2	-69	162.2	0	0	0	111.8	F148 L156 L157 P160 L200 F208	F148-L204 HydrophobicContact CB-CD2 3.92Å; F148-L204 HydrophobicContact CD1-CD2 3.68Å; F148-L204 HydrophobicContact CG-CD2 4.13Å; L156-L204 HydrophobicContact CD1-CD2 3.87Å; L157-L204 HydrophobicContact CB-CD1 3.64Å; P160-L204 HydrophobicContact CB-CD1 4.12Å; P160-L204 HydrophobicContact CG-CD1 3.78Å; L200-L204 WeakPolarHBondContact O-CB 3.34Å; L200-L204 WeakPolarHBondContact O-CD1 3.38Å; L200-L204 WeakPolarHBondContact O-CG 3.46Å; L200-L204 PolarHBondContact O-N 3.36Å; L204-F208 HydrophobicContact CD2-CD2 4.09Å; L204-F208 HydrophobicContact CD2-CE2 4.29Å; L204-F208 PolarHBondContact O-N 3.38Å
205	D	93.7	Very high	94.3	Very high	52 Å²	52	41.1 Å²	41.1	28%	0.278	22%	0.217	S	C	.	.	H	α-helix	trans	-68.7	-31.9	174.7	-78.6	-13.9	0	0	0	113	S201 G202 L203 E209 S212 K216	S201-D205 WeakPolarHBondContact O-CB 3.48Å; S201-D205 PolarHBondContact O-N 2.79Å; S201-D205 VanDerWaalsContact O-N 3.11Å; G202-D205 PolarHBondContact O-N 2.91Å; L203-D205 VanDerWaalsContact C-N 3.31Å; L203-D205 PolarHBondContact O-N 3.27Å; D205-E209 WeakPolarHBondContact O-CA 3.43Å; D205-E209 WeakPolarHBondContact O-CB 3.5Å; D205-S212 WeakPolarHBondContact OD1-CB 3.47Å; D205-S212 PolarHBondContact OD1-OG 3.46Å; D205-K216 IonicContact OD1-NZ 3.63Å; D205-K216 PolarHBondContact OD1-NZ 3.33Å; D205-K216 IonicContact OD2-NZ 3.4Å; D205-K216 PolarHBondContact OD2-NZ 3.15Å
206	K	93.1	Very high	94.4	Very high	80 Å²	80	40.1 Å²	40.1	35%	0.348	21%	0.213	S	C	.	.	H	α-helix	trans	-73.4	-47.7	172.6	-171.5	-173.8	-176.5	-172.6	0	112.1	G202 L203 L472 D474 D477	G202-K206 PolarHBondContact O-N 3.02Å; L203-K206 PolarHBondContact O-N 2.84Å; K206-L472 WeakPolarHBondContact CE-O 3.42Å; K206-L472 PolarHBondContact NZ-O 2.82Å; K206-L472 VanDerWaalsContact NZ-O 3.09Å; K206-D474 IonicContact NZ-OD2 3.7Å; K206-D477 VanDerWaalsContact CD-OD1 3.31Å; K206-D477 WeakPolarHBondContact CD-OD1 3.41Å; K206-D477 IonicContact NZ-OD1 3.17Å; K206-D477 PolarHBondContact NZ-OD1 3.17Å; K206-D477 IonicContact NZ-OD2 2.78Å; K206-D477 PolarHBondContact NZ-OD2 3.11Å
207	L	91.8	Very high	94.3	Very high	13 Å²	13	40.8 Å²	40.8	7%	0.068	21%	0.214	C	C	.	.	H	α-helix	trans	-78.6	-30.3	-172.3	-63.7	-173.5	0	0	0	113.6	F148 L203 V468 L472 L473	F148-L207 HydrophobicContact CE1-CD1 4.35Å; F148-L207 HydrophobicContact CZ-CD1 4.09Å; L203-L207 HydrophobicContact CD1-CD1 3.76Å; L203-L207 HydrophobicContact CD1-CG 4Å; L203-L207 HydrophobicContact CG-CD1 3.97Å; L203-L207 HydrophobicContact CG-CG 4.36Å; L203-L207 WeakPolarHBondContact O-CB 3.33Å; L203-L207 WeakPolarHBondContact O-CG 3.4Å; L203-L207 PolarHBondContact O-N 3.38Å; L207-V468 HydrophobicContact CD1-CG1 4.11Å; L207-V468 HydrophobicContact CD1-CG2 4.08Å; L207-V468 HydrophobicContact CD2-CG1 4.01Å; L207-L472 HydrophobicContact CD2-CB 4.04Å; L207-L473 HydrophobicContact CD2-CB 4.28Å
208	F	92.4	Very high	94.2	Very high	19 Å²	19	41.7 Å²	41.7	8%	0.083	22%	0.217	C	C	.	.	S	Bend	trans	-134.6	42	-171.9	-52.9	-66	0	0	0	112.2	F148 L156 L204 T210 E211 S212 R466 V468	F148-F208 HydrophobicContact CB-CE2 3.96Å; F148-F208 HydrophobicContact CD1-CE2 4.08Å; F148-F208 AromaticContact CD2-CE2 3.57Å; F148-F208 HydrophobicContact CD2-CE2 3.57Å; F148-F208 AromaticContact CD2-CZ 3.6Å; F148-F208 HydrophobicContact CD2-CZ 3.6Å; F148-F208 HydrophobicContact CE1-CE2 4.47Å; F148-F208 HydrophobicContact CE2-CE2 4.03Å; F148-F208 AromaticContact CE2-CZ 3.93Å; F148-F208 HydrophobicContact CE2-CZ 3.93Å; F148-F208 AromaticContact CG-CE2 3.59Å; F148-F208 HydrophobicContact CG-CE2 3.59Å; F148-F208 HydrophobicContact CG-CZ 4.11Å; F148-F208 HydrophobicContact CZ-CE2 4.44Å; L156-F208 HydrophobicContact CD1-CD2 3.82Å; L156-F208 HydrophobicContact CD1-CE2 4.32Å; L156-F208 HydrophobicContact CD1-CG 4.29Å; L156-F208 HydrophobicContact CD2-CB 3.94Å; L204-F208 HydrophobicContact CD2-CD2 4.09Å; L204-F208 HydrophobicContact CD2-CE2 4.29Å; L204-F208 PolarHBondContact O-N 3.38Å; F208-T210 VanDerWaalsContact C-N 3.31Å; F208-T210 PolarHBondContact O-N 2.97Å; F208-T210 VanDerWaalsContact O-N 3.14Å; F208-E211 HydrophobicContact CB-CB 4.44Å; F208-E211 PolarHBondContact O-N 2.85Å; F208-E211 VanDerWaalsContact O-N 3.1Å; F208-S212 WeakPolarHBondContact O-CB 3.47Å; F208-S212 PolarHBondContact O-N 3.33Å; F208-R466 HydrophobicContact CE1-CB 3.79Å; F208-R466 HydrophobicContact CE1-CG 4.22Å; F208-R466 HydrophobicContact CZ-CB 4.01Å; F208-V468 HydrophobicContact CE1-CG2 4.17Å; F208-V468 HydrophobicContact CE2-CG2 4.46Å; F208-V468 HydrophobicContact CZ-CG2 3.59Å
209	E	92.1	Very high	94	Very high	103 Å²	103	39.5 Å²	39.5	48%	0.481	20%	0.203	S	C	.	.	H	α-helix	trans	-47	-48.7	-170.7	-161.1	-139.1	126.5	0	0	113.7	D205 R213	D205-E209 WeakPolarHBondContact O-CA 3.43Å; D205-E209 WeakPolarHBondContact O-CB 3.5Å; E209-R213 VanDerWaalsContact O-CB 3.3Å; E209-R213 WeakPolarHBondContact O-CB 3.16Å; E209-R213 WeakPolarHBondContact O-CD 3.08Å; E209-R213 WeakPolarHBondContact O-CG 3.16Å; E209-R213 PolarHBondContact O-N 3.16Å; E209-R213 WeakPolarHBondContact OE1-CD 3.34Å; E209-R213 IonicContact OE1-CZ 3.16Å; E209-R213 IonicContact OE1-NE 3.59Å; E209-R213 IonicContact OE1-NH1 2.72Å; E209-R213 PolarHBondContact OE1-NH1 2.88Å
210	T	92	Very high	93.9	Very high	82 Å²	82	41.8 Å²	41.8	50%	0.503	21%	0.211	S	C	.	.	H	α-helix	trans	-67.9	-44.8	-179.2	49.5	0	0	0	0	113	F208 R213 A214	F208-T210 VanDerWaalsContact C-N 3.31Å; F208-T210 PolarHBondContact O-N 2.97Å; F208-T210 VanDerWaalsContact O-N 3.14Å; T210-R213 PolarHBondContact O-N 3.4Å; T210-A214 WeakPolarHBondContact O-CB 3.39Å; T210-A214 PolarHBondContact O-N 3.48Å
211	E	91.1	Very high	93.8	Very high	60 Å²	60	41.7 Å²	41.7	28%	0.28	21%	0.211	S	C	.	.	H	α-helix	trans	-70.9	-38.4	179.3	-167.2	-173.2	172.8	0	0	111.7	L156 F208 A214 R215 R466	L156-E211 HydrophobicContact CD2-CB 3.96Å; L156-E211 HydrophobicContact CD2-CG 3.88Å; F208-E211 HydrophobicContact CB-CB 4.44Å; F208-E211 PolarHBondContact O-N 2.85Å; F208-E211 VanDerWaalsContact O-N 3.1Å; E211-A214 PolarHBondContact O-N 3.29Å; E211-R215 WeakPolarHBondContact O-CB 3.33Å; E211-R215 PolarHBondContact O-N 2.85Å; E211-R466 IonicContact OE1-CZ 2.76Å; E211-R466 IonicContact OE1-NE 3.86Å; E211-R466 PolarHBondContact OE1-NE 3.34Å; E211-R466 IonicContact OE1-NH2 3.66Å; E211-R466 PolarHBondContact OE1-NH2 3.5Å; E211-R466 WeakPolarHBondContact OE2-CD 3.36Å; E211-R466 IonicContact OE2-CZ 2.64Å; E211-R466 IonicContact OE2-NE 2.7Å; E211-R466 PolarHBondContact OE2-NE 2.95Å; E211-R466 IonicContact OE2-NH2 2.8Å
212	S	93.6	Very high	93.7	Very high	1 Å²	1	42 Å²	42	1%	0.007	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-47.7	172.9	175.2	0	0	0	0	111	D205 F208 A214 R215 K216	D205-S212 WeakPolarHBondContact OD1-CB 3.47Å; D205-S212 PolarHBondContact OD1-OG 3.46Å; F208-S212 WeakPolarHBondContact O-CB 3.47Å; F208-S212 PolarHBondContact O-N 3.33Å; S212-A214 PolarHBondContact O-N 2.65Å; S212-R215 PolarHBondContact O-N 2.65Å; S212-R215 VanDerWaalsContact O-N 3.16Å; S212-K216 VanDerWaalsContact O-CG 3.3Å; S212-K216 WeakPolarHBondContact O-CG 3.37Å; S212-K216 PolarHBondContact O-N 3.29Å; S212-K216 VanDerWaalsContact OG-CE 3.32Å; S212-K216 WeakPolarHBondContact OG-CE 3.45Å; S212-K216 PolarHBondContact OG-NZ 3.34Å
213	R	94.8	Very high	93.6	Very high	109 Å²	109	42.5 Å²	42.5	41%	0.411	20%	0.203	S	C	.	.	H	α-helix	trans	-60.3	-43.1	175	-73.7	169.6	59	-174.9	-4.9	112.1	E209 T210 R215 K216 M217 L243	E209-R213 VanDerWaalsContact O-CB 3.3Å; E209-R213 WeakPolarHBondContact O-CB 3.16Å; E209-R213 WeakPolarHBondContact O-CD 3.08Å; E209-R213 WeakPolarHBondContact O-CG 3.16Å; E209-R213 PolarHBondContact O-N 3.16Å; E209-R213 WeakPolarHBondContact OE1-CD 3.34Å; E209-R213 IonicContact OE1-CZ 3.16Å; E209-R213 IonicContact OE1-NE 3.59Å; E209-R213 IonicContact OE1-NH1 2.72Å; E209-R213 PolarHBondContact OE1-NH1 2.88Å; T210-R213 PolarHBondContact O-N 3.4Å; R213-R215 PolarHBondContact O-N 3.2Å; R213-K216 PolarHBondContact O-N 3.25Å; R213-M217 WeakPolarHBondContact O-CG 3.42Å; R213-M217 PolarHBondContact O-N 3.34Å; R213-M217 VanDerWaalsContact O-N 3.08Å; R213-L243 HydrophobicContact CB-CD1 3.77Å
214	A	94.6	Very high	93.7	Very high	3 Å²	3	43.7 Å²	43.7	3%	0.025	21%	0.209	C	C	.	.	H	α-helix	trans	-62.2	-40.7	173.8	0	0	0	0	0	112.3	T210 E211 S212 M217 W218 A240 L243 A244	T210-A214 WeakPolarHBondContact O-CB 3.39Å; T210-A214 PolarHBondContact O-N 3.48Å; E211-A214 PolarHBondContact O-N 3.29Å; S212-A214 PolarHBondContact O-N 2.65Å; A214-M217 PolarHBondContact O-N 2.69Å; A214-W218 WeakPolarHBondContact O-CB 3.36Å; A214-W218 PolarHBondContact O-N 3.34Å; A214-A240 WeakPolarHBondContact O-CB 3.36Å; A214-L243 HydrophobicContact CB-CB 3.9Å; A214-L243 HydrophobicContact CB-CD1 4.48Å; A214-A244 HydrophobicContact CB-CB 3.66Å
215	R	93.5	Very high	93.7	Very high	20 Å²	20	45.5 Å²	45.5	8%	0.075	22%	0.216	C	C	.	.	H	α-helix	trans	-70.6	-34.7	179.3	-173	59.1	-177	141.2	10.3	112.5	Q158 E211 S212 R213 W218 I219 E222	Q158-R215 HydrophobicContact CB-CG 3.87Å; Q158-R215 HydrophobicContact CG-CG 4.31Å; E211-R215 WeakPolarHBondContact O-CB 3.33Å; E211-R215 PolarHBondContact O-N 2.85Å; S212-R215 PolarHBondContact O-N 2.65Å; S212-R215 VanDerWaalsContact O-N 3.16Å; R213-R215 PolarHBondContact O-N 3.2Å; R215-W218 VanDerWaalsContact NH1-CE3 3.3Å; R215-I219 WeakPolarHBondContact O-CG1 3.37Å; R215-I219 PolarHBondContact O-N 2.85Å; R215-E222 IonicContact NH1-OE1 3.13Å; R215-E222 PolarHBondContact NH1-OE1 3.15Å
216	K	94.2	Very high	93.6	Very high	62 Å²	62	47.5 Å²	47.5	27%	0.27	23%	0.234	S	C	.	.	H	α-helix	trans	-60	-54	170.1	-72.2	162.2	-179.9	168.5	0	110.8	D205 S212 R213 W218 I219 E220	D205-K216 IonicContact OD1-NZ 3.63Å; D205-K216 PolarHBondContact OD1-NZ 3.33Å; D205-K216 IonicContact OD2-NZ 3.4Å; D205-K216 PolarHBondContact OD2-NZ 3.15Å; S212-K216 VanDerWaalsContact O-CG 3.3Å; S212-K216 WeakPolarHBondContact O-CG 3.37Å; S212-K216 PolarHBondContact O-N 3.29Å; S212-K216 VanDerWaalsContact OG-CE 3.32Å; S212-K216 WeakPolarHBondContact OG-CE 3.45Å; S212-K216 PolarHBondContact OG-NZ 3.34Å; R213-K216 PolarHBondContact O-N 3.25Å; K216-W218 VanDerWaalsContact C-N 3.34Å; K216-W218 PolarHBondContact O-N 3.19Å; K216-I219 PolarHBondContact O-N 2.93Å; K216-I219 VanDerWaalsContact O-N 3.15Å; K216-E220 PolarHBondContact O-N 2.94Å
217	M	95.6	Very high	93.7	Very high	52 Å²	52	50.8 Å²	50.8	26%	0.256	25%	0.249	S	C	.	.	H	α-helix	trans	-60	-40.4	177.8	-70.7	173.5	171.5	0	0	112.7	R213 A214 E220 G221 R236 A239 A240 L243	R213-M217 WeakPolarHBondContact O-CG 3.42Å; R213-M217 PolarHBondContact O-N 3.34Å; R213-M217 VanDerWaalsContact O-N 3.08Å; A214-M217 PolarHBondContact O-N 2.69Å; M217-E220 WeakPolarHBondContact O-CB 3.4Å; M217-E220 PolarHBondContact O-N 2.94Å; M217-G221 PolarHBondContact O-N 3.01Å; M217-R236 WeakPolarHBondContact O-CB 3.5Å; M217-A239 HydrophobicContact CE-CB 4.25Å; M217-A239 HydrophobicContact SD-CB 3.62Å; M217-A240 HydrophobicContact CB-CB 3.84Å; M217-L243 HydrophobicContact CE-CD1 4.2Å; M217-L243 HydrophobicContact SD-CD1 3.65Å
218	W	94.1	Very high	93.7	Very high	20 Å²	20	56.2 Å²	56.2	8%	0.076	27%	0.273	C	S	.	.	H	α-helix	trans	-60.2	-47.5	173.7	178.2	2.8	0	0	0	111.5	C155 A214 R215 K216 E220 G221 E222 Y237 A240 R249 L250 Q253	C155-W218 VanDerWaalsContact SG-CH2 3.53Å; A214-W218 WeakPolarHBondContact O-CB 3.36Å; A214-W218 PolarHBondContact O-N 3.34Å; R215-W218 VanDerWaalsContact NH1-CE3 3.3Å; K216-W218 VanDerWaalsContact C-N 3.34Å; K216-W218 PolarHBondContact O-N 3.19Å; W218-E220 VanDerWaalsContact C-N 3.33Å; W218-E220 PolarHBondContact O-N 3.37Å; W218-G221 WeakPolarHBondContact O-CA 3.48Å; W218-G221 PolarHBondContact O-N 3.33Å; W218-E222 PolarHBondContact NE1-OE1 3.07Å; W218-E222 PolarHBondContact O-N 3.11Å; W218-Y237 AromaticContact CD1-CE1 3.35Å; W218-Y237 AromaticContact CD1-CZ 3.77Å; W218-Y237 HydrophobicContact CG-CE1 4.18Å; W218-Y237 AromaticContact NE1-CE1 3.82Å; W218-A240 HydrophobicContact CB-CB 4.36Å; W218-R249 HydrophobicContact CH2-CB 3.65Å; W218-R249 HydrophobicContact CZ2-CB 4.33Å; W218-R249 HydrophobicContact CZ3-CB 4.43Å; W218-L250 HydrophobicContact CB-CD1 3.74Å; W218-L250 HydrophobicContact CD2-CB 4.42Å; W218-L250 HydrophobicContact CD2-CD1 3.63Å; W218-L250 HydrophobicContact CE3-CB 4.11Å; W218-L250 HydrophobicContact CE3-CD1 3.98Å; W218-L250 HydrophobicContact CG-CD1 3.5Å; W218-L250 HydrophobicContact CZ3-CB 4.34Å; W218-Q253 HydrophobicContact CZ2-CG 4.06Å
219	I	93.4	Very high	93.9	Very high	34 Å²	34	58 Å²	58	17%	0.174	28%	0.284	C	S	.	.	H	α-helix	trans	-64.8	-35.5	178.2	-70.9	-177.1	0	0	0	112	Q158 R215 K216 G221 E222 V223	Q158-I219 HydrophobicContact CB-CD1 4.06Å; Q158-I219 HydrophobicContact CG-CD1 3.76Å; R215-I219 WeakPolarHBondContact O-CG1 3.37Å; R215-I219 PolarHBondContact O-N 2.85Å; K216-I219 PolarHBondContact O-N 2.93Å; K216-I219 VanDerWaalsContact O-N 3.15Å; I219-G221 VanDerWaalsContact C-N 3.35Å; I219-E222 PolarHBondContact O-N 3.38Å; I219-V223 VanDerWaalsContact O-CG2 3.31Å; I219-V223 WeakPolarHBondContact O-CG2 3.47Å; I219-V223 PolarHBondContact O-N 3.46Å; I219-V223 VanDerWaalsContact O-N 3.09Å
220	E	94.7	Very high	94	Very high	85 Å²	85	54.7 Å²	54.7	40%	0.397	27%	0.269	S	S	.	.	H	α-helix	trans	-59.2	-45.1	168.7	-72.5	179	-141.5	0	0	111.7	K216 M217 W218 V223 L224 R236	K216-E220 PolarHBondContact O-N 2.94Å; M217-E220 WeakPolarHBondContact O-CB 3.4Å; M217-E220 PolarHBondContact O-N 2.94Å; W218-E220 VanDerWaalsContact C-N 3.33Å; W218-E220 PolarHBondContact O-N 3.37Å; E220-V223 PolarHBondContact O-N 3.33Å; E220-V223 VanDerWaalsContact O-N 3.16Å; E220-L224 WeakPolarHBondContact O-CG 3.13Å; E220-L224 PolarHBondContact O-N 2.76Å; E220-R236 HydrophobicContact CB-CG 4.18Å; E220-R236 IonicContact OE2-CZ 3.61Å; E220-R236 IonicContact OE2-NH1 2.73Å; E220-R236 PolarHBondContact OE2-NH1 2.99Å
221	G	95.6	Very high	94.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.5	-45.5	176.3	0	0	0	0	0	113.2	M217 W218 I219 V223 L224 W225	M217-G221 PolarHBondContact O-N 3.01Å; W218-G221 WeakPolarHBondContact O-CA 3.48Å; W218-G221 PolarHBondContact O-N 3.33Å; I219-G221 VanDerWaalsContact C-N 3.35Å; G221-V223 VanDerWaalsContact C-N 3.31Å; G221-V223 PolarHBondContact O-N 2.72Å; G221-L224 PolarHBondContact O-N 2.93Å; G221-W225 VanDerWaalsContact O-CB 3.3Å; G221-W225 WeakPolarHBondContact O-CB 3.49Å; G221-W225 PolarHBondContact O-N 3.04Å
222	E	93.3	Very high	94.3	Very high	33 Å²	33	54.3 Å²	54.3	15%	0.154	28%	0.275	C	S	.	.	H	α-helix	trans	-59.8	-39.8	173.4	-67.8	176.5	-158.9	0	0	112.1	R172 R215 W218 I219 S226 Y237	R172-E222 IonicContact CZ-OE2 2.69Å; R172-E222 IonicContact NH1-OE2 2.81Å; R172-E222 PolarHBondContact NH1-OE2 3.47Å; R172-E222 IonicContact NH2-OE2 3.18Å; R172-E222 PolarHBondContact NH2-OE2 2.74Å; R215-E222 IonicContact NH1-OE1 3.13Å; R215-E222 PolarHBondContact NH1-OE1 3.15Å; W218-E222 PolarHBondContact NE1-OE1 3.07Å; W218-E222 PolarHBondContact O-N 3.11Å; I219-E222 PolarHBondContact O-N 3.38Å; E222-S226 WeakPolarHBondContact O-CB 3.42Å; E222-S226 PolarHBondContact O-N 3.07Å; E222-S226 PolarHBondContact O-OG 3.07Å; E222-Y237 VanDerWaalsContact CG-OH 3.3Å; E222-Y237 WeakPolarHBondContact CG-OH 3.46Å
223	V	93.9	Very high	94.5	Very high	53 Å²	53	54.3 Å²	54.3	32%	0.321	28%	0.275	S	S	.	.	H	α-helix	trans	-73.7	-26.8	179.7	169.8	0	0	0	0	112.5	I219 E220 G221 S226 K227	I219-V223 VanDerWaalsContact O-CG2 3.31Å; I219-V223 WeakPolarHBondContact O-CG2 3.47Å; I219-V223 PolarHBondContact O-N 3.46Å; I219-V223 VanDerWaalsContact O-N 3.09Å; E220-V223 PolarHBondContact O-N 3.33Å; E220-V223 VanDerWaalsContact O-N 3.16Å; G221-V223 VanDerWaalsContact C-N 3.31Å; G221-V223 PolarHBondContact O-N 2.72Å; V223-S226 WeakPolarHBondContact CA-OG 3.41Å; V223-S226 PolarHBondContact O-OG 3.13Å; V223-K227 VanDerWaalsContact O-CD 3.23Å; V223-K227 WeakPolarHBondContact O-CD 3.26Å; V223-K227 WeakPolarHBondContact O-CE 3.39Å; V223-K227 VanDerWaalsContact O-CG 3.26Å; V223-K227 WeakPolarHBondContact O-CG 3.31Å
224	L	95.4	Very high	94.6	Very high	32 Å²	32	50.2 Å²	50.2	17%	0.168	26%	0.261	C	S	.	.	H	α-helix	trans	-79.7	-40.6	172.4	-71.8	163.6	0	0	0	111.7	E220 G221 K227 Q228 N229 D232 A233 R236	E220-L224 WeakPolarHBondContact O-CG 3.13Å; E220-L224 PolarHBondContact O-N 2.76Å; G221-L224 PolarHBondContact O-N 2.93Å; L224-K227 CarbonylContact O-C 3.57Å; L224-K227 WeakPolarHBondContact O-CA 3.26Å; L224-K227 WeakPolarHBondContact O-CB 3.17Å; L224-K227 PolarHBondContact O-N 3.15Å; L224-K227 VanDerWaalsContact O-N 3.12Å; L224-Q228 PolarHBondContact O-N 3.05Å; L224-N229 PolarHBondContact O-N 2.94Å; L224-D232 HydrophobicContact CD1-CB 4.02Å; L224-D232 HydrophobicContact CD2-CB 4.3Å; L224-A233 HydrophobicContact CB-CB 3.8Å; L224-R236 HydrophobicContact CD1-CG 3.82Å
225	W	94.3	Very high	94.6	Very high	43 Å²	43	55.2 Å²	55.2	16%	0.163	28%	0.284	C	S	.	.	H	α-helix	trans	-63.9	-45.4	177.5	-173.4	3.7	0	0	0	111.7	G221 K227 Q228 L230 A233 Y237 E256 L257 E260	G221-W225 VanDerWaalsContact O-CB 3.3Å; G221-W225 WeakPolarHBondContact O-CB 3.49Å; G221-W225 PolarHBondContact O-N 3.04Å; W225-K227 PolarHBondContact O-N 3.39Å; W225-K227 VanDerWaalsContact O-N 3.14Å; W225-Q228 WeakPolarHBondContact O-CA 3.35Å; W225-Q228 PolarHBondContact O-N 2.64Å; W225-L230 VanDerWaalsContact CD1-CD2 3.48Å; W225-L230 HydrophobicContact CG-CD2 4.43Å; W225-A233 HydrophobicContact CB-CB 4.01Å; W225-Y237 AromaticContact CE3-CE2 3.92Å; W225-Y237 HydrophobicContact CE3-CE2 3.92Å; W225-Y237 HydrophobicContact CZ3-CE2 4.42Å; W225-E256 HydrophobicContact CH2-CB 3.83Å; W225-L257 HydrophobicContact CD2-CB 4.38Å; W225-L257 HydrophobicContact CD2-CD1 3.97Å; W225-L257 HydrophobicContact CE3-CB 4.26Å; W225-L257 HydrophobicContact CG-CD1 4.07Å; W225-L257 HydrophobicContact CH2-CB 3.98Å; W225-L257 HydrophobicContact CZ2-CB 4.08Å; W225-L257 HydrophobicContact CZ2-CD1 4.42Å; W225-L257 HydrophobicContact CZ3-CB 4.07Å; W225-E260 PolarHBondContact NE1-OE2 3.38Å
226	S	92.3	Very high	94.8	Very high	94 Å²	94	57.9 Å²	57.9	66%	0.657	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-18	173.7	53.1	0	0	0	0	114.1	E222 V223	E222-S226 WeakPolarHBondContact O-CB 3.42Å; E222-S226 PolarHBondContact O-N 3.07Å; E222-S226 PolarHBondContact O-OG 3.07Å; V223-S226 WeakPolarHBondContact CA-OG 3.41Å; V223-S226 PolarHBondContact O-OG 3.13Å
227	K	94.5	Very high	94.9	Very high	149 Å²	149	54.9 Å²	54.9	65%	0.648	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	11.1	171.1	-65.7	170.6	-170.5	169.6	0	113.3	V223 L224 W225 N229	V223-K227 VanDerWaalsContact O-CD 3.23Å; V223-K227 WeakPolarHBondContact O-CD 3.26Å; V223-K227 WeakPolarHBondContact O-CE 3.39Å; V223-K227 VanDerWaalsContact O-CG 3.26Å; V223-K227 WeakPolarHBondContact O-CG 3.31Å; L224-K227 CarbonylContact O-C 3.57Å; L224-K227 WeakPolarHBondContact O-CA 3.26Å; L224-K227 WeakPolarHBondContact O-CB 3.17Å; L224-K227 PolarHBondContact O-N 3.15Å; L224-K227 VanDerWaalsContact O-N 3.12Å; W225-K227 PolarHBondContact O-N 3.39Å; W225-K227 VanDerWaalsContact O-N 3.14Å; K227-N229 PolarHBondContact O-N 3.38Å
228	Q	93.4	Very high	94.9	Very high	126 Å²	126	55 Å²	55	59%	0.589	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	19.4	-176.9	-77.6	-74.8	-40.1	0	0	114.8	L224 W225 L230 E260	L224-Q228 PolarHBondContact O-N 3.05Å; W225-Q228 WeakPolarHBondContact O-CA 3.35Å; W225-Q228 PolarHBondContact O-N 2.64Å; Q228-L230 PolarHBondContact O-N 3.48Å; Q228-E260 PolarHBondContact NE2-OE1 3.09Å; Q228-E260 VanDerWaalsContact NE2-OE1 3.1Å
229	N	94.9	Very high	95	Very high	57 Å²	57	55.5 Å²	55.5	31%	0.305	29%	0.291	S	S	.	.			trans	-92.1	74.4	173.6	-171.3	-2.9	0	0	0	110.5	L224 K227 A231 D232 A233	L224-N229 PolarHBondContact O-N 2.94Å; K227-N229 PolarHBondContact O-N 3.38Å; N229-A231 VanDerWaalsContact C-N 3.32Å; N229-A231 PolarHBondContact O-N 2.91Å; N229-D232 VanDerWaalsContact ND2-CG 3.28Å; N229-D232 PolarHBondContact ND2-OD2 3.29Å; N229-A233 VanDerWaalsContact O-CB 3.26Å; N229-A233 WeakPolarHBondContact O-CB 3.44Å; N229-A233 PolarHBondContact O-N 3.01Å; N229-A233 VanDerWaalsContact O-N 3.07Å
230	L	94.9	Very high	95.1	Very high	33 Å²	33	53.9 Å²	53.9	17%	0.173	28%	0.282	C	S	.	.	H	α-helix	trans	-66.4	-29.7	-170.5	-52.7	-177.3	0	0	0	113.7	W225 Q228 L234 L257 E260 M261	W225-L230 VanDerWaalsContact CD1-CD2 3.48Å; W225-L230 HydrophobicContact CG-CD2 4.43Å; Q228-L230 PolarHBondContact O-N 3.48Å; L230-L234 WeakPolarHBondContact O-CB 3.38Å; L230-L234 PolarHBondContact O-N 3.34Å; L230-L257 HydrophobicContact CB-CD1 4.25Å; L230-L257 HydrophobicContact CD2-CD1 3.85Å; L230-E260 HydrophobicContact CD1-CG 4.32Å; L230-M261 HydrophobicContact CB-CE 4.12Å; L230-M261 HydrophobicContact CB-CG 3.9Å; L230-M261 HydrophobicContact CB-SD 4.1Å; L230-M261 HydrophobicContact CD1-CG 4.01Å
231	A	94.9	Very high	95.1	Very high	62 Å²	62	50.2 Å²	50.2	51%	0.512	27%	0.266	S	S	.	.	H	α-helix	trans	-71.8	-52.4	-178.6	0	0	0	0	0	111.7	N229 A233 L234 E235	N229-A231 VanDerWaalsContact C-N 3.32Å; N229-A231 PolarHBondContact O-N 2.91Å; A231-A233 VanDerWaalsContact C-N 3.29Å; A231-A233 PolarHBondContact O-N 2.88Å; A231-L234 PolarHBondContact O-N 2.69Å; A231-L234 VanDerWaalsContact O-N 3.16Å; A231-E235 PolarHBondContact O-N 3.44Å
232	D	95.1	Very high	95	Very high	73 Å²	73	56.4 Å²	56.4	39%	0.39	30%	0.299	S	S	.	.	H	α-helix	trans	-67.5	-33.4	177.9	-60.3	-1.2	0	0	0	110.8	L224 N229 E235 R236	L224-D232 HydrophobicContact CD1-CB 4.02Å; L224-D232 HydrophobicContact CD2-CB 4.3Å; N229-D232 VanDerWaalsContact ND2-CG 3.28Å; N229-D232 PolarHBondContact ND2-OD2 3.29Å; D232-E235 WeakPolarHBondContact O-CB 3.29Å; D232-E235 PolarHBondContact O-N 3.43Å; D232-R236 PolarHBondContact O-N 3.06Å
233	A	96.7	Very high	95	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-58.8	-46.8	171.1	0	0	0	0	0	111.4	L224 W225 N229 A231 E235 R236 Y237 L257	L224-A233 HydrophobicContact CB-CB 3.8Å; W225-A233 HydrophobicContact CB-CB 4.01Å; N229-A233 VanDerWaalsContact O-CB 3.26Å; N229-A233 WeakPolarHBondContact O-CB 3.44Å; N229-A233 PolarHBondContact O-N 3.01Å; N229-A233 VanDerWaalsContact O-N 3.07Å; A231-A233 VanDerWaalsContact C-N 3.29Å; A231-A233 PolarHBondContact O-N 2.88Å; A233-E235 VanDerWaalsContact C-N 3.33Å; A233-E235 PolarHBondContact O-N 3.2Å; A233-R236 PolarHBondContact O-N 3.04Å; A233-Y237 VanDerWaalsContact O-CD2 3.25Å; A233-Y237 WeakPolarHBondContact O-CD2 3.44Å; A233-Y237 PolarHBondContact O-N 3.47Å; A233-L257 HydrophobicContact CB-CD2 4.01Å
234	L	96.3	Very high	94.7	Very high	23 Å²	23	55.3 Å²	55.3	12%	0.12	29%	0.294	C	S	.	.	H	α-helix	trans	-64.3	-36.2	178.7	179.4	60.6	0	0	0	112.3	L230 A231 R236 Y237 N238 R254 L257 H258 M261	L230-L234 WeakPolarHBondContact O-CB 3.38Å; L230-L234 PolarHBondContact O-N 3.34Å; A231-L234 PolarHBondContact O-N 2.69Å; A231-L234 VanDerWaalsContact O-N 3.16Å; L234-R236 VanDerWaalsContact C-N 3.35Å; L234-R236 PolarHBondContact O-N 2.86Å; L234-Y237 PolarHBondContact O-N 2.92Å; L234-N238 WeakPolarHBondContact O-CB 3.29Å; L234-N238 VanDerWaalsContact O-CG 3.25Å; L234-N238 PolarHBondContact O-N 2.92Å; L234-N238 PolarHBondContact O-ND2 3.15Å; L234-R254 HydrophobicContact CD1-CG 4.01Å; L234-L257 HydrophobicContact CB-CD2 3.99Å; L234-L257 HydrophobicContact CD1-CD2 4.43Å; L234-H258 VanDerWaalsContact CD1-CE1 3.46Å; L234-H258 WeakPolarHBondContact CD1-CE1 3.49Å; L234-M261 HydrophobicContact CB-CE 4.5Å; L234-M261 HydrophobicContact CB-SD 4.05Å; L234-M261 HydrophobicContact CD2-CE 4.04Å; L234-M261 HydrophobicContact CD2-SD 3.8Å; L234-M261 HydrophobicContact CG-SD 4.45Å
235	E	96.6	Very high	94.3	Very high	109 Å²	109	57.8 Å²	57.8	51%	0.509	31%	0.312	S	S	.	.	H	α-helix	trans	-55.8	-49	171.5	-173.2	-161.9	-125.9	0	0	111.1	A231 D232 A233 N238 A239	A231-E235 PolarHBondContact O-N 3.44Å; D232-E235 WeakPolarHBondContact O-CB 3.29Å; D232-E235 PolarHBondContact O-N 3.43Å; A233-E235 VanDerWaalsContact C-N 3.33Å; A233-E235 PolarHBondContact O-N 3.2Å; E235-N238 PolarHBondContact O-N 2.8Å; E235-A239 PolarHBondContact O-N 3.11Å
236	R	97.1	Very high	93.7	Very high	75 Å²	75	59.8 Å²	59.8	28%	0.283	33%	0.333	S	S	.	.	H	α-helix	trans	-68.8	-36.4	179.5	-57.3	-59	144.2	89	10.9	113.2	M217 E220 L224 D232 A233 L234 N238 A239 A240	M217-R236 WeakPolarHBondContact O-CB 3.5Å; E220-R236 HydrophobicContact CB-CG 4.18Å; E220-R236 IonicContact OE2-CZ 3.61Å; E220-R236 IonicContact OE2-NH1 2.73Å; E220-R236 PolarHBondContact OE2-NH1 2.99Å; L224-R236 HydrophobicContact CD1-CG 3.82Å; D232-R236 PolarHBondContact O-N 3.06Å; A233-R236 PolarHBondContact O-N 3.04Å; L234-R236 VanDerWaalsContact C-N 3.35Å; L234-R236 PolarHBondContact O-N 2.86Å; R236-N238 VanDerWaalsContact C-N 3.34Å; R236-A239 PolarHBondContact O-N 3.41Å; R236-A240 VanDerWaalsContact O-CB 3.29Å; R236-A240 WeakPolarHBondContact O-CB 3.27Å; R236-A240 PolarHBondContact O-N 3.02Å
237	Y	95.9	Very high	93.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.1	-37	172.2	-86.2	-71.2	0	0	0	112.6	W218 E222 W225 A233 L234 V241 L250 Q253 R254 L257	W218-Y237 AromaticContact CD1-CE1 3.35Å; W218-Y237 AromaticContact CD1-CZ 3.77Å; W218-Y237 HydrophobicContact CG-CE1 4.18Å; W218-Y237 AromaticContact NE1-CE1 3.82Å; E222-Y237 VanDerWaalsContact CG-OH 3.3Å; E222-Y237 WeakPolarHBondContact CG-OH 3.46Å; W225-Y237 AromaticContact CE3-CE2 3.92Å; W225-Y237 HydrophobicContact CE3-CE2 3.92Å; W225-Y237 HydrophobicContact CZ3-CE2 4.42Å; A233-Y237 VanDerWaalsContact O-CD2 3.25Å; A233-Y237 WeakPolarHBondContact O-CD2 3.44Å; A233-Y237 PolarHBondContact O-N 3.47Å; L234-Y237 PolarHBondContact O-N 2.92Å; Y237-V241 VanDerWaalsContact O-CG2 3.29Å; Y237-V241 WeakPolarHBondContact O-CG2 3.32Å; Y237-V241 PolarHBondContact O-N 2.85Å; Y237-L250 HydrophobicContact CD1-CD1 3.74Å; Y237-L250 HydrophobicContact CE1-CD1 3.99Å; Y237-Q253 HydrophobicContact CD1-CB 4.45Å; Y237-Q253 HydrophobicContact CE1-CB 3.52Å; Y237-R254 HydrophobicContact CD1-CB 4.23Å; Y237-R254 HydrophobicContact CG-CB 4.38Å; Y237-L257 HydrophobicContact CD2-CD2 3.55Å; Y237-L257 HydrophobicContact CE2-CD2 4.02Å; Y237-L257 HydrophobicContact CG-CD2 4.44Å
238	N	95.5	Very high	92.9	Very high	54 Å²	54	50.9 Å²	50.9	29%	0.289	29%	0.293	S	S	.	.	H	α-helix	trans	-65.1	-53.2	174	-71.8	-25.2	0	0	0	111.2	L234 E235 R236 A240 V241 D242 R254	L234-N238 WeakPolarHBondContact O-CB 3.29Å; L234-N238 VanDerWaalsContact O-CG 3.25Å; L234-N238 PolarHBondContact O-N 2.92Å; L234-N238 PolarHBondContact O-ND2 3.15Å; E235-N238 PolarHBondContact O-N 2.8Å; R236-N238 VanDerWaalsContact C-N 3.34Å; N238-A240 PolarHBondContact O-N 2.87Å; N238-V241 PolarHBondContact O-N 3.4Å; N238-D242 VanDerWaalsContact O-CG 3.24Å; N238-D242 PolarHBondContact O-N 2.98Å; N238-R254 VanDerWaalsContact OD1-CD 3.29Å; N238-R254 WeakPolarHBondContact OD1-CD 3.44Å; N238-R254 PolarHBondContact OD1-NH1 3.34Å
239	A	96.1	Very high	92.5	Very high	30 Å²	30	48.2 Å²	48.2	25%	0.248	28%	0.278	C	S	.	.	H	α-helix	trans	-58.8	-33.8	178.7	0	0	0	0	0	113	M217 E235 R236 L243	M217-A239 HydrophobicContact CE-CB 4.25Å; M217-A239 HydrophobicContact SD-CB 3.62Å; E235-A239 PolarHBondContact O-N 3.11Å; R236-A239 PolarHBondContact O-N 3.41Å; A239-L243 WeakPolarHBondContact O-CG 3.25Å; A239-L243 PolarHBondContact O-N 2.7Å
240	A	95.4	Very high	92.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-67.1	-42.1	172.2	0	0	0	0	0	112.7	A214 M217 W218 R236 N238 L243 A244 L250	A214-A240 WeakPolarHBondContact O-CB 3.36Å; M217-A240 HydrophobicContact CB-CB 3.84Å; W218-A240 HydrophobicContact CB-CB 4.36Å; R236-A240 VanDerWaalsContact O-CB 3.29Å; R236-A240 WeakPolarHBondContact O-CB 3.27Å; R236-A240 PolarHBondContact O-N 3.02Å; N238-A240 PolarHBondContact O-N 2.87Å; A240-L243 PolarHBondContact O-N 2.72Å; A240-A244 PolarHBondContact O-N 2.68Å; A240-L250 HydrophobicContact CB-CD1 3.93Å; A240-L250 HydrophobicContact CB-CD2 3.83Å; A240-L250 HydrophobicContact CB-CG 4.49Å
241	V	93.9	Very high	92.1	Very high	9 Å²	9	44.2 Å²	44.2	6%	0.055	26%	0.256	C	S	.	.	H	α-helix	trans	-70.7	-35.7	178.9	170.3	0	0	0	0	111.3	Y237 N238 L243 A244 P245 L250 L251	Y237-V241 VanDerWaalsContact O-CG2 3.29Å; Y237-V241 WeakPolarHBondContact O-CG2 3.32Å; Y237-V241 PolarHBondContact O-N 2.85Å; N238-V241 PolarHBondContact O-N 3.4Å; V241-L243 PolarHBondContact O-N 3.17Å; V241-A244 CarbonylContact O-C 3.58Å; V241-A244 VanDerWaalsContact O-C 3.27Å; V241-A244 PolarHBondContact O-N 2.99Å; V241-A244 VanDerWaalsContact O-N 3.14Å; V241-P245 WeakPolarHBondContact O-CA 3.42Å; V241-P245 WeakPolarHBondContact O-CB 3.37Å; V241-P245 VanDerWaalsContact O-CD 3.29Å; V241-P245 WeakPolarHBondContact O-CD 3.32Å; V241-L250 HydrophobicContact CB-CD2 4.43Å; V241-L250 HydrophobicContact CG2-CD2 3.71Å; V241-L250 HydrophobicContact CG2-CG 3.71Å; V241-L251 HydrophobicContact CG1-CD2 3.88Å; V241-L251 HydrophobicContact CG2-CD2 4.03Å
242	D	94.4	Very high	92	Very high	129 Å²	129	41.4 Å²	41.4	69%	0.69	23%	0.233	S	C	*	.	H	α-helix	trans	-62.5	-29.7	175.7	-63.6	-27.9	0	0	0	112	N238	N238-D242 VanDerWaalsContact O-CG 3.24Å; N238-D242 PolarHBondContact O-N 2.98Å
243	L	93.4	Very high	91.8	Very high	47 Å²	47	40.1 Å²	40.1	25%	0.246	22%	0.224	C	C	.	.	H	α-helix	trans	-83.9	-29.6	172.8	-68.8	174.6	0	0	0	113.9	R213 A214 M217 A239 A240 V241	R213-L243 HydrophobicContact CB-CD1 3.77Å; A214-L243 HydrophobicContact CB-CB 3.9Å; A214-L243 HydrophobicContact CB-CD1 4.48Å; M217-L243 HydrophobicContact CE-CD1 4.2Å; M217-L243 HydrophobicContact SD-CD1 3.65Å; A239-L243 WeakPolarHBondContact O-CG 3.25Å; A239-L243 PolarHBondContact O-N 2.7Å; A240-L243 PolarHBondContact O-N 2.72Å; V241-L243 PolarHBondContact O-N 3.17Å
244	A	88.4	Confident	91.7	Very high	16 Å²	16	41.7 Å²	41.7	13%	0.132	23%	0.23	C	C	.	.			trans	-139	62.8	-173.6	0	0	0	0	0	113.2	A214 A240 V241 S246 S247 L250	A214-A244 HydrophobicContact CB-CB 3.66Å; A240-A244 PolarHBondContact O-N 2.68Å; V241-A244 CarbonylContact O-C 3.58Å; V241-A244 VanDerWaalsContact O-C 3.27Å; V241-A244 PolarHBondContact O-N 2.99Å; V241-A244 VanDerWaalsContact O-N 3.14Å; A244-S246 PolarHBondContact O-N 3.16Å; A244-S246 VanDerWaalsContact O-N 3.12Å; A244-S247 VanDerWaalsContact O-CB 3.29Å; A244-S247 WeakPolarHBondContact O-CB 3.34Å; A244-S247 PolarHBondContact O-N 2.72Å; A244-L250 HydrophobicContact CB-CD2 4.43Å
245	P	85.3	Confident	91.7	Very high	84 Å²	84	40.6 Å²	40.6	55%	0.545	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-13.5	-167.8	27	-36.2	0	0	0	114.9	V241 L251	V241-P245 WeakPolarHBondContact O-CA 3.42Å; V241-P245 WeakPolarHBondContact O-CB 3.37Å; V241-P245 VanDerWaalsContact O-CD 3.29Å; V241-P245 WeakPolarHBondContact O-CD 3.32Å; P245-L251 WeakPolarHBondContact O-CD1 3.25Å
246	S	82.3	Confident	91.5	Very high	86 Å²	86	38 Å²	38	60%	0.601	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-0	174.9	52.2	0	0	0	0	113.9	A244 G248	A244-S246 PolarHBondContact O-N 3.16Å; A244-S246 VanDerWaalsContact O-N 3.12Å; S246-G248 PolarHBondContact O-N 3.28Å; S246-G248 VanDerWaalsContact O-N 3.07Å
247	S	84.9	Confident	91.4	Very high	33 Å²	33	34.4 Å²	34.4	23%	0.231	20%	0.199	C	C	.	.			trans	-75.4	98.9	-175.2	-177.4	0	0	0	0	112.2	A244 R249 L250 L251	A244-S247 VanDerWaalsContact O-CB 3.29Å; A244-S247 WeakPolarHBondContact O-CB 3.34Å; A244-S247 PolarHBondContact O-N 2.72Å; S247-R249 PolarHBondContact O-N 3.17Å; S247-L250 WeakPolarHBondContact O-CB 3.21Å; S247-L250 PolarHBondContact O-N 3.28Å; S247-L250 VanDerWaalsContact O-N 3.13Å; S247-L250 WeakPolarHBondContact OG-CB 3.23Å; S247-L251 PolarHBondContact O-N 3.41Å
248	G	84.6	Confident	91.4	Very high	23 Å²	23	35 Å²	35	24%	0.237	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-36.6	-175.5	0	0	0	0	0	114.9	S246 C252 L274	S246-G248 PolarHBondContact O-N 3.28Å; S246-G248 VanDerWaalsContact O-N 3.07Å; G248-C252 VanDerWaalsContact O-CB 3.29Å; G248-C252 WeakPolarHBondContact O-CB 3.48Å; G248-C252 PolarHBondContact O-N 3.29Å; G248-C252 VanDerWaalsContact O-N 3.14Å; G248-L274 VanDerWaalsContact O-CD2 3.29Å; G248-L274 WeakPolarHBondContact O-CD2 3.44Å
249	R	86.4	Confident	91.3	Very high	70 Å²	70	33.2 Å²	33.2	26%	0.264	19%	0.192	S	C	.	.	H	α-helix	trans	-70.5	-34.8	175.3	-72.9	-173.7	170.5	-119.6	-9.6	112	E138 E140 W218 S247 C252 Q253	E138-R249 IonicContact OE1-CZ 3.92Å; E138-R249 IonicContact OE1-NH1 3.18Å; E138-R249 PolarHBondContact OE1-NH1 2.93Å; E138-R249 VanDerWaalsContact OE1-NH1 3.16Å; E138-R249 IonicContact OE1-NH2 2.85Å; E138-R249 PolarHBondContact OE1-NH2 3.39Å; E138-R249 IonicContact OE2-NH2 3.41Å; E140-R249 IonicContact OE1-NH2 2.69Å; E140-R249 IonicContact OE2-CZ 3.76Å; E140-R249 IonicContact OE2-NE 2.82Å; E140-R249 IonicContact OE2-NH2 2.65Å; E140-R249 PolarHBondContact OE2-NH2 2.91Å; W218-R249 HydrophobicContact CH2-CB 3.65Å; W218-R249 HydrophobicContact CZ2-CB 4.33Å; W218-R249 HydrophobicContact CZ3-CB 4.43Å; S247-R249 PolarHBondContact O-N 3.17Å; R249-C252 WeakPolarHBondContact O-CB 3.47Å; R249-Q253 WeakPolarHBondContact O-CG 3.48Å; R249-Q253 PolarHBondContact O-N 2.99Å
250	L	89.9	Confident	91.2	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-69.7	-49.1	178.6	177.4	63.6	0	0	0	112.3	W218 Y237 A240 V241 A244 S247 C252 Q253 R254	W218-L250 HydrophobicContact CB-CD1 3.74Å; W218-L250 HydrophobicContact CD2-CB 4.42Å; W218-L250 HydrophobicContact CD2-CD1 3.63Å; W218-L250 HydrophobicContact CE3-CB 4.11Å; W218-L250 HydrophobicContact CE3-CD1 3.98Å; W218-L250 HydrophobicContact CG-CD1 3.5Å; W218-L250 HydrophobicContact CZ3-CB 4.34Å; Y237-L250 HydrophobicContact CD1-CD1 3.74Å; Y237-L250 HydrophobicContact CE1-CD1 3.99Å; A240-L250 HydrophobicContact CB-CD1 3.93Å; A240-L250 HydrophobicContact CB-CD2 3.83Å; A240-L250 HydrophobicContact CB-CG 4.49Å; V241-L250 HydrophobicContact CB-CD2 4.43Å; V241-L250 HydrophobicContact CG2-CD2 3.71Å; V241-L250 HydrophobicContact CG2-CG 3.71Å; A244-L250 HydrophobicContact CB-CD2 4.43Å; S247-L250 WeakPolarHBondContact O-CB 3.21Å; S247-L250 PolarHBondContact O-N 3.28Å; S247-L250 VanDerWaalsContact O-N 3.13Å; S247-L250 WeakPolarHBondContact OG-CB 3.23Å; L250-C252 PolarHBondContact O-N 2.74Å; L250-Q253 PolarHBondContact O-N 3.06Å; L250-Q253 VanDerWaalsContact O-N 3.1Å; L250-R254 PolarHBondContact O-N 2.8Å
251	L	91.6	Very high	91.1	Very high	5 Å²	5	38.2 Å²	38.2	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-34.4	175	-77.7	173.7	0	0	0	111.9	V241 P245 S247 R254 A255 D270 L274 L277	V241-L251 HydrophobicContact CG1-CD2 3.88Å; V241-L251 HydrophobicContact CG2-CD2 4.03Å; P245-L251 WeakPolarHBondContact O-CD1 3.25Å; S247-L251 PolarHBondContact O-N 3.41Å; L251-R254 PolarHBondContact O-N 2.93Å; L251-A255 VanDerWaalsContact O-CB 3.31Å; L251-A255 WeakPolarHBondContact O-CB 3.48Å; L251-A255 PolarHBondContact O-N 3.12Å; L251-D270 HydrophobicContact CD2-CB 4.42Å; L251-L274 HydrophobicContact CB-CD2 3.47Å; L251-L274 VanDerWaalsContact CB-CD2 3.47Å; L251-L274 HydrophobicContact CB-CG 4.04Å; L251-L274 HydrophobicContact CD1-CD2 3.99Å; L251-L274 HydrophobicContact CG-CD2 4.4Å; L251-L277 HydrophobicContact CD1-CD1 3.96Å
252	C	91.5	Very high	91.1	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.02	24%	0.244	C	C	.	.	H	α-helix	trans	-61.2	-44.6	172.5	-169.4	0	0	0	0	111.8	G248 R249 L250 E256 L274 W281 K283 L287	G248-C252 VanDerWaalsContact O-CB 3.29Å; G248-C252 WeakPolarHBondContact O-CB 3.48Å; G248-C252 PolarHBondContact O-N 3.29Å; G248-C252 VanDerWaalsContact O-N 3.14Å; R249-C252 WeakPolarHBondContact O-CB 3.47Å; L250-C252 PolarHBondContact O-N 2.74Å; C252-E256 WeakPolarHBondContact O-CB 3.46Å; C252-E256 VanDerWaalsContact O-CG 3.26Å; C252-E256 WeakPolarHBondContact O-CG 3.5Å; C252-E256 PolarHBondContact O-N 2.92Å; C252-E256 PolarHBondContact SG-OE1 2.94Å; C252-L274 HydrophobicContact CB-CD1 4.08Å; C252-W281 HydrophobicContact CB-CH2 4.08Å; C252-K283 PolarHBondContact SG-NZ 2.92Å; C252-L287 HydrophobicContact CB-CD2 4.37Å
253	Q	91.9	Very high	91.1	Very high	45 Å²	45	44 Å²	44	21%	0.21	23%	0.226	C	C	.	.	H	α-helix	trans	-68.3	-40.7	177.1	-67.3	-62.3	-87.1	0	0	112.8	W218 Y237 R249 L250 E256 L257	W218-Q253 HydrophobicContact CZ2-CG 4.06Å; Y237-Q253 HydrophobicContact CD1-CB 4.45Å; Y237-Q253 HydrophobicContact CE1-CB 3.52Å; R249-Q253 WeakPolarHBondContact O-CG 3.48Å; R249-Q253 PolarHBondContact O-N 2.99Å; L250-Q253 PolarHBondContact O-N 3.06Å; L250-Q253 VanDerWaalsContact O-N 3.1Å; Q253-E256 PolarHBondContact NE2-OE2 3.07Å; Q253-E256 PolarHBondContact O-N 3.03Å; Q253-L257 PolarHBondContact O-N 3.29Å
254	R	95	Very high	91.2	Very high	33 Å²	33	44.1 Å²	44.1	13%	0.125	23%	0.225	C	C	.	.	H	α-helix	trans	-64.7	-39.9	175.8	-169.8	174.8	71.9	-179.9	-4.7	112.2	L234 Y237 N238 L250 L251 L257 H258 D270	L234-R254 HydrophobicContact CD1-CG 4.01Å; Y237-R254 HydrophobicContact CD1-CB 4.23Å; Y237-R254 HydrophobicContact CG-CB 4.38Å; N238-R254 VanDerWaalsContact OD1-CD 3.29Å; N238-R254 WeakPolarHBondContact OD1-CD 3.44Å; N238-R254 PolarHBondContact OD1-NH1 3.34Å; L250-R254 PolarHBondContact O-N 2.8Å; L251-R254 PolarHBondContact O-N 2.93Å; R254-L257 PolarHBondContact O-N 2.91Å; R254-H258 WeakPolarHBondContact O-CB 3.41Å; R254-H258 PolarHBondContact O-CD2 3.43Å; R254-H258 PolarHBondContact O-N 3.03Å; R254-D270 WeakPolarHBondContact CG-OD2 3.3Å; R254-D270 IonicContact CZ-OD1 3.68Å; R254-D270 IonicContact CZ-OD2 2.68Å; R254-D270 IonicContact NE-OD1 2.7Å; R254-D270 PolarHBondContact NE-OD1 3.49Å; R254-D270 IonicContact NE-OD2 3.93Å; R254-D270 PolarHBondContact NE-OD2 3.48Å; R254-D270 IonicContact NH2-OD1 3.76Å; R254-D270 PolarHBondContact NH2-OD1 2.99Å; R254-D270 IonicContact NH2-OD2 3.29Å
255	A	94.4	Very high	91.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.5	-41.3	173.5	0	0	0	0	0	112.6	L251 H258 M259 A267 D270 L287	L251-A255 VanDerWaalsContact O-CB 3.31Å; L251-A255 WeakPolarHBondContact O-CB 3.48Å; L251-A255 PolarHBondContact O-N 3.12Å; A255-H258 PolarHBondContact O-N 2.75Å; A255-M259 WeakPolarHBondContact O-CB 2.99Å; A255-M259 WeakPolarHBondContact O-CG 3.31Å; A255-M259 PolarHBondContact O-N 2.88Å; A255-A267 HydrophobicContact CB-CB 4.43Å; A255-D270 HydrophobicContact CB-CB 3.8Å; A255-L287 HydrophobicContact CB-CD2 3.82Å; A255-L287 HydrophobicContact CB-CG 4.3Å
256	E	93.8	Very high	91.9	Very high	54 Å²	54	47.3 Å²	47.3	25%	0.252	23%	0.233	S	C	.	.	H	α-helix	trans	-62.7	-40.5	174.5	-73.1	168	-159.4	0	0	111.5	W225 C252 Q253 M259 E260 K283 L287	W225-E256 HydrophobicContact CH2-CB 3.83Å; C252-E256 WeakPolarHBondContact O-CB 3.46Å; C252-E256 VanDerWaalsContact O-CG 3.26Å; C252-E256 WeakPolarHBondContact O-CG 3.5Å; C252-E256 PolarHBondContact O-N 2.92Å; C252-E256 PolarHBondContact SG-OE1 2.94Å; Q253-E256 PolarHBondContact NE2-OE2 3.07Å; Q253-E256 PolarHBondContact O-N 3.03Å; E256-M259 WeakPolarHBondContact O-CB 2.96Å; E256-M259 PolarHBondContact O-N 3Å; E256-E260 PolarHBondContact O-N 2.61Å; E256-K283 WeakPolarHBondContact OE1-CE 3.29Å; E256-K283 IonicContact OE1-NZ 2.85Å; E256-K283 PolarHBondContact OE1-NZ 2.99Å; E256-L287 HydrophobicContact CG-CD1 3.91Å
257	L	94.9	Very high	92.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.7	-45.3	172.6	175.4	60.1	0	0	0	112.6	W225 L230 A233 L234 Y237 Q253 R254 M259 E260 M261	W225-L257 HydrophobicContact CD2-CB 4.38Å; W225-L257 HydrophobicContact CD2-CD1 3.97Å; W225-L257 HydrophobicContact CE3-CB 4.26Å; W225-L257 HydrophobicContact CG-CD1 4.07Å; W225-L257 HydrophobicContact CH2-CB 3.98Å; W225-L257 HydrophobicContact CZ2-CB 4.08Å; W225-L257 HydrophobicContact CZ2-CD1 4.42Å; W225-L257 HydrophobicContact CZ3-CB 4.07Å; L230-L257 HydrophobicContact CB-CD1 4.25Å; L230-L257 HydrophobicContact CD2-CD1 3.85Å; A233-L257 HydrophobicContact CB-CD2 4.01Å; L234-L257 HydrophobicContact CB-CD2 3.99Å; L234-L257 HydrophobicContact CD1-CD2 4.43Å; Y237-L257 HydrophobicContact CD2-CD2 3.55Å; Y237-L257 HydrophobicContact CE2-CD2 4.02Å; Y237-L257 HydrophobicContact CG-CD2 4.44Å; Q253-L257 PolarHBondContact O-N 3.29Å; R254-L257 PolarHBondContact O-N 2.91Å; L257-M259 PolarHBondContact O-N 2.99Å; L257-E260 PolarHBondContact O-N 3.04Å; L257-E260 VanDerWaalsContact O-N 3.08Å; L257-M261 HydrophobicContact CD1-CG 4.17Å; L257-M261 HydrophobicContact CD1-SD 4.16Å; L257-M261 HydrophobicContact CG-SD 4.1Å; L257-M261 WeakPolarHBondContact O-CG 3.44Å; L257-M261 PolarHBondContact O-N 3.47Å
258	H	95.9	Very high	92.9	Very high	13 Å²	13	41.8 Å²	41.8	6%	0.06	19%	0.194	C	C	.	.	H	α-helix	trans	-57.1	-34.2	174.1	-83.5	-52.5	0	0	0	112.1	L234 R254 A255 M261 R262 N263 A267 D270	L234-H258 VanDerWaalsContact CD1-CE1 3.46Å; L234-H258 WeakPolarHBondContact CD1-CE1 3.49Å; R254-H258 WeakPolarHBondContact O-CB 3.41Å; R254-H258 PolarHBondContact O-CD2 3.43Å; R254-H258 PolarHBondContact O-N 3.03Å; A255-H258 PolarHBondContact O-N 2.75Å; H258-M261 PolarHBondContact O-N 3.14Å; H258-R262 PolarHBondContact O-N 2.75Å; H258-N263 HydrophobicContact CB-CB 4.23Å; H258-N263 PolarHBondContact O-N 3.23Å; H258-A267 HydrophobicContact CB-CB 3.85Å; H258-D270 IonicContact CD2-OD2 2.74Å
259	M	93.4	Very high	93.3	Very high	16 Å²	16	46.5 Å²	46.5	8%	0.079	21%	0.21	C	C	.	.	H	α-helix	trans	-70.6	-29.2	176.4	-74.9	-76.9	-86.9	0	0	114.2	A255 E256 L257 F264 A267 T290 A291 K294	A255-M259 WeakPolarHBondContact O-CB 2.99Å; A255-M259 WeakPolarHBondContact O-CG 3.31Å; A255-M259 PolarHBondContact O-N 2.88Å; E256-M259 WeakPolarHBondContact O-CB 2.96Å; E256-M259 PolarHBondContact O-N 3Å; L257-M259 PolarHBondContact O-N 2.99Å; M259-F264 HydrophobicContact SD-CD1 3.7Å; M259-F264 HydrophobicContact SD-CE1 4.28Å; M259-A267 HydrophobicContact CG-CB 3.64Å; M259-A267 HydrophobicContact SD-CB 4.03Å; M259-T290 HydrophobicContact CE-CG2 3.69Å; M259-T290 WeakPolarHBondContact CE-O 3.44Å; M259-A291 VanDerWaalsContact CE-CA 3.49Å; M259-A291 HydrophobicContact CE-CB 4.01Å; M259-A291 HydrophobicContact CG-CB 4.49Å; M259-A291 VanDerWaalsContact SD-CA 3.53Å; M259-A291 HydrophobicContact SD-CB 3.65Å; M259-K294 HydrophobicContact CE-CB 4.34Å; M259-K294 HydrophobicContact CE-CD 3.58Å; M259-K294 HydrophobicContact CE-CG 4.01Å; M259-K294 HydrophobicContact SD-CB 4.44Å; M259-K294 HydrophobicContact SD-CD 4.08Å
260	E	93.7	Very high	93.7	Very high	85 Å²	85	43.6 Å²	43.6	40%	0.397	20%	0.2	S	C	.	.	H	α-helix	trans	-75.8	-42.3	171.2	-170.6	171.2	167.5	0	0	110.6	W225 Q228 L230 E256 L257 R262	W225-E260 PolarHBondContact NE1-OE2 3.38Å; Q228-E260 PolarHBondContact NE2-OE1 3.09Å; Q228-E260 VanDerWaalsContact NE2-OE1 3.1Å; L230-E260 HydrophobicContact CD1-CG 4.32Å; E256-E260 PolarHBondContact O-N 2.61Å; L257-E260 PolarHBondContact O-N 3.04Å; L257-E260 VanDerWaalsContact O-N 3.08Å; E260-R262 PolarHBondContact O-N 3.09Å; E260-R262 VanDerWaalsContact O-N 3.1Å
261	M	94.3	Very high	93.8	Very high	51 Å²	51	43.6 Å²	43.6	25%	0.251	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	1.1	175.9	-62.1	-179.1	83.5	0	0	114.9	L230 L234 L257 H258 N263	L230-M261 HydrophobicContact CB-CE 4.12Å; L230-M261 HydrophobicContact CB-CG 3.9Å; L230-M261 HydrophobicContact CB-SD 4.1Å; L230-M261 HydrophobicContact CD1-CG 4.01Å; L234-M261 HydrophobicContact CB-CE 4.5Å; L234-M261 HydrophobicContact CB-SD 4.05Å; L234-M261 HydrophobicContact CD2-CE 4.04Å; L234-M261 HydrophobicContact CD2-SD 3.8Å; L234-M261 HydrophobicContact CG-SD 4.45Å; L257-M261 HydrophobicContact CD1-CG 4.17Å; L257-M261 HydrophobicContact CD1-SD 4.16Å; L257-M261 HydrophobicContact CG-SD 4.1Å; L257-M261 WeakPolarHBondContact O-CG 3.44Å; L257-M261 PolarHBondContact O-N 3.47Å; H258-M261 PolarHBondContact O-N 3.14Å; M261-N263 PolarHBondContact O-N 2.79Å
262	R	93.6	Very high	93.8	Very high	200 Å²	200	45.5 Å²	45.5	76%	0.755	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.7	17.1	-174.1	-51.6	-175.5	-179.1	-164.7	-0.6	115.7	H258 E260 F264	H258-R262 PolarHBondContact O-N 2.75Å; E260-R262 PolarHBondContact O-N 3.09Å; E260-R262 VanDerWaalsContact O-N 3.1Å; R262-F264 HydrophobicContact CB-CE1 4.19Å; R262-F264 HydrophobicContact CB-CE2 4.08Å; R262-F264 HydrophobicContact CB-CZ 3.75Å; R262-F264 HydrophobicContact CG-CZ 3.98Å; R262-F264 WeakPolarHBondContact O-CD2 3.44Å; R262-F264 PolarHBondContact O-N 3.1Å
263	N	94.8	Very high	93.8	Very high	59 Å²	59	47.5 Å²	47.5	32%	0.316	22%	0.224	S	C	.	.			trans	-83.4	58.1	176.6	-72.5	-39.2	0	0	0	110.7	H258 M261 N265 Q266 A267	H258-N263 HydrophobicContact CB-CB 4.23Å; H258-N263 PolarHBondContact O-N 3.23Å; M261-N263 PolarHBondContact O-N 2.79Å; N263-N265 VanDerWaalsContact C-N 3.33Å; N263-N265 PolarHBondContact O-N 3.45Å; N263-Q266 PolarHBondContact O-N 2.75Å; N263-Q266 VanDerWaalsContact O-N 3.16Å; N263-Q266 PolarHBondContact O-OE1 3.34Å; N263-A267 PolarHBondContact O-N 2.95Å; N263-A267 VanDerWaalsContact O-N 3.15Å
264	F	94.7	Very high	93.7	Very high	49 Å²	49	45.4 Å²	45.4	22%	0.215	21%	0.214	C	C	.	.	H	α-helix	trans	-63.2	-34.8	-166.5	-50.9	-52.1	0	0	0	113.6	M259 R262 Q266 A267 V268 K294 A295	M259-F264 HydrophobicContact SD-CD1 3.7Å; M259-F264 HydrophobicContact SD-CE1 4.28Å; R262-F264 HydrophobicContact CB-CE1 4.19Å; R262-F264 HydrophobicContact CB-CE2 4.08Å; R262-F264 HydrophobicContact CB-CZ 3.75Å; R262-F264 HydrophobicContact CG-CZ 3.98Å; R262-F264 WeakPolarHBondContact O-CD2 3.44Å; R262-F264 PolarHBondContact O-N 3.1Å; F264-Q266 VanDerWaalsContact C-N 3.32Å; F264-Q266 PolarHBondContact O-N 3.25Å; F264-A267 PolarHBondContact O-N 3.3Å; F264-V268 WeakPolarHBondContact O-CG2 3.47Å; F264-V268 PolarHBondContact O-N 3.18Å; F264-K294 HydrophobicContact CD1-CB 3.74Å; F264-K294 HydrophobicContact CD1-CD 4.26Å; F264-K294 HydrophobicContact CD2-CB 4.35Å; F264-K294 WeakPolarHBondContact CD2-O 3.21Å; F264-K294 HydrophobicContact CE1-CB 3.68Å; F264-K294 HydrophobicContact CE1-CD 3.64Å; F264-K294 HydrophobicContact CE1-CG 4.32Å; F264-K294 HydrophobicContact CE2-CB 4.3Å; F264-K294 WeakPolarHBondContact CE2-O 3.31Å; F264-K294 HydrophobicContact CG-CB 4.09Å; F264-K294 HydrophobicContact CZ-CB 3.97Å; F264-K294 HydrophobicContact CZ-CD 4.21Å; F264-A295 HydrophobicContact CB-CB 3.83Å
265	N	93.3	Very high	93.4	Very high	89 Å²	89	44.6 Å²	44.6	48%	0.476	21%	0.213	S	C	.	.	H	α-helix	trans	-64	-36.7	177.6	-76.9	-57.5	0	0	0	112.5	N263 V268 Q269	N263-N265 VanDerWaalsContact C-N 3.33Å; N263-N265 PolarHBondContact O-N 3.45Å; N265-V268 PolarHBondContact O-N 2.99Å; N265-Q269 WeakPolarHBondContact O-CG 3.42Å; N265-Q269 PolarHBondContact O-N 2.83Å
266	Q	94.3	Very high	93.1	Very high	78 Å²	78	54.2 Å²	54.2	36%	0.364	25%	0.249	S	C	.	.	H	α-helix	trans	-71	-41.7	175.1	-68	78.5	-2.2	0	0	111	N263 F264 V268 Q269 D270	N263-Q266 PolarHBondContact O-N 2.75Å; N263-Q266 VanDerWaalsContact O-N 3.16Å; N263-Q266 PolarHBondContact O-OE1 3.34Å; F264-Q266 VanDerWaalsContact C-N 3.32Å; F264-Q266 PolarHBondContact O-N 3.25Å; Q266-V268 VanDerWaalsContact C-N 3.27Å; Q266-V268 PolarHBondContact O-N 3.08Å; Q266-Q269 WeakPolarHBondContact O-CB 3.35Å; Q266-Q269 PolarHBondContact O-N 3.23Å; Q266-D270 PolarHBondContact O-N 2.9Å
267	A	94.8	Very high	92.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.6	-38.3	171.9	0	0	0	0	0	112.5	A255 H258 M259 N263 F264 A271 A291	A255-A267 HydrophobicContact CB-CB 4.43Å; H258-A267 HydrophobicContact CB-CB 3.85Å; M259-A267 HydrophobicContact CG-CB 3.64Å; M259-A267 HydrophobicContact SD-CB 4.03Å; N263-A267 PolarHBondContact O-N 2.95Å; N263-A267 VanDerWaalsContact O-N 3.15Å; F264-A267 PolarHBondContact O-N 3.3Å; A267-A271 VanDerWaalsContact O-CB 3.25Å; A267-A271 WeakPolarHBondContact O-CB 3.39Å; A267-A271 PolarHBondContact O-N 2.95Å; A267-A291 HydrophobicContact CB-CB 4.01Å
268	V	94.3	Very high	92	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.024	28%	0.277	C	S	.	.	H	α-helix	trans	-67.3	-33.6	173.4	170.1	0	0	0	0	112	F264 N265 Q266 N272 A291 L292	F264-V268 WeakPolarHBondContact O-CG2 3.47Å; F264-V268 PolarHBondContact O-N 3.18Å; N265-V268 PolarHBondContact O-N 2.99Å; Q266-V268 VanDerWaalsContact C-N 3.27Å; Q266-V268 PolarHBondContact O-N 3.08Å; V268-N272 WeakPolarHBondContact CG1-ND2 3.3Å; V268-N272 VanDerWaalsContact O-CB 3.27Å; V268-N272 WeakPolarHBondContact O-CB 3.45Å; V268-N272 PolarHBondContact O-N 3.23Å; V268-N272 PolarHBondContact O-ND2 2.99Å; V268-A291 HydrophobicContact CG2-CB 3.61Å; V268-L292 HydrophobicContact CG1-CD2 3.9Å; V268-L292 HydrophobicContact CG1-CG 4.41Å; V268-L292 HydrophobicContact CG2-CD2 3.94Å; V268-L292 HydrophobicContact CG2-CG 3.99Å
269	Q	93.4	Very high	91.5	Very high	122 Å²	122	63 Å²	63	57%	0.57	30%	0.298	S	S	*	.	H	α-helix	trans	-68.4	-44.9	175	-72.5	170.1	11.8	0	0	111.9	N265 Q266 N272 S273	N265-Q269 WeakPolarHBondContact O-CG 3.42Å; N265-Q269 PolarHBondContact O-N 2.83Å; Q266-Q269 WeakPolarHBondContact O-CB 3.35Å; Q266-Q269 PolarHBondContact O-N 3.23Å; Q269-N272 PolarHBondContact O-N 3.1Å; Q269-S273 PolarHBondContact O-N 2.86Å; Q269-S273 PolarHBondContact O-OG 3.16Å
270	D	93.4	Very high	90.9	Very high	9 Å²	9	68.1 Å²	68.1	5%	0.048	33%	0.325	C	S	.	.	H	α-helix	trans	-62.8	-48.8	174.7	-79.8	-8.9	0	0	0	110.9	L251 R254 A255 H258 Q266 N272 S273 L274	L251-D270 HydrophobicContact CD2-CB 4.42Å; R254-D270 WeakPolarHBondContact CG-OD2 3.3Å; R254-D270 IonicContact CZ-OD1 3.68Å; R254-D270 IonicContact CZ-OD2 2.68Å; R254-D270 IonicContact NE-OD1 2.7Å; R254-D270 PolarHBondContact NE-OD1 3.49Å; R254-D270 IonicContact NE-OD2 3.93Å; R254-D270 PolarHBondContact NE-OD2 3.48Å; R254-D270 IonicContact NH2-OD1 3.76Å; R254-D270 PolarHBondContact NH2-OD1 2.99Å; R254-D270 IonicContact NH2-OD2 3.29Å; A255-D270 HydrophobicContact CB-CB 3.8Å; H258-D270 IonicContact CD2-OD2 2.74Å; Q266-D270 PolarHBondContact O-N 2.9Å; D270-N272 VanDerWaalsContact C-N 3.34Å; D270-N272 PolarHBondContact O-N 3.19Å; D270-S273 CarbonylContact O-C 3.54Å; D270-S273 WeakPolarHBondContact O-CA 3.3Å; D270-S273 WeakPolarHBondContact O-CB 3.3Å; D270-S273 PolarHBondContact O-N 2.96Å; D270-L274 WeakPolarHBondContact O-CG 3.25Å; D270-L274 PolarHBondContact O-N 3.3Å
271	A	92.9	Very high	90.4	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.4	-33.5	179.7	0	0	0	0	0	113.1	A267 S273 L274 C275 L287 K288	A267-A271 VanDerWaalsContact O-CB 3.25Å; A267-A271 WeakPolarHBondContact O-CB 3.39Å; A267-A271 PolarHBondContact O-N 2.95Å; A271-S273 VanDerWaalsContact C-N 3.33Å; A271-L274 WeakPolarHBondContact O-CB 3.34Å; A271-L274 PolarHBondContact O-N 3.29Å; A271-C275 PolarHBondContact O-N 3.35Å; A271-C275 PolarHBondContact O-SG 3.14Å; A271-L287 HydrophobicContact CB-CG 4.4Å; A271-K288 HydrophobicContact CB-CB 3.69Å; A271-K288 HydrophobicContact CB-CG 4.24Å
272	N	92	Very high	90.1	Very high	46 Å²	46	64.3 Å²	64.3	25%	0.246	31%	0.307	C	S	.	.	H	α-helix	trans	-63.7	-37.7	168.7	-87.2	-59.4	0	0	0	112.3	V268 Q269 D270 C275 R276 K288	V268-N272 WeakPolarHBondContact CG1-ND2 3.3Å; V268-N272 VanDerWaalsContact O-CB 3.27Å; V268-N272 WeakPolarHBondContact O-CB 3.45Å; V268-N272 PolarHBondContact O-N 3.23Å; V268-N272 PolarHBondContact O-ND2 2.99Å; Q269-N272 PolarHBondContact O-N 3.1Å; D270-N272 VanDerWaalsContact C-N 3.34Å; D270-N272 PolarHBondContact O-N 3.19Å; N272-C275 PolarHBondContact O-N 3.35Å; N272-R276 WeakPolarHBondContact O-CG 3.47Å; N272-R276 PolarHBondContact O-N 3.02Å; N272-R276 VanDerWaalsContact O-N 3.09Å; N272-K288 WeakPolarHBondContact OD1-CE 3.29Å; N272-K288 PolarHBondContact OD1-NZ 2.73Å
273	S	91.1	Very high	89.7	Confident	44 Å²	44	59 Å²	59	31%	0.308	29%	0.289	S	S	.	.	H	α-helix	trans	-66.8	-39.8	176.6	-55.9	0	0	0	0	111.1	Q269 D270 A271 R276 L277	Q269-S273 PolarHBondContact O-N 2.86Å; Q269-S273 PolarHBondContact O-OG 3.16Å; D270-S273 CarbonylContact O-C 3.54Å; D270-S273 WeakPolarHBondContact O-CA 3.3Å; D270-S273 WeakPolarHBondContact O-CB 3.3Å; D270-S273 PolarHBondContact O-N 2.96Å; A271-S273 VanDerWaalsContact C-N 3.33Å; S273-R276 PolarHBondContact O-N 3.35Å; S273-L277 VanDerWaalsContact O-CG 3.32Å; S273-L277 WeakPolarHBondContact O-CG 3.45Å; S273-L277 PolarHBondContact O-N 3.15Å
274	L	89.1	Confident	89.4	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-59.3	-47.4	171.4	-64.8	179.9	0	0	0	113.1	G248 L251 C252 D270 A271 R276 L277 K278 W281 A284 L287	G248-L274 VanDerWaalsContact O-CD2 3.29Å; G248-L274 WeakPolarHBondContact O-CD2 3.44Å; L251-L274 HydrophobicContact CB-CD2 3.47Å; L251-L274 VanDerWaalsContact CB-CD2 3.47Å; L251-L274 HydrophobicContact CB-CG 4.04Å; L251-L274 HydrophobicContact CD1-CD2 3.99Å; L251-L274 HydrophobicContact CG-CD2 4.4Å; C252-L274 HydrophobicContact CB-CD1 4.08Å; D270-L274 WeakPolarHBondContact O-CG 3.25Å; D270-L274 PolarHBondContact O-N 3.3Å; A271-L274 WeakPolarHBondContact O-CB 3.34Å; A271-L274 PolarHBondContact O-N 3.29Å; L274-R276 PolarHBondContact O-N 2.84Å; L274-L277 PolarHBondContact O-N 3.13Å; L274-L277 VanDerWaalsContact O-N 3.07Å; L274-K278 PolarHBondContact O-N 3Å; L274-W281 HydrophobicContact CB-CZ3 4.39Å; L274-W281 HydrophobicContact CD1-CZ3 3.99Å; L274-W281 HydrophobicContact CD2-CZ3 3.92Å; L274-W281 HydrophobicContact CG-CZ3 4.32Å; L274-A284 HydrophobicContact CB-CB 3.59Å; L274-A284 HydrophobicContact CD1-CB 4.28Å; L274-L287 HydrophobicContact CD1-CD2 4.08Å
275	C	89.1	Confident	89.2	Confident	16 Å²	16	54.3 Å²	54.3	11%	0.108	27%	0.266	C	S	.	.	H	α-helix	trans	-65.4	-24.7	178.9	-61.3	0	0	0	0	112.4	A271 N272 P279	A271-C275 PolarHBondContact O-N 3.35Å; A271-C275 PolarHBondContact O-SG 3.14Å; N272-C275 PolarHBondContact O-N 3.35Å; C275-P279 VanDerWaalsContact O-CA 3.26Å; C275-P279 WeakPolarHBondContact O-CA 3.48Å; C275-P279 WeakPolarHBondContact O-CG 3.48Å
276	R	88.2	Confident	89.1	Confident	202 Å²	202	51 Å²	51	76%	0.762	25%	0.25	S	S	*	.	H	α-helix	trans	-76.9	-34.5	170.8	-70.8	168.7	179.2	-177.3	-0.6	112.7	N272 S273 L274	N272-R276 WeakPolarHBondContact O-CG 3.47Å; N272-R276 PolarHBondContact O-N 3.02Å; N272-R276 VanDerWaalsContact O-N 3.09Å; S273-R276 PolarHBondContact O-N 3.35Å; L274-R276 PolarHBondContact O-N 2.84Å
277	L	84.6	Confident	89	Confident	82 Å²	82	48.2 Å²	48.2	43%	0.429	24%	0.237	S	C	.	.	H	α-helix	trans	-77.7	-43.3	-178.3	-72	165.8	0	0	0	113.2	L251 S273 L274	L251-L277 HydrophobicContact CD1-CD1 3.96Å; S273-L277 VanDerWaalsContact O-CG 3.32Å; S273-L277 WeakPolarHBondContact O-CG 3.45Å; S273-L277 PolarHBondContact O-N 3.15Å; L274-L277 PolarHBondContact O-N 3.13Å; L274-L277 VanDerWaalsContact O-N 3.07Å
278	K	82.1	Confident	88.9	Confident	91 Å²	91	49.4 Å²	49.4	40%	0.396	24%	0.243	S	C	.	.	S	Bend	trans	-131.2	85.3	172.8	-67.8	-162.3	178.4	-169	0	110.4	E143 L274 L280 W281	E143-K278 IonicContact OE1-NZ 3.65Å; E143-K278 PolarHBondContact OE1-NZ 2.82Å; E143-K278 IonicContact OE2-NZ 2.65Å; E143-K278 PolarHBondContact OE2-NZ 2.69Å; L274-K278 PolarHBondContact O-N 3Å; K278-L280 PolarHBondContact O-N 3.5Å; K278-W281 HydrophobicContact CB-CB 3.7Å; K278-W281 WeakPolarHBondContact O-CB 3.39Å; K278-W281 PolarHBondContact O-N 3.24Å
279	P	83.6	Confident	88.9	Confident	79 Å²	79	49.2 Å²	49.2	51%	0.513	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	2.4	-173.3	-23.4	34.3	0	0	0	117.9	C275 H285	C275-P279 VanDerWaalsContact O-CA 3.26Å; C275-P279 WeakPolarHBondContact O-CA 3.48Å; C275-P279 WeakPolarHBondContact O-CG 3.48Å; P279-H285 PolarHBondContact O-NE2 3.19Å
280	L	82	Confident	88.9	Confident	123 Å²	123	45.5 Å²	45.5	64%	0.644	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.1	2.8	174.7	-60.4	175.3	0	0	0	112.1	K278 T282 L311	K278-L280 PolarHBondContact O-N 3.5Å; L280-T282 PolarHBondContact O-N 3.02Å; L280-L311 HydrophobicContact CD2-CD2 3.91Å
281	W	83.2	Confident	88.9	Confident	32 Å²	32	45 Å²	45	12%	0.121	23%	0.225	C	C	.	.			trans	-77.6	96.8	-175.4	-172.9	44.6	0	0	0	110.7	E140 C252 L274 K278 K283 A284 H285	E140-W281 WeakPolarHBondContact OE1-CZ2 3.45Å; E140-W281 PolarHBondContact OE1-NE1 3.36Å; C252-W281 HydrophobicContact CB-CH2 4.08Å; L274-W281 HydrophobicContact CB-CZ3 4.39Å; L274-W281 HydrophobicContact CD1-CZ3 3.99Å; L274-W281 HydrophobicContact CD2-CZ3 3.92Å; L274-W281 HydrophobicContact CG-CZ3 4.32Å; K278-W281 HydrophobicContact CB-CB 3.7Å; K278-W281 WeakPolarHBondContact O-CB 3.39Å; K278-W281 PolarHBondContact O-N 3.24Å; W281-K283 HydrophobicContact CZ2-CB 4.25Å; W281-K283 HydrophobicContact CZ2-CD 4.46Å; W281-K283 PolarHBondContact O-N 3.07Å; W281-A284 HydrophobicContact CD2-CB 4.19Å; W281-A284 HydrophobicContact CE3-CB 3.54Å; W281-A284 HydrophobicContact CZ3-CB 4.11Å; W281-A284 WeakPolarHBondContact O-CB 3.29Å; W281-A284 PolarHBondContact O-N 3.07Å; W281-H285 PolarHBondContact O-N 3.05Å
282	T	86.8	Confident	88.9	Confident	25 Å²	25	45 Å²	45	15%	0.153	23%	0.225	C	C	.	.	H	α-helix	trans	-52.7	-32.2	-173.4	60.9	0	0	0	0	114.6	L280 C286 L311 K312	L280-T282 PolarHBondContact O-N 3.02Å; T282-C286 WeakPolarHBondContact O-CB 3.2Å; T282-C286 PolarHBondContact O-N 2.85Å; T282-L311 HydrophobicContact CG2-CB 3.58Å; T282-L311 HydrophobicContact CG2-CD1 4Å; T282-L311 HydrophobicContact CG2-CG 4.41Å; T282-K312 HydrophobicContact CG2-CB 4.27Å
283	K	86.5	Confident	88.9	Confident	87 Å²	87	44.1 Å²	44.1	38%	0.378	22%	0.222	S	C	.	.	H	α-helix	trans	-65.4	-39.2	175.8	-164.5	-173.2	175.2	-161.6	0	112.3	C252 E256 W281 C286 L287	C252-K283 PolarHBondContact SG-NZ 2.92Å; E256-K283 WeakPolarHBondContact OE1-CE 3.29Å; E256-K283 IonicContact OE1-NZ 2.85Å; E256-K283 PolarHBondContact OE1-NZ 2.99Å; W281-K283 HydrophobicContact CZ2-CB 4.25Å; W281-K283 HydrophobicContact CZ2-CD 4.46Å; W281-K283 PolarHBondContact O-N 3.07Å; K283-C286 PolarHBondContact O-N 3.21Å; K283-L287 WeakPolarHBondContact O-CB 3.28Å; K283-L287 PolarHBondContact O-N 2.86Å
284	A	87.9	Confident	88.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-65.3	-44.5	178.7	0	0	0	0	0	112.4	L274 W281 C286 L287 K288	L274-A284 HydrophobicContact CB-CB 3.59Å; L274-A284 HydrophobicContact CD1-CB 4.28Å; W281-A284 HydrophobicContact CD2-CB 4.19Å; W281-A284 HydrophobicContact CE3-CB 3.54Å; W281-A284 HydrophobicContact CZ3-CB 4.11Å; W281-A284 WeakPolarHBondContact O-CB 3.29Å; W281-A284 PolarHBondContact O-N 3.07Å; A284-C286 VanDerWaalsContact C-N 3.32Å; A284-C286 PolarHBondContact O-N 3Å; A284-L287 PolarHBondContact O-N 3.14Å; A284-K288 WeakPolarHBondContact O-CB 3.49Å; A284-K288 PolarHBondContact O-N 3.1Å
285	H	90.3	Very high	89	Confident	10 Å²	10	47.9 Å²	47.9	5%	0.046	24%	0.237	C	C	.	.	H	α-helix	trans	-62.9	-39.9	175.3	-68.5	-76.5	0	0	0	111.5	P279 W281 L287 K288 A289 E304 L307 C308	P279-H285 PolarHBondContact O-NE2 3.19Å; W281-H285 PolarHBondContact O-N 3.05Å; H285-L287 PolarHBondContact O-N 3.09Å; H285-K288 PolarHBondContact O-N 2.83Å; H285-A289 WeakPolarHBondContact O-CB 3.26Å; H285-A289 PolarHBondContact O-N 2.69Å; H285-E304 IonicContact CE1-OE2 2.63Å; H285-E304 IonicContact CG-OE2 3.92Å; H285-E304 IonicContact ND1-OE2 2.72Å; H285-E304 PolarHBondContact ND1-OE2 3.12Å; H285-L307 WeakPolarHBondContact ND1-CD2 3.47Å; H285-C308 WeakPolarHBondContact CB-SG 3.46Å
286	C	91.7	Very high	89	Confident	20 Å²	20	53.6 Å²	53.6	14%	0.135	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-40.2	176.7	-177.6	0	0	0	0	111.9	T282 K283 A284 T290 C308 W315 V318	T282-C286 WeakPolarHBondContact O-CB 3.2Å; T282-C286 PolarHBondContact O-N 2.85Å; K283-C286 PolarHBondContact O-N 3.21Å; A284-C286 VanDerWaalsContact C-N 3.32Å; A284-C286 PolarHBondContact O-N 3Å; C286-T290 WeakPolarHBondContact O-CB 3.47Å; C286-T290 PolarHBondContact O-N 3.32Å; C286-T290 PolarHBondContact O-OG1 2.82Å; C286-C308 VanDerWaalsContact CA-SG 3.51Å; C286-C308 PolarHBondContact N-SG 3.35Å; C286-W315 HydrophobicContact CB-CH2 3.52Å; C286-W315 HydrophobicContact CB-CZ2 4.36Å; C286-W315 HydrophobicContact CB-CZ3 3.8Å; C286-V318 VanDerWaalsContact SG-CG2 3.51Å
287	L	92	Very high	89	Confident	19 Å²	19	47.9 Å²	47.9	10%	0.099	25%	0.245	C	C	.	.	H	α-helix	trans	-65.6	-43.6	175.7	-175.9	58.8	0	0	0	111.2	C252 A255 E256 A271 L274 K283 A284 H285 T290 A291	C252-L287 HydrophobicContact CB-CD2 4.37Å; A255-L287 HydrophobicContact CB-CD2 3.82Å; A255-L287 HydrophobicContact CB-CG 4.3Å; E256-L287 HydrophobicContact CG-CD1 3.91Å; A271-L287 HydrophobicContact CB-CG 4.4Å; L274-L287 HydrophobicContact CD1-CD2 4.08Å; K283-L287 WeakPolarHBondContact O-CB 3.28Å; K283-L287 PolarHBondContact O-N 2.86Å; A284-L287 PolarHBondContact O-N 3.14Å; H285-L287 PolarHBondContact O-N 3.09Å; L287-T290 PolarHBondContact O-N 2.96Å; L287-A291 WeakPolarHBondContact O-CB 3.29Å; L287-A291 PolarHBondContact O-N 2.79Å
288	K	93.7	Very high	89.1	Confident	25 Å²	25	45.7 Å²	45.7	11%	0.109	23%	0.233	C	C	.	.	H	α-helix	trans	-60.6	-49.3	174.8	-173.9	179.5	162	-175.3	0	111.6	A271 N272 A284 H285 T290 A291 L292 E304	A271-K288 HydrophobicContact CB-CB 3.69Å; A271-K288 HydrophobicContact CB-CG 4.24Å; N272-K288 WeakPolarHBondContact OD1-CE 3.29Å; N272-K288 PolarHBondContact OD1-NZ 2.73Å; A284-K288 WeakPolarHBondContact O-CB 3.49Å; A284-K288 PolarHBondContact O-N 3.1Å; H285-K288 PolarHBondContact O-N 2.83Å; K288-T290 VanDerWaalsContact C-N 3.34Å; K288-T290 PolarHBondContact O-N 3.42Å; K288-A291 PolarHBondContact O-N 3.19Å; K288-L292 HydrophobicContact CG-CD1 3.91Å; K288-L292 HydrophobicContact CG-CG 4.48Å; K288-L292 WeakPolarHBondContact O-CB 3.23Å; K288-L292 WeakPolarHBondContact O-CG 3.21Å; K288-L292 PolarHBondContact O-N 3.39Å; K288-E304 HydrophobicContact CD-CG 3.87Å; K288-E304 WeakPolarHBondContact CD-OE1 3.48Å; K288-E304 WeakPolarHBondContact CE-OE1 3.46Å; K288-E304 HydrophobicContact CG-CG 4.14Å; K288-E304 IonicContact NZ-OE1 2.8Å; K288-E304 PolarHBondContact NZ-OE1 3.1Å
289	A	92.6	Very high	89.1	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.9	-45	178.1	0	0	0	0	0	112	H285 A291 L292 S293 A301 E304 Y305	H285-A289 WeakPolarHBondContact O-CB 3.26Å; H285-A289 PolarHBondContact O-N 2.69Å; A289-A291 VanDerWaalsContact C-N 3.34Å; A289-A291 PolarHBondContact O-N 3.05Å; A289-L292 PolarHBondContact O-N 3.33Å; A289-S293 WeakPolarHBondContact O-CB 3.37Å; A289-S293 PolarHBondContact O-N 2.8Å; A289-A301 WeakPolarHBondContact O-CB 3.38Å; A289-E304 HydrophobicContact CB-CB 3.63Å; A289-Y305 HydrophobicContact CB-CD1 3.32Å; A289-Y305 HydrophobicContact CB-CD2 3.88Å; A289-Y305 HydrophobicContact CB-CE1 3.4Å; A289-Y305 VanDerWaalsContact CB-CE1 3.4Å; A289-Y305 HydrophobicContact CB-CE2 3.94Å; A289-Y305 HydrophobicContact CB-CG 3.58Å
290	T	93.2	Very high	89.3	Confident	44 Å²	44	44.7 Å²	44.7	27%	0.27	23%	0.226	S	C	.	.	H	α-helix	trans	-65.2	-37.9	177.5	-49.8	0	0	0	0	111.5	M259 C286 L287 K288 K294 Y305	M259-T290 HydrophobicContact CE-CG2 3.69Å; M259-T290 WeakPolarHBondContact CE-O 3.44Å; C286-T290 WeakPolarHBondContact O-CB 3.47Å; C286-T290 PolarHBondContact O-N 3.32Å; C286-T290 PolarHBondContact O-OG1 2.82Å; L287-T290 PolarHBondContact O-N 2.96Å; K288-T290 VanDerWaalsContact C-N 3.34Å; K288-T290 PolarHBondContact O-N 3.42Å; T290-K294 PolarHBondContact O-N 3.27Å; T290-Y305 WeakPolarHBondContact CA-OH 3.25Å; T290-Y305 PolarHBondContact OG1-OH 3.24Å
291	A	94.1	Very high	89.7	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-70.7	-37.3	177.3	0	0	0	0	0	113.3	M259 A267 V268 L287 K288 A289 A295	M259-A291 VanDerWaalsContact CE-CA 3.49Å; M259-A291 HydrophobicContact CE-CB 4.01Å; M259-A291 HydrophobicContact CG-CB 4.49Å; M259-A291 VanDerWaalsContact SD-CA 3.53Å; M259-A291 HydrophobicContact SD-CB 3.65Å; A267-A291 HydrophobicContact CB-CB 4.01Å; V268-A291 HydrophobicContact CG2-CB 3.61Å; L287-A291 WeakPolarHBondContact O-CB 3.29Å; L287-A291 PolarHBondContact O-N 2.79Å; K288-A291 PolarHBondContact O-N 3.19Å; A289-A291 VanDerWaalsContact C-N 3.34Å; A289-A291 PolarHBondContact O-N 3.05Å; A291-A295 WeakPolarHBondContact O-CB 3.44Å; A291-A295 PolarHBondContact O-N 3.31Å; A291-A295 VanDerWaalsContact O-N 3.15Å
292	L	93.8	Very high	90	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.8	-43.5	172.3	-73.3	164.4	0	0	0	111.7	V268 K288 A289 A295 D296 R297 E300 A301 E304	V268-L292 HydrophobicContact CG1-CD2 3.9Å; V268-L292 HydrophobicContact CG1-CG 4.41Å; V268-L292 HydrophobicContact CG2-CD2 3.94Å; V268-L292 HydrophobicContact CG2-CG 3.99Å; K288-L292 HydrophobicContact CG-CD1 3.91Å; K288-L292 HydrophobicContact CG-CG 4.48Å; K288-L292 WeakPolarHBondContact O-CB 3.23Å; K288-L292 WeakPolarHBondContact O-CG 3.21Å; K288-L292 PolarHBondContact O-N 3.39Å; A289-L292 PolarHBondContact O-N 3.33Å; L292-A295 CarbonylContact O-C 3.37Å; L292-A295 WeakPolarHBondContact O-CA 3.49Å; L292-A295 WeakPolarHBondContact O-CB 3.48Å; L292-A295 PolarHBondContact O-N 2.84Å; L292-D296 PolarHBondContact O-N 3.48Å; L292-R297 HydrophobicContact CB-CB 4.37Å; L292-R297 HydrophobicContact CD2-CB 4.03Å; L292-R297 PolarHBondContact O-N 2.83Å; L292-E300 HydrophobicContact CD1-CB 3.84Å; L292-E300 HydrophobicContact CD2-CB 4.07Å; L292-E300 HydrophobicContact CG-CB 4.43Å; L292-A301 HydrophobicContact CB-CB 3.76Å; L292-E304 HydrophobicContact CD1-CG 4.07Å
293	S	91.4	Very high	90	Very high	27 Å²	27	39.1 Å²	39.1	19%	0.189	20%	0.197	C	C	.	.	H	α-helix	trans	-65.4	-40.1	178.7	-178.9	0	0	0	0	112.4	A289 A295 D296 N298 V325	A289-S293 WeakPolarHBondContact O-CB 3.37Å; A289-S293 PolarHBondContact O-N 2.8Å; S293-A295 PolarHBondContact O-N 3.04Å; S293-D296 PolarHBondContact O-N 3.25Å; S293-D296 VanDerWaalsContact O-N 3.15Å; S293-N298 PolarHBondContact OG-OD1 2.99Å; S293-V325 WeakPolarHBondContact OG-CG2 3.28Å
294	K	90.4	Very high	90.1	Very high	102 Å²	102	36.2 Å²	36.2	44%	0.443	18%	0.184	S	C	.	.	H	α-helix	trans	-69.4	-16.3	171.5	-69.7	-163.3	-168.1	177.2	0	114.1	M259 F264 T290 D296	M259-K294 HydrophobicContact CE-CB 4.34Å; M259-K294 HydrophobicContact CE-CD 3.58Å; M259-K294 HydrophobicContact CE-CG 4.01Å; M259-K294 HydrophobicContact SD-CB 4.44Å; M259-K294 HydrophobicContact SD-CD 4.08Å; F264-K294 HydrophobicContact CD1-CB 3.74Å; F264-K294 HydrophobicContact CD1-CD 4.26Å; F264-K294 HydrophobicContact CD2-CB 4.35Å; F264-K294 WeakPolarHBondContact CD2-O 3.21Å; F264-K294 HydrophobicContact CE1-CB 3.68Å; F264-K294 HydrophobicContact CE1-CD 3.64Å; F264-K294 HydrophobicContact CE1-CG 4.32Å; F264-K294 HydrophobicContact CE2-CB 4.3Å; F264-K294 WeakPolarHBondContact CE2-O 3.31Å; F264-K294 HydrophobicContact CG-CB 4.09Å; F264-K294 HydrophobicContact CZ-CB 3.97Å; F264-K294 HydrophobicContact CZ-CD 4.21Å; T290-K294 PolarHBondContact O-N 3.27Å; K294-D296 VanDerWaalsContact C-N 3.32Å
295	A	91.9	Very high	90.2	Very high	22 Å²	22	36.5 Å²	36.5	18%	0.182	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	15.5	172.2	0	0	0	0	0	112.9	F264 A291 L292 S293 R297	F264-A295 HydrophobicContact CB-CB 3.83Å; A291-A295 WeakPolarHBondContact O-CB 3.44Å; A291-A295 PolarHBondContact O-N 3.31Å; A291-A295 VanDerWaalsContact O-N 3.15Å; L292-A295 CarbonylContact O-C 3.37Å; L292-A295 WeakPolarHBondContact O-CA 3.49Å; L292-A295 WeakPolarHBondContact O-CB 3.48Å; L292-A295 PolarHBondContact O-N 2.84Å; S293-A295 PolarHBondContact O-N 3.04Å; A295-R297 PolarHBondContact O-N 2.76Å
296	D	88.4	Confident	90.1	Very high	135 Å²	135	36.2 Å²	36.2	72%	0.722	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	7.8	-176.4	-58.7	-55.1	0	0	0	115.7	L292 S293 K294 N298	L292-D296 PolarHBondContact O-N 3.48Å; S293-D296 PolarHBondContact O-N 3.25Å; S293-D296 VanDerWaalsContact O-N 3.15Å; K294-D296 VanDerWaalsContact C-N 3.32Å; D296-N298 PolarHBondContact O-N 2.89Å; D296-N298 PolarHBondContact O-ND2 2.7Å
297	R	89.4	Confident	89.9	Confident	82 Å²	82	36 Å²	36	31%	0.309	18%	0.182	S	C	.	.			trans	-83.4	59.3	176.4	-68.8	165	68.2	-177.4	1.2	110.4	L292 A295 D299 E300 A301	L292-R297 HydrophobicContact CB-CB 4.37Å; L292-R297 HydrophobicContact CD2-CB 4.03Å; L292-R297 PolarHBondContact O-N 2.83Å; A295-R297 PolarHBondContact O-N 2.76Å; R297-D299 VanDerWaalsContact C-N 3.31Å; R297-D299 PolarHBondContact O-N 3.28Å; R297-E300 IonicContact CZ-OE1 3.52Å; R297-E300 IonicContact CZ-OE2 3.74Å; R297-E300 IonicContact NE-OE1 2.77Å; R297-E300 PolarHBondContact NE-OE1 2.75Å; R297-E300 IonicContact NE-OE2 3.83Å; R297-E300 IonicContact NH2-OE1 2.81Å; R297-E300 PolarHBondContact NH2-OE1 3.12Å; R297-E300 IonicContact NH2-OE2 2.64Å; R297-E300 PolarHBondContact NH2-OE2 2.94Å; R297-E300 PolarHBondContact O-N 3.07Å; R297-A301 WeakPolarHBondContact O-CB 3.26Å; R297-A301 PolarHBondContact O-N 2.68Å
298	N	86.5	Confident	89.7	Confident	36 Å²	36	35.1 Å²	35.1	19%	0.193	18%	0.177	C	C	.	.	H	α-helix	trans	-67.9	-28.1	-169.2	-71.5	-54.6	0	0	0	113.4	S293 D296 L302 V325 V329	S293-N298 PolarHBondContact OG-OD1 2.99Å; D296-N298 PolarHBondContact O-N 2.89Å; D296-N298 PolarHBondContact O-ND2 2.7Å; N298-L302 VanDerWaalsContact O-CG 3.3Å; N298-L302 WeakPolarHBondContact O-CG 3.3Å; N298-L302 PolarHBondContact O-N 2.75Å; N298-L302 VanDerWaalsContact O-N 3.1Å; N298-V325 HydrophobicContact CB-CG1 3.66Å; N298-V325 WeakPolarHBondContact OD1-CG1 3.43Å; N298-V329 HydrophobicContact CB-CG2 3.71Å
299	D	82.4	Confident	89.5	Confident	89 Å²	89	34.2 Å²	34.2	48%	0.476	17%	0.173	S	C	.	.	H	α-helix	trans	-67.2	-47	174	65.6	-41.9	0	0	0	112.2	R297 Q303	R297-D299 VanDerWaalsContact C-N 3.31Å; R297-D299 PolarHBondContact O-N 3.28Å; D299-Q303 WeakPolarHBondContact O-CG 3.09Å
300	E	87.7	Confident	89.2	Confident	61 Å²	61	34.2 Å²	34.2	29%	0.285	17%	0.174	S	C	.	.	H	α-helix	trans	-67.6	-40.2	173.4	-68.7	-178.7	-112.6	0	0	111.7	L292 R297 L302 Q303 E304	L292-E300 HydrophobicContact CD1-CB 3.84Å; L292-E300 HydrophobicContact CD2-CB 4.07Å; L292-E300 HydrophobicContact CG-CB 4.43Å; R297-E300 IonicContact CZ-OE1 3.52Å; R297-E300 IonicContact CZ-OE2 3.74Å; R297-E300 IonicContact NE-OE1 2.77Å; R297-E300 PolarHBondContact NE-OE1 2.75Å; R297-E300 IonicContact NE-OE2 3.83Å; R297-E300 IonicContact NH2-OE1 2.81Å; R297-E300 PolarHBondContact NH2-OE1 3.12Å; R297-E300 IonicContact NH2-OE2 2.64Å; R297-E300 PolarHBondContact NH2-OE2 2.94Å; R297-E300 PolarHBondContact O-N 3.07Å; E300-L302 VanDerWaalsContact C-N 3.29Å; E300-L302 PolarHBondContact O-N 3.02Å; E300-Q303 PolarHBondContact O-N 3.39Å; E300-Q303 VanDerWaalsContact O-N 3.16Å; E300-E304 PolarHBondContact O-N 3.36Å
301	A	89.9	Confident	88.9	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58.2	-40.7	178.1	0	0	0	0	0	112.3	A289 L292 R297 Q303 E304 Y305	A289-A301 WeakPolarHBondContact O-CB 3.38Å; L292-A301 HydrophobicContact CB-CB 3.76Å; R297-A301 WeakPolarHBondContact O-CB 3.26Å; R297-A301 PolarHBondContact O-N 2.68Å; A301-Q303 PolarHBondContact O-N 3.14Å; A301-E304 PolarHBondContact O-N 3.29Å; A301-Y305 HydrophobicContact CB-CE2 4.45Å; A301-Y305 VanDerWaalsContact O-CD2 3.26Å; A301-Y305 WeakPolarHBondContact O-CD2 3.33Å; A301-Y305 PolarHBondContact O-N 3.46Å
302	L	88.9	Confident	88.5	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-63.3	-38.4	176.8	-78.3	167.8	0	0	0	112.8	N298 E300 E304 Y305 F306 A322 V325 L326 V329	N298-L302 VanDerWaalsContact O-CG 3.3Å; N298-L302 WeakPolarHBondContact O-CG 3.3Å; N298-L302 PolarHBondContact O-N 2.75Å; N298-L302 VanDerWaalsContact O-N 3.1Å; E300-L302 VanDerWaalsContact C-N 3.29Å; E300-L302 PolarHBondContact O-N 3.02Å; L302-E304 VanDerWaalsContact C-N 3.34Å; L302-E304 PolarHBondContact O-N 3.19Å; L302-Y305 PolarHBondContact O-N 3.27Å; L302-F306 HydrophobicContact CB-CD2 4.37Å; L302-F306 HydrophobicContact CB-CE2 3.95Å; L302-F306 HydrophobicContact CD2-CE2 4.39Å; L302-F306 HydrophobicContact CD2-CZ 4.16Å; L302-F306 WeakPolarHBondContact O-CB 3.3Å; L302-F306 WeakPolarHBondContact O-CD2 3.34Å; L302-F306 VanDerWaalsContact O-CG 3.23Å; L302-F306 WeakPolarHBondContact O-CG 3.43Å; L302-F306 PolarHBondContact O-N 2.96Å; L302-A322 WeakPolarHBondContact CD2-O 3.47Å; L302-V325 HydrophobicContact CD1-CG1 4.19Å; L302-V325 HydrophobicContact CD2-CB 4.08Å; L302-V325 HydrophobicContact CD2-CG1 4.09Å; L302-V325 HydrophobicContact CG-CB 4.32Å; L302-V325 HydrophobicContact CG-CG1 3.76Å; L302-L326 HydrophobicContact CD1-CB 4.42Å; L302-L326 HydrophobicContact CD1-CD1 4.02Å; L302-L326 HydrophobicContact CD2-CB 3.9Å; L302-V329 HydrophobicContact CD1-CB 4.31Å; L302-V329 HydrophobicContact CD1-CG2 3.84Å
303	Q	86.5	Confident	88	Confident	62 Å²	62	38.5 Å²	38.5	29%	0.29	20%	0.195	S	C	.	.	H	α-helix	trans	-61.5	-46	178.8	-38.2	-166.4	12.1	0	0	110.6	D299 E300 A301 F306 L307 L360	D299-Q303 WeakPolarHBondContact O-CG 3.09Å; E300-Q303 PolarHBondContact O-N 3.39Å; E300-Q303 VanDerWaalsContact O-N 3.16Å; A301-Q303 PolarHBondContact O-N 3.14Å; Q303-F306 PolarHBondContact O-N 2.95Å; Q303-L307 WeakPolarHBondContact O-CB 3.48Å; Q303-L307 PolarHBondContact O-N 3.39Å; Q303-L360 HydrophobicContact CB-CD2 3.72Å; Q303-L360 HydrophobicContact CG-CD2 3.56Å
304	E	89.1	Confident	87.8	Confident	25 Å²	25	42.5 Å²	42.5	12%	0.117	21%	0.214	C	C	.	.	H	α-helix	trans	-68.2	-38.3	177.9	-65.5	-66.3	164.2	0	0	112.1	H285 K288 A289 L292 E300 A301 L302 L307 C308	H285-E304 IonicContact CE1-OE2 2.63Å; H285-E304 IonicContact CG-OE2 3.92Å; H285-E304 IonicContact ND1-OE2 2.72Å; H285-E304 PolarHBondContact ND1-OE2 3.12Å; K288-E304 HydrophobicContact CD-CG 3.87Å; K288-E304 WeakPolarHBondContact CD-OE1 3.48Å; K288-E304 WeakPolarHBondContact CE-OE1 3.46Å; K288-E304 HydrophobicContact CG-CG 4.14Å; K288-E304 IonicContact NZ-OE1 2.8Å; K288-E304 PolarHBondContact NZ-OE1 3.1Å; A289-E304 HydrophobicContact CB-CB 3.63Å; L292-E304 HydrophobicContact CD1-CG 4.07Å; E300-E304 PolarHBondContact O-N 3.36Å; A301-E304 PolarHBondContact O-N 3.29Å; L302-E304 VanDerWaalsContact C-N 3.34Å; L302-E304 PolarHBondContact O-N 3.19Å; E304-L307 PolarHBondContact O-N 3.02Å; E304-C308 PolarHBondContact O-N 2.93Å; E304-C308 PolarHBondContact O-SG 2.85Å
305	Y	90.6	Very high	87.6	Confident	7 Å²	7	40 Å²	40	3%	0.027	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-40.9	172.8	-78.8	-45.4	0	0	0	112.8	A289 T290 A301 L302 L307 C308 L309 V318 E321 A322 V325	A289-Y305 HydrophobicContact CB-CD1 3.32Å; A289-Y305 HydrophobicContact CB-CD2 3.88Å; A289-Y305 HydrophobicContact CB-CE1 3.4Å; A289-Y305 VanDerWaalsContact CB-CE1 3.4Å; A289-Y305 HydrophobicContact CB-CE2 3.94Å; A289-Y305 HydrophobicContact CB-CG 3.58Å; T290-Y305 WeakPolarHBondContact CA-OH 3.25Å; T290-Y305 PolarHBondContact OG1-OH 3.24Å; A301-Y305 HydrophobicContact CB-CE2 4.45Å; A301-Y305 VanDerWaalsContact O-CD2 3.26Å; A301-Y305 WeakPolarHBondContact O-CD2 3.33Å; A301-Y305 PolarHBondContact O-N 3.46Å; L302-Y305 PolarHBondContact O-N 3.27Å; Y305-L307 VanDerWaalsContact C-N 3.31Å; Y305-L307 PolarHBondContact O-N 2.85Å; Y305-C308 WeakPolarHBondContact O-CB 3.38Å; Y305-C308 PolarHBondContact O-N 3.03Å; Y305-L309 WeakPolarHBondContact O-CG 3.39Å; Y305-L309 PolarHBondContact O-N 3.4Å; Y305-L309 VanDerWaalsContact O-N 3.1Å; Y305-V318 HydrophobicContact CD1-CG1 3.7Å; Y305-V318 HydrophobicContact CE1-CG1 4.31Å; Y305-E321 HydrophobicContact CE1-CB 4.33Å; Y305-E321 HydrophobicContact CE2-CB 4.44Å; Y305-A322 HydrophobicContact CG-CB 4.32Å; Y305-V325 HydrophobicContact CE2-CG2 4.05Å
306	F	88.6	Confident	87.4	Confident	4 Å²	4	44 Å²	44	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-65.5	-35.7	174.4	-64.9	-47.3	0	0	0	111.7	V102 I105 L109 L302 Q303 L309 A310 L326	V102-F306 HydrophobicContact CB-CE1 4.31Å; V102-F306 HydrophobicContact CG1-CD1 4.4Å; V102-F306 HydrophobicContact CG1-CE1 4.12Å; V102-F306 HydrophobicContact CG2-CE1 4.17Å; I105-F306 HydrophobicContact CB-CD1 4.16Å; I105-F306 HydrophobicContact CB-CE1 4.18Å; I105-F306 HydrophobicContact CB-CG 4.49Å; I105-F306 HydrophobicContact CD1-CE1 4.06Å; I105-F306 HydrophobicContact CD1-CE2 4.22Å; I105-F306 HydrophobicContact CD1-CZ 3.73Å; I105-F306 HydrophobicContact CG2-CB 4.13Å; I105-F306 HydrophobicContact CG2-CD1 3.8Å; I105-F306 HydrophobicContact CG2-CD2 3.73Å; I105-F306 HydrophobicContact CG2-CE1 4.09Å; I105-F306 HydrophobicContact CG2-CE2 4.02Å; I105-F306 HydrophobicContact CG2-CG 3.63Å; I105-F306 HydrophobicContact CG2-CZ 4.2Å; L109-F306 HydrophobicContact CD1-CB 3.61Å; L302-F306 HydrophobicContact CB-CD2 4.37Å; L302-F306 HydrophobicContact CB-CE2 3.95Å; L302-F306 HydrophobicContact CD2-CE2 4.39Å; L302-F306 HydrophobicContact CD2-CZ 4.16Å; L302-F306 WeakPolarHBondContact O-CB 3.3Å; L302-F306 WeakPolarHBondContact O-CD2 3.34Å; L302-F306 VanDerWaalsContact O-CG 3.23Å; L302-F306 WeakPolarHBondContact O-CG 3.43Å; L302-F306 PolarHBondContact O-N 2.96Å; Q303-F306 PolarHBondContact O-N 2.95Å; F306-L309 PolarHBondContact O-N 3.09Å; F306-A310 WeakPolarHBondContact O-CB 3.31Å; F306-A310 PolarHBondContact O-N 3.28Å; F306-L326 HydrophobicContact CZ-CD2 4.43Å
307	L	87.6	Confident	87.5	Confident	16 Å²	16	42.7 Å²	42.7	8%	0.084	21%	0.212	C	C	.	.	H	α-helix	trans	-65.3	-41.5	172.8	-178.9	56.4	0	0	0	112	L114 H285 Q303 E304 Y305 L309 A310 L311 L364	L114-L307 HydrophobicContact CD1-CD1 4.03Å; L114-L307 HydrophobicContact CD2-CD1 4.25Å; H285-L307 WeakPolarHBondContact ND1-CD2 3.47Å; Q303-L307 WeakPolarHBondContact O-CB 3.48Å; Q303-L307 PolarHBondContact O-N 3.39Å; E304-L307 PolarHBondContact O-N 3.02Å; Y305-L307 VanDerWaalsContact C-N 3.31Å; Y305-L307 PolarHBondContact O-N 2.85Å; L307-L309 VanDerWaalsContact C-N 3.31Å; L307-L309 PolarHBondContact O-N 3.45Å; L307-A310 PolarHBondContact O-N 2.91Å; L307-L311 HydrophobicContact CD1-CD1 4.32Å; L307-L311 HydrophobicContact CD1-CG 4.41Å; L307-L311 HydrophobicContact CG-CD1 4.34Å; L307-L311 WeakPolarHBondContact O-CG 3.44Å; L307-L311 PolarHBondContact O-N 3.42Å; L307-L364 HydrophobicContact CD2-CD2 4.2Å
308	C	88.1	Confident	87.5	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-55.9	-45.7	172.7	-66.9	0	0	0	0	112.1	H285 C286 E304 Y305 L311 K312 V318	H285-C308 WeakPolarHBondContact CB-SG 3.46Å; C286-C308 VanDerWaalsContact CA-SG 3.51Å; C286-C308 PolarHBondContact N-SG 3.35Å; E304-C308 PolarHBondContact O-N 2.93Å; E304-C308 PolarHBondContact O-SG 2.85Å; Y305-C308 WeakPolarHBondContact O-CB 3.38Å; Y305-C308 PolarHBondContact O-N 3.03Å; C308-L311 PolarHBondContact O-N 3.16Å; C308-K312 PolarHBondContact O-N 2.88Å; C308-V318 HydrophobicContact CB-CG1 3.93Å
309	L	89.2	Confident	87.7	Confident	5 Å²	5	39.4 Å²	39.4	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-75.5	-29.8	-179	-65.4	168.1	0	0	0	112.3	V102 A106 Y305 F306 L307 L311 K312 P313 W315 V318 K319 A322	V102-L309 HydrophobicContact CG1-CD1 3.6Å; A106-L309 HydrophobicContact CB-CB 3.57Å; Y305-L309 WeakPolarHBondContact O-CG 3.39Å; Y305-L309 PolarHBondContact O-N 3.4Å; Y305-L309 VanDerWaalsContact O-N 3.1Å; F306-L309 PolarHBondContact O-N 3.09Å; L307-L309 VanDerWaalsContact C-N 3.31Å; L307-L309 PolarHBondContact O-N 3.45Å; L309-L311 VanDerWaalsContact C-N 3.32Å; L309-K312 CarbonylContact O-C 3.53Å; L309-P313 VanDerWaalsContact O-CA 3.26Å; L309-P313 WeakPolarHBondContact O-CA 3.43Å; L309-W315 HydrophobicContact CD2-CB 4.39Å; L309-V318 HydrophobicContact CD2-CB 4.33Å; L309-V318 HydrophobicContact CD2-CG1 4.13Å; L309-V318 HydrophobicContact CG-CG1 4.09Å; L309-K319 HydrophobicContact CD1-CB 4.43Å; L309-K319 HydrophobicContact CD2-CB 4.07Å; L309-A322 HydrophobicContact CD1-CB 4.11Å
310	A	86.7	Confident	88.1	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-64.7	-37.8	171.5	0	0	0	0	0	111.4	A106 L109 R110 L114 F306 L307	A106-A310 WeakPolarHBondContact O-CB 3.12Å; L109-A310 HydrophobicContact CB-CB 4.04Å; R110-A310 HydrophobicContact CB-CB 4.09Å; R110-A310 VanDerWaalsContact CD-O 3.28Å; R110-A310 WeakPolarHBondContact CD-O 3.49Å; R110-A310 VanDerWaalsContact CG-O 3.27Å; R110-A310 WeakPolarHBondContact CG-O 3.32Å; R110-A310 PolarHBondContact NH1-O 3.19Å; L114-A310 HydrophobicContact CD1-CB 3.97Å; F306-A310 WeakPolarHBondContact O-CB 3.31Å; F306-A310 PolarHBondContact O-N 3.28Å; L307-A310 PolarHBondContact O-N 2.91Å
311	L	85.3	Confident	88.2	Confident	27 Å²	27	38.9 Å²	38.9	14%	0.141	20%	0.195	C	C	.	.	H	α-helix	trans	-75.3	-50.9	175.1	-66.9	167.7	0	0	0	112.2	R110 L114 L116 L280 T282 L307 C308 L309	R110-L311 PolarHBondContact NH1-O 2.94Å; L114-L311 HydrophobicContact CD1-CD2 3.81Å; L114-L311 HydrophobicContact CD1-CG 4.15Å; L116-L311 HydrophobicContact CD1-CD2 4.17Å; L280-L311 HydrophobicContact CD2-CD2 3.91Å; T282-L311 HydrophobicContact CG2-CB 3.58Å; T282-L311 HydrophobicContact CG2-CD1 4Å; T282-L311 HydrophobicContact CG2-CG 4.41Å; L307-L311 HydrophobicContact CD1-CD1 4.32Å; L307-L311 HydrophobicContact CD1-CG 4.41Å; L307-L311 HydrophobicContact CG-CD1 4.34Å; L307-L311 WeakPolarHBondContact O-CG 3.44Å; L307-L311 PolarHBondContact O-N 3.42Å; C308-L311 PolarHBondContact O-N 3.16Å; L309-L311 VanDerWaalsContact C-N 3.32Å
312	K	86.7	Confident	88.2	Confident	57 Å²	57	38.9 Å²	38.9	25%	0.248	20%	0.195	C	C	.	.			trans	-125.6	87.8	-178.3	-173.7	174.8	178.3	171.1	0	111.3	C139 T282 C308 L309 D314 W315	C139-K312 PolarHBondContact SG-NZ 3.07Å; T282-K312 HydrophobicContact CG2-CB 4.27Å; C308-K312 PolarHBondContact O-N 2.88Å; L309-K312 CarbonylContact O-C 3.53Å; K312-D314 VanDerWaalsContact C-N 3.34Å; K312-D314 PolarHBondContact O-N 3.37Å; K312-W315 HydrophobicContact CD-CB 4.4Å; K312-W315 HydrophobicContact CD-CD2 4.33Å; K312-W315 HydrophobicContact CD-CE3 4.17Å; K312-W315 HydrophobicContact CD-CG 4.48Å; K312-W315 HydrophobicContact CG-CB 4.25Å; K312-W315 PolarHBondContact O-N 3.16Å
313	P	83.8	Confident	88.3	Confident	50 Å²	50	39.6 Å²	39.6	33%	0.325	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-36	-174.6	-27	36.2	0	0	0	115.1	L309 W315	L309-P313 VanDerWaalsContact O-CA 3.26Å; L309-P313 WeakPolarHBondContact O-CA 3.43Å; P313-W315 PolarHBondContact O-N 3.44Å; P313-W315 VanDerWaalsContact O-N 3.11Å
314	D	85.6	Confident	88.5	Confident	111 Å²	111	40.7 Å²	40.7	59%	0.594	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	8.8	-173.1	-52.1	-61.1	0	0	0	114.2	K312 T316	K312-D314 VanDerWaalsContact C-N 3.34Å; K312-D314 PolarHBondContact O-N 3.37Å; D314-T316 VanDerWaalsContact C-N 3.28Å; D314-T316 PolarHBondContact O-N 3.06Å
315	W	86.8	Confident	88.4	Confident	50 Å²	50	39.9 Å²	39.9	19%	0.189	20%	0.199	C	C	.	.			trans	-80.7	72.8	-175.2	-155.3	-5.6	0	0	0	112.2	C286 L309 K312 P313 K317 V318 K319	C286-W315 HydrophobicContact CB-CH2 3.52Å; C286-W315 HydrophobicContact CB-CZ2 4.36Å; C286-W315 HydrophobicContact CB-CZ3 3.8Å; L309-W315 HydrophobicContact CD2-CB 4.39Å; K312-W315 HydrophobicContact CD-CB 4.4Å; K312-W315 HydrophobicContact CD-CD2 4.33Å; K312-W315 HydrophobicContact CD-CE3 4.17Å; K312-W315 HydrophobicContact CD-CG 4.48Å; K312-W315 HydrophobicContact CG-CB 4.25Å; K312-W315 PolarHBondContact O-N 3.16Å; P313-W315 PolarHBondContact O-N 3.44Å; P313-W315 VanDerWaalsContact O-N 3.11Å; W315-K317 VanDerWaalsContact C-N 3.31Å; W315-K317 PolarHBondContact O-N 3.01Å; W315-K317 VanDerWaalsContact O-N 3.16Å; W315-V318 HydrophobicContact CB-CB 4.23Å; W315-V318 HydrophobicContact CD2-CB 4.03Å; W315-V318 HydrophobicContact CD2-CG2 3.41Å; W315-V318 VanDerWaalsContact CD2-CG2 3.41Å; W315-V318 HydrophobicContact CE3-CB 4.36Å; W315-V318 HydrophobicContact CE3-CG2 3.77Å; W315-V318 HydrophobicContact CG-CB 3.95Å; W315-V318 HydrophobicContact CG-CG2 3.75Å; W315-V318 HydrophobicContact CH2-CG2 4.29Å; W315-V318 HydrophobicContact CZ2-CG2 3.98Å; W315-V318 HydrophobicContact CZ3-CG2 4.19Å; W315-V318 PolarHBondContact O-N 2.97Å; W315-K319 PolarHBondContact O-N 2.77Å
316	T	88.4	Confident	88.2	Confident	105 Å²	105	39.8 Å²	39.8	64%	0.644	20%	0.199	S	C	*	.	H	α-helix	trans	-47	-44.8	-175.7	55	0	0	0	0	114.6	D314 V318 K319 L320	D314-T316 VanDerWaalsContact C-N 3.28Å; D314-T316 PolarHBondContact O-N 3.06Å; T316-V318 PolarHBondContact O-N 3.06Å; T316-K319 WeakPolarHBondContact O-CB 3.18Å; T316-K319 PolarHBondContact O-N 3.34Å; T316-L320 PolarHBondContact O-N 3.39Å
317	K	89.5	Confident	88.2	Confident	107 Å²	107	40.3 Å²	40.3	47%	0.465	20%	0.203	S	C	.	.	H	α-helix	trans	-57.7	-46.6	176.1	-71.4	172.7	173	168.3	0	112	D136 W315 L320 E321	D136-K317 IonicContact OD1-NZ 3.57Å; D136-K317 PolarHBondContact OD1-NZ 3.03Å; D136-K317 IonicContact OD2-NZ 3.93Å; D136-K317 PolarHBondContact OD2-NZ 3.15Å; W315-K317 VanDerWaalsContact C-N 3.31Å; W315-K317 PolarHBondContact O-N 3.01Å; W315-K317 VanDerWaalsContact O-N 3.16Å; K317-L320 PolarHBondContact O-N 2.89Å; K317-E321 PolarHBondContact O-N 3.31Å; K317-E321 VanDerWaalsContact O-N 3.12Å
318	V	89.6	Confident	88	Confident	6 Å²	6	41.6 Å²	41.6	4%	0.036	22%	0.216	C	C	.	.	H	α-helix	trans	-71.1	-34.4	178.2	174	0	0	0	0	111.7	C286 Y305 C308 L309 W315 T316 L320 E321 A322	C286-V318 VanDerWaalsContact SG-CG2 3.51Å; Y305-V318 HydrophobicContact CD1-CG1 3.7Å; Y305-V318 HydrophobicContact CE1-CG1 4.31Å; C308-V318 HydrophobicContact CB-CG1 3.93Å; L309-V318 HydrophobicContact CD2-CB 4.33Å; L309-V318 HydrophobicContact CD2-CG1 4.13Å; L309-V318 HydrophobicContact CG-CG1 4.09Å; W315-V318 HydrophobicContact CB-CB 4.23Å; W315-V318 HydrophobicContact CD2-CB 4.03Å; W315-V318 HydrophobicContact CD2-CG2 3.41Å; W315-V318 VanDerWaalsContact CD2-CG2 3.41Å; W315-V318 HydrophobicContact CE3-CB 4.36Å; W315-V318 HydrophobicContact CE3-CG2 3.77Å; W315-V318 HydrophobicContact CG-CB 3.95Å; W315-V318 HydrophobicContact CG-CG2 3.75Å; W315-V318 HydrophobicContact CH2-CG2 4.29Å; W315-V318 HydrophobicContact CZ2-CG2 3.98Å; W315-V318 HydrophobicContact CZ3-CG2 4.19Å; W315-V318 PolarHBondContact O-N 2.97Å; T316-V318 PolarHBondContact O-N 3.06Å; V318-L320 VanDerWaalsContact C-N 3.3Å; V318-L320 PolarHBondContact O-N 3.37Å; V318-E321 PolarHBondContact O-N 2.94Å; V318-A322 WeakPolarHBondContact O-CB 3.29Å; V318-A322 PolarHBondContact O-N 3.42Å
319	K	89.9	Confident	87.8	Confident	43 Å²	43	42.5 Å²	42.5	19%	0.187	22%	0.221	C	C	.	.	H	α-helix	trans	-58.8	-43.3	171.9	-163.8	176.9	-173	175	0	110.9	V102 E103 L309 W315 T316 A322 Q323	V102-K319 HydrophobicContact CG1-CG 4.14Å; E103-K319 IonicContact OE2-NZ 2.67Å; E103-K319 PolarHBondContact OE2-NZ 3.43Å; L309-K319 HydrophobicContact CD1-CB 4.43Å; L309-K319 HydrophobicContact CD2-CB 4.07Å; W315-K319 PolarHBondContact O-N 2.77Å; T316-K319 WeakPolarHBondContact O-CB 3.18Å; T316-K319 PolarHBondContact O-N 3.34Å; K319-A322 PolarHBondContact O-N 2.97Å; K319-Q323 WeakPolarHBondContact O-CG 3.12Å; K319-Q323 PolarHBondContact O-N 3.19Å; K319-Q323 PolarHBondContact O-OE1 3.45Å; K319-Q323 VanDerWaalsContact O-OE1 3.11Å
320	L	90.8	Very high	87.4	Confident	67 Å²	67	42.7 Å²	42.7	35%	0.351	22%	0.222	S	C	.	.	H	α-helix	trans	-67.3	-42.5	178.1	-175	61.8	0	0	0	113.3	P95 T316 K317 V318 Q323 K324	P95-L320 HydrophobicContact CB-CD1 4.15Å; T316-L320 PolarHBondContact O-N 3.39Å; K317-L320 PolarHBondContact O-N 2.89Å; V318-L320 VanDerWaalsContact C-N 3.3Å; V318-L320 PolarHBondContact O-N 3.37Å; L320-Q323 PolarHBondContact O-N 3.19Å; L320-K324 HydrophobicContact CG-CD 4.47Å; L320-K324 WeakPolarHBondContact O-CG 3.38Å; L320-K324 PolarHBondContact O-N 3.35Å
321	E	90.9	Very high	87	Confident	72 Å²	72	43.1 Å²	43.1	34%	0.336	23%	0.225	S	C	.	.	H	α-helix	trans	-66.1	-39.4	174.4	-57.1	-40.3	124	0	0	111.7	Y305 K317 V318 Q323 K324 V325	Y305-E321 HydrophobicContact CE1-CB 4.33Å; Y305-E321 HydrophobicContact CE2-CB 4.44Å; K317-E321 PolarHBondContact O-N 3.31Å; K317-E321 VanDerWaalsContact O-N 3.12Å; V318-E321 PolarHBondContact O-N 2.94Å; E321-Q323 VanDerWaalsContact C-N 3.34Å; E321-Q323 PolarHBondContact O-N 2.9Å; E321-K324 PolarHBondContact O-N 3.02Å; E321-K324 IonicContact OE1-NZ 2.87Å; E321-K324 PolarHBondContact OE1-NZ 3.17Å; E321-K324 WeakPolarHBondContact OE2-CD 3.44Å; E321-K324 IonicContact OE2-NZ 2.75Å; E321-K324 PolarHBondContact OE2-NZ 3.2Å; E321-V325 WeakPolarHBondContact O-CG2 3.42Å; E321-V325 PolarHBondContact O-N 2.94Å
322	A	89.6	Confident	86.3	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.3	-43.3	172.5	0	0	0	0	0	112.1	V102 L302 Y305 L309 V318 K319 L326	V102-A322 HydrophobicContact CG1-CB 4.06Å; L302-A322 WeakPolarHBondContact CD2-O 3.47Å; Y305-A322 HydrophobicContact CG-CB 4.32Å; L309-A322 HydrophobicContact CD1-CB 4.11Å; V318-A322 WeakPolarHBondContact O-CB 3.29Å; V318-A322 PolarHBondContact O-N 3.42Å; K319-A322 PolarHBondContact O-N 2.97Å; A322-L326 WeakPolarHBondContact O-CB 3.24Å; A322-L326 PolarHBondContact O-N 3.48Å
323	Q	91	Very high	85.1	Confident	16 Å²	16	43.4 Å²	43.4	8%	0.075	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-41.4	175.3	-72.5	166.2	-74.1	0	0	112.3	P95 L98 V102 K319 L320 E321 S327	P95-Q323 HydrophobicContact CB-CB 3.82Å; P95-Q323 WeakPolarHBondContact O-CB 3.37Å; P95-Q323 VanDerWaalsContact O-CD 3.32Å; P95-Q323 WeakPolarHBondContact O-CG 3.35Å; P95-Q323 PolarHBondContact O-NE2 3.3Å; L98-Q323 HydrophobicContact CB-CB 4.43Å; L98-Q323 HydrophobicContact CB-CG 4.14Å; L98-Q323 WeakPolarHBondContact CD1-O 3.37Å; V102-Q323 HydrophobicContact CG2-CG 3.93Å; K319-Q323 WeakPolarHBondContact O-CG 3.12Å; K319-Q323 PolarHBondContact O-N 3.19Å; K319-Q323 PolarHBondContact O-OE1 3.45Å; K319-Q323 VanDerWaalsContact O-OE1 3.11Å; L320-Q323 PolarHBondContact O-N 3.19Å; E321-Q323 VanDerWaalsContact C-N 3.34Å; E321-Q323 PolarHBondContact O-N 2.9Å; Q323-S327 VanDerWaalsContact O-CB 3.31Å; Q323-S327 WeakPolarHBondContact O-CB 3.16Å; Q323-S327 PolarHBondContact O-N 3.46Å
324	K	90.4	Very high	83.8	Confident	85 Å²	85	43.9 Å²	43.9	37%	0.37	23%	0.232	S	C	.	.	H	α-helix	trans	-64.6	-48.2	176.5	-72.8	161.1	172	174.1	0	112.3	P95 L320 E321 L326 S327 A328	P95-K324 HydrophobicContact CB-CG 4.21Å; P95-K324 HydrophobicContact CG-CG 3.78Å; L320-K324 HydrophobicContact CG-CD 4.47Å; L320-K324 WeakPolarHBondContact O-CG 3.38Å; L320-K324 PolarHBondContact O-N 3.35Å; E321-K324 PolarHBondContact O-N 3.02Å; E321-K324 IonicContact OE1-NZ 2.87Å; E321-K324 PolarHBondContact OE1-NZ 3.17Å; E321-K324 WeakPolarHBondContact OE2-CD 3.44Å; E321-K324 IonicContact OE2-NZ 2.75Å; E321-K324 PolarHBondContact OE2-NZ 3.2Å; K324-L326 VanDerWaalsContact C-N 3.3Å; K324-L326 PolarHBondContact O-N 2.93Å; K324-S327 WeakPolarHBondContact O-CB 3.46Å; K324-S327 PolarHBondContact O-N 3.44Å; K324-A328 PolarHBondContact O-N 2.92Å
325	V	87.5	Confident	82.2	Confident	9 Å²	9	44.6 Å²	44.6	6%	0.055	23%	0.232	C	C	.	.	H	α-helix	trans	-65.6	-37	179	179.9	0	0	0	0	110.7	S293 N298 L302 Y305 E321 A328 V329	S293-V325 WeakPolarHBondContact OG-CG2 3.28Å; N298-V325 HydrophobicContact CB-CG1 3.66Å; N298-V325 WeakPolarHBondContact OD1-CG1 3.43Å; L302-V325 HydrophobicContact CD1-CG1 4.19Å; L302-V325 HydrophobicContact CD2-CB 4.08Å; L302-V325 HydrophobicContact CD2-CG1 4.09Å; L302-V325 HydrophobicContact CG-CB 4.32Å; L302-V325 HydrophobicContact CG-CG1 3.76Å; Y305-V325 HydrophobicContact CE2-CG2 4.05Å; E321-V325 WeakPolarHBondContact O-CG2 3.42Å; E321-V325 PolarHBondContact O-N 2.94Å; V325-A328 WeakPolarHBondContact O-CB 3.1Å; V325-A328 PolarHBondContact O-N 2.96Å; V325-V329 WeakPolarHBondContact O-CG2 3.39Å; V325-V329 PolarHBondContact O-N 3.5Å
326	L	87	Confident	80.3	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-66.5	-42.7	175.9	-173.7	58.7	0	0	0	112	L98 L101 V102 L302 F306 A322 K324 A328 V329 F330	L98-L326 HydrophobicContact CD1-CB 4.13Å; L98-L326 HydrophobicContact CD1-CD2 4.27Å; L98-L326 HydrophobicContact CD1-CG 4.07Å; L98-L326 HydrophobicContact CD2-CD2 4.3Å; L101-L326 HydrophobicContact CD2-CD2 3.84Å; L101-L326 HydrophobicContact CG-CD2 4.39Å; V102-L326 HydrophobicContact CG2-CD2 3.74Å; L302-L326 HydrophobicContact CD1-CB 4.42Å; L302-L326 HydrophobicContact CD1-CD1 4.02Å; L302-L326 HydrophobicContact CD2-CB 3.9Å; F306-L326 HydrophobicContact CZ-CD2 4.43Å; A322-L326 WeakPolarHBondContact O-CB 3.24Å; A322-L326 PolarHBondContact O-N 3.48Å; K324-L326 VanDerWaalsContact C-N 3.3Å; K324-L326 PolarHBondContact O-N 2.93Å; L326-A328 VanDerWaalsContact C-N 3.33Å; L326-A328 PolarHBondContact O-N 3.5Å; L326-V329 PolarHBondContact O-N 3.16Å; L326-F330 HydrophobicContact CD1-CD2 4.08Å; L326-F330 HydrophobicContact CD1-CE2 3.74Å; L326-F330 HydrophobicContact CD2-CE2 4.32Å; L326-F330 HydrophobicContact CG-CD2 3.95Å; L326-F330 HydrophobicContact CG-CE2 3.72Å; L326-F330 WeakPolarHBondContact O-CD2 3.49Å; L326-F330 PolarHBondContact O-N 2.81Å
327	S	86.9	Confident	78.2	Confident	15 Å²	15	51.2 Å²	51.2	11%	0.105	26%	0.262	C	S	.	.	H	α-helix	trans	-57.4	-42.7	170	160.7	0	0	0	0	112.1	L93 Q323 K324 S331	L93-S327 WeakPolarHBondContact O-CB 3.31Å; L93-S327 PolarHBondContact O-OG 3.35Å; Q323-S327 VanDerWaalsContact O-CB 3.31Å; Q323-S327 WeakPolarHBondContact O-CB 3.16Å; Q323-S327 PolarHBondContact O-N 3.46Å; K324-S327 WeakPolarHBondContact O-CB 3.46Å; K324-S327 PolarHBondContact O-N 3.44Å; S327-S331 PolarHBondContact O-N 2.86Å; S327-S331 VanDerWaalsContact O-N 3.09Å; S327-S331 PolarHBondContact O-OG 3.21Å
328	A	84.7	Confident	75.6	Confident	43 Å²	43	53.5 Å²	53.5	36%	0.355	28%	0.279	S	S	.	.	H	α-helix	trans	-64.8	-45.7	176.1	0	0	0	0	0	112.1	K324 V325 L326 F330 S331 S332	K324-A328 PolarHBondContact O-N 2.92Å; V325-A328 WeakPolarHBondContact O-CB 3.1Å; V325-A328 PolarHBondContact O-N 2.96Å; L326-A328 VanDerWaalsContact C-N 3.33Å; L326-A328 PolarHBondContact O-N 3.5Å; A328-F330 PolarHBondContact O-N 2.91Å; A328-S331 WeakPolarHBondContact O-CA 3.41Å; A328-S331 VanDerWaalsContact O-CB 3.29Å; A328-S331 WeakPolarHBondContact O-CB 3.33Å; A328-S331 PolarHBondContact O-N 3.44Å; A328-S332 PolarHBondContact O-N 3.21Å; A328-S332 PolarHBondContact O-OG 2.94Å
329	V	83.7	Confident	72.5	Confident	19 Å²	19	60.9 Å²	60.9	12%	0.115	32%	0.315	C	S	.	.	H	α-helix	trans	-60.5	-46.3	176.4	168.7	0	0	0	0	111.3	N298 L302 V325 L326 S331 S332 V333 L354	N298-V329 HydrophobicContact CB-CG2 3.71Å; L302-V329 HydrophobicContact CD1-CB 4.31Å; L302-V329 HydrophobicContact CD1-CG2 3.84Å; V325-V329 WeakPolarHBondContact O-CG2 3.39Å; V325-V329 PolarHBondContact O-N 3.5Å; L326-V329 PolarHBondContact O-N 3.16Å; V329-S331 PolarHBondContact O-N 3.01Å; V329-S332 WeakPolarHBondContact CA-OG 3.41Å; V329-S332 PolarHBondContact O-N 3Å; V329-S332 PolarHBondContact O-OG 2.86Å; V329-V333 WeakPolarHBondContact O-CG2 3.39Å; V329-V333 PolarHBondContact O-N 3.26Å; V329-L354 HydrophobicContact CG1-CD2 4.28Å
330	F	81.2	Confident	70	Confident	9 Å²	9	64.1 Å²	64.1	4%	0.039	34%	0.341	C	S	.	.	H	α-helix	trans	-59.7	-24.7	172.7	-81.9	-63.3	0	0	0	113	L81 A88 L93 L98 L101 L326 A328 F334	L81-F330 HydrophobicContact CD2-CZ 4.05Å; A88-F330 HydrophobicContact CB-CB 4.4Å; A88-F330 HydrophobicContact CB-CD1 4.49Å; L93-F330 HydrophobicContact CD1-CB 4.24Å; L93-F330 HydrophobicContact CD1-CD1 4.36Å; L93-F330 HydrophobicContact CD1-CD2 3.7Å; L93-F330 HydrophobicContact CD1-CE2 4.05Å; L93-F330 HydrophobicContact CD1-CG 3.88Å; L98-F330 HydrophobicContact CD2-CD2 4.42Å; L98-F330 HydrophobicContact CD2-CE2 4.03Å; L101-F330 HydrophobicContact CD2-CE2 4.25Å; L101-F330 HydrophobicContact CD2-CZ 4.36Å; L326-F330 HydrophobicContact CD1-CD2 4.08Å; L326-F330 HydrophobicContact CD1-CE2 3.74Å; L326-F330 HydrophobicContact CD2-CE2 4.32Å; L326-F330 HydrophobicContact CG-CD2 3.95Å; L326-F330 HydrophobicContact CG-CE2 3.72Å; L326-F330 WeakPolarHBondContact O-CD2 3.49Å; L326-F330 PolarHBondContact O-N 2.81Å; A328-F330 PolarHBondContact O-N 2.91Å; F330-F334 WeakPolarHBondContact O-CD2 3.29Å; F330-F334 WeakPolarHBondContact O-CE2 3.06Å
331	S	77.3	Confident	66.9	Low	11 Å²	11	66.9 Å²	66.9	8%	0.077	36%	0.36	C	S	.	.	H	α-helix	trans	-81.7	-47.8	176.9	-52.5	0	0	0	0	112.2	K92 S327 A328 V329 V333 F334 E335	K92-S331 WeakPolarHBondContact CE-OG 3Å; K92-S331 WeakPolarHBondContact CG-OG 3.32Å; K92-S331 PolarHBondContact NZ-OG 3.3Å; S327-S331 PolarHBondContact O-N 2.86Å; S327-S331 VanDerWaalsContact O-N 3.09Å; S327-S331 PolarHBondContact O-OG 3.21Å; A328-S331 WeakPolarHBondContact O-CA 3.41Å; A328-S331 VanDerWaalsContact O-CB 3.29Å; A328-S331 WeakPolarHBondContact O-CB 3.33Å; A328-S331 PolarHBondContact O-N 3.44Å; V329-S331 PolarHBondContact O-N 3.01Å; S331-V333 PolarHBondContact O-N 3.1Å; S331-V333 VanDerWaalsContact O-N 3.14Å; S331-F334 PolarHBondContact O-N 3.48Å; S331-E335 PolarHBondContact O-N 3.47Å
332	S	70.1	Confident	64.4	Low	51 Å²	51	69.2 Å²	69.2	36%	0.357	38%	0.382	S	S	.	.	H	α-helix	trans	-63.1	-21.4	-176.6	53.2	0	0	0	0	113.8	A328 V329 F334 N336	A328-S332 PolarHBondContact O-N 3.21Å; A328-S332 PolarHBondContact O-OG 2.94Å; V329-S332 WeakPolarHBondContact CA-OG 3.41Å; V329-S332 PolarHBondContact O-N 3Å; V329-S332 PolarHBondContact O-OG 2.86Å; S332-F334 VanDerWaalsContact C-N 3.3Å; S332-F334 PolarHBondContact O-N 3.03Å; S332-N336 PolarHBondContact O-ND2 2.82Å
333	V	62.2	Low	61.3	Low	39 Å²	39	77.1 Å²	77.1	24%	0.236	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-34.5	174	172.3	0	0	0	0	111.8	V329 S331 L354	V329-V333 WeakPolarHBondContact O-CG2 3.39Å; V329-V333 PolarHBondContact O-N 3.26Å; S331-V333 PolarHBondContact O-N 3.1Å; S331-V333 VanDerWaalsContact O-N 3.14Å; V333-L354 HydrophobicContact CG1-CD1 4.29Å; V333-L354 HydrophobicContact CG2-CD1 4.04Å; V333-L354 HydrophobicContact CG2-CD2 3.9Å; V333-L354 HydrophobicContact CG2-CG 4.21Å
334	F	57.3	Low	58.2	Low	59 Å²	59	85.3 Å²	85.3	26%	0.259	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-20.7	-174.5	-51.8	-59.9	0	0	0	113.2	A88 N89 F330 S331 S332 N336 E337	A88-F334 HydrophobicContact CB-CD2 4.33Å; A88-F334 HydrophobicContact CB-CE2 3.66Å; N89-F334 VanDerWaalsContact OD1-CD1 3.28Å; N89-F334 WeakPolarHBondContact OD1-CD1 3.29Å; N89-F334 WeakPolarHBondContact OD1-CE1 3.06Å; N89-F334 VanDerWaalsContact OD1-CZ 3.29Å; N89-F334 WeakPolarHBondContact OD1-CZ 3.07Å; F330-F334 WeakPolarHBondContact O-CD2 3.29Å; F330-F334 WeakPolarHBondContact O-CE2 3.06Å; S331-F334 PolarHBondContact O-N 3.48Å; S332-F334 VanDerWaalsContact C-N 3.3Å; S332-F334 PolarHBondContact O-N 3.03Å; F334-N336 PolarHBondContact O-N 3.39Å; F334-N336 VanDerWaalsContact O-N 3.17Å; F334-E337 PolarHBondContact O-N 3.4Å
335	E	52.4	Low	55.5	Low	126 Å²	126	86.3 Å²	86.3	59%	0.589	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-2	171	-67.9	169.5	-163.2	0	0	113.1	K92 S331	K92-E335 IonicContact NZ-OE1 3.29Å; K92-E335 PolarHBondContact NZ-OE1 2.94Å; S331-E335 PolarHBondContact O-N 3.47Å
336	N	45.6	Very low	52.6	Low	133 Å²	133	94 Å²	94	71%	0.711	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-4.2	177.5	-78.5	-81.3	0	0	0	115	S332 F334	S332-N336 PolarHBondContact O-ND2 2.82Å; F334-N336 PolarHBondContact O-N 3.39Å; F334-N336 VanDerWaalsContact O-N 3.17Å
337	E	43.8	Very low	50	Low	161 Å²	161	103.5 Å²	103.5	75%	0.752	56%	0.56	S	S	*	*			trans	-104.9	38.7	-173.6	-76.3	-78.5	134.5	0	0	112.9	F334 M339	F334-E337 PolarHBondContact O-N 3.4Å; E337-M339 VanDerWaalsContact C-N 3.34Å; E337-M339 PolarHBondContact O-N 2.94Å
338	D	34.8	Very low	47.4	Very low	156 Å²	156	106.2 Å²	106.2	83%	0.834	59%	0.591	S	S	*	*			trans	-83.7	64.4	-169.9	-131.2	-8.4	0	0	0	113.4
339	M	26.3	Very low	44.8	Very low	160 Å²	160	106.2 Å²	106.2	79%	0.788	60%	0.595	S	S	*	*			trans	-145.8	117.5	164.9	-94.4	-57.8	-61.7	0	0	112.3	E337	E337-M339 VanDerWaalsContact C-N 3.34Å; E337-M339 PolarHBondContact O-N 2.94Å
340	P	36.3	Very low	42.4	Very low	112 Å²	112	111.4 Å²	111.4	73%	0.727	62%	0.622	S	S	*	*			trans	-89.4	116.6	-170.2	32.4	-34.2	0	0	0	114.3
341	T	25.5	Very low	40.1	Very low	125 Å²	125	114.8 Å²	114.8	77%	0.767	65%	0.651	S	S	*	*			trans	-153.7	130.6	155.8	-49.1	0	0	0	0	110.5
342	P	38.2	Very low	38.1	Very low	121 Å²	121	118.1 Å²	118.1	79%	0.786	67%	0.671	S	S	*	*			trans	-94.1	120.5	-168.5	33.9	-33.4	0	0	0	114.4
343	L	24.6	Very low	36.6	Very low	166 Å²	166	124.3 Å²	124.3	87%	0.869	69%	0.694	S	S	*	*			trans	-144.8	128.4	167	-74.4	178.6	0	0	0	113.4
344	H	26	Very low	35.6	Very low	188 Å²	188	124.9 Å²	124.9	87%	0.87	70%	0.696	S	S	*	*			trans	-77.4	157.7	157.6	-110	-97.6	0	0	0	109.8
345	P	34.1	Very low	35	Very low	105 Å²	105	124.8 Å²	124.8	68%	0.682	70%	0.697	S	S	*	*			cis	-121.1	123	-35.1	30.4	-14.2	0	0	0	110.7	Q347	P345-Q347 PolarHBondContact O-N 3.34Å; P345-Q347 VanDerWaalsContact O-N 3.07Å
346	L	27.5	Very low	34.3	Very low	172 Å²	172	124.3 Å²	124.3	90%	0.901	69%	0.693	S	S	*	*			trans	-77.4	99.5	-179.8	-81.6	172.4	0	0	0	112.6	G348	L346-G348 PolarHBondContact O-N 3.41Å
347	Q	32.3	Very low	33.8	Very low	202 Å²	202	120.8 Å²	120.8	94%	0.944	68%	0.677	S	S	*	*			trans	-78	83.4	177.7	-164.9	167.5	18.3	0	0	111.3	P345	P345-Q347 PolarHBondContact O-N 3.34Å; P345-Q347 VanDerWaalsContact O-N 3.07Å
348	G	32.1	Very low	33.3	Very low	72 Å²	72	117 Å²	117	74%	0.742	67%	0.667	S	S	*	*	S	Bend	trans	109.9	119.4	174.8	0	0	0	0	0	113.7	L346	L346-G348 PolarHBondContact O-N 3.41Å
349	G	30.1	Very low	33.3	Very low	44 Å²	44	112 Å²	112	45%	0.454	65%	0.647	S	S	.	*	S	Bend	trans	174.8	-60.7	176.3	0	0	0	0	0	114.5	A351 T352	G349-A351 PolarHBondContact O-N 3.49Å; G349-T352 PolarHBondContact O-OG1 2.83Å
350	L	32.4	Very low	33.8	Very low	128 Å²	128	105.5 Å²	105.5	67%	0.67	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-72.4	-30.4	-169.7	-80.1	76	0	0	0	114.5	T352 H353	L350-T352 PolarHBondContact O-N 3.5Å; L350-H353 PolarHBondContact O-N 3.27Å
351	A	34.1	Very low	33.9	Very low	79 Å²	79	103.3 Å²	103.3	65%	0.653	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-66	-2.8	-178.9	0	0	0	0	0	114.8	G349	G349-A351 PolarHBondContact O-N 3.49Å
352	T	35.3	Very low	34.4	Very low	82 Å²	82	104.5 Å²	104.5	50%	0.503	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-89.1	-23.5	-177.9	-9.2	0	0	0	0	114.1	G349 L350	G349-T352 PolarHBondContact O-OG1 2.83Å; L350-T352 PolarHBondContact O-N 3.5Å
353	H	38.6	Very low	34.3	Very low	180 Å²	180	102.8 Å²	102.8	83%	0.833	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	-30.7	-178.2	-75.2	-86.2	0	0	0	113.7	L350 I355	L350-H353 PolarHBondContact O-N 3.27Å; H353-I355 PolarHBondContact O-N 3.49Å
354	L	41.3	Very low	34.8	Very low	52 Å²	52	97.9 Å²	97.9	27%	0.272	56%	0.559	S	S	.	*	S	Bend	trans	-82.5	108.9	173.1	-84	169.8	0	0	0	111.3	V329 V333 K356	V329-L354 HydrophobicContact CG1-CD2 4.28Å; V333-L354 HydrophobicContact CG1-CD1 4.29Å; V333-L354 HydrophobicContact CG2-CD1 4.04Å; V333-L354 HydrophobicContact CG2-CD2 3.9Å; V333-L354 HydrophobicContact CG2-CG 4.21Å; L354-K356 PolarHBondContact O-N 2.64Å
355	I	44.3	Very low	35	Very low	57 Å²	57	99.3 Å²	99.3	29%	0.292	56%	0.557	S	S	.	*			trans	39.2	73.5	157	-44.4	-179.6	0	0	0	114.1	H353 P357 L360	H353-I355 PolarHBondContact O-N 3.49Å; I355-P357 VanDerWaalsContact O-CD 3.23Å; I355-P357 WeakPolarHBondContact O-CD 3.46Å; I355-L360 HydrophobicContact CG2-CD1 3.44Å; I355-L360 VanDerWaalsContact CG2-CD1 3.44Å; I355-L360 HydrophobicContact CG2-CG 4.03Å
356	K	36.5	Very low	34.7	Very low	115 Å²	115	99 Å²	99	50%	0.5	56%	0.555	S	S	.	*			trans	-56.5	120.7	164.2	-76.3	179.7	-178.9	173.4	0	108.9	L354 P358 A359 L360	L354-K356 PolarHBondContact O-N 2.64Å; K356-P358 VanDerWaalsContact C-N 3.28Å; K356-A359 HydrophobicContact CB-CB 4Å; K356-A359 WeakPolarHBondContact O-CB 3Å; K356-A359 PolarHBondContact O-N 2.67Å; K356-L360 PolarHBondContact O-N 2.73Å
357	P	36.6	Very low	35	Very low	59 Å²	59	99.3 Å²	99.3	38%	0.383	56%	0.556	S	S	.	*	H	α-helix	trans	-54.4	-41.6	173.1	-22.9	32.8	0	0	0	111.9	I355 A359 L360 L361	I355-P357 VanDerWaalsContact O-CD 3.23Å; I355-P357 WeakPolarHBondContact O-CD 3.46Å; P357-A359 PolarHBondContact O-N 2.81Å; P357-A359 VanDerWaalsContact O-N 3.13Å; P357-L360 WeakPolarHBondContact O-CB 3.21Å; P357-L360 PolarHBondContact O-N 3.15Å; P357-L361 HydrophobicContact CB-CD1 4.42Å; P357-L361 WeakPolarHBondContact O-CD1 3.17Å; P357-L361 WeakPolarHBondContact O-CG 3.33Å; P357-L361 PolarHBondContact O-N 3.01Å
358	P	32.2	Very low	34.8	Very low	83 Å²	83	96 Å²	96	54%	0.539	55%	0.55	S	S	.	*	H	α-helix	trans	-54.6	-30	171.9	-29.6	37.3	0	0	0	115.7	K356 Q362	K356-P358 VanDerWaalsContact C-N 3.28Å; P358-Q362 WeakPolarHBondContact O-CB 3.44Å; P358-Q362 PolarHBondContact O-N 2.85Å
359	A	34.6	Very low	34.7	Very low	49 Å²	49	101.5 Å²	101.5	41%	0.405	56%	0.557	S	S	.	*	H	α-helix	trans	-77.8	-36.6	179.2	0	0	0	0	0	112.7	K356 P357 L361 S363	K356-A359 HydrophobicContact CB-CB 4Å; K356-A359 WeakPolarHBondContact O-CB 3Å; K356-A359 PolarHBondContact O-N 2.67Å; P357-A359 PolarHBondContact O-N 2.81Å; P357-A359 VanDerWaalsContact O-N 3.13Å; A359-L361 VanDerWaalsContact C-N 3.33Å; A359-S363 PolarHBondContact O-N 2.97Å; A359-S363 PolarHBondContact O-OG 3.04Å
360	L	37.6	Very low	34.5	Very low	25 Å²	25	107.8 Å²	107.8	13%	0.131	57%	0.572	C	S	.	*	H	α-helix	trans	-57.8	-46.6	166.9	-92.3	168.8	0	0	0	110.9	Q303 I355 K356 P357	Q303-L360 HydrophobicContact CB-CD2 3.72Å; Q303-L360 HydrophobicContact CG-CD2 3.56Å; I355-L360 HydrophobicContact CG2-CD1 3.44Å; I355-L360 VanDerWaalsContact CG2-CD1 3.44Å; I355-L360 HydrophobicContact CG2-CG 4.03Å; K356-L360 PolarHBondContact O-N 2.73Å; P357-L360 WeakPolarHBondContact O-CB 3.21Å; P357-L360 PolarHBondContact O-N 3.15Å
361	L	38.1	Very low	34.1	Very low	66 Å²	66	108.3 Å²	108.3	35%	0.346	58%	0.58	S	S	.	*	H	α-helix	trans	-76.4	-32.4	-174.5	-57.1	163.8	0	0	0	112.4	L109 E113 P357 A359 S363 L364	L109-L361 HydrophobicContact CD2-CD2 4.34Å; E113-L361 HydrophobicContact CG-CD2 3.64Å; E113-L361 WeakPolarHBondContact OE1-CD2 3.4Å; P357-L361 HydrophobicContact CB-CD1 4.42Å; P357-L361 WeakPolarHBondContact O-CD1 3.17Å; P357-L361 WeakPolarHBondContact O-CG 3.33Å; P357-L361 PolarHBondContact O-N 3.01Å; A359-L361 VanDerWaalsContact C-N 3.33Å; L361-S363 VanDerWaalsContact C-N 3.31Å; L361-S363 PolarHBondContact O-N 3.42Å; L361-L364 PolarHBondContact O-N 2.86Å
362	Q	36.5	Very low	33.5	Very low	149 Å²	149	111 Å²	111	70%	0.696	58%	0.584	S	S	*	*	H	α-helix	trans	-75.7	-18.9	-178.6	-172.8	165.7	9.8	0	0	113.5	P358	P358-Q362 WeakPolarHBondContact O-CB 3.44Å; P358-Q362 PolarHBondContact O-N 2.85Å
363	S	35.2	Very low	32.9	Very low	86 Å²	86	113.4 Å²	113.4	60%	0.601	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-17.3	178.1	-56.5	0	0	0	0	113.3	A359 L361 R365	A359-S363 PolarHBondContact O-N 2.97Å; A359-S363 PolarHBondContact O-OG 3.04Å; L361-S363 VanDerWaalsContact C-N 3.31Å; L361-S363 PolarHBondContact O-N 3.42Å; S363-R365 PolarHBondContact O-N 2.84Å
364	L	34.7	Very low	32.2	Very low	63 Å²	63	110.1 Å²	110.1	33%	0.33	60%	0.6	S	S	.	*			trans	-96	46.4	-175	-67.6	171.3	0	0	0	113.1	L109 E113 L307 L361 P366	L109-L364 HydrophobicContact CD2-CD1 4.21Å; E113-L364 HydrophobicContact CB-CD1 4.49Å; E113-L364 HydrophobicContact CG-CD1 4.39Å; L307-L364 HydrophobicContact CD2-CD2 4.2Å; L361-L364 PolarHBondContact O-N 2.86Å; L364-P366 VanDerWaalsContact O-CD 3.27Å; L364-P366 WeakPolarHBondContact O-CD 3.32Å
365	R	30.4	Very low	31.5	Very low	218 Å²	218	112.6 Å²	112.6	82%	0.823	62%	0.621	S	S	*	*			trans	-105.9	96.5	170.2	-76.4	-173.9	173.8	-176.6	-1.2	112.2	S363	S363-R365 PolarHBondContact O-N 2.84Å
366	P	29.1	Very low	30.7	Very low	98 Å²	98	119.3 Å²	119.3	64%	0.636	65%	0.652	S	S	*	*			trans	-62.9	158.8	161.2	-19.1	32.2	0	0	0	111.8	L364 T368	L364-P366 VanDerWaalsContact O-CD 3.27Å; L364-P366 WeakPolarHBondContact O-CD 3.32Å; P366-T368 PolarHBondContact O-N 2.74Å
367	L	32.8	Very low	30	Very low	178 Å²	178	121.3 Å²	121.3	93%	0.932	67%	0.667	S	S	*	*			trans	-76.6	94.2	177.4	-68.5	90.8	0	0	0	111.2
368	T	28.3	Very low	29.4	Very low	133 Å²	133	124.3 Å²	124.3	82%	0.816	69%	0.69	S	S	*	*			trans	-124.1	38.4	169.1	57.1	0	0	0	0	113.1	P366	P366-T368 PolarHBondContact O-N 2.74Å
369	Q	29.6	Very low	28.9	Very low	188 Å²	188	128.7 Å²	128.7	88%	0.879	70%	0.703	S	S	*	*			trans	-94.9	116.7	157.9	-80.3	-171.9	-34.3	0	0	109.8
370	K	25.6	Very low	28.3	Very low	176 Å²	176	134.7 Å²	134.7	77%	0.765	72%	0.721	S	S	*	*			trans	-65.2	129.7	157.8	-67.7	179.8	178.6	-179.9	0	107.7	D372	K370-D372 VanDerWaalsContact C-N 3.27Å; K370-D372 PolarHBondContact O-N 2.8Å; K370-D372 VanDerWaalsContact O-N 3.07Å
371	T	24	Very low	27.6	Very low	138 Å²	138	138 Å²	138	85%	0.847	75%	0.746	S	S	*	*			trans	-76.9	84	161.7	49.4	0	0	0	0	108.3	C373	T371-C373 PolarHBondContact O-N 3.11Å
372	D	22.9	Very low	26.8	Very low	136 Å²	136	141.7 Å²	141.7	73%	0.727	77%	0.771	S	S	*	*			trans	-64.7	113.8	168.7	-73.8	-33	0	0	0	108.4	K370 S374	K370-D372 VanDerWaalsContact C-N 3.27Å; K370-D372 PolarHBondContact O-N 2.8Å; K370-D372 VanDerWaalsContact O-N 3.07Å; D372-S374 PolarHBondContact O-N 2.84Å; D372-S374 VanDerWaalsContact O-N 3.13Å
373	C	21.9	Very low	26.1	Very low	132 Å²	132	139 Å²	139	89%	0.892	77%	0.774	S	S	*	*			trans	-84.5	89	-171.7	-164.5	0	0	0	0	110.5	T371	T371-C373 PolarHBondContact O-N 3.11Å
374	S	25	Very low	25.5	Very low	112 Å²	112	144.9 Å²	144.9	78%	0.783	79%	0.789	S	S	*	*			trans	-91	107.9	171.1	63	0	0	0	0	111	D372	D372-S374 PolarHBondContact O-N 2.84Å; D372-S374 VanDerWaalsContact O-N 3.13Å
375	S	25.7	Very low	24.9	Very low	104 Å²	104	147 Å²	147	73%	0.727	81%	0.809	S	S	*	*			trans	-62	138.8	173.2	52.4	0	0	0	0	113
376	Q	27.3	Very low	25.2	Very low	198 Å²	198	142 Å²	142	93%	0.925	81%	0.805	S	S	*	*			trans	-150.4	125	151.3	-118	170	39.7	0	0	110.4
377	D	21.4	Very low	25.6	Very low	156 Å²	156	142.2 Å²	142.2	83%	0.834	81%	0.806	S	S	*	*			trans	-81.1	146.4	-177.5	-51.7	-83.4	0	0	0	112.3
378	S	24.6	Very low	25.3	Very low	123 Å²	123	141.4 Å²	141.4	86%	0.86	80%	0.8	S	S	*	*			trans	-154.6	131.8	152.4	58.1	0	0	0	0	110.4
379	E	21.3	Very low	25.1	Very low	174 Å²	174	142.2 Å²	142.2	81%	0.813	80%	0.799	S	S	*	*			trans	-97.8	158.4	-168.9	-82.6	-168.3	110.6	0	0	114.6
380	F	22.4	Very low	24.7	Very low	175 Å²	175	136.1 Å²	136.1	77%	0.768	79%	0.787	S	S	*	*			trans	75.1	110.8	145.9	-98.4	-118.6	0	0	0	122.3
381	S	22.5	Very low	25.5	Very low	96 Å²	96	134.1 Å²	134.1	67%	0.671	79%	0.792	S	S	*	*				116.7	117.6	105.9	69.9	0	0	0	0	122.6
382	V	21.8	Very low	25.6	Very low	142 Å²	142	132.8 Å²	132.8	86%	0.861	79%	0.788	S	S	*	*			trans	66.4	117.4	131.5	179.4	0	0	0	0	121.5
383	A	21.8	Very low	25.6	Very low	93 Å²	93	132.4 Å²	132.4	77%	0.769	80%	0.796	S	S	*	*				-176.1	123.7	119.5	0	0	0	0	0	116.4
384	K	21.5	Very low	25.7	Very low	210 Å²	210	134.9 Å²	134.9	91%	0.913	80%	0.795	S	S	*	*			trans	28	134.8	144.7	-74.7	-178.8	174.8	178.2	0	124.6
385	S	23.9	Very low	25.6	Very low	107 Å²	107	138 Å²	138	75%	0.748	80%	0.801	S	S	*	*			trans	-86.3	-178.8	147.5	66.2	0	0	0	0	111.2
386	P	36	Very low	25.4	Very low	114 Å²	114	138.1 Å²	138.1	74%	0.74	80%	0.802	S	S	*	*				-156.8	-142.7	64.6	41.8	-16.3	0	0	0	113.5
387	P	38.1	Very low	26	Very low	102 Å²	102	134.2 Å²	134.2	66%	0.662	79%	0.794	S	S	*	*				-124.6	-169.9	-55.4	28.6	-7.5	0	0	0	114.3
388	M	25.8	Very low	26	Very low	161 Å²	161	135.4 Å²	135.4	79%	0.793	80%	0.797	S	S	*	*			trans	127.2	138.8	145.5	-65.5	-43.6	-144.1	0	0	114.2
389	D	24.4	Very low	25.9	Very low	149 Å²	149	134.2 Å²	134.2	80%	0.797	79%	0.788	S	S	*	*			cis	-158.8	173.3	-31.5	-144.8	-23.4	0	0	0	110
390	G	21.5	Very low	26.8	Very low	61 Å²	61	131.8 Å²	131.8	63%	0.629	79%	0.788	S	S	*	*			trans	-84.5	-155.3	-173.4	0	0	0	0	0	117.2
391	P	40.9	Very low	26.9	Very low	133 Å²	133	127.3 Å²	127.3	86%	0.864	78%	0.783	S	S	*	*			cis	-139.6	-167.3	12.1	43.7	-24.2	0	0	0	116.6
392	S	25.9	Very low	27	Very low	111 Å²	111	131.5 Å²	131.5	78%	0.776	79%	0.789	S	S	*	*			trans	-107.3	173.5	-169.6	-17.2	0	0	0	0	115.2
393	S	24.1	Very low	27.2	Very low	127 Å²	127	130.1 Å²	130.1	89%	0.888	79%	0.786	S	S	*	*			trans	-176.6	151.8	134.4	-80.5	0	0	0	0	114.3
394	E	22.9	Very low	27.4	Very low	185 Å²	185	131.8 Å²	131.8	86%	0.864	78%	0.782	S	S	*	*			trans	-99.8	162.5	165.2	-58.6	-180	118.2	0	0	111
395	L	24.2	Very low	27.6	Very low	176 Å²	176	129.6 Å²	129.6	92%	0.921	78%	0.779	S	S	*	*				178.2	165.6	129	-96.9	164.9	0	0	0	112.7
396	S	21.6	Very low	27.7	Very low	107 Å²	107	128.3 Å²	128.3	75%	0.748	78%	0.775	S	S	*	*			trans	-107.4	-153.4	-168.6	-58.6	0	0	0	0	112.9
397	P	39.4	Very low	27.2	Very low	116 Å²	116	128.2 Å²	128.2	75%	0.753	78%	0.784	S	S	*	*				-117.7	-173.2	-86.9	38.5	-24.2	0	0	0	112.6
398	M	21.9	Very low	26.5	Very low	182 Å²	182	127.3 Å²	127.3	90%	0.897	79%	0.793	S	S	*	*			trans	180	157	141.6	-92.1	-96.5	98.9	0	0	112.2
399	S	22.6	Very low	26.4	Very low	97 Å²	97	129.6 Å²	129.6	68%	0.678	80%	0.802	S	S	*	*			trans	-130.9	-176.2	173.8	72.9	0	0	0	0	108.1
400	P	39.4	Very low	26.5	Very low	123 Å²	123	126.2 Å²	126.2	80%	0.799	80%	0.802	S	S	*	*			cis	-126.6	-147.3	17	31.5	-4.1	0	0	0	111.1
401	A	23.8	Very low	26.7	Very low	81 Å²	81	128.7 Å²	128.7	67%	0.669	81%	0.81	S	S	*	*			cis	-160.3	148.8	9.6	0	0	0	0	0	116
402	K	26.3	Very low	26.2	Very low	184 Å²	184	127.7 Å²	127.7	80%	0.8	81%	0.806	S	S	*	*			trans	35.4	121.8	140.1	-61	-170.5	175.4	-164.6	0	122.5
403	S	25.9	Very low	26.3	Very low	113 Å²	113	132 Å²	132	79%	0.79	81%	0.811	S	S	*	*				-163.7	108.7	99.4	42.1	0	0	0	0	113.6
404	D	24.4	Very low	26.5	Very low	128 Å²	128	130.7 Å²	130.7	68%	0.684	80%	0.802	S	S	*	*				32.6	126.9	118.2	-64.7	6.8	0	0	0	117.5
405	L	27.4	Very low	26.8	Very low	165 Å²	165	128.4 Å²	128.4	86%	0.864	80%	0.795	S	S	*	*			cis	-159.9	167.5	17.4	-83.5	136	0	0	0	108.2
406	A	25.3	Very low	27.2	Very low	80 Å²	80	123 Å²	123	66%	0.661	78%	0.776	S	S	*	*			cis	-173.9	178.3	-14.9	0	0	0	0	0	110.9
407	A	24.9	Very low	27.7	Very low	111 Å²	111	124.8 Å²	124.8	92%	0.917	78%	0.777	S	S	*	*			trans	67.6	119	161.3	0	0	0	0	0	119.4
408	G	22.9	Very low	27.4	Very low	84 Å²	84	124.3 Å²	124.3	87%	0.866	77%	0.771	S	S	*	*			trans	170.6	-25	162.9	0	0	0	0	0	120.4
409	E	24.2	Very low	27.9	Very low	208 Å²	208	122.5 Å²	122.5	97%	0.972	77%	0.765	S	S	*	*			trans	-102.1	143.4	-171	-67	-164	139.7	0	0	115.1
410	G	26.6	Very low	28.3	Very low	78 Å²	78	122 Å²	122	80%	0.804	77%	0.766	S	S	*	*			trans	-161.3	72.4	-174.4	0	0	0	0	0	113.1
411	S	26.2	Very low	27.8	Very low	113 Å²	113	120.6 Å²	120.6	79%	0.79	76%	0.76	S	S	*	*			trans	-51.4	149.7	-173.1	-175.5	0	0	0	0	116
412	S	31.2	Very low	28	Very low	113 Å²	113	124.2 Å²	124.2	79%	0.79	77%	0.767	S	S	*	*			trans	-54.1	131	179.5	51	0	0	0	0	114.3
413	K	26.8	Very low	27.9	Very low	200 Å²	200	121.2 Å²	121.2	87%	0.87	77%	0.766	S	S	*	*			trans	-128.2	140.2	158.5	-70.2	-176.4	178.5	177.1	0	109.1
414	S	28.3	Very low	28	Very low	100 Å²	100	120.2 Å²	120.2	70%	0.699	77%	0.765	S	S	*	*			trans	-61.2	143.5	-169.4	-179	0	0	0	0	113.4	A416	S414-A416 PolarHBondContact O-N 2.96Å
415	L	30.5	Very low	28	Very low	137 Å²	137	120 Å²	120	72%	0.717	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-55	-24.3	179.4	-121.1	81.4	0	0	0	113.9	N417 V418	L415-N417 PolarHBondContact O-N 2.78Å; L415-N417 VanDerWaalsContact O-N 3.16Å; L415-V418 PolarHBondContact O-N 3.47Å; L415-V418 VanDerWaalsContact O-N 3.14Å
416	A	31.2	Very low	27.9	Very low	63 Å²	63	121.5 Å²	121.5	52%	0.521	77%	0.773	S	S	.	*	G	3₁₀ helix	trans	-53.3	-37	-174.5	0	0	0	0	0	113.8	S414 V418	S414-A416 PolarHBondContact O-N 2.96Å; A416-V418 PolarHBondContact O-N 2.52Å
417	N	31.7	Very low	27.9	Very low	145 Å²	145	121.9 Å²	121.9	78%	0.775	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-84.3	-5.6	-174.8	-71.6	5.1	0	0	0	114.4	L415	L415-N417 PolarHBondContact O-N 2.78Å; L415-N417 VanDerWaalsContact O-N 3.16Å
418	V	34.8	Very low	27.9	Very low	105 Å²	105	120.3 Å²	120.3	64%	0.636	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-31.3	175.4	-178.4	0	0	0	0	111.3	L415 A416 A420	L415-V418 PolarHBondContact O-N 3.47Å; L415-V418 VanDerWaalsContact O-N 3.14Å; A416-V418 PolarHBondContact O-N 2.52Å; V418-A420 VanDerWaalsContact C-N 3.29Å; V418-A420 PolarHBondContact O-N 3.23Å
419	L	31.6	Very low	28.1	Very low	145 Å²	145	124.8 Å²	124.8	76%	0.759	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-12.5	-176.6	-64.1	174	0	0	0	114.1
420	A	30.7	Very low	28.2	Very low	85 Å²	85	124.9 Å²	124.9	70%	0.702	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-1.9	-177.3	0	0	0	0	0	115	V418	V418-A420 VanDerWaalsContact C-N 3.29Å; V418-A420 PolarHBondContact O-N 3.23Å
421	S	30.1	Very low	28.2	Very low	95 Å²	95	132.8 Å²	132.8	66%	0.664	78%	0.784	S	S	*	*	S	Bend	trans	-143	49.3	-163.1	-61.3	0	0	0	0	115.2
422	L	26	Very low	28.1	Very low	157 Å²	157	136.8 Å²	136.8	82%	0.822	79%	0.788	S	S	*	*			trans	-134.7	146.3	167.6	-74.9	177.1	0	0	0	112.5
423	P	25.9	Very low	27.7	Very low	120 Å²	120	140.8 Å²	140.8	78%	0.779	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-88.1	156.6	-172.4	35.2	-35.5	0	0	0	113.9
424	A	26.9	Very low	27.6	Very low	92 Å²	92	136.8 Å²	136.8	76%	0.76	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-80.3	136.9	-176.7	0	0	0	0	0	113.9
425	P	24.6	Very low	27.5	Very low	124 Å²	124	135.2 Å²	135.2	81%	0.805	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-87.1	161.7	167.5	34	-32.1	0	0	0	112.7
426	H	25.1	Very low	27.3	Very low	197 Å²	197	137 Å²	137	91%	0.912	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-96.1	151	-173.6	-62.2	-98	0	0	0	114.1
427	G	26.4	Very low	27	Very low	87 Å²	87	137.6 Å²	137.6	90%	0.897	81%	0.813	S	S	*	*			trans	128.5	108.7	154.5	0	0	0	0	0	115.4
428	G	24.4	Very low	27	Very low	78 Å²	78	136.1 Å²	136.1	80%	0.804	82%	0.821	S	S	*	*			trans	-170.1	59.8	-176.4	0	0	0	0	0	114.6
429	L	27	Very low	26.6	Very low	178 Å²	178	135.9 Å²	135.9	93%	0.932	83%	0.83	S	S	*	*			trans	5.1	106.7	171.2	-62.9	173.5	0	0	0	118.5
430	K	25.9	Very low	26.6	Very low	210 Å²	210	133.4 Å²	133.4	91%	0.913	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-64.8	138.7	169.9	-65.3	179.1	177.4	-180	0	112.1
431	R	27.1	Very low	26.5	Very low	245 Å²	245	134.8 Å²	134.8	93%	0.925	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-101.1	128.4	152.7	-160.1	180	-64.1	178.5	1.8	107.9
432	K	24.5	Very low	26.3	Very low	197 Å²	197	140 Å²	140	86%	0.857	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-74.9	134.2	-179.7	-79.1	-177.3	173.2	-178.7	0	110.9
433	H	22.7	Very low	26.4	Very low	197 Å²	197	139.1 Å²	139.1	91%	0.912	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-101.1	156.8	147.5	-92.6	-86.1	0	0	0	109.1
434	S	25.2	Very low	26.6	Very low	116 Å²	116	138.5 Å²	138.5	81%	0.811	84%	0.835	S	S	*	*			trans	-154.7	128.6	177.8	52.8	0	0	0	0	111.8
435	G	25	Very low	26.6	Very low	66 Å²	66	140.5 Å²	140.5	68%	0.68	84%	0.84	S	S	*	*			trans	83	80.7	149	0	0	0	0	0	117.8
436	D	26.4	Very low	26.8	Very low	174 Å²	174	139.2 Å²	139.2	93%	0.93	83%	0.834	S	S	*	*				46.7	120.4	128.6	-49.3	-24.3	0	0	0	121.4
437	G	24.2	Very low	27.1	Very low	77 Å²	77	140.1 Å²	140.1	79%	0.794	84%	0.836	S	S	*	*			trans	-169.8	108.2	162.9	0	0	0	0	0	108.7
438	A	32	Very low	27.2	Very low	114 Å²	114	143.5 Å²	143.5	94%	0.942	83%	0.832	S	S	*	*			trans	-75.8	131.3	-161.8	0	0	0	0	0	114.2
439	A	27.6	Very low	27.5	Very low	99 Å²	99	145.6 Å²	145.6	82%	0.818	83%	0.834	S	S	*	*			trans	-141.6	157.9	166	0	0	0	0	0	109.8
440	A	31.4	Very low	27.5	Very low	93 Å²	93	146.5 Å²	146.5	77%	0.769	83%	0.831	S	S	*	*			trans	-69.6	149.2	-168.5	0	0	0	0	0	113.9	F442	A440-F442 PolarHBondContact O-N 2.66Å
441	P	27.7	Very low	27.6	Very low	115 Å²	115	142 Å²	142	75%	0.747	82%	0.823	S	S	*	*			trans	-72.5	118.5	-179.6	29	-34.3	0	0	0	112.1	N443	P441-N443 PolarHBondContact O-N 3.43Å
442	F	25.5	Very low	28	Very low	205 Å²	205	137.5 Å²	137.5	90%	0.899	82%	0.817	S	S	*	*			trans	-73.8	107.6	161.8	-115.2	-92.5	0	0	0	108.8	A440	A440-F442 PolarHBondContact O-N 2.66Å
443	N	28.4	Very low	28.1	Very low	138 Å²	138	135.3 Å²	135.3	74%	0.738	82%	0.815	S	S	*	*			trans	-78.2	128	169.7	-77	-23.2	0	0	0	109.5	P441	P441-N443 PolarHBondContact O-N 3.43Å
444	P	29.9	Very low	28.6	Very low	107 Å²	107	132.7 Å²	132.7	70%	0.695	81%	0.813	S	S	*	*			trans	-67.3	146.2	164.7	30.4	-33.5	0	0	0	109.5	S446	P444-S446 PolarHBondContact O-N 2.86Å
445	P	28.7	Very low	28.8	Very low	133 Å²	133	134.8 Å²	134.8	86%	0.864	81%	0.807	S	S	*	*			trans	-69	105.1	179.3	27.6	-33.6	0	0	0	110.5
446	S	26.8	Very low	29	Very low	97 Å²	97	136.2 Å²	136.2	68%	0.678	81%	0.813	S	S	*	*			trans	-73.8	137.7	171.4	45.4	0	0	0	0	110.7	P444 L448	P444-S446 PolarHBondContact O-N 2.86Å; S446-L448 PolarHBondContact O-N 3.08Å
447	K	32.7	Very low	29.5	Very low	217 Å²	217	135.1 Å²	135.1	94%	0.943	80%	0.8	S	S	*	*			trans	-61.9	108	173.7	-75.7	-172.6	175	-175.8	0	109.7
448	L	27.7	Very low	30.2	Very low	158 Å²	158	139.9 Å²	139.9	83%	0.827	80%	0.801	S	S	*	*			trans	-102.1	106.1	163.4	-86.3	167.5	0	0	0	108.3	S446	S446-L448 PolarHBondContact O-N 3.08Å
449	S	31.9	Very low	30.5	Very low	121 Å²	121	139.5 Å²	139.5	85%	0.846	79%	0.788	S	S	*	*			trans	-66	139.9	169.8	40.7	0	0	0	0	110.6
450	K	25.9	Very low	31.1	Very low	198 Å²	198	137.7 Å²	137.7	86%	0.861	77%	0.772	S	S	*	*			trans	-119.7	146.2	161.7	-77.2	-173.4	174.7	-177.5	0	108.2
451	P	28.6	Very low	31.6	Very low	114 Å²	114	137.1 Å²	137.1	74%	0.74	76%	0.763	S	S	*	*			trans	-77.8	145.9	-174.6	32	-35.4	0	0	0	112.5
452	D	35.7	Very low	32	Very low	151 Å²	151	135.1 Å²	135.1	81%	0.807	75%	0.748	S	S	*	*			trans	20.8	98.3	150.7	-48.8	-26.7	0	0	0	118.3
453	D	26.7	Very low	32.5	Very low	152 Å²	152	130.8 Å²	130.8	81%	0.813	74%	0.742	S	S	*	*			trans	-116.2	98.3	153.2	-120	-32.7	0	0	0	107.1	K455	D453-K455 VanDerWaalsContact C-N 3.28Å; D453-K455 PolarHBondContact O-N 2.74Å
454	V	32.2	Very low	33.4	Very low	142 Å²	142	128.4 Å²	128.4	86%	0.861	75%	0.75	S	S	*	*			trans	-74.8	79.4	-173.5	-174.7	0	0	0	0	110.6	A456	V454-A456 PolarHBondContact O-N 2.81Å
455	K	29.2	Very low	35	Very low	159 Å²	159	124.3 Å²	124.3	69%	0.691	73%	0.727	S	S	*	*			trans	-74	121.1	164.7	-72.8	-179.2	180	173.8	0	109.1	D453 F457	D453-K455 VanDerWaalsContact C-N 3.28Å; D453-K455 PolarHBondContact O-N 2.74Å; K455-F457 VanDerWaalsContact C-N 3.28Å; K455-F457 HydrophobicContact CB-CD2 4.43Å; K455-F457 PolarHBondContact O-N 2.94Å
456	A	30.7	Very low	37.4	Very low	97 Å²	97	120.8 Å²	120.8	80%	0.802	70%	0.697	S	S	*	*			trans	-69	83.5	174.6	0	0	0	0	0	110.9	V454 Q458	V454-A456 PolarHBondContact O-N 2.81Å; A456-Q458 PolarHBondContact O-N 2.89Å
457	F	35.3	Very low	39.8	Very low	150 Å²	150	119.8 Å²	119.8	66%	0.658	69%	0.687	S	S	*	*			trans	-62.9	125.4	167.4	-93.1	-90	0	0	0	109.2	K455 T459	K455-F457 VanDerWaalsContact C-N 3.28Å; K455-F457 HydrophobicContact CB-CD2 4.43Å; K455-F457 PolarHBondContact O-N 2.94Å; F457-T459 PolarHBondContact O-N 3.22Å
458	Q	39.8	Very low	42.2	Very low	178 Å²	178	110 Å²	110	83%	0.832	64%	0.644	S	S	*	*			trans	-68.6	127	-179.6	-65.2	175.1	-3.2	0	0	109.1	A456 A460	A456-Q458 PolarHBondContact O-N 2.89Å; Q458-A460 PolarHBondContact O-N 3.45Å
459	T	37.9	Very low	44.7	Very low	106 Å²	106	105.3 Å²	105.3	65%	0.65	62%	0.624	S	S	*	*			trans	-60.4	110.5	168.2	38	0	0	0	0	108.4	F457 S461	F457-T459 PolarHBondContact O-N 3.22Å; T459-S461 PolarHBondContact O-N 3.14Å
460	A	40.3	Very low	46.6	Very low	60 Å²	60	103.6 Å²	103.6	50%	0.496	61%	0.608	S	S	.	*			trans	-76	56.6	-168	0	0	0	0	0	113.3	Q458 V462	Q458-A460 PolarHBondContact O-N 3.45Å; A460-V462 PolarHBondContact O-N 3.37Å
461	S	41.1	Very low	49.1	Very low	82 Å²	82	101.9 Å²	101.9	57%	0.573	61%	0.608	S	S	*	*			trans	-67.3	109.2	175.1	-173.9	0	0	0	0	110.3	T459	T459-S461 PolarHBondContact O-N 3.14Å
462	V	37.9	Very low	51.8	Low	72 Å²	72	99.9 Å²	99.9	44%	0.436	59%	0.591	S	S	.	*			trans	-87.5	136.8	159.5	-178.9	0	0	0	0	106.9	A460 G464 G465	A460-V462 PolarHBondContact O-N 3.37Å; V462-G464 PolarHBondContact O-N 2.96Å; V462-G464 VanDerWaalsContact O-N 3.07Å; V462-G465 PolarHBondContact O-N 2.97Å
463	C	34.9	Very low	54.3	Low	115 Å²	115	93.4 Å²	93.4	78%	0.777	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-38.9	113.3	-175.8	-81.8	0	0	0	0	113.8	G465	C463-G465 VanDerWaalsContact C-N 3.31Å; C463-G465 PolarHBondContact O-N 3.45Å
464	G	47.9	Very low	57.2	Low	87 Å²	87	90.2 Å²	90.2	90%	0.897	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	-6.9	173.2	0	0	0	0	0	116.7	V462	V462-G464 PolarHBondContact O-N 2.96Å; V462-G464 VanDerWaalsContact O-N 3.07Å
465	G	62.5	Low	59.8	Low	21 Å²	21	85.9 Å²	85.9	22%	0.216	52%	0.515	C	S	.	.	P	Polyproline II helix	trans	-81.3	163.4	-176.7	0	0	0	0	0	115.2	V462 C463 V467	V462-G465 PolarHBondContact O-N 2.97Å; C463-G465 VanDerWaalsContact C-N 3.31Å; C463-G465 PolarHBondContact O-N 3.45Å; G465-V467 PolarHBondContact O-N 2.88Å
466	R	80.1	Confident	62.6	Low	59 Å²	59	80 Å²	80	22%	0.223	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-57.3	133.2	170.4	-71.2	170	-168.1	83.3	5.8	111.3	D146 S149 L156 F208 E211	D146-R466 VanDerWaalsContact CG-NH1 3.28Å; D146-R466 IonicContact OD1-NH1 2.72Å; D146-R466 PolarHBondContact OD1-NH1 3.02Å; D146-R466 VanDerWaalsContact OD2-CB 3.28Å; D146-R466 WeakPolarHBondContact OD2-CB 3.31Å; D146-R466 WeakPolarHBondContact OD2-CG 3.05Å; D146-R466 IonicContact OD2-CZ 2.87Å; D146-R466 PolarHBondContact OD2-N 3.46Å; D146-R466 IonicContact OD2-NH1 3.14Å; D146-R466 PolarHBondContact OD2-NH1 3.27Å; S149-R466 PolarHBondContact OG-NH1 2.99Å; L156-R466 VanDerWaalsContact N-NH2 3.19Å; F208-R466 HydrophobicContact CE1-CB 3.79Å; F208-R466 HydrophobicContact CE1-CG 4.22Å; F208-R466 HydrophobicContact CZ-CB 4.01Å; E211-R466 IonicContact OE1-CZ 2.76Å; E211-R466 IonicContact OE1-NE 3.86Å; E211-R466 PolarHBondContact OE1-NE 3.34Å; E211-R466 IonicContact OE1-NH2 3.66Å; E211-R466 PolarHBondContact OE1-NH2 3.5Å; E211-R466 WeakPolarHBondContact OE2-CD 3.36Å; E211-R466 IonicContact OE2-CZ 2.64Å; E211-R466 IonicContact OE2-NE 2.7Å; E211-R466 PolarHBondContact OE2-NE 2.95Å; E211-R466 IonicContact OE2-NH2 2.8Å
467	V	77.8	Confident	65.5	Low	77 Å²	77	77.8 Å²	77.8	47%	0.467	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-94.2	126.9	172.8	-178.8	0	0	0	0	108.9	G465	G465-V467 PolarHBondContact O-N 2.88Å
468	V	83.1	Confident	68.4	Low	10 Å²	10	70.6 Å²	70.6	6%	0.061	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-94.3	119.9	169	173.6	0	0	0	0	108.2	F148 L207 F208 Y543	F148-V468 HydrophobicContact CD2-CG2 4.48Å; F148-V468 HydrophobicContact CE2-CG2 3.62Å; F148-V468 HydrophobicContact CZ-CG2 4.13Å; L207-V468 HydrophobicContact CD1-CG1 4.11Å; L207-V468 HydrophobicContact CD1-CG2 4.08Å; L207-V468 HydrophobicContact CD2-CG1 4.01Å; F208-V468 HydrophobicContact CE1-CG2 4.17Å; F208-V468 HydrophobicContact CE2-CG2 4.46Å; F208-V468 HydrophobicContact CZ-CG2 3.59Å; V468-Y543 HydrophobicContact CB-CE1 3.72Å; V468-Y543 HydrophobicContact CG1-CD1 4.43Å; V468-Y543 HydrophobicContact CG1-CE1 4.07Å; V468-Y543 HydrophobicContact CG2-CE1 4.32Å
469	P	78.6	Confident	71.1	Confident	60 Å²	60	66.1 Å²	66.1	39%	0.39	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-61.9	136.4	169.5	-23.7	35.6	0	0	0	111.3	D471 L472	P469-D471 VanDerWaalsContact C-N 3.28Å; P469-D471 PolarHBondContact O-N 3.25Å; P469-L472 HydrophobicContact CB-CD1 4.13Å; P469-L472 HydrophobicContact CB-CG 4.35Å; P469-L472 HydrophobicContact CG-CD1 3.87Å; P469-L472 PolarHBondContact O-N 3.22Å
470	V	73.1	Confident	73.9	Confident	86 Å²	86	61.1 Å²	61.1	52%	0.521	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-60.7	-38.9	-175.3	-176.9	0	0	0	0	111.3	L472	V470-L472 PolarHBondContact O-N 3.32Å
471	D	77.9	Confident	76.5	Confident	161 Å²	161	60.5 Å²	60.5	86%	0.861	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-75.2	-4.2	-175.7	-42.3	-70.4	0	0	0	114.6	P469	P469-D471 VanDerWaalsContact C-N 3.28Å; P469-D471 PolarHBondContact O-N 3.25Å
472	L	84.9	Confident	79.1	Confident	72 Å²	72	58.7 Å²	58.7	38%	0.377	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-94.5	-13.1	-179.4	-82.7	177	0	0	0	114.4	K206 L207 P469 V470	K206-L472 WeakPolarHBondContact CE-O 3.42Å; K206-L472 PolarHBondContact NZ-O 2.82Å; K206-L472 VanDerWaalsContact NZ-O 3.09Å; L207-L472 HydrophobicContact CD2-CB 4.04Å; P469-L472 HydrophobicContact CB-CD1 4.13Å; P469-L472 HydrophobicContact CB-CG 4.35Å; P469-L472 HydrophobicContact CG-CD1 3.87Å; P469-L472 PolarHBondContact O-N 3.22Å; V470-L472 PolarHBondContact O-N 3.32Å
473	L	88	Confident	81.8	Confident	15 Å²	15	57 Å²	57	8%	0.079	36%	0.358	C	S	.	.			trans	-119.6	120.9	178	-173.6	62.1	0	0	0	110	L203 L207 D477 L478 V539 Y543	L203-L473 HydrophobicContact CD1-CD1 3.46Å; L203-L473 VanDerWaalsContact CD1-CD1 3.46Å; L207-L473 HydrophobicContact CD2-CB 4.28Å; L473-D477 HydrophobicContact CD1-CB 3.77Å; L473-D477 WeakPolarHBondContact CD1-OD2 3.31Å; L473-L478 HydrophobicContact CD1-CD1 4.16Å; L473-L478 HydrophobicContact CD2-CD1 4.32Å; L473-V539 HydrophobicContact CD2-CG1 4.02Å; L473-Y543 HydrophobicContact CD2-CD2 4.2Å; L473-Y543 HydrophobicContact CD2-CG 4.03Å
474	D	87.3	Confident	84.7	Confident	86 Å²	86	57.6 Å²	57.6	46%	0.46	35%	0.351	S	S	.	.			trans	-122.5	168.4	175.5	74.2	74.9	0	0	0	111.6	K206 G476 D477	K206-D474 IonicContact NZ-OD2 3.7Å; D474-G476 PolarHBondContact O-N 3.46Å; D474-G476 VanDerWaalsContact O-N 3.16Å; D474-G476 VanDerWaalsContact OD1-CA 3.29Å; D474-G476 WeakPolarHBondContact OD1-CA 3.3Å; D474-G476 PolarHBondContact OD1-N 2.96Å; D474-D477 PolarHBondContact N-OD2 2.98Å; D474-D477 PolarHBondContact O-N 3.41Å
475	S	87.1	Confident	87	Confident	51 Å²	51	58.3 Å²	58.3	36%	0.357	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-62	-22.9	-177	52.1	0	0	0	0	114	L478 E479	S475-L478 CarbonylContact O-C 3.6Å; S475-L478 PolarHBondContact O-N 3.24Å; S475-E479 WeakPolarHBondContact O-CG 3.14Å; S475-E479 PolarHBondContact O-N 2.65Å
476	G	88.9	Confident	88.6	Confident	36 Å²	36	58 Å²	58	37%	0.371	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-69.8	-32.4	177.1	0	0	0	0	0	113.9	D474 L478 E479	D474-G476 PolarHBondContact O-N 3.46Å; D474-G476 VanDerWaalsContact O-N 3.16Å; D474-G476 VanDerWaalsContact OD1-CA 3.29Å; D474-G476 WeakPolarHBondContact OD1-CA 3.3Å; D474-G476 PolarHBondContact OD1-N 2.96Å; G476-L478 PolarHBondContact O-N 3.2Å; G476-E479 PolarHBondContact O-N 3.32Å
477	D	91.8	Very high	89.4	Confident	49 Å²	49	55.2 Å²	55.2	26%	0.262	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-62.9	-23.7	175.5	-63.2	-52.6	0	0	0	112.5	K206 L473 D474	K206-D477 VanDerWaalsContact CD-OD1 3.31Å; K206-D477 WeakPolarHBondContact CD-OD1 3.41Å; K206-D477 IonicContact NZ-OD1 3.17Å; K206-D477 PolarHBondContact NZ-OD1 3.17Å; K206-D477 IonicContact NZ-OD2 2.78Å; K206-D477 PolarHBondContact NZ-OD2 3.11Å; L473-D477 HydrophobicContact CD1-CB 3.77Å; L473-D477 WeakPolarHBondContact CD1-OD2 3.31Å; D474-D477 PolarHBondContact N-OD2 2.98Å; D474-D477 PolarHBondContact O-N 3.41Å
478	L	95.4	Very high	90.3	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-123.4	35.4	-173.2	-68.1	172.2	0	0	0	111.8	V199 L473 S475 G476 L486 F487 M536 V539 L540 L544	V199-L478 HydrophobicContact CG1-CD2 4.11Å; L473-L478 HydrophobicContact CD1-CD1 4.16Å; L473-L478 HydrophobicContact CD2-CD1 4.32Å; S475-L478 CarbonylContact O-C 3.6Å; S475-L478 PolarHBondContact O-N 3.24Å; G476-L478 PolarHBondContact O-N 3.2Å; L478-L486 HydrophobicContact CB-CD1 3.98Å; L478-L486 CarbonylContact O-C 3.53Å; L478-L486 WeakPolarHBondContact O-CA 3.46Å; L478-F487 HydrophobicContact CB-CD2 4.06Å; L478-F487 HydrophobicContact CD2-CD2 4.26Å; L478-F487 WeakPolarHBondContact O-CD2 3.39Å; L478-F487 PolarHBondContact O-N 3.04Å; L478-M536 HydrophobicContact CD2-CE 3.97Å; L478-V539 HydrophobicContact CD1-CG1 3.74Å; L478-L540 HydrophobicContact CB-CD2 4.06Å; L478-L540 HydrophobicContact CD1-CD2 3.97Å; L478-L540 HydrophobicContact CD1-CG 4.46Å; L478-L544 HydrophobicContact CB-CD1 4.34Å; L478-L544 HydrophobicContact CD1-CD1 3.86Å
479	E	95.9	Very high	90.9	Very high	84 Å²	84	54.7 Å²	54.7	39%	0.393	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-84.2	139.6	169.4	-76.4	-170.8	-159.7	0	0	113.6	S475 G476 R485 F487	S475-E479 WeakPolarHBondContact O-CG 3.14Å; S475-E479 PolarHBondContact O-N 2.65Å; G476-E479 PolarHBondContact O-N 3.32Å; E479-R485 WeakPolarHBondContact CA-O 3.34Å; E479-F487 WeakPolarHBondContact O-CE2 3.42Å; E479-F487 WeakPolarHBondContact O-CZ 3.13Å
480	C	97.3	Very high	91.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.281	C	S	.	.			trans	-83.1	118.3	168.9	179.8	0	0	0	0	111.5	L482 C483 M484 R485 F487 C500	C480-L482 PolarHBondContact O-N 3.07Å; C480-C483 PolarHBondContact O-N 2.88Å; C480-M484 PolarHBondContact O-N 3.5Å; C480-R485 PolarHBondContact N-O 3.36Å; C480-F487 HydrophobicContact CB-CD1 3.66Å; C480-F487 HydrophobicContact CB-CE1 3.56Å; C480-F487 HydrophobicContact CB-CG 4.49Å; C480-F487 HydrophobicContact CB-CZ 4.31Å; C480-C500 HydrophobicContact CB-CB 4.49Å; C480-C500 WeakPolarHBondContact CB-SG 3.48Å; C480-C500 PolarHBondContact SG-N 3.03Å
481	S	95.8	Very high	92.9	Very high	47 Å²	47	47.8 Å²	47.8	33%	0.329	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-4.5	178	60.4	0	0	0	0	116.9	M484	S481-M484 WeakPolarHBondContact O-CE 3.35Å
482	L	95.7	Very high	93.7	Very high	44 Å²	44	40.8 Å²	40.8	23%	0.23	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-18.8	175.6	-65.9	177	0	0	0	114	C480 F499 C503 P515	C480-L482 PolarHBondContact O-N 3.07Å; L482-F499 HydrophobicContact CD1-CB 4.16Å; L482-F499 HydrophobicContact CD1-CD1 3.39Å; L482-F499 HydrophobicContact CD1-CE1 3.95Å; L482-F499 HydrophobicContact CD1-CG 3.92Å; L482-F499 HydrophobicContact CD2-CE1 4.45Å; L482-F499 HydrophobicContact CG-CD1 3.61Å; L482-F499 HydrophobicContact CG-CE1 3.93Å; L482-C503 HydrophobicContact CB-CB 3.86Å; L482-C503 HydrophobicContact CD1-CB 3.86Å; L482-P515 HydrophobicContact CD1-CG 4.27Å; L482-P515 HydrophobicContact CD2-CB 3.75Å; L482-P515 HydrophobicContact CD2-CG 4Å
483	C	94.5	Very high	94.2	Very high	36 Å²	36	37.6 Å²	37.6	24%	0.243	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.3	-9.5	179.3	62	0	0	0	0	114.5	C480 R485	C480-C483 PolarHBondContact O-N 2.88Å; C483-R485 VanDerWaalsContact C-N 3.29Å; C483-R485 PolarHBondContact O-N 3.16Å
484	M	95	Very high	94.3	Very high	128 Å²	128	38.9 Å²	38.9	63%	0.631	21%	0.214	S	C	*	.	S	Bend	trans	50	52.2	-177.2	-46	-50.2	-176.7	0	0	111.2	C480 S481	C480-M484 PolarHBondContact O-N 3.5Å; S481-M484 WeakPolarHBondContact O-CE 3.35Å
485	R	95.3	Very high	94.7	Very high	102 Å²	102	35.2 Å²	35.2	39%	0.385	20%	0.195	S	C	.	.	S	Bend	trans	-148.4	157.2	178.4	-63.9	-179.3	-173.8	174.1	1.1	107.5	E479 C480 C483 E558	E479-R485 WeakPolarHBondContact CA-O 3.34Å; C480-R485 PolarHBondContact N-O 3.36Å; C483-R485 VanDerWaalsContact C-N 3.29Å; C483-R485 PolarHBondContact O-N 3.16Å; R485-E558 IonicContact CZ-OE1 2.79Å; R485-E558 IonicContact NH1-OE1 3.51Å; R485-E558 PolarHBondContact NH1-OE1 3.23Å; R485-E558 IonicContact NH1-OE2 2.71Å; R485-E558 IonicContact NH2-OE1 3.58Å; R485-E558 PolarHBondContact NH2-OE1 3.3Å
486	L	97	Very high	95	Very high	14 Å²	14	33 Å²	33	7%	0.073	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-45.4	138.5	171.9	-168.7	74.6	0	0	0	112.1	L478 Y488 L540 L544 E547 L548 R551	L478-L486 HydrophobicContact CB-CD1 3.98Å; L478-L486 CarbonylContact O-C 3.53Å; L478-L486 WeakPolarHBondContact O-CA 3.46Å; L486-Y488 PolarHBondContact O-N 2.87Å; L486-L540 HydrophobicContact CD1-CD2 3.67Å; L486-L540 HydrophobicContact CD2-CD2 4.15Å; L486-L540 HydrophobicContact CG-CD2 3.84Å; L486-L544 HydrophobicContact CD1-CD1 3.68Å; L486-E547 HydrophobicContact CD2-CB 3.79Å; L486-L548 HydrophobicContact CD2-CB 4.3Å; L486-R551 HydrophobicContact CB-CG 4.46Å; L486-R551 HydrophobicContact CD2-CB 4.44Å; L486-R551 PolarHBondContact O-NE 3.31Å
487	F	97.5	Very high	95.4	Very high	2 Å²	2	33 Å²	33	1%	0.009	17%	0.17	C	C	.	.			trans	-52.1	132	174.5	-79.1	-65.4	0	0	0	111.5	V199 L478 E479 C480 P490 T498 M536 L540	V199-F487 HydrophobicContact CG1-CE2 3.97Å; V199-F487 HydrophobicContact CG2-CE2 4.42Å; V199-F487 HydrophobicContact CG2-CZ 4.17Å; L478-F487 HydrophobicContact CB-CD2 4.06Å; L478-F487 HydrophobicContact CD2-CD2 4.26Å; L478-F487 WeakPolarHBondContact O-CD2 3.39Å; L478-F487 PolarHBondContact O-N 3.04Å; E479-F487 WeakPolarHBondContact O-CE2 3.42Å; E479-F487 WeakPolarHBondContact O-CZ 3.13Å; C480-F487 HydrophobicContact CB-CD1 3.66Å; C480-F487 HydrophobicContact CB-CE1 3.56Å; C480-F487 HydrophobicContact CB-CG 4.49Å; C480-F487 HydrophobicContact CB-CZ 4.31Å; F487-P490 HydrophobicContact CB-CB 4.15Å; F487-P490 HydrophobicContact CD1-CB 4.12Å; F487-P490 HydrophobicContact CG-CB 4.19Å; F487-T498 HydrophobicContact CD1-CG2 4.36Å; F487-T498 HydrophobicContact CE1-CG2 3.9Å; F487-T498 WeakPolarHBondContact CE1-O 3.3Å; F487-T498 HydrophobicContact CZ-CG2 4.2Å; F487-M536 HydrophobicContact CD2-CE 3.62Å; F487-M536 HydrophobicContact CE2-CE 3.66Å; F487-M536 HydrophobicContact CG-CE 4.23Å; F487-M536 HydrophobicContact CZ-CE 4.23Å; F487-L540 HydrophobicContact CB-CD1 3.85Å; F487-L540 HydrophobicContact CB-CD2 4.45Å
488	Y	96	Very high	95.6	Very high	35 Å²	35	30.9 Å²	30.9	14%	0.137	16%	0.159	C	C	.	.	S	Bend	trans	-129.1	120.6	170.7	-176.5	-98.9	0	0	0	107.8	L486 C500 L548 R551 K552 H555	L486-Y488 PolarHBondContact O-N 2.87Å; Y488-C500 PolarHBondContact N-SG 2.91Å; Y488-C500 WeakPolarHBondContact O-CA 3.49Å; Y488-C500 VanDerWaalsContact O-CB 3.27Å; Y488-C500 WeakPolarHBondContact O-CB 3.15Å; Y488-L548 HydrophobicContact CD2-CD1 4.46Å; Y488-R551 HydrophobicContact CD2-CG 4.27Å; Y488-R551 HydrophobicContact CG-CG 4.47Å; Y488-K552 HydrophobicContact CD2-CB 4.42Å; Y488-K552 HydrophobicContact CE2-CB 3.75Å; Y488-K552 HydrophobicContact CE2-CG 3.93Å; Y488-H555 HydrophobicContact CE1-CB 4.31Å; Y488-H555 AromaticContact CE1-CD2 3.49Å; Y488-H555 VanDerWaalsContact CE1-CD2 3.49Å; Y488-H555 WeakPolarHBondContact CE1-CD2 3.37Å; Y488-H555 AromaticContact CE1-CG 3.85Å; Y488-H555 AromaticContact CZ-CD2 3.93Å
489	E	95.6	Very high	95.7	Very high	40 Å²	40	30.9 Å²	30.9	19%	0.187	16%	0.159	C	C	.	.	S	Bend	trans	50.7	63.1	-170.5	-52.1	-169.4	119.1	0	0	111.6	V491 L501 K532	E489-V491 PolarHBondContact O-N 3.1Å; E489-L501 HydrophobicContact CB-CB 4.03Å; E489-L501 WeakPolarHBondContact O-CB 3.47Å; E489-L501 PolarHBondContact O-N 3.39Å; E489-K532 HydrophobicContact CB-CD 4.12Å; E489-K532 HydrophobicContact CB-CG 4.49Å; E489-K532 HydrophobicContact CG-CD 4.36Å; E489-K532 WeakPolarHBondContact OE1-CE 3.41Å; E489-K532 IonicContact OE1-NZ 3.21Å; E489-K532 PolarHBondContact OE1-NZ 3.42Å
490	P	97.4	Very high	95.8	Very high	1 Å²	1	27 Å²	27	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	130.9	-177	25.4	-33.7	0	0	0	111.4	F487 T498 F499 K532 T533 M536 E537 L540	F487-P490 HydrophobicContact CB-CB 4.15Å; F487-P490 HydrophobicContact CD1-CB 4.12Å; F487-P490 HydrophobicContact CG-CB 4.19Å; P490-T498 HydrophobicContact CB-CG2 3.79Å; P490-F499 CarbonylContact C-O 3.27Å; P490-F499 WeakPolarHBondContact CA-O 2.82Å; P490-K532 CarbonylContact O-C 3.5Å; P490-K532 WeakPolarHBondContact O-CA 3.04Å; P490-T533 PolarHBondContact O-N 2.77Å; P490-M536 HydrophobicContact CB-CB 4.12Å; P490-M536 HydrophobicContact CB-CE 4.21Å; P490-M536 HydrophobicContact CB-SD 4.45Å; P490-M536 HydrophobicContact CG-CB 3.66Å; P490-E537 HydrophobicContact CG-CG 4.18Å; P490-L540 HydrophobicContact CG-CD1 4.04Å
491	V	96.2	Very high	95.6	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	122.3	176.9	174.1	0	0	0	0	108.7	E489 T498 F499 L501 L504 F524	E489-V491 PolarHBondContact O-N 3.1Å; V491-T498 WeakPolarHBondContact O-CA 3.3Å; V491-F499 PolarHBondContact N-O 2.9Å; V491-F499 PolarHBondContact O-N 3.26Å; V491-L501 HydrophobicContact CG2-CB 3.87Å; V491-L501 HydrophobicContact CG2-CD1 3.99Å; V491-L501 HydrophobicContact CG2-CG 4.47Å; V491-L504 HydrophobicContact CG1-CD2 4.26Å; V491-F524 HydrophobicContact CG1-CZ 4.13Å
492	A	95.4	Very high	95.2	Very high	13 Å²	13	28.7 Å²	28.7	11%	0.107	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	135.8	168.2	0	0	0	0	0	110.5	T162 T533	T162-A492 HydrophobicContact CG2-CB 3.86Å; A492-T533 PolarHBondContact N-OG1 3.37Å; A492-T533 VanDerWaalsContact N-OG1 3.16Å
493	T	94.3	Very high	95.1	Very high	5 Å²	5	27.3 Å²	27.3	3%	0.031	14%	0.138	C	C	.	.			trans	-81.6	159	168.3	57.8	0	0	0	0	111	C495 G496 H497 F499 L504 L521 F524	T493-C495 PolarHBondContact O-N 2.72Å; T493-C495 PolarHBondContact OG1-SG 2.8Å; T493-G496 PolarHBondContact O-N 2.66Å; T493-H497 PolarHBondContact N-O 3.24Å; T493-H497 PolarHBondContact OG1-N 3.38Å; T493-H497 PolarHBondContact OG1-O 3.23Å; T493-F499 HydrophobicContact CG2-CD2 3.99Å; T493-F499 HydrophobicContact CG2-CE2 3.94Å; T493-L504 HydrophobicContact CG2-CD1 4.08Å; T493-L504 HydrophobicContact CG2-CD2 3.73Å; T493-L521 HydrophobicContact CG2-CD1 3.66Å; T493-F524 HydrophobicContact CG2-CE1 4.27Å
494	P	91.9	Very high	95	Very high	43 Å²	43	25.7 Å²	25.7	28%	0.279	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-28.4	171	-29.8	35.8	0	0	0	114.1	K195 G496 F524	K195-P494 VanDerWaalsContact CB-O 3.28Å; K195-P494 WeakPolarHBondContact CB-O 3.34Å; K195-P494 WeakPolarHBondContact CG-O 2.85Å; P494-G496 VanDerWaalsContact C-N 3.26Å; P494-G496 PolarHBondContact O-N 3.46Å; P494-F524 HydrophobicContact CG-CB 4.07Å; P494-F524 HydrophobicContact CG-CD1 4.46Å; P494-F524 HydrophobicContact CG-CD2 3.59Å; P494-F524 HydrophobicContact CG-CE2 4.07Å; P494-F524 HydrophobicContact CG-CG 3.82Å
495	C	93.8	Very high	94.6	Very high	9 Å²	9	20.8 Å²	20.8	6%	0.061	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	17.1	174.8	68.2	0	0	0	0	114.9	T493 H497 C514 C517 E519	T493-C495 PolarHBondContact O-N 2.72Å; T493-C495 PolarHBondContact OG1-SG 2.8Å; C495-H497 VanDerWaalsContact C-N 3.34Å; C495-H497 PolarHBondContact O-CE1 3.43Å; C495-H497 PolarHBondContact O-N 2.9Å; C495-H497 PolarHBondContact O-ND1 3.47Å; C495-C514 VanDerWaalsContact SG-CB 3.55Å; C495-C517 PolarHBondContact SG-SG 3.15Å; C495-E519 HydrophobicContact CB-CB 4.04Å; C495-E519 HydrophobicContact CB-CG 4.18Å; C495-E519 WeakPolarHBondContact CB-OE2 3.22Å
496	G	94.6	Very high	94.1	Very high	3 Å²	3	20.3 Å²	20.3	3%	0.031	10%	0.101	C	C	.	.	S	Bend	trans	77.6	6.7	172	0	0	0	0	0	116.4	V196 N197 V198 T493 P494	V196-G496 VanDerWaalsContact O-CA 3.23Å; V196-G496 WeakPolarHBondContact O-CA 3.39Å; N197-G496 CarbonylContact C-O 3.6Å; N197-G496 VanDerWaalsContact CA-O 3.3Å; N197-G496 WeakPolarHBondContact CA-O 3.39Å; V198-G496 PolarHBondContact N-O 3.01Å; T493-G496 PolarHBondContact O-N 2.66Å; P494-G496 VanDerWaalsContact C-N 3.26Å; P494-G496 PolarHBondContact O-N 3.46Å
497	H	96.6	Very high	93.7	Very high	37 Å²	37	21.4 Å²	21.4	17%	0.171	11%	0.109	C	C	.	.			trans	-99.7	132.2	-178.5	-66.5	78.4	0	0	0	110.7	T493 C495 F499 L516	T493-H497 PolarHBondContact N-O 3.24Å; T493-H497 PolarHBondContact OG1-N 3.38Å; T493-H497 PolarHBondContact OG1-O 3.23Å; C495-H497 VanDerWaalsContact C-N 3.34Å; C495-H497 PolarHBondContact O-CE1 3.43Å; C495-H497 PolarHBondContact O-N 2.9Å; C495-H497 PolarHBondContact O-ND1 3.47Å; H497-F499 HydrophobicContact CB-CE2 3.68Å; H497-F499 HydrophobicContact CB-CZ 3.9Å; H497-L516 HydrophobicContact CB-CD1 4.35Å
498	T	97.4	Very high	93.2	Very high	4 Å²	4	21.4 Å²	21.4	3%	0.025	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	137.9	-178.1	-59.9	0	0	0	0	112.3	N197 F487 P490 V491 M536	N197-T498 PolarHBondContact ND2-OG1 3.36Å; N197-T498 VanDerWaalsContact ND2-OG1 3.15Å; N197-T498 PolarHBondContact OD1-OG1 3.29Å; F487-T498 HydrophobicContact CD1-CG2 4.36Å; F487-T498 HydrophobicContact CE1-CG2 3.9Å; F487-T498 WeakPolarHBondContact CE1-O 3.3Å; F487-T498 HydrophobicContact CZ-CG2 4.2Å; P490-T498 HydrophobicContact CB-CG2 3.79Å; V491-T498 WeakPolarHBondContact O-CA 3.3Å; T498-M536 HydrophobicContact CG2-CE 3.77Å; T498-M536 HydrophobicContact CG2-SD 3.69Å
499	F	97.6	Very high	92.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	159.3	-179.2	-57	-76.7	0	0	0	110.6	L482 P490 V491 T493 H497 L501 L504 P515 L516	L482-F499 HydrophobicContact CD1-CB 4.16Å; L482-F499 HydrophobicContact CD1-CD1 3.39Å; L482-F499 HydrophobicContact CD1-CE1 3.95Å; L482-F499 HydrophobicContact CD1-CG 3.92Å; L482-F499 HydrophobicContact CD2-CE1 4.45Å; L482-F499 HydrophobicContact CG-CD1 3.61Å; L482-F499 HydrophobicContact CG-CE1 3.93Å; P490-F499 CarbonylContact C-O 3.27Å; P490-F499 WeakPolarHBondContact CA-O 2.82Å; V491-F499 PolarHBondContact N-O 2.9Å; V491-F499 PolarHBondContact O-N 3.26Å; T493-F499 HydrophobicContact CG2-CD2 3.99Å; T493-F499 HydrophobicContact CG2-CE2 3.94Å; H497-F499 HydrophobicContact CB-CE2 3.68Å; H497-F499 HydrophobicContact CB-CZ 3.9Å; F499-L501 PolarHBondContact O-N 3.11Å; F499-L504 HydrophobicContact CB-CB 3.91Å; F499-L504 HydrophobicContact CD2-CB 4.49Å; F499-L504 HydrophobicContact CD2-CD1 3.84Å; F499-L504 HydrophobicContact CD2-CD2 4.33Å; F499-L504 HydrophobicContact CD2-CG 4.44Å; F499-L504 HydrophobicContact CE2-CD1 4.24Å; F499-L504 HydrophobicContact CG-CB 4.44Å; F499-L504 HydrophobicContact CG-CD1 4.43Å; F499-P515 HydrophobicContact CE1-CB 4.39Å; F499-P515 HydrophobicContact CE1-CG 4.44Å; F499-P515 HydrophobicContact CZ-CB 4.34Å; F499-P515 HydrophobicContact CZ-CG 4.27Å; F499-L516 HydrophobicContact CE1-CD1 3.75Å; F499-L516 HydrophobicContact CE1-CG 3.96Å; F499-L516 HydrophobicContact CZ-CB 4.48Å; F499-L516 HydrophobicContact CZ-CD1 3.74Å; F499-L516 HydrophobicContact CZ-CG 3.87Å
500	C	96.6	Very high	91.8	Very high	3 Å²	3	23.4 Å²	23.4	2%	0.02	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	133.9	162	-57.9	0	0	0	0	109.3	C480 Y488 K502 C503 L504	C480-C500 HydrophobicContact CB-CB 4.49Å; C480-C500 WeakPolarHBondContact CB-SG 3.48Å; C480-C500 PolarHBondContact SG-N 3.03Å; Y488-C500 PolarHBondContact N-SG 2.91Å; Y488-C500 WeakPolarHBondContact O-CA 3.49Å; Y488-C500 VanDerWaalsContact O-CB 3.27Å; Y488-C500 WeakPolarHBondContact O-CB 3.15Å; C500-K502 PolarHBondContact O-N 3.43Å; C500-C503 HydrophobicContact CB-CB 4.01Å; C500-C503 WeakPolarHBondContact O-CA 3.3Å; C500-C503 WeakPolarHBondContact O-CB 3.23Å; C500-C503 PolarHBondContact O-N 2.92Å; C500-L504 PolarHBondContact O-N 2.67Å
501	L	92.9	Very high	91.2	Very high	31 Å²	31	27.6 Å²	27.6	16%	0.162	14%	0.142	C	C	.	.	H	α-helix	trans	-40.8	-59.9	-179.7	170.9	60.9	0	0	0	112.7	E489 V491 F499 C503 L504 E505 Y530	E489-L501 HydrophobicContact CB-CB 4.03Å; E489-L501 WeakPolarHBondContact O-CB 3.47Å; E489-L501 PolarHBondContact O-N 3.39Å; V491-L501 HydrophobicContact CG2-CB 3.87Å; V491-L501 HydrophobicContact CG2-CD1 3.99Å; V491-L501 HydrophobicContact CG2-CG 4.47Å; F499-L501 PolarHBondContact O-N 3.11Å; L501-C503 VanDerWaalsContact C-N 3.29Å; L501-C503 PolarHBondContact O-N 2.94Å; L501-L504 PolarHBondContact O-N 2.9Å; L501-E505 HydrophobicContact CD1-CG 4.3Å; L501-E505 PolarHBondContact O-N 3.15Å; L501-Y530 HydrophobicContact CD1-CD2 3.85Å; L501-Y530 HydrophobicContact CD1-CG 4.01Å
502	K	88.8	Confident	90.8	Very high	51 Å²	51	29.8 Å²	29.8	22%	0.222	16%	0.156	C	C	.	.	H	α-helix	trans	-67.6	-25.8	-176.3	-57.5	-166.8	-179.6	-148.4	0	113.9	C500 R506 H555 M559 E601	C500-K502 PolarHBondContact O-N 3.43Å; K502-R506 WeakPolarHBondContact O-CB 3.39Å; K502-R506 PolarHBondContact O-N 3Å; K502-R506 VanDerWaalsContact O-N 3.15Å; K502-H555 WeakPolarHBondContact CD-CE1 3.01Å; K502-H555 WeakPolarHBondContact CE-CE1 3.28Å; K502-H555 WeakPolarHBondContact CE-NE2 3.43Å; K502-H555 PolarHBondContact NZ-CE1 3.44Å; K502-H555 PolarHBondContact NZ-NE2 2.76Å; K502-M559 PolarHBondContact NZ-SD 3.28Å; K502-E601 WeakPolarHBondContact CD-OE2 3.22Å; K502-E601 VanDerWaalsContact CE-OE2 3.29Å; K502-E601 WeakPolarHBondContact CE-OE2 3.41Å; K502-E601 IonicContact NZ-OE2 3.8Å; K502-E601 PolarHBondContact NZ-OE2 3.4Å
503	C	92.6	Very high	90.6	Very high	16 Å²	16	31.3 Å²	31.3	11%	0.108	16%	0.162	C	C	.	.	H	α-helix	trans	-73.1	-43	174.8	-63.3	0	0	0	0	111	L482 C500 L501 R506 C507	L482-C503 HydrophobicContact CB-CB 3.86Å; L482-C503 HydrophobicContact CD1-CB 3.86Å; C500-C503 HydrophobicContact CB-CB 4.01Å; C500-C503 WeakPolarHBondContact O-CA 3.3Å; C500-C503 WeakPolarHBondContact O-CB 3.23Å; C500-C503 PolarHBondContact O-N 2.92Å; L501-C503 VanDerWaalsContact C-N 3.29Å; L501-C503 PolarHBondContact O-N 2.94Å; C503-R506 PolarHBondContact O-N 3.42Å; C503-C507 PolarHBondContact O-N 2.87Å; C503-C507 VanDerWaalsContact O-N 3.11Å
504	L	92.3	Very high	90.7	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-62.7	-48.1	174.4	179.5	59.6	0	0	0	111.3	V491 T493 F499 C500 L501 R506 C507 L508 F524	V491-L504 HydrophobicContact CG1-CD2 4.26Å; T493-L504 HydrophobicContact CG2-CD1 4.08Å; T493-L504 HydrophobicContact CG2-CD2 3.73Å; F499-L504 HydrophobicContact CB-CB 3.91Å; F499-L504 HydrophobicContact CD2-CB 4.49Å; F499-L504 HydrophobicContact CD2-CD1 3.84Å; F499-L504 HydrophobicContact CD2-CD2 4.33Å; F499-L504 HydrophobicContact CD2-CG 4.44Å; F499-L504 HydrophobicContact CE2-CD1 4.24Å; F499-L504 HydrophobicContact CG-CB 4.44Å; F499-L504 HydrophobicContact CG-CD1 4.43Å; C500-L504 PolarHBondContact O-N 2.67Å; L501-L504 PolarHBondContact O-N 2.9Å; L504-R506 VanDerWaalsContact C-N 3.33Å; L504-R506 PolarHBondContact O-N 3.31Å; L504-C507 PolarHBondContact O-N 3.3Å; L504-C507 VanDerWaalsContact O-N 3.09Å; L504-L508 HydrophobicContact CD1-CD1 3.91Å; L504-L508 HydrophobicContact CD1-CD2 4.47Å; L504-L508 HydrophobicContact CD1-CG 3.94Å; L504-L508 HydrophobicContact CD2-CD1 4.45Å; L504-L508 HydrophobicContact CG-CD1 3.82Å; L504-L508 HydrophobicContact CG-CG 4.25Å; L504-L508 WeakPolarHBondContact O-CG 3.29Å; L504-L508 PolarHBondContact O-N 3.39Å; L504-F524 HydrophobicContact CD2-CE1 4.11Å
505	E	87.1	Confident	90.8	Very high	25 Å²	25	31.5 Å²	31.5	12%	0.117	16%	0.164	C	C	.	.	H	α-helix	trans	-58.8	-42	178.3	-74.7	-157.2	98	0	0	112.9	L501 C507 L508 D509 R528 Y530 R597	L501-E505 HydrophobicContact CD1-CG 4.3Å; L501-E505 PolarHBondContact O-N 3.15Å; E505-C507 VanDerWaalsContact C-N 3.34Å; E505-C507 PolarHBondContact O-N 2.84Å; E505-L508 PolarHBondContact O-N 3.2Å; E505-D509 PolarHBondContact O-N 2.91Å; E505-D509 VanDerWaalsContact O-N 3.08Å; E505-R528 IonicContact OE1-NH1 3.6Å; E505-R528 PolarHBondContact OE1-NH1 3.36Å; E505-Y530 HydrophobicContact CG-CD2 4.03Å; E505-Y530 HydrophobicContact CG-CE2 3.56Å; E505-Y530 WeakPolarHBondContact OE1-CE2 3.12Å; E505-R597 IonicContact OE1-CZ 3.75Å; E505-R597 IonicContact OE1-NE 3.5Å; E505-R597 PolarHBondContact OE1-NE 3.18Å
506	R	85.5	Confident	90.9	Very high	92 Å²	92	35.3 Å²	35.3	35%	0.347	18%	0.183	S	C	.	.	H	α-helix	trans	-62.7	-39.6	174.7	-174.3	175.5	65.5	164.4	-2.7	111.7	K502 C503 L504 H510 L594 D657	K502-R506 WeakPolarHBondContact O-CB 3.39Å; K502-R506 PolarHBondContact O-N 3Å; K502-R506 VanDerWaalsContact O-N 3.15Å; C503-R506 PolarHBondContact O-N 3.42Å; L504-R506 VanDerWaalsContact C-N 3.33Å; L504-R506 PolarHBondContact O-N 3.31Å; R506-H510 PolarHBondContact O-CD2 3.33Å; R506-L594 HydrophobicContact CB-CD1 4.37Å; R506-L594 HydrophobicContact CG-CD1 4.09Å; R506-L594 HydrophobicContact CG-CD2 4.03Å; R506-D657 WeakPolarHBondContact CD-OD1 3.39Å; R506-D657 IonicContact CZ-OD1 2.81Å; R506-D657 IonicContact NH1-OD1 3.19Å; R506-D657 PolarHBondContact NH1-OD1 3.02Å
507	C	88.2	Confident	90.9	Very high	37 Å²	37	37.8 Å²	37.8	25%	0.25	20%	0.199	C	C	.	.	H	α-helix	trans	-66.8	-44.6	175.4	-75.4	0	0	0	0	112.4	C503 L504 E505 D509 H510 N511 P515	C503-C507 PolarHBondContact O-N 2.87Å; C503-C507 VanDerWaalsContact O-N 3.11Å; L504-C507 PolarHBondContact O-N 3.3Å; L504-C507 VanDerWaalsContact O-N 3.09Å; E505-C507 VanDerWaalsContact C-N 3.34Å; E505-C507 PolarHBondContact O-N 2.84Å; C507-D509 PolarHBondContact O-N 2.63Å; C507-H510 PolarHBondContact O-N 3.21Å; C507-N511 PolarHBondContact O-N 2.92Å; C507-N511 VanDerWaalsContact O-N 3.07Å; C507-P515 HydrophobicContact CB-CG 3.82Å
508	L	85.8	Confident	90.9	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-66.1	-19.1	179.7	-67.5	176.7	0	0	0	113.4	L504 E505 N511 L521 L525 Y530	L504-L508 HydrophobicContact CD1-CD1 3.91Å; L504-L508 HydrophobicContact CD1-CD2 4.47Å; L504-L508 HydrophobicContact CD1-CG 3.94Å; L504-L508 HydrophobicContact CD2-CD1 4.45Å; L504-L508 HydrophobicContact CG-CD1 3.82Å; L504-L508 HydrophobicContact CG-CG 4.25Å; L504-L508 WeakPolarHBondContact O-CG 3.29Å; L504-L508 PolarHBondContact O-N 3.39Å; E505-L508 PolarHBondContact O-N 3.2Å; L508-N511 WeakPolarHBondContact CA-O 3.04Å; L508-L521 HydrophobicContact CD2-CB 4.14Å; L508-L521 HydrophobicContact CD2-CD1 4.18Å; L508-L525 HydrophobicContact CB-CD1 3.88Å; L508-L525 HydrophobicContact CB-CD2 4.45Å; L508-L525 HydrophobicContact CD1-CD1 4.28Å; L508-Y530 HydrophobicContact CD1-CE1 4.37Å
509	D	80.3	Confident	90.7	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.011	24%	0.244	C	C	.	.	H	α-helix	trans	-64.3	-40.2	168.2	-87.9	-43.2	0	0	0	112.6	E505 C507 R593 R597	E505-D509 PolarHBondContact O-N 2.91Å; E505-D509 VanDerWaalsContact O-N 3.08Å; C507-D509 PolarHBondContact O-N 2.63Å; D509-R593 VanDerWaalsContact CA-NH1 3.26Å; D509-R593 PolarHBondContact O-NH1 2.68Å; D509-R593 PolarHBondContact O-NH2 2.83Å; D509-R593 WeakPolarHBondContact OD1-CB 3.25Å; D509-R593 IonicContact OD1-CZ 3.28Å; D509-R593 IonicContact OD1-NH1 2.76Å; D509-R593 PolarHBondContact OD1-NH1 3.46Å; D509-R597 IonicContact OD1-NH2 2.72Å; D509-R597 PolarHBondContact OD1-NH2 2.72Å; D509-R597 IonicContact OD2-CZ 3.63Å; D509-R597 IonicContact OD2-NH1 2.82Å; D509-R597 PolarHBondContact OD2-NH1 2.75Å; D509-R597 IonicContact OD2-NH2 3.59Å; D509-R597 PolarHBondContact OD2-NH2 3.18Å
510	H	81.8	Confident	90.4	Very high	114 Å²	114	52.2 Å²	52.2	53%	0.528	27%	0.267	S	S	.	.	H	α-helix	trans	-86.3	-33.9	-176.6	-68.2	-86.4	0	0	0	113.1	R506 C507 P590	R506-H510 PolarHBondContact O-CD2 3.33Å; C507-H510 PolarHBondContact O-N 3.21Å; H510-P590 WeakPolarHBondContact ND1-CB 3.34Å
511	N	85.4	Confident	90.1	Very high	90 Å²	90	52.3 Å²	52.3	48%	0.481	27%	0.267	S	S	.	.			trans	-152	121.7	-179.2	-176.7	-10.4	0	0	0	109.7	C507 L508 N513	C507-N511 PolarHBondContact O-N 2.92Å; C507-N511 VanDerWaalsContact O-N 3.07Å; L508-N511 WeakPolarHBondContact CA-O 3.04Å; N511-N513 PolarHBondContact O-N 3.45Å; N511-N513 WeakPolarHBondContact OD1-CB 3.49Å; N511-N513 PolarHBondContact OD1-N 2.84Å
512	P	87.6	Confident	89.6	Confident	46 Å²	46	53 Å²	53	30%	0.299	28%	0.275	S	S	.	.	S	Bend	trans	-74	19	-177.5	34	-38.8	0	0	0	114	L521 L525	P512-L521 CarbonylContact O-C 3.58Å; P512-L521 WeakPolarHBondContact O-CA 3.27Å; P512-L521 WeakPolarHBondContact O-CB 3.41Å; P512-L521 PolarHBondContact O-N 3.4Å; P512-L525 HydrophobicContact CB-CD2 3.99Å
513	N	92.7	Very high	89.3	Confident	46 Å²	46	58.6 Å²	58.6	25%	0.246	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-107.4	152	178.1	-69.4	25.8	0	0	0	111.4	N511 K518 E519 N520	N511-N513 PolarHBondContact O-N 3.45Å; N511-N513 WeakPolarHBondContact OD1-CB 3.49Å; N511-N513 PolarHBondContact OD1-N 2.84Å; N513-K518 PolarHBondContact ND2-O 2.91Å; N513-E519 CarbonylContact C-O 3.6Å; N513-E519 VanDerWaalsContact CA-O 3.22Å; N513-E519 WeakPolarHBondContact CA-O 3.4Å; N513-E519 WeakPolarHBondContact CB-O 3.21Å; N513-N520 PolarHBondContact OD1-ND2 3.18Å
514	C	94.3	Very high	88.8	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.014	30%	0.3	C	S	.	.			trans	-56.6	127.1	175.2	179.6	0	0	0	0	111.3	C495 L516 C517 K518 E519 L521	C495-C514 VanDerWaalsContact SG-CB 3.55Å; C514-L516 PolarHBondContact O-N 3.03Å; C514-L516 VanDerWaalsContact O-N 3.09Å; C514-C517 VanDerWaalsContact CB-SG 3.55Å; C514-K518 WeakPolarHBondContact O-CA 3.49Å; C514-K518 PolarHBondContact O-N 3.16Å; C514-E519 PolarHBondContact N-O 2.81Å; C514-L521 HydrophobicContact CB-CD1 3.87Å; C514-L521 HydrophobicContact CB-CG 4.31Å
515	P	95	Very high	88.2	Confident	50 Å²	50	58.7 Å²	58.7	33%	0.325	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-22.6	-179.6	-29.1	37.3	0	0	0	115.7	L482 F499 C507	L482-P515 HydrophobicContact CD1-CG 4.27Å; L482-P515 HydrophobicContact CD2-CB 3.75Å; L482-P515 HydrophobicContact CD2-CG 4Å; F499-P515 HydrophobicContact CE1-CB 4.39Å; F499-P515 HydrophobicContact CE1-CG 4.44Å; F499-P515 HydrophobicContact CZ-CB 4.34Å; F499-P515 HydrophobicContact CZ-CG 4.27Å; C507-P515 HydrophobicContact CB-CG 3.82Å
516	L	95.3	Very high	87.6	Confident	89 Å²	89	59.5 Å²	59.5	47%	0.466	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-64	-177.2	-64.6	173.9	0	0	0	112	H497 F499 C514	H497-L516 HydrophobicContact CB-CD1 4.35Å; F499-L516 HydrophobicContact CE1-CD1 3.75Å; F499-L516 HydrophobicContact CE1-CG 3.96Å; F499-L516 HydrophobicContact CZ-CB 4.48Å; F499-L516 HydrophobicContact CZ-CD1 3.74Å; F499-L516 HydrophobicContact CZ-CG 3.87Å; C514-L516 PolarHBondContact O-N 3.03Å; C514-L516 VanDerWaalsContact O-N 3.09Å
517	C	95.9	Very high	87.1	Confident	55 Å²	55	58.5 Å²	58.5	37%	0.372	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-7.7	-177	66.3	0	0	0	0	115.3	C495 C514 E519	C495-C517 PolarHBondContact SG-SG 3.15Å; C514-C517 VanDerWaalsContact CB-SG 3.55Å; C517-E519 PolarHBondContact O-N 3.09Å; C517-E519 VanDerWaalsContact O-N 3.16Å; C517-E519 VanDerWaalsContact SG-CB 3.55Å
518	K	95.3	Very high	86.2	Confident	163 Å²	163	59.9 Å²	59.9	71%	0.709	32%	0.318	S	S	*	.			trans	63.1	8.9	-177	-51.1	171.1	-174.3	169.1	0	115.8	N513 C514	N513-K518 PolarHBondContact ND2-O 2.91Å; C514-K518 WeakPolarHBondContact O-CA 3.49Å; C514-K518 PolarHBondContact O-N 3.16Å
519	E	93.7	Very high	85.4	Confident	90 Å²	90	61.3 Å²	61.3	42%	0.421	33%	0.333	S	S	.	.			trans	-59.6	145.1	171.3	-166.9	171.4	150.3	0	0	111.1	C495 N513 C514 C517	C495-E519 HydrophobicContact CB-CB 4.04Å; C495-E519 HydrophobicContact CB-CG 4.18Å; C495-E519 WeakPolarHBondContact CB-OE2 3.22Å; N513-E519 CarbonylContact C-O 3.6Å; N513-E519 VanDerWaalsContact CA-O 3.22Å; N513-E519 WeakPolarHBondContact CA-O 3.4Å; N513-E519 WeakPolarHBondContact CB-O 3.21Å; C514-E519 PolarHBondContact N-O 2.81Å; C517-E519 PolarHBondContact O-N 3.09Å; C517-E519 VanDerWaalsContact O-N 3.16Å; C517-E519 VanDerWaalsContact SG-CB 3.55Å
520	N	91.4	Very high	85.7	Confident	91 Å²	91	62.4 Å²	62.4	49%	0.487	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-80	131.9	-175.6	-173.6	-92.8	0	0	0	111.4	N513 S522	N513-N520 PolarHBondContact OD1-ND2 3.18Å; N520-S522 VanDerWaalsContact CG-OG 3.24Å; N520-S522 PolarHBondContact ND2-OG 3.35Å; N520-S522 VanDerWaalsContact OD1-CB 3.28Å; N520-S522 WeakPolarHBondContact OD1-CB 2.97Å; N520-S522 PolarHBondContact OD1-N 3.06Å; N520-S522 VanDerWaalsContact OD1-N 3.1Å; N520-S522 PolarHBondContact OD1-OG 3.4Å
521	L	89.3	Confident	86.1	Confident	5 Å²	5	61.8 Å²	61.8	3%	0.026	33%	0.333	C	S	.	.			trans	-118.3	24.2	-176.3	-58	-179.1	0	0	0	111.8	T493 L508 P512 C514 E523 F524 L525	T493-L521 HydrophobicContact CG2-CD1 3.66Å; L508-L521 HydrophobicContact CD2-CB 4.14Å; L508-L521 HydrophobicContact CD2-CD1 4.18Å; P512-L521 CarbonylContact O-C 3.58Å; P512-L521 WeakPolarHBondContact O-CA 3.27Å; P512-L521 WeakPolarHBondContact O-CB 3.41Å; P512-L521 PolarHBondContact O-N 3.4Å; C514-L521 HydrophobicContact CB-CD1 3.87Å; C514-L521 HydrophobicContact CB-CG 4.31Å; L521-E523 VanDerWaalsContact C-N 3.33Å; L521-E523 PolarHBondContact O-N 2.91Å; L521-F524 HydrophobicContact CB-CB 4.33Å; L521-F524 WeakPolarHBondContact O-CB 3.42Å; L521-F524 PolarHBondContact O-N 2.85Å; L521-L525 WeakPolarHBondContact O-CB 3.43Å; L521-L525 PolarHBondContact O-N 2.92Å
522	S	84.3	Confident	86.6	Confident	46 Å²	46	60.2 Å²	60.2	32%	0.322	32%	0.322	S	S	.	.	H	α-helix	trans	-63.5	-35.9	-174.7	-47.5	0	0	0	0	112.9	N520 L525 A526	N520-S522 VanDerWaalsContact CG-OG 3.24Å; N520-S522 PolarHBondContact ND2-OG 3.35Å; N520-S522 VanDerWaalsContact OD1-CB 3.28Å; N520-S522 WeakPolarHBondContact OD1-CB 2.97Å; N520-S522 PolarHBondContact OD1-N 3.06Å; N520-S522 VanDerWaalsContact OD1-N 3.1Å; N520-S522 PolarHBondContact OD1-OG 3.4Å; S522-L525 PolarHBondContact O-N 2.78Å; S522-A526 VanDerWaalsContact O-CB 3.28Å; S522-A526 WeakPolarHBondContact O-CB 3.44Å; S522-A526 PolarHBondContact O-N 3.28Å
523	E	81.8	Confident	87	Confident	167 Å²	167	58 Å²	58	78%	0.78	31%	0.308	S	S	*	.	H	α-helix	trans	-69.2	-39.2	176.1	-174.1	167.1	-159.4	0	0	111.7	L521 A526 S527	L521-E523 VanDerWaalsContact C-N 3.33Å; L521-E523 PolarHBondContact O-N 2.91Å; E523-A526 WeakPolarHBondContact O-CB 3.29Å; E523-A526 PolarHBondContact O-N 2.86Å; E523-S527 PolarHBondContact O-N 2.92Å
524	F	82.2	Confident	87.1	Confident	17 Å²	17	60 Å²	60	8%	0.075	31%	0.314	C	S	.	.	H	α-helix	trans	-66.7	-38.4	174.2	-169.6	-118.8	0	0	0	112.1	V491 T493 P494 L504 L521 A526 S527 Y530	V491-F524 HydrophobicContact CG1-CZ 4.13Å; T493-F524 HydrophobicContact CG2-CE1 4.27Å; P494-F524 HydrophobicContact CG-CB 4.07Å; P494-F524 HydrophobicContact CG-CD1 4.46Å; P494-F524 HydrophobicContact CG-CD2 3.59Å; P494-F524 HydrophobicContact CG-CE2 4.07Å; P494-F524 HydrophobicContact CG-CG 3.82Å; L504-F524 HydrophobicContact CD2-CE1 4.11Å; L521-F524 HydrophobicContact CB-CB 4.33Å; L521-F524 WeakPolarHBondContact O-CB 3.42Å; L521-F524 PolarHBondContact O-N 2.85Å; F524-A526 VanDerWaalsContact C-N 3.33Å; F524-S527 PolarHBondContact O-OG 3.47Å; F524-S527 VanDerWaalsContact O-OG 3.11Å; F524-Y530 HydrophobicContact CD1-CD1 4.11Å; F524-Y530 AromaticContact CD1-CE1 3.73Å; F524-Y530 HydrophobicContact CD1-CE1 3.73Å; F524-Y530 AromaticContact CE1-CD1 3.58Å; F524-Y530 HydrophobicContact CE1-CD1 3.58Å; F524-Y530 AromaticContact CE1-CE1 3.64Å; F524-Y530 HydrophobicContact CE1-CE1 3.64Å; F524-Y530 HydrophobicContact CE2-CD1 4.34Å; F524-Y530 HydrophobicContact CG-CE1 4.37Å; F524-Y530 AromaticContact CZ-CD1 3.73Å; F524-Y530 HydrophobicContact CZ-CD1 3.73Å; F524-Y530 HydrophobicContact CZ-CE1 4.22Å
525	L	79.9	Confident	87.2	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-65.6	-36	172.1	179.9	59.9	0	0	0	112.2	L508 P512 L521 S522 R528 Y530	L508-L525 HydrophobicContact CB-CD1 3.88Å; L508-L525 HydrophobicContact CB-CD2 4.45Å; L508-L525 HydrophobicContact CD1-CD1 4.28Å; P512-L525 HydrophobicContact CB-CD2 3.99Å; L521-L525 WeakPolarHBondContact O-CB 3.43Å; L521-L525 PolarHBondContact O-N 2.92Å; S522-L525 PolarHBondContact O-N 2.78Å; L525-R528 VanDerWaalsContact CD1-CZ 3.48Å; L525-R528 VanDerWaalsContact CD1-NH2 3.27Å; L525-R528 WeakPolarHBondContact O-CD 3.37Å; L525-R528 PolarHBondContact O-NE 3.18Å; L525-Y530 VanDerWaalsContact CD1-OH 3.28Å; L525-Y530 WeakPolarHBondContact CD1-OH 3.49Å
526	A	74.9	Confident	87.2	Confident	41 Å²	41	58.3 Å²	58.3	34%	0.339	30%	0.302	S	S	.	.	H	α-helix	trans	-72.6	-36.7	179.2	0	0	0	0	0	113	S522 E523 F524 R528 P634	S522-A526 VanDerWaalsContact O-CB 3.28Å; S522-A526 WeakPolarHBondContact O-CB 3.44Å; S522-A526 PolarHBondContact O-N 3.28Å; E523-A526 WeakPolarHBondContact O-CB 3.29Å; E523-A526 PolarHBondContact O-N 2.86Å; F524-A526 VanDerWaalsContact C-N 3.33Å; A526-R528 VanDerWaalsContact C-N 3.27Å; A526-R528 PolarHBondContact O-N 2.92Å; A526-P634 HydrophobicContact CB-CB 3.59Å; A526-P634 HydrophobicContact CB-CG 4.3Å
527	S	73.3	Confident	87.3	Confident	71 Å²	71	56.6 Å²	56.6	50%	0.497	29%	0.292	S	S	.	.	H	α-helix	trans	-66.7	-29.9	178.8	80.2	0	0	0	0	112.6	E523 F524 G529	E523-S527 PolarHBondContact O-N 2.92Å; F524-S527 PolarHBondContact O-OG 3.47Å; F524-S527 VanDerWaalsContact O-OG 3.11Å; S527-G529 PolarHBondContact O-N 3.04Å; S527-G529 PolarHBondContact OG-N 2.84Å
528	R	70.6	Confident	87.2	Confident	67 Å²	67	58.8 Å²	58.8	25%	0.253	30%	0.296	S	S	.	.			trans	51.2	17.2	-170.5	-64.1	-69.8	173.1	169.5	-3.6	113.6	E505 L525 A526 Y530	E505-R528 IonicContact OE1-NH1 3.6Å; E505-R528 PolarHBondContact OE1-NH1 3.36Å; L525-R528 VanDerWaalsContact CD1-CZ 3.48Å; L525-R528 VanDerWaalsContact CD1-NH2 3.27Å; L525-R528 WeakPolarHBondContact O-CD 3.37Å; L525-R528 PolarHBondContact O-NE 3.18Å; A526-R528 VanDerWaalsContact C-N 3.27Å; A526-R528 PolarHBondContact O-N 2.92Å; R528-Y530 PolarHBondContact O-N 2.76Å; R528-Y530 VanDerWaalsContact O-N 3.15Å
529	G	69.4	Low	87.1	Confident	31 Å²	31	51 Å²	51	32%	0.32	26%	0.263	S	S	.	.			trans	-81.8	12.2	-168.9	0	0	0	0	0	114.9	S527 K531	S527-G529 PolarHBondContact O-N 3.04Å; S527-G529 PolarHBondContact OG-N 2.84Å; G529-K531 WeakPolarHBondContact O-CD 3.27Å; G529-K531 WeakPolarHBondContact O-CE 3.31Å; G529-K531 WeakPolarHBondContact O-CG 3.48Å; G529-K531 PolarHBondContact O-N 3.1Å
530	Y	84.9	Confident	87.2	Confident	25 Å²	25	46.8 Å²	46.8	10%	0.098	24%	0.243	C	C	.	.			trans	-43.5	108	-168	-50.9	-54.4	0	0	0	112.5	L501 E505 L508 F524 L525 R528	L501-Y530 HydrophobicContact CD1-CD2 3.85Å; L501-Y530 HydrophobicContact CD1-CG 4.01Å; E505-Y530 HydrophobicContact CG-CD2 4.03Å; E505-Y530 HydrophobicContact CG-CE2 3.56Å; E505-Y530 WeakPolarHBondContact OE1-CE2 3.12Å; L508-Y530 HydrophobicContact CD1-CE1 4.37Å; F524-Y530 HydrophobicContact CD1-CD1 4.11Å; F524-Y530 AromaticContact CD1-CE1 3.73Å; F524-Y530 HydrophobicContact CD1-CE1 3.73Å; F524-Y530 AromaticContact CE1-CD1 3.58Å; F524-Y530 HydrophobicContact CE1-CD1 3.58Å; F524-Y530 AromaticContact CE1-CE1 3.64Å; F524-Y530 HydrophobicContact CE1-CE1 3.64Å; F524-Y530 HydrophobicContact CE2-CD1 4.34Å; F524-Y530 HydrophobicContact CG-CE1 4.37Å; F524-Y530 AromaticContact CZ-CD1 3.73Å; F524-Y530 HydrophobicContact CZ-CD1 3.73Å; F524-Y530 HydrophobicContact CZ-CE1 4.22Å; L525-Y530 VanDerWaalsContact CD1-OH 3.28Å; L525-Y530 WeakPolarHBondContact CD1-OH 3.49Å; R528-Y530 PolarHBondContact O-N 2.76Å; R528-Y530 VanDerWaalsContact O-N 3.15Å
531	K	90.9	Very high	87.3	Confident	102 Å²	102	48.1 Å²	48.1	44%	0.443	25%	0.246	S	C	.	.			trans	-98.9	143.2	171.6	-57.5	-50.3	175.9	-168	0	109.9	E164 G529	E164-K531 VanDerWaalsContact O-CB 3.29Å; E164-K531 WeakPolarHBondContact O-CB 3.26Å; E164-K531 WeakPolarHBondContact O-CG 3.45Å; G529-K531 WeakPolarHBondContact O-CD 3.27Å; G529-K531 WeakPolarHBondContact O-CE 3.31Å; G529-K531 WeakPolarHBondContact O-CG 3.48Å; G529-K531 PolarHBondContact O-N 3.1Å
532	K	95.3	Very high	87.4	Confident	57 Å²	57	53 Å²	53	25%	0.248	26%	0.264	C	S	.	.			trans	-71.3	143.7	175.4	-51.6	-175.2	-177.8	-175.4	0	109.4	G166 E489 P490 F534 E537	G166-K532 WeakPolarHBondContact CA-O 3.34Å; E489-K532 HydrophobicContact CB-CD 4.12Å; E489-K532 HydrophobicContact CB-CG 4.49Å; E489-K532 HydrophobicContact CG-CD 4.36Å; E489-K532 WeakPolarHBondContact OE1-CE 3.41Å; E489-K532 IonicContact OE1-NZ 3.21Å; E489-K532 PolarHBondContact OE1-NZ 3.42Å; P490-K532 CarbonylContact O-C 3.5Å; P490-K532 WeakPolarHBondContact O-CA 3.04Å; K532-F534 PolarHBondContact O-N 3.01Å; K532-E537 HydrophobicContact CB-CG 4.48Å; K532-E537 WeakPolarHBondContact CB-OE2 3.46Å; K532-E537 HydrophobicContact CD-CG 4.41Å; K532-E537 WeakPolarHBondContact CD-OE1 3.47Å; K532-E537 WeakPolarHBondContact CD-OE2 3.48Å; K532-E537 IonicContact NZ-OE1 2.73Å; K532-E537 PolarHBondContact NZ-OE1 3.34Å
533	T	96.5	Very high	87.7	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.26	C	S	.	.			trans	-72.7	93.5	173.5	-55.7	0	0	0	0	108	T162 L200 P490 A492 L535 M536 E537	T162-T533 HydrophobicContact CG2-CG2 3.9Å; L200-T533 HydrophobicContact CD1-CG2 4.02Å; P490-T533 PolarHBondContact O-N 2.77Å; A492-T533 PolarHBondContact N-OG1 3.37Å; A492-T533 VanDerWaalsContact N-OG1 3.16Å; T533-L535 PolarHBondContact O-N 3.02Å; T533-L535 VanDerWaalsContact O-N 3.17Å; T533-M536 HydrophobicContact CG2-CB 4.05Å; T533-M536 HydrophobicContact CG2-CG 3.72Å; T533-M536 HydrophobicContact CG2-SD 3.91Å; T533-M536 WeakPolarHBondContact O-CA 3.33Å; T533-M536 PolarHBondContact O-N 2.8Å; T533-E537 PolarHBondContact O-N 3.28Å; T533-E537 VanDerWaalsContact O-N 3.11Å
534	F	96.1	Very high	88.3	Confident	87 Å²	87	45.9 Å²	45.9	38%	0.382	22%	0.224	S	C	.	.	H	α-helix	trans	-55.2	-39.3	-171.8	-67.2	-57.8	0	0	0	112.9	C165 G166 H167 K532 M536 E537 E538	C165-F534 VanDerWaalsContact O-CE2 3.3Å; C165-F534 WeakPolarHBondContact O-CE2 3.28Å; G166-F534 PolarHBondContact O-N 2.97Å; H167-F534 AromaticContact CE1-CD2 3.65Å; H167-F534 AromaticContact CE1-CE2 3.47Å; H167-F534 VanDerWaalsContact CE1-CE2 3.47Å; H167-F534 WeakPolarHBondContact CE1-CE2 3.42Å; H167-F534 AromaticContact ND1-CD2 3.83Å; H167-F534 AromaticContact ND1-CE2 3.79Å; H167-F534 AromaticContact NE2-CD2 3.81Å; K532-F534 PolarHBondContact O-N 3.01Å; F534-M536 VanDerWaalsContact C-N 3.25Å; F534-M536 PolarHBondContact O-N 2.87Å; F534-E537 PolarHBondContact O-N 3.41Å; F534-E538 WeakPolarHBondContact O-CG 3.28Å; F534-E538 PolarHBondContact O-N 3.21Å
535	L	95.7	Very high	88.9	Confident	17 Å²	17	46.1 Å²	46.1	9%	0.089	23%	0.231	C	C	.	.	H	α-helix	trans	-58.3	-35.8	174.8	176.4	52.3	0	0	0	112.5	L147 L157 T168 L200 T533 V539	L147-L535 HydrophobicContact CD1-CD1 3.5Å; L147-L535 VanDerWaalsContact CD1-CD1 3.5Å; L147-L535 HydrophobicContact CD2-CD1 4.49Å; L147-L535 HydrophobicContact CG-CD1 3.59Å; L147-L535 WeakPolarHBondContact O-CD1 3.36Å; L157-L535 HydrophobicContact CD1-CD2 3.4Å; T168-L535 HydrophobicContact CG2-CD2 4.02Å; L200-L535 HydrophobicContact CD1-CB 4.45Å; L200-L535 HydrophobicContact CD1-CD2 3.85Å; L200-L535 HydrophobicContact CD1-CG 4.2Å; L200-L535 HydrophobicContact CD2-CD2 4.2Å; L200-L535 HydrophobicContact CD2-CG 4.09Å; T533-L535 PolarHBondContact O-N 3.02Å; T533-L535 VanDerWaalsContact O-N 3.17Å; L535-V539 HydrophobicContact CD1-CG2 4.24Å; L535-V539 WeakPolarHBondContact O-CB 3.47Å; L535-V539 VanDerWaalsContact O-CG2 3.24Å; L535-V539 WeakPolarHBondContact O-CG2 3.4Å; L535-V539 PolarHBondContact O-N 3.29Å
536	M	95.7	Very high	89.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-78.9	-34.4	176.9	-68.8	179.9	68.1	0	0	112.6	V199 L200 L478 F487 P490 T498 T533 F534 V539 L540	V199-M536 HydrophobicContact CB-CE 4.2Å; V199-M536 HydrophobicContact CG1-CE 3.66Å; L200-M536 HydrophobicContact CD1-CG 4.15Å; L200-M536 HydrophobicContact CD1-SD 4.42Å; L200-M536 HydrophobicContact CD2-CG 3.53Å; L200-M536 HydrophobicContact CD2-SD 4.2Å; L200-M536 HydrophobicContact CG-CG 3.85Å; L200-M536 HydrophobicContact CG-SD 3.94Å; L478-M536 HydrophobicContact CD2-CE 3.97Å; F487-M536 HydrophobicContact CD2-CE 3.62Å; F487-M536 HydrophobicContact CE2-CE 3.66Å; F487-M536 HydrophobicContact CG-CE 4.23Å; F487-M536 HydrophobicContact CZ-CE 4.23Å; P490-M536 HydrophobicContact CB-CB 4.12Å; P490-M536 HydrophobicContact CB-CE 4.21Å; P490-M536 HydrophobicContact CB-SD 4.45Å; P490-M536 HydrophobicContact CG-CB 3.66Å; T498-M536 HydrophobicContact CG2-CE 3.77Å; T498-M536 HydrophobicContact CG2-SD 3.69Å; T533-M536 HydrophobicContact CG2-CB 4.05Å; T533-M536 HydrophobicContact CG2-CG 3.72Å; T533-M536 HydrophobicContact CG2-SD 3.91Å; T533-M536 WeakPolarHBondContact O-CA 3.33Å; T533-M536 PolarHBondContact O-N 2.8Å; F534-M536 VanDerWaalsContact C-N 3.25Å; F534-M536 PolarHBondContact O-N 2.87Å; M536-V539 PolarHBondContact O-N 2.87Å; M536-L540 WeakPolarHBondContact O-CB 3.13Å; M536-L540 VanDerWaalsContact O-CD1 3.31Å; M536-L540 WeakPolarHBondContact O-CD1 3.39Å; M536-L540 WeakPolarHBondContact O-CG 3.44Å; M536-L540 PolarHBondContact O-N 3.45Å
537	E	95.5	Very high	90.5	Very high	53 Å²	53	54.2 Å²	54.2	25%	0.248	27%	0.266	C	S	.	.	H	α-helix	trans	-62	-44	170.1	-76.8	-169	122.2	0	0	111.5	P490 K532 T533 F534 L540 Q541	P490-E537 HydrophobicContact CG-CG 4.18Å; K532-E537 HydrophobicContact CB-CG 4.48Å; K532-E537 WeakPolarHBondContact CB-OE2 3.46Å; K532-E537 HydrophobicContact CD-CG 4.41Å; K532-E537 WeakPolarHBondContact CD-OE1 3.47Å; K532-E537 WeakPolarHBondContact CD-OE2 3.48Å; K532-E537 IonicContact NZ-OE1 2.73Å; K532-E537 PolarHBondContact NZ-OE1 3.34Å; T533-E537 PolarHBondContact O-N 3.28Å; T533-E537 VanDerWaalsContact O-N 3.11Å; F534-E537 PolarHBondContact O-N 3.41Å; E537-L540 PolarHBondContact O-N 3.45Å; E537-Q541 WeakPolarHBondContact O-CB 3.22Å; E537-Q541 PolarHBondContact O-N 2.84Å
538	E	94.2	Very high	91.6	Very high	100 Å²	100	52 Å²	52	47%	0.467	25%	0.248	S	C	.	.	H	α-helix	trans	-64	-41.3	175.9	-73.1	-67.6	140.7	0	0	112.7	L147 F534 R542	L147-E538 HydrophobicContact CD1-CB 3.56Å; L147-E538 HydrophobicContact CD1-CG 4.2Å; L147-E538 HydrophobicContact CD2-CB 4.09Å; L147-E538 HydrophobicContact CG-CB 4.48Å; F534-E538 WeakPolarHBondContact O-CG 3.28Å; F534-E538 PolarHBondContact O-N 3.21Å; E538-R542 WeakPolarHBondContact O-CB 3.28Å; E538-R542 PolarHBondContact O-N 3.32Å
539	V	93.8	Very high	92.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.4	-48.9	174.7	167	0	0	0	0	111	L147 F148 L203 L473 L478 L535 M536 Q541 R542 Y543	L147-V539 HydrophobicContact CD2-CG2 3.71Å; L147-V539 HydrophobicContact CG-CG2 4.33Å; F148-V539 HydrophobicContact CE1-CG2 3.66Å; F148-V539 HydrophobicContact CZ-CG2 3.84Å; L203-V539 HydrophobicContact CD2-CG1 4.2Å; L473-V539 HydrophobicContact CD2-CG1 4.02Å; L478-V539 HydrophobicContact CD1-CG1 3.74Å; L535-V539 HydrophobicContact CD1-CG2 4.24Å; L535-V539 WeakPolarHBondContact O-CB 3.47Å; L535-V539 VanDerWaalsContact O-CG2 3.24Å; L535-V539 WeakPolarHBondContact O-CG2 3.4Å; L535-V539 PolarHBondContact O-N 3.29Å; M536-V539 PolarHBondContact O-N 2.87Å; V539-Q541 VanDerWaalsContact C-N 3.35Å; V539-Q541 PolarHBondContact O-N 3.01Å; V539-R542 PolarHBondContact O-N 3.47Å; V539-Y543 HydrophobicContact CG1-CD2 4.15Å; V539-Y543 WeakPolarHBondContact O-CD2 3.48Å; V539-Y543 PolarHBondContact O-N 2.78Å
540	L	94.8	Very high	94.1	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-58.2	-48	177.3	-71.3	162.6	0	0	0	110.8	L478 L486 F487 P490 M536 E537 R542 L544 G545 L548	L478-L540 HydrophobicContact CB-CD2 4.06Å; L478-L540 HydrophobicContact CD1-CD2 3.97Å; L478-L540 HydrophobicContact CD1-CG 4.46Å; L486-L540 HydrophobicContact CD1-CD2 3.67Å; L486-L540 HydrophobicContact CD2-CD2 4.15Å; L486-L540 HydrophobicContact CG-CD2 3.84Å; F487-L540 HydrophobicContact CB-CD1 3.85Å; F487-L540 HydrophobicContact CB-CD2 4.45Å; P490-L540 HydrophobicContact CG-CD1 4.04Å; M536-L540 WeakPolarHBondContact O-CB 3.13Å; M536-L540 VanDerWaalsContact O-CD1 3.31Å; M536-L540 WeakPolarHBondContact O-CD1 3.39Å; M536-L540 WeakPolarHBondContact O-CG 3.44Å; M536-L540 PolarHBondContact O-N 3.45Å; E537-L540 PolarHBondContact O-N 3.45Å; L540-R542 VanDerWaalsContact C-N 3.33Å; L540-R542 PolarHBondContact O-N 2.83Å; L540-L544 HydrophobicContact CD2-CD1 4.47Å; L540-L544 CarbonylContact O-C 3.39Å; L540-L544 WeakPolarHBondContact O-CA 3.36Å; L540-L544 PolarHBondContact O-N 3.15Å; L540-G545 PolarHBondContact O-N 3.29Å; L540-L548 HydrophobicContact CB-CD1 4.43Å; L540-L548 HydrophobicContact CB-CD2 4.05Å
541	Q	94	Very high	94.6	Very high	120 Å²	120	54 Å²	54	56%	0.561	26%	0.262	S	S	*	.	H	α-helix	trans	-68.8	-28.9	-177.2	-174.9	57.6	88.6	0	0	113.2	E537 V539 L548	E537-Q541 WeakPolarHBondContact O-CB 3.22Å; E537-Q541 PolarHBondContact O-N 2.84Å; V539-Q541 VanDerWaalsContact C-N 3.35Å; V539-Q541 PolarHBondContact O-N 3.01Å; Q541-L548 HydrophobicContact CB-CD2 4.26Å
542	R	91.6	Very high	94.8	Very high	107 Å²	107	53.9 Å²	53.9	40%	0.404	26%	0.262	S	S	.	.	H	α-helix	trans	-86.7	-33.6	-178.1	-170.2	176.6	-145.2	92.3	8.2	114	E538 V539 L540	E538-R542 WeakPolarHBondContact O-CB 3.28Å; E538-R542 PolarHBondContact O-N 3.32Å; V539-R542 PolarHBondContact O-N 3.47Å; L540-R542 VanDerWaalsContact C-N 3.33Å; L540-R542 PolarHBondContact O-N 2.83Å
543	Y	91.8	Very high	94.8	Very high	58 Å²	58	55.1 Å²	55.1	23%	0.227	27%	0.267	C	S	.	.	H	α-helix	trans	-119.4	-23.3	-170.5	-59.8	-75.1	0	0	0	114.8	L147 F148 V468 L473 V539	L147-Y543 HydrophobicContact CD2-CE2 4.34Å; F148-Y543 HydrophobicContact CE2-CE2 4.27Å; F148-Y543 HydrophobicContact CZ-CE2 4.07Å; V468-Y543 HydrophobicContact CB-CE1 3.72Å; V468-Y543 HydrophobicContact CG1-CD1 4.43Å; V468-Y543 HydrophobicContact CG1-CE1 4.07Å; V468-Y543 HydrophobicContact CG2-CE1 4.32Å; L473-Y543 HydrophobicContact CD2-CD2 4.2Å; L473-Y543 HydrophobicContact CD2-CG 4.03Å; V539-Y543 HydrophobicContact CG1-CD2 4.15Å; V539-Y543 WeakPolarHBondContact O-CD2 3.48Å; V539-Y543 PolarHBondContact O-N 2.78Å
544	L	94	Very high	94.6	Very high	6 Å²	6	57.7 Å²	57.7	3%	0.031	28%	0.28	C	S	.	.	S	Bend	trans	-128.5	42.1	-179.5	-61.7	176.3	0	0	0	110.6	L478 L486 L540 D546 E547 L548	L478-L544 HydrophobicContact CB-CD1 4.34Å; L478-L544 HydrophobicContact CD1-CD1 3.86Å; L486-L544 HydrophobicContact CD1-CD1 3.68Å; L540-L544 HydrophobicContact CD2-CD1 4.47Å; L540-L544 CarbonylContact O-C 3.39Å; L540-L544 WeakPolarHBondContact O-CA 3.36Å; L540-L544 PolarHBondContact O-N 3.15Å; L544-D546 PolarHBondContact O-N 3.36Å; L544-E547 VanDerWaalsContact C-OE2 3.23Å; L544-E547 VanDerWaalsContact CA-OE2 3.3Å; L544-E547 WeakPolarHBondContact CA-OE2 3.34Å; L544-L548 WeakPolarHBondContact O-CB 3.39Å; L544-L548 PolarHBondContact O-N 3.4Å
545	G	94	Very high	94.4	Very high	22 Å²	22	55.1 Å²	55.1	23%	0.227	27%	0.269	C	S	.	.	H	α-helix	trans	-67.4	-35.6	-168.9	0	0	0	0	0	114.1	L540 A549	L540-G545 PolarHBondContact O-N 3.29Å; G545-A549 WeakPolarHBondContact O-CB 3.35Å; G545-A549 PolarHBondContact O-N 3.03Å
546	D	94.3	Very high	94.2	Very high	125 Å²	125	59.3 Å²	59.3	67%	0.668	29%	0.288	S	S	*	.	H	α-helix	trans	-74.9	-40.9	179	-74.3	-19.6	0	0	0	110.8	L544 A549 E550	L544-D546 PolarHBondContact O-N 3.36Å; D546-A549 PolarHBondContact O-N 2.82Å; D546-E550 PolarHBondContact O-N 2.68Å
547	E	95.2	Very high	94	Very high	89 Å²	89	64.3 Å²	64.3	42%	0.416	31%	0.312	S	S	.	.	H	α-helix	trans	-65.7	-38.2	173.6	-59.9	84.8	169.3	0	0	111.7	L486 L544 R551	L486-E547 HydrophobicContact CD2-CB 3.79Å; L544-E547 VanDerWaalsContact C-OE2 3.23Å; L544-E547 VanDerWaalsContact CA-OE2 3.3Å; L544-E547 WeakPolarHBondContact CA-OE2 3.34Å; E547-R551 WeakPolarHBondContact O-CB 3.11Å; E547-R551 PolarHBondContact O-N 2.99Å
548	L	95.8	Very high	93.7	Very high	25 Å²	25	64.9 Å²	64.9	13%	0.131	32%	0.315	C	S	.	.	H	α-helix	trans	-65	-38.7	173.4	-177.4	65.8	0	0	0	111.4	L486 Y488 L540 Q541 L544 R551 K552	L486-L548 HydrophobicContact CD2-CB 4.3Å; Y488-L548 HydrophobicContact CD2-CD1 4.46Å; L540-L548 HydrophobicContact CB-CD1 4.43Å; L540-L548 HydrophobicContact CB-CD2 4.05Å; Q541-L548 HydrophobicContact CB-CD2 4.26Å; L544-L548 WeakPolarHBondContact O-CB 3.39Å; L544-L548 PolarHBondContact O-N 3.4Å; L548-R551 PolarHBondContact O-N 3.17Å; L548-K552 VanDerWaalsContact O-CB 3.27Å; L548-K552 WeakPolarHBondContact O-CB 3.3Å; L548-K552 PolarHBondContact O-N 2.76Å
549	A	96.1	Very high	93.4	Very high	57 Å²	57	61.4 Å²	61.4	47%	0.471	30%	0.298	S	S	.	.	H	α-helix	trans	-65.2	-45.9	176.8	0	0	0	0	0	112	G545 D546 K552 K553	G545-A549 WeakPolarHBondContact O-CB 3.35Å; G545-A549 PolarHBondContact O-N 3.03Å; D546-A549 PolarHBondContact O-N 2.82Å; A549-K552 WeakPolarHBondContact O-CB 3.28Å; A549-K552 PolarHBondContact O-N 2.98Å; A549-K553 PolarHBondContact O-N 3.24Å
550	E	95.6	Very high	93.2	Very high	87 Å²	87	68.9 Å²	68.9	41%	0.407	33%	0.331	S	S	.	.	H	α-helix	trans	-68	-39.4	174.7	-177.4	57.9	-156.7	0	0	111.4	D546 K552 K553 I554	D546-E550 PolarHBondContact O-N 2.68Å; E550-K552 VanDerWaalsContact C-N 3.26Å; E550-K552 PolarHBondContact O-N 2.81Å; E550-K553 PolarHBondContact O-N 3.46Å; E550-K553 IonicContact OE1-NZ 3.5Å; E550-K553 PolarHBondContact OE1-NZ 3.44Å; E550-K553 IonicContact OE2-NZ 2.72Å; E550-K553 PolarHBondContact OE2-NZ 2.97Å; E550-I554 HydrophobicContact CG-CD1 4.12Å; E550-I554 WeakPolarHBondContact O-CG1 3.41Å; E550-I554 PolarHBondContact O-N 3.29Å
551	R	95.2	Very high	92.9	Very high	21 Å²	21	73.6 Å²	73.6	8%	0.079	35%	0.353	C	S	.	.	H	α-helix	trans	-58.9	-37.3	173.9	175.2	62.4	-165.3	102.1	-5.8	112.2	L486 Y488 E547 L548 H555	L486-R551 HydrophobicContact CB-CG 4.46Å; L486-R551 HydrophobicContact CD2-CB 4.44Å; L486-R551 PolarHBondContact O-NE 3.31Å; Y488-R551 HydrophobicContact CD2-CG 4.27Å; Y488-R551 HydrophobicContact CG-CG 4.47Å; E547-R551 WeakPolarHBondContact O-CB 3.11Å; E547-R551 PolarHBondContact O-N 2.99Å; L548-R551 PolarHBondContact O-N 3.17Å; R551-H555 PolarHBondContact O-N 2.86Å
552	K	95.1	Very high	92.5	Very high	100 Å²	100	69.4 Å²	69.4	44%	0.435	33%	0.334	S	S	.	.	H	α-helix	trans	-69.6	-47.4	174.1	177.9	176.3	168.6	-179.4	0	111.6	Y488 L548 A549 E550 I554 H555 E556	Y488-K552 HydrophobicContact CD2-CB 4.42Å; Y488-K552 HydrophobicContact CE2-CB 3.75Å; Y488-K552 HydrophobicContact CE2-CG 3.93Å; L548-K552 VanDerWaalsContact O-CB 3.27Å; L548-K552 WeakPolarHBondContact O-CB 3.3Å; L548-K552 PolarHBondContact O-N 2.76Å; A549-K552 WeakPolarHBondContact O-CB 3.28Å; A549-K552 PolarHBondContact O-N 2.98Å; E550-K552 VanDerWaalsContact C-N 3.26Å; E550-K552 PolarHBondContact O-N 2.81Å; K552-I554 VanDerWaalsContact C-N 3.35Å; K552-I554 PolarHBondContact O-N 3.09Å; K552-H555 CarbonylContact O-C 3.49Å; K552-H555 WeakPolarHBondContact O-CA 3.07Å; K552-H555 WeakPolarHBondContact O-CB 3.41Å; K552-H555 PolarHBondContact O-N 3.38Å; K552-E556 WeakPolarHBondContact CE-OE1 3.48Å; K552-E556 IonicContact NZ-OE1 3.34Å; K552-E556 PolarHBondContact O-N 2.97Å
553	K	95.6	Very high	92.4	Very high	83 Å²	83	66.4 Å²	66.4	36%	0.361	33%	0.33	S	S	.	.	H	α-helix	trans	-56.4	-46.4	176.2	171.1	172.1	144.8	-72.1	0	112	A549 E550 H555 E556 E557	A549-K553 PolarHBondContact O-N 3.24Å; E550-K553 PolarHBondContact O-N 3.46Å; E550-K553 IonicContact OE1-NZ 3.5Å; E550-K553 PolarHBondContact OE1-NZ 3.44Å; E550-K553 IonicContact OE2-NZ 2.72Å; E550-K553 PolarHBondContact OE2-NZ 2.97Å; K553-H555 VanDerWaalsContact C-N 3.26Å; K553-H555 PolarHBondContact O-N 3.47Å; K553-E556 PolarHBondContact O-N 2.9Å; K553-E556 VanDerWaalsContact O-N 3.15Å; K553-E557 VanDerWaalsContact CE-OE1 3.29Å; K553-E557 WeakPolarHBondContact CE-OE1 3.48Å; K553-E557 WeakPolarHBondContact CG-OE1 3.49Å; K553-E557 IonicContact NZ-OE1 3.49Å; K553-E557 WeakPolarHBondContact O-CG 3.41Å; K553-E557 PolarHBondContact O-N 3.2Å
554	I	92.9	Very high	92.3	Very high	53 Å²	53	66.5 Å²	66.5	27%	0.272	33%	0.334	S	S	.	.	H	α-helix	trans	-57	-40.3	173.8	-68.7	165.1	0	0	0	111.1	E550 K552 E557 E558	E550-I554 HydrophobicContact CG-CD1 4.12Å; E550-I554 WeakPolarHBondContact O-CG1 3.41Å; E550-I554 PolarHBondContact O-N 3.29Å; K552-I554 VanDerWaalsContact C-N 3.35Å; K552-I554 PolarHBondContact O-N 3.09Å; I554-E557 PolarHBondContact O-N 3.22Å; I554-E558 HydrophobicContact CG2-CG 4.4Å; I554-E558 WeakPolarHBondContact O-CB 3.27Å; I554-E558 VanDerWaalsContact O-CG 3.25Å; I554-E558 WeakPolarHBondContact O-CG 3.42Å; I554-E558 PolarHBondContact O-N 3.01Å
555	H	91.4	Very high	91.9	Very high	33 Å²	33	67.5 Å²	67.5	15%	0.153	34%	0.34	C	S	.	.	H	α-helix	trans	-68.9	-38.9	177.4	-174.1	58.6	0	0	0	112.7	Y488 K502 R551 K552 K553 E557 E558 M559	Y488-H555 HydrophobicContact CE1-CB 4.31Å; Y488-H555 AromaticContact CE1-CD2 3.49Å; Y488-H555 VanDerWaalsContact CE1-CD2 3.49Å; Y488-H555 WeakPolarHBondContact CE1-CD2 3.37Å; Y488-H555 AromaticContact CE1-CG 3.85Å; Y488-H555 AromaticContact CZ-CD2 3.93Å; K502-H555 WeakPolarHBondContact CD-CE1 3.01Å; K502-H555 WeakPolarHBondContact CE-CE1 3.28Å; K502-H555 WeakPolarHBondContact CE-NE2 3.43Å; K502-H555 PolarHBondContact NZ-CE1 3.44Å; K502-H555 PolarHBondContact NZ-NE2 2.76Å; R551-H555 PolarHBondContact O-N 2.86Å; K552-H555 CarbonylContact O-C 3.49Å; K552-H555 WeakPolarHBondContact O-CA 3.07Å; K552-H555 WeakPolarHBondContact O-CB 3.41Å; K552-H555 PolarHBondContact O-N 3.38Å; K553-H555 VanDerWaalsContact C-N 3.26Å; K553-H555 PolarHBondContact O-N 3.47Å; H555-E557 VanDerWaalsContact C-N 3.34Å; H555-E558 IonicContact ND1-OE2 2.69Å; H555-E558 PolarHBondContact O-N 3.31Å; H555-M559 VanDerWaalsContact CE1-CG 3.43Å; H555-M559 WeakPolarHBondContact CE1-CG 3.48Å; H555-M559 PolarHBondContact CE1-SD 3.29Å; H555-M559 WeakPolarHBondContact NE2-CG 3.39Å; H555-M559 WeakPolarHBondContact O-CB 3.41Å; H555-M559 VanDerWaalsContact O-CG 3.24Å; H555-M559 WeakPolarHBondContact O-CG 3.26Å; H555-M559 PolarHBondContact O-N 3.01Å
556	E	91.4	Very high	91.5	Very high	106 Å²	106	70.4 Å²	70.4	50%	0.495	35%	0.35	S	S	.	.	H	α-helix	trans	-66.2	-36.5	175.4	-69.9	175.2	179.7	0	0	111.7	K552 K553 K560	K552-E556 WeakPolarHBondContact CE-OE1 3.48Å; K552-E556 IonicContact NZ-OE1 3.34Å; K552-E556 PolarHBondContact O-N 2.97Å; K553-E556 PolarHBondContact O-N 2.9Å; K553-E556 VanDerWaalsContact O-N 3.15Å; E556-K560 WeakPolarHBondContact O-CB 3.46Å; E556-K560 PolarHBondContact O-N 3.4Å
557	E	92.1	Very high	91.2	Very high	105 Å²	105	69.2 Å²	69.2	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-66.6	-47.5	171.9	-70.9	170.8	-175.5	0	0	111.8	K553 I554 H555 M559 K560 E561	K553-E557 VanDerWaalsContact CE-OE1 3.29Å; K553-E557 WeakPolarHBondContact CE-OE1 3.48Å; K553-E557 WeakPolarHBondContact CG-OE1 3.49Å; K553-E557 IonicContact NZ-OE1 3.49Å; K553-E557 WeakPolarHBondContact O-CG 3.41Å; K553-E557 PolarHBondContact O-N 3.2Å; I554-E557 PolarHBondContact O-N 3.22Å; H555-E557 VanDerWaalsContact C-N 3.34Å; E557-M559 PolarHBondContact O-N 3.04Å; E557-K560 PolarHBondContact O-N 3.12Å; E557-E561 PolarHBondContact O-N 2.9Å
558	E	89.2	Confident	90.9	Very high	65 Å²	65	67.1 Å²	67.1	30%	0.304	33%	0.33	S	S	.	.	H	α-helix	trans	-56.3	-44.6	173.9	-76.4	170.4	164.1	0	0	111.8	R485 I554 H555 L562	R485-E558 IonicContact CZ-OE1 2.79Å; R485-E558 IonicContact NH1-OE1 3.51Å; R485-E558 PolarHBondContact NH1-OE1 3.23Å; R485-E558 IonicContact NH1-OE2 2.71Å; R485-E558 IonicContact NH2-OE1 3.58Å; R485-E558 PolarHBondContact NH2-OE1 3.3Å; I554-E558 HydrophobicContact CG2-CG 4.4Å; I554-E558 WeakPolarHBondContact O-CB 3.27Å; I554-E558 VanDerWaalsContact O-CG 3.25Å; I554-E558 WeakPolarHBondContact O-CG 3.42Å; I554-E558 PolarHBondContact O-N 3.01Å; H555-E558 IonicContact ND1-OE2 2.69Å; H555-E558 PolarHBondContact O-N 3.31Å; E558-L562 WeakPolarHBondContact O-CG 3.33Å; E558-L562 PolarHBondContact O-N 2.95Å
559	M	87.5	Confident	90.9	Very high	26 Å²	26	66 Å²	66	13%	0.128	32%	0.324	C	S	.	.	H	α-helix	trans	-69.6	-36.7	177.7	-70.3	-61.5	-54.5	0	0	112.8	K502 H555 E557 L562 S563 E601 T602	K502-M559 PolarHBondContact NZ-SD 3.28Å; H555-M559 VanDerWaalsContact CE1-CG 3.43Å; H555-M559 WeakPolarHBondContact CE1-CG 3.48Å; H555-M559 PolarHBondContact CE1-SD 3.29Å; H555-M559 WeakPolarHBondContact NE2-CG 3.39Å; H555-M559 WeakPolarHBondContact O-CB 3.41Å; H555-M559 VanDerWaalsContact O-CG 3.24Å; H555-M559 WeakPolarHBondContact O-CG 3.26Å; H555-M559 PolarHBondContact O-N 3.01Å; E557-M559 PolarHBondContact O-N 3.04Å; M559-L562 PolarHBondContact O-N 3.17Å; M559-S563 PolarHBondContact O-N 3.22Å; M559-E601 HydrophobicContact CE-CB 3.82Å; M559-T602 HydrophobicContact CE-CG2 3.63Å
560	K	89.2	Confident	90.9	Very high	158 Å²	158	63.9 Å²	63.9	69%	0.687	31%	0.306	S	S	*	.	H	α-helix	trans	-67.4	-38.9	177.8	-177.7	177.5	177.9	-178.2	0	111.7	E556 E557 S563	E556-K560 WeakPolarHBondContact O-CB 3.46Å; E556-K560 PolarHBondContact O-N 3.4Å; E557-K560 PolarHBondContact O-N 3.12Å; K560-S563 PolarHBondContact O-N 2.96Å; K560-S563 PolarHBondContact O-OG 3.21Å
561	E	88.4	Confident	90.9	Very high	100 Å²	100	59.7 Å²	59.7	47%	0.467	29%	0.286	S	S	.	.	H	α-helix	trans	-58.7	-51.7	171.6	-173.6	-178.6	102.4	0	0	110.8	E557 S563 N564 R656	E557-E561 PolarHBondContact O-N 2.9Å; E561-S563 PolarHBondContact O-N 3.42Å; E561-N564 VanDerWaalsContact O-CB 3.23Å; E561-N564 WeakPolarHBondContact O-CB 3.43Å; E561-N564 PolarHBondContact O-N 3.43Å; E561-R656 IonicContact OE1-CZ 3.69Å; E561-R656 IonicContact OE1-NH1 2.85Å; E561-R656 PolarHBondContact OE1-NH1 2.71Å; E561-R656 IonicContact OE1-NH2 2.84Å; E561-R656 PolarHBondContact OE1-NH2 2.97Å
562	L	86	Confident	91	Very high	31 Å²	31	59.5 Å²	59.5	16%	0.162	29%	0.286	C	S	.	.	H	α-helix	trans	-63.5	-19.6	178.3	-70.9	169.2	0	0	0	114.2	E558 M559 N564 T602	E558-L562 WeakPolarHBondContact O-CG 3.33Å; E558-L562 PolarHBondContact O-N 2.95Å; M559-L562 PolarHBondContact O-N 3.17Å; L562-N564 VanDerWaalsContact C-N 3.28Å; L562-T602 HydrophobicContact CB-CG2 3.76Å
563	S	89.3	Confident	91	Very high	45 Å²	45	56.1 Å²	56.1	32%	0.315	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-6.1	174.4	76.7	0	0	0	0	114.1	M559 K560 E561 L565 T604	M559-S563 PolarHBondContact O-N 3.22Å; K560-S563 PolarHBondContact O-N 2.96Å; K560-S563 PolarHBondContact O-OG 3.21Å; E561-S563 PolarHBondContact O-N 3.42Å; S563-L565 PolarHBondContact O-N 2.91Å; S563-T604 WeakPolarHBondContact O-CG2 3.23Å
564	N	89.1	Confident	90.9	Very high	60 Å²	60	55.4 Å²	55.4	32%	0.321	28%	0.278	S	S	.	.			trans	-81.3	84.5	-173.1	-166.7	-27.3	0	0	0	113.1	E561 L562 N566 Q567 E568	E561-N564 VanDerWaalsContact O-CB 3.23Å; E561-N564 WeakPolarHBondContact O-CB 3.43Å; E561-N564 PolarHBondContact O-N 3.43Å; L562-N564 VanDerWaalsContact C-N 3.28Å; N564-N566 PolarHBondContact O-N 2.9Å; N564-N566 PolarHBondContact OD1-N 3.41Å; N564-Q567 PolarHBondContact O-N 2.91Å; N564-Q567 VanDerWaalsContact O-N 3.08Å; N564-Q567 PolarHBondContact OD1-N 3.32Å; N564-E568 PolarHBondContact O-N 3.46Å; N564-E568 VanDerWaalsContact O-N 3.16Å
565	L	86.6	Confident	90.9	Very high	27 Å²	27	55.9 Å²	55.9	14%	0.141	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	11.4	176.4	-60.7	179.8	0	0	0	116	S563 V569 T604 Q606	S563-L565 PolarHBondContact O-N 2.91Å; L565-V569 VanDerWaalsContact C-CG2 3.45Å; L565-V569 WeakPolarHBondContact O-CG2 3.39Å; L565-T604 HydrophobicContact CD1-CG2 4.22Å; L565-T604 HydrophobicContact CD2-CG2 4.07Å; L565-T604 HydrophobicContact CG-CG2 3.98Å; L565-Q606 HydrophobicContact CD1-CB 3.9Å; L565-Q606 HydrophobicContact CD2-CB 4.32Å
566	N	86.2	Confident	91	Very high	82 Å²	82	55.6 Å²	55.6	44%	0.439	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-27.5	168.3	-72.9	-56.7	0	0	0	113.1	N564 K663 I664 Y666	N564-N566 PolarHBondContact O-N 2.9Å; N564-N566 PolarHBondContact OD1-N 3.41Å; N566-K663 WeakPolarHBondContact O-CA 3.42Å; N566-K663 WeakPolarHBondContact O-CG 3.02Å; N566-I664 PolarHBondContact O-N 3.3Å; N566-Y666 WeakPolarHBondContact OD1-CE2 3.31Å
567	Q	87.8	Confident	91.2	Very high	100 Å²	100	50.9 Å²	50.9	47%	0.467	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-33.1	-171.2	-62.2	-145.8	92.7	0	0	114.6	N564	N564-Q567 PolarHBondContact O-N 2.91Å; N564-Q567 VanDerWaalsContact O-N 3.08Å; N564-Q567 PolarHBondContact OD1-N 3.32Å
568	E	88.5	Confident	91.4	Very high	46 Å²	46	46.1 Å²	46.1	22%	0.215	24%	0.24	C	C	.	.	S	Bend	trans	-130.3	47.3	179.5	-66	-150.7	137.9	0	0	111.9	N564 P570 R656	N564-E568 PolarHBondContact O-N 3.46Å; N564-E568 VanDerWaalsContact O-N 3.16Å; E568-P570 VanDerWaalsContact O-CD 3.27Å; E568-P570 WeakPolarHBondContact O-CD 3.5Å; E568-P570 VanDerWaalsContact O-N 3.14Å; E568-R656 VanDerWaalsContact CD-NH2 3.3Å; E568-R656 IonicContact OE1-CZ 3.82Å; E568-R656 IonicContact OE1-NE 3.81Å; E568-R656 PolarHBondContact OE1-NE 2.99Å; E568-R656 IonicContact OE1-NH1 2.75Å; E568-R656 IonicContact OE1-NH2 3.66Å; E568-R656 PolarHBondContact OE1-NH2 3.5Å; E568-R656 IonicContact OE2-CZ 3.16Å; E568-R656 IonicContact OE2-NE 2.71Å; E568-R656 PolarHBondContact OE2-NE 3.48Å; E568-R656 VanDerWaalsContact OE2-NE 3.16Å; E568-R656 IonicContact OE2-NH1 3.05Å; E568-R656 PolarHBondContact OE2-NH1 3.2Å; E568-R656 IonicContact OE2-NH2 3.22Å; E568-R656 PolarHBondContact OE2-NH2 2.8Å
569	V	94.9	Very high	91.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	121.3	177.7	177.5	0	0	0	0	109.3	L565 I571 M624 T661 A662 I664	L565-V569 VanDerWaalsContact C-CG2 3.45Å; L565-V569 WeakPolarHBondContact O-CG2 3.39Å; V569-I571 HydrophobicContact CB-CD1 4.37Å; V569-I571 HydrophobicContact CG1-CD1 3.79Å; V569-I571 PolarHBondContact O-N 3.33Å; V569-M624 HydrophobicContact CG1-CE 3.62Å; V569-M624 HydrophobicContact CG1-SD 4.21Å; V569-M624 HydrophobicContact CG2-CE 4.02Å; V569-T661 CarbonylContact O-C 3.58Å; V569-T661 WeakPolarHBondContact O-CA 3.42Å; V569-A662 WeakPolarHBondContact CB-O 3.46Å; V569-A662 PolarHBondContact N-O 3.45Å; V569-A662 PolarHBondContact O-N 2.7Å; V569-I664 HydrophobicContact CB-CG2 4.25Å; V569-I664 HydrophobicContact CG2-CD1 3.74Å; V569-I664 HydrophobicContact CG2-CG1 3.72Å; V569-I664 HydrophobicContact CG2-CG2 4.03Å
570	P	96.3	Very high	91.9	Very high	13 Å²	13	45 Å²	45	8%	0.084	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	129.1	171.4	22.8	-28.3	0	0	0	109.8	E568 M595 F607 G608 Y659	E568-P570 VanDerWaalsContact O-CD 3.27Å; E568-P570 WeakPolarHBondContact O-CD 3.5Å; E568-P570 VanDerWaalsContact O-N 3.14Å; P570-M595 HydrophobicContact CB-CG 3.46Å; P570-M595 VanDerWaalsContact CB-CG 3.46Å; P570-M595 HydrophobicContact CB-SD 3.86Å; P570-M595 HydrophobicContact CG-CG 4.43Å; P570-F607 HydrophobicContact CB-CB 4.26Å; P570-F607 HydrophobicContact CG-CB 3.74Å; P570-F607 WeakPolarHBondContact O-CB 3.35Å; P570-G608 PolarHBondContact O-N 2.82Å; P570-Y659 HydrophobicContact CB-CD2 4.27Å; P570-Y659 HydrophobicContact CB-CE2 3.84Å
571	I	96.9	Very high	92.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	116	-178	-56.6	-61.8	0	0	0	110.6	V569 V573 G608 C610 F618 F648 N660 A662	V569-I571 HydrophobicContact CB-CD1 4.37Å; V569-I571 HydrophobicContact CG1-CD1 3.79Å; V569-I571 PolarHBondContact O-N 3.33Å; I571-V573 HydrophobicContact CG2-CG2 4.01Å; I571-G608 CarbonylContact C-O 3.6Å; I571-G608 WeakPolarHBondContact CA-O 3.5Å; I571-C610 HydrophobicContact CG2-CB 4.13Å; I571-F618 HydrophobicContact CB-CE2 4.41Å; I571-F618 HydrophobicContact CB-CZ 4.42Å; I571-F618 HydrophobicContact CG1-CE2 3.96Å; I571-F618 HydrophobicContact CG1-CZ 4.05Å; I571-F618 HydrophobicContact CG2-CD2 3.9Å; I571-F618 HydrophobicContact CG2-CE2 4Å; I571-F618 HydrophobicContact CG2-CG 4.18Å; I571-F618 HydrophobicContact CG2-CZ 4.38Å; I571-F648 HydrophobicContact CD1-CE2 4.16Å; I571-F648 HydrophobicContact CD1-CZ 3.82Å; I571-N660 HydrophobicContact CB-CB 4.08Å; I571-N660 PolarHBondContact N-O 3.01Å; I571-A662 HydrophobicContact CD1-CB 3.91Å; I571-A662 HydrophobicContact CG1-CB 3.75Å
572	F	97.1	Very high	92.4	Very high	16 Å²	16	36.2 Å²	36.2	7%	0.07	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	129.3	164.2	-158.3	-83.6	0	0	0	108.7	C574 L585 V587 Y592 M595 F607 G608 M609 C610	F572-C574 HydrophobicContact CD1-CB 3.71Å; F572-C574 HydrophobicContact CE1-CB 3.6Å; F572-L585 HydrophobicContact CD1-CD1 4.45Å; F572-L585 HydrophobicContact CE1-CD1 4.34Å; F572-L585 HydrophobicContact CZ-CD1 4.4Å; F572-V587 HydrophobicContact CE2-CG1 4.3Å; F572-V587 HydrophobicContact CE2-CG2 3.9Å; F572-V587 HydrophobicContact CZ-CG2 4.26Å; F572-Y592 AromaticContact CD2-CD1 3.69Å; F572-Y592 HydrophobicContact CD2-CD1 3.69Å; F572-Y592 HydrophobicContact CD2-CD2 4.14Å; F572-Y592 HydrophobicContact CD2-CE1 4.06Å; F572-Y592 HydrophobicContact CD2-CE2 4.47Å; F572-Y592 AromaticContact CD2-CG 3.74Å; F572-Y592 HydrophobicContact CD2-CG 3.74Å; F572-Y592 HydrophobicContact CE2-CD1 4.07Å; F572-Y592 AromaticContact CE2-CD2 3.73Å; F572-Y592 HydrophobicContact CE2-CD2 3.73Å; F572-Y592 HydrophobicContact CE2-CE2 4.3Å; F572-Y592 AromaticContact CE2-CG 3.6Å; F572-Y592 HydrophobicContact CE2-CG 3.6Å; F572-Y592 HydrophobicContact CG-CD1 4.44Å; F572-Y592 HydrophobicContact CG-CE1 4.37Å; F572-Y592 HydrophobicContact CZ-CD2 4.18Å; F572-Y592 HydrophobicContact CZ-CG 4.48Å; F572-M595 HydrophobicContact CB-CE 4.24Å; F572-M595 HydrophobicContact CB-SD 4.47Å; F572-M595 HydrophobicContact CD2-CE 3.93Å; F572-M595 HydrophobicContact CD2-SD 4.48Å; F572-F607 HydrophobicContact CB-CD2 3.81Å; F572-F607 HydrophobicContact CB-CE2 3.7Å; F572-F607 HydrophobicContact CD2-CE2 4.46Å; F572-F607 HydrophobicContact CG-CE2 4.23Å; F572-G608 PolarHBondContact N-O 2.91Å; F572-M609 HydrophobicContact CB-CE 4.15Å; F572-M609 HydrophobicContact CB-SD 4.24Å; F572-M609 HydrophobicContact CD1-CE 3.51Å; F572-M609 HydrophobicContact CD1-SD 3.8Å; F572-M609 HydrophobicContact CE1-CE 4.19Å; F572-M609 HydrophobicContact CG-CE 4.09Å; F572-M609 HydrophobicContact CG-SD 4.48Å; F572-M609 WeakPolarHBondContact O-CA 3.48Å; F572-C610 PolarHBondContact O-N 3.21Å; F572-C610 VanDerWaalsContact O-N 3.08Å
573	V	95.6	Very high	92.8	Very high	29 Å²	29	35.6 Å²	35.6	18%	0.176	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	108.4	-179	-174.1	0	0	0	0	109.3	I571 Y592 C610 A612 F618 N660	I571-V573 HydrophobicContact CG2-CG2 4.01Å; V573-Y592 PolarHBondContact N-OH 2.81Å; V573-C610 WeakPolarHBondContact CA-O 3.36Å; V573-A612 HydrophobicContact CG1-CB 3.8Å; V573-F618 HydrophobicContact CG1-CB 4.17Å; V573-F618 HydrophobicContact CG2-CB 3.77Å; V573-F618 HydrophobicContact CG2-CD1 4.4Å; V573-F618 HydrophobicContact CG2-CG 4.29Å; V573-N660 WeakPolarHBondContact CG2-ND2 3.43Å
574	C	93.3	Very high	93	Very high	68 Å²	68	37.2 Å²	37.2	46%	0.459	21%	0.214	S	C	.	.	S	Bend	trans	-155.7	-80.7	-177	-168.9	0	0	0	0	113.5	F572 M609 C610	F572-C574 HydrophobicContact CD1-CB 3.71Å; F572-C574 HydrophobicContact CE1-CB 3.6Å; C574-M609 HydrophobicContact CB-CE 4.41Å; C574-M609 HydrophobicContact CB-SD 3.86Å; C574-C610 PolarHBondContact N-O 3.36Å
575	T	91.9	Very high	93.3	Very high	64 Å²	64	35.1 Å²	35.1	39%	0.393	20%	0.202	S	C	.	.	S	Bend	trans	-132	168.4	-168.9	45.4	0	0	0	0	111.9	A577 M609	T575-A577 PolarHBondContact O-N 2.94Å; T575-M609 VanDerWaalsContact O-CG 3.29Å; T575-M609 WeakPolarHBondContact O-CG 3.4Å
576	M	93.7	Very high	93.6	Very high	26 Å²	26	38 Å²	38	13%	0.128	22%	0.215	C	C	.	.			trans	-68.5	123.5	171.1	-71.4	-59.8	-55.2	0	0	110	F578 I611 N741 Q744 L745 L748	M576-F578 HydrophobicContact CB-CE2 3.99Å; M576-F578 HydrophobicContact CB-CZ 4Å; M576-F578 HydrophobicContact CE-CE1 4.21Å; M576-F578 HydrophobicContact CE-CZ 4.29Å; M576-I611 HydrophobicContact CB-CG2 4.49Å; M576-I611 HydrophobicContact CG-CG2 3.74Å; M576-I611 HydrophobicContact SD-CB 4.47Å; M576-I611 HydrophobicContact SD-CD1 3.96Å; M576-I611 HydrophobicContact SD-CG1 4.17Å; M576-I611 HydrophobicContact SD-CG2 3.55Å; M576-I611 VanDerWaalsContact SD-CG2 3.55Å; M576-N741 HydrophobicContact CG-CB 4.23Å; M576-Q744 HydrophobicContact CE-CB 4.11Å; M576-Q744 HydrophobicContact CG-CB 4.07Å; M576-L745 HydrophobicContact CE-CB 4.26Å; M576-L745 HydrophobicContact CE-CD1 4.22Å; M576-L745 HydrophobicContact SD-CB 4.16Å; M576-L745 HydrophobicContact SD-CD1 4.14Å; M576-L748 HydrophobicContact CE-CB 4.34Å; M576-L748 HydrophobicContact CE-CD2 3.99Å
577	A	95.6	Very high	94	Very high	8 Å²	8	34.2 Å²	34.2	7%	0.066	20%	0.195	C	C	.	.			trans	-110.3	155.2	166.6	0	0	0	0	0	110.3	T575 M609 C623 L625	T575-A577 PolarHBondContact O-N 2.94Å; A577-M609 HydrophobicContact CB-CB 3.97Å; A577-M609 HydrophobicContact CB-CG 3.82Å; A577-C623 HydrophobicContact CB-CB 4Å; A577-C623 WeakPolarHBondContact O-CB 3.49Å; A577-L625 HydrophobicContact CB-CD2 3.77Å; A577-L625 HydrophobicContact CB-CG 4.47Å
578	F	95.9	Very high	94.1	Very high	5 Å²	5	35 Å²	35	2%	0.022	20%	0.196	C	C	.	.			trans	-138.3	149.7	-177.4	-55.5	-87.3	0	0	0	110.8	M576 I581 G644 W731 L734 A735 Q744 L748	M576-F578 HydrophobicContact CB-CE2 3.99Å; M576-F578 HydrophobicContact CB-CZ 4Å; M576-F578 HydrophobicContact CE-CE1 4.21Å; M576-F578 HydrophobicContact CE-CZ 4.29Å; F578-I581 HydrophobicContact CB-CB 4.46Å; F578-I581 HydrophobicContact CB-CG1 3.96Å; F578-I581 PolarHBondContact O-N 2.93Å; F578-G644 WeakPolarHBondContact O-CA 3.37Å; F578-W731 HydrophobicContact CB-CB 4.05Å; F578-W731 HydrophobicContact CB-CE3 4.38Å; F578-W731 AromaticContact CD1-CE3 3.87Å; F578-W731 HydrophobicContact CD1-CE3 3.87Å; F578-W731 HydrophobicContact CD1-CZ3 4.35Å; F578-L734 HydrophobicContact CD1-CB 4.34Å; F578-L734 HydrophobicContact CE1-CB 3.96Å; F578-L734 HydrophobicContact CZ-CB 4.23Å; F578-A735 HydrophobicContact CD2-CB 3.85Å; F578-A735 HydrophobicContact CE2-CB 4.03Å; F578-Q744 HydrophobicContact CE1-CB 4.34Å; F578-Q744 HydrophobicContact CZ-CB 3.93Å; F578-Q744 HydrophobicContact CZ-CG 3.98Å; F578-L748 HydrophobicContact CD1-CD1 3.69Å; F578-L748 HydrophobicContact CE1-CD1 4.23Å
579	P	95.6	Very high	94.2	Very high	1 Å²	1	36 Å²	36	1%	0.006	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-51.8	143.3	172.8	-26.9	35.1	0	0	0	112.8	I581 G644 R647 E725 W731	P579-I581 PolarHBondContact O-N 3.3Å; P579-G644 CarbonylContact C-O 3.47Å; P579-G644 WeakPolarHBondContact CA-O 3.47Å; P579-R647 HydrophobicContact CG-CG 3.75Å; P579-E725 HydrophobicContact CB-CB 4.01Å; P579-E725 HydrophobicContact CB-CG 4.06Å; P579-E725 HydrophobicContact CG-CB 4.12Å; P579-E725 HydrophobicContact CG-CG 4.07Å; P579-W731 HydrophobicContact CB-CG 4.23Å; P579-W731 HydrophobicContact CG-CD2 4.32Å; P579-W731 HydrophobicContact CG-CG 4.44Å; P579-W731 WeakPolarHBondContact O-CB 3.47Å
580	T	92.9	Very high	93.8	Very high	65 Å²	65	38 Å²	38	40%	0.399	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	-3.3	-176.2	72	0	0	0	0	116.9	I643 G644 A728	T580-I643 WeakPolarHBondContact O-CD1 3.24Å; T580-G644 PolarHBondContact N-O 3.49Å; T580-A728 HydrophobicContact CG2-CB 3.99Å
581	I	94	Very high	93.5	Very high	16 Å²	16	41.1 Å²	41.1	8%	0.082	22%	0.224	C	C	.	.			trans	-96.8	128.2	-175.8	-52.7	-51.4	0	0	0	111.5	F578 P579 G644 F710 W731 W732 A735	F578-I581 HydrophobicContact CB-CB 4.46Å; F578-I581 HydrophobicContact CB-CG1 3.96Å; F578-I581 PolarHBondContact O-N 2.93Å; P579-I581 PolarHBondContact O-N 3.3Å; I581-G644 PolarHBondContact O-N 3.03Å; I581-F710 HydrophobicContact CG2-CD1 4.28Å; I581-W731 HydrophobicContact CG1-CB 4.34Å; I581-W732 HydrophobicContact CD1-CB 3.97Å; I581-A735 HydrophobicContact CG1-CB 4.35Å; I581-A735 HydrophobicContact CG2-CB 4.21Å
582	P	93.6	Very high	93.3	Very high	59 Å²	59	41.4 Å²	41.4	38%	0.383	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-62	139.6	172.5	-23	34.4	0	0	0	112.4	T642	P582-T642 CarbonylContact C-O 3.53Å; P582-T642 VanDerWaalsContact CA-O 3.32Å; P582-T642 WeakPolarHBondContact CA-O 3.43Å
583	C	93.5	Very high	93	Very high	18 Å²	18	42 Å²	42	12%	0.122	23%	0.227	C	C	.	.			trans	-136	82	178.3	-165.8	0	0	0	0	109.7	L585 L625 T642	C583-L585 PolarHBondContact O-N 3.32Å; C583-L625 HydrophobicContact CB-CD1 4.31Å; C583-L625 HydrophobicContact CB-CD2 4.12Å; C583-T642 WeakPolarHBondContact CB-OG1 3.27Å; C583-T642 PolarHBondContact N-O 3.33Å; C583-T642 PolarHBondContact O-OG1 3.36Å
584	P	93.6	Very high	92.6	Very high	79 Å²	79	40.9 Å²	40.9	51%	0.513	22%	0.221	S	C	.	.			trans	-72.9	124.9	177.7	28.8	-33.5	0	0	0	110.6	V640	P584-V640 WeakPolarHBondContact CA-O 3.42Å
585	L	95.2	Very high	92.5	Very high	15 Å²	15	37.7 Å²	37.7	8%	0.079	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	140.7	-176.3	-58.2	178.8	0	0	0	111.8	F572 C583 V587 F607 M609 L625 V639 V640	F572-L585 HydrophobicContact CD1-CD1 4.45Å; F572-L585 HydrophobicContact CE1-CD1 4.34Å; F572-L585 HydrophobicContact CZ-CD1 4.4Å; C583-L585 PolarHBondContact O-N 3.32Å; L585-V587 HydrophobicContact CB-CG2 4.09Å; L585-F607 HydrophobicContact CD1-CE2 4.03Å; L585-F607 HydrophobicContact CD1-CZ 3.7Å; L585-M609 HydrophobicContact CD1-CE 3.65Å; L585-M609 HydrophobicContact CD2-CE 3.9Å; L585-M609 HydrophobicContact CG-CE 4.4Å; L585-L625 HydrophobicContact CD1-CD1 4.38Å; L585-V639 CarbonylContact O-C 3.55Å; L585-V639 WeakPolarHBondContact O-CA 3.36Å; L585-V640 HydrophobicContact CB-CB 4.46Å; L585-V640 PolarHBondContact N-O 3.27Å; L585-V640 PolarHBondContact O-N 2.95Å
586	H	94.3	Very high	92.5	Very high	89 Å²	89	34.7 Å²	34.7	41%	0.412	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	106.1	167.3	171.5	-128.1	0	0	0	109.1	R637 S638 V639	H586-R637 PolarHBondContact NE2-NH1 2.93Å; H586-S638 CarbonylContact C-O 3.58Å; H586-S638 WeakPolarHBondContact CA-O 3.49Å; H586-V639 HydrophobicContact CB-CG2 4.37Å
587	V	93.3	Very high	92.2	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.012	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	109.5	-171.2	-176.5	0	0	0	0	109.9	F572 L585 R593 I596 R637 S638 V640	F572-V587 HydrophobicContact CE2-CG1 4.3Å; F572-V587 HydrophobicContact CE2-CG2 3.9Å; F572-V587 HydrophobicContact CZ-CG2 4.26Å; L585-V587 HydrophobicContact CB-CG2 4.09Å; V587-R593 HydrophobicContact CG1-CG 4.05Å; V587-I596 HydrophobicContact CG1-CG1 4.37Å; V587-I596 HydrophobicContact CG2-CG1 4.31Å; V587-R637 WeakPolarHBondContact O-CA 3.42Å; V587-S638 PolarHBondContact N-O 2.78Å; V587-S638 PolarHBondContact O-N 3.34Å; V587-V640 HydrophobicContact CG2-CG2 3.86Å
588	F	90.8	Very high	91.8	Very high	115 Å²	115	35.7 Å²	35.7	50%	0.504	18%	0.181	S	C	.	.			trans	-118.2	-26.8	-177.6	60.8	-88.9	0	0	0	114.1	R593 R637	F588-R593 PolarHBondContact O-NE 3.14Å; F588-R637 HydrophobicContact CB-CG 3.83Å
589	E	90	Very high	91.6	Very high	67 Å²	67	35.6 Å²	35.6	31%	0.313	18%	0.181	S	C	.	.	S	Bend	trans	-65.5	132	177.9	-65.8	-173.4	-140.4	0	0	111.9	R591 Y592 R593	E589-R591 VanDerWaalsContact C-N 3.33Å; E589-R591 HydrophobicContact CB-CG 4.38Å; E589-R591 PolarHBondContact O-N 2.89Å; E589-R591 IonicContact OE1-NH2 3.17Å; E589-R591 IonicContact OE2-CZ 2.72Å; E589-R591 IonicContact OE2-NE 2.67Å; E589-R591 PolarHBondContact OE2-NE 2.69Å; E589-R591 IonicContact OE2-NH2 2.8Å; E589-R591 PolarHBondContact OE2-NH2 3.41Å; E589-Y592 HydrophobicContact CB-CD2 3.96Å; E589-Y592 HydrophobicContact CG-CD2 4.36Å; E589-Y592 PolarHBondContact O-N 2.84Å; E589-R593 PolarHBondContact O-N 3.13Å
590	P	87.1	Confident	91.3	Very high	43 Å²	43	38.7 Å²	38.7	28%	0.279	20%	0.196	S	C	.	.	H	α-helix	trans	-50.5	-45.8	-178.2	-28.1	32.4	0	0	0	114.7	H510 Y592 R593 L594	H510-P590 WeakPolarHBondContact ND1-CB 3.34Å; P590-Y592 VanDerWaalsContact C-N 3.3Å; P590-Y592 PolarHBondContact O-N 2.81Å; P590-R593 PolarHBondContact O-N 3.07Å; P590-L594 PolarHBondContact O-N 2.9Å
591	R	90.5	Very high	91	Very high	78 Å²	78	38.7 Å²	38.7	29%	0.294	19%	0.191	S	C	.	.	H	α-helix	trans	-59.3	-38.1	-179.6	61.8	177.3	171.8	160.5	2.2	113	E589 M595 G658 Y659	E589-R591 VanDerWaalsContact C-N 3.33Å; E589-R591 HydrophobicContact CB-CG 4.38Å; E589-R591 PolarHBondContact O-N 2.89Å; E589-R591 IonicContact OE1-NH2 3.17Å; E589-R591 IonicContact OE2-CZ 2.72Å; E589-R591 IonicContact OE2-NE 2.67Å; E589-R591 PolarHBondContact OE2-NE 2.69Å; E589-R591 IonicContact OE2-NH2 2.8Å; E589-R591 PolarHBondContact OE2-NH2 3.41Å; R591-M595 WeakPolarHBondContact O-CB 3.49Å; R591-M595 PolarHBondContact O-N 2.97Å; R591-M595 VanDerWaalsContact O-N 3.09Å; R591-G658 VanDerWaalsContact CD-O 3.24Å; R591-G658 WeakPolarHBondContact CD-O 3.23Å; R591-Y659 WeakPolarHBondContact O-CD1 3.21Å
592	Y	92.3	Very high	90.7	Very high	7 Å²	7	39.2 Å²	39.2	3%	0.027	20%	0.195	C	C	.	.	H	α-helix	trans	-84.3	-25.3	179.9	-65.1	-48.2	0	0	0	112.2	F572 V573 E589 P590 M595 I596	F572-Y592 AromaticContact CD2-CD1 3.69Å; F572-Y592 HydrophobicContact CD2-CD1 3.69Å; F572-Y592 HydrophobicContact CD2-CD2 4.14Å; F572-Y592 HydrophobicContact CD2-CE1 4.06Å; F572-Y592 HydrophobicContact CD2-CE2 4.47Å; F572-Y592 AromaticContact CD2-CG 3.74Å; F572-Y592 HydrophobicContact CD2-CG 3.74Å; F572-Y592 HydrophobicContact CE2-CD1 4.07Å; F572-Y592 AromaticContact CE2-CD2 3.73Å; F572-Y592 HydrophobicContact CE2-CD2 3.73Å; F572-Y592 HydrophobicContact CE2-CE2 4.3Å; F572-Y592 AromaticContact CE2-CG 3.6Å; F572-Y592 HydrophobicContact CE2-CG 3.6Å; F572-Y592 HydrophobicContact CG-CD1 4.44Å; F572-Y592 HydrophobicContact CG-CE1 4.37Å; F572-Y592 HydrophobicContact CZ-CD2 4.18Å; F572-Y592 HydrophobicContact CZ-CG 4.48Å; V573-Y592 PolarHBondContact N-OH 2.81Å; E589-Y592 HydrophobicContact CB-CD2 3.96Å; E589-Y592 HydrophobicContact CG-CD2 4.36Å; E589-Y592 PolarHBondContact O-N 2.84Å; P590-Y592 VanDerWaalsContact C-N 3.3Å; P590-Y592 PolarHBondContact O-N 2.81Å; Y592-M595 HydrophobicContact CD1-SD 3.89Å; Y592-M595 HydrophobicContact CE1-SD 4.43Å; Y592-M595 WeakPolarHBondContact O-CB 3.4Å; Y592-M595 PolarHBondContact O-N 3.39Å; Y592-I596 WeakPolarHBondContact O-CG1 3.29Å; Y592-I596 PolarHBondContact O-N 2.98Å
593	R	89.4	Confident	90.5	Very high	28 Å²	28	39 Å²	39	11%	0.106	20%	0.204	C	C	.	.	H	α-helix	trans	-64.5	-42.8	169.1	-69.5	-171.6	-85.4	117.8	-15.6	111.9	D509 V587 F588 E589 P590 R597 G636	D509-R593 VanDerWaalsContact CA-NH1 3.26Å; D509-R593 PolarHBondContact O-NH1 2.68Å; D509-R593 PolarHBondContact O-NH2 2.83Å; D509-R593 WeakPolarHBondContact OD1-CB 3.25Å; D509-R593 IonicContact OD1-CZ 3.28Å; D509-R593 IonicContact OD1-NH1 2.76Å; D509-R593 PolarHBondContact OD1-NH1 3.46Å; V587-R593 HydrophobicContact CG1-CG 4.05Å; F588-R593 PolarHBondContact O-NE 3.14Å; E589-R593 PolarHBondContact O-N 3.13Å; P590-R593 PolarHBondContact O-N 3.07Å; R593-R597 PolarHBondContact O-N 3.31Å; R593-G636 VanDerWaalsContact CD-C 3.48Å; R593-G636 WeakPolarHBondContact CD-O 3.45Å
594	L	87.9	Confident	90.5	Very high	6 Å²	6	39.4 Å²	39.4	3%	0.031	21%	0.206	C	C	.	.	H	α-helix	trans	-60.9	-44.9	170	178.8	63.7	0	0	0	111.7	R506 P590 R597 R598 D657 Y659	R506-L594 HydrophobicContact CB-CD1 4.37Å; R506-L594 HydrophobicContact CG-CD1 4.09Å; R506-L594 HydrophobicContact CG-CD2 4.03Å; P590-L594 PolarHBondContact O-N 2.9Å; L594-R597 PolarHBondContact O-N 3.1Å; L594-R598 HydrophobicContact CD1-CG 4.32Å; L594-R598 WeakPolarHBondContact O-CB 3.41Å; L594-R598 WeakPolarHBondContact O-CG 3.42Å; L594-R598 PolarHBondContact O-N 2.8Å; L594-D657 HydrophobicContact CD2-CB 3.54Å; L594-Y659 HydrophobicContact CD2-CE1 4.42Å; L594-Y659 HydrophobicContact CG-CE1 4.48Å
595	M	91.8	Very high	90.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56.8	-50.1	177.4	-168.3	-157.5	82.8	0	0	112	P570 F572 R591 Y592 R598 S599 F607 Y659	P570-M595 HydrophobicContact CB-CG 3.46Å; P570-M595 VanDerWaalsContact CB-CG 3.46Å; P570-M595 HydrophobicContact CB-SD 3.86Å; P570-M595 HydrophobicContact CG-CG 4.43Å; F572-M595 HydrophobicContact CB-CE 4.24Å; F572-M595 HydrophobicContact CB-SD 4.47Å; F572-M595 HydrophobicContact CD2-CE 3.93Å; F572-M595 HydrophobicContact CD2-SD 4.48Å; R591-M595 WeakPolarHBondContact O-CB 3.49Å; R591-M595 PolarHBondContact O-N 2.97Å; R591-M595 VanDerWaalsContact O-N 3.09Å; Y592-M595 HydrophobicContact CD1-SD 3.89Å; Y592-M595 HydrophobicContact CE1-SD 4.43Å; Y592-M595 WeakPolarHBondContact O-CB 3.4Å; Y592-M595 PolarHBondContact O-N 3.39Å; M595-R598 PolarHBondContact O-N 2.62Å; M595-S599 PolarHBondContact O-N 3.05Å; M595-S599 PolarHBondContact O-OG 2.83Å; M595-F607 HydrophobicContact CE-CB 3.91Å; M595-F607 HydrophobicContact CE-CD1 4.12Å; M595-F607 HydrophobicContact CE-CD2 3.55Å; M595-F607 HydrophobicContact CE-CE2 4.05Å; M595-F607 HydrophobicContact CE-CG 3.59Å; M595-Y659 HydrophobicContact CB-CD1 3.98Å; M595-Y659 HydrophobicContact CB-CD2 4.27Å; M595-Y659 HydrophobicContact CB-CE1 4.18Å; M595-Y659 HydrophobicContact CB-CE2 4.48Å; M595-Y659 HydrophobicContact CB-CG 4.04Å; M595-Y659 HydrophobicContact CG-CD1 4.42Å; M595-Y659 HydrophobicContact CG-CD2 3.82Å; M595-Y659 HydrophobicContact CG-CE2 3.96Å; M595-Y659 HydrophobicContact CG-CG 4.09Å; M595-Y659 HydrophobicContact SD-CD2 4.42Å
596	I	91.8	Very high	90.6	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-42.7	178.5	-65.9	-64.4	0	0	0	111.2	V587 Y592 R598 S599 M600 F607 V630 V640	V587-I596 HydrophobicContact CG1-CG1 4.37Å; V587-I596 HydrophobicContact CG2-CG1 4.31Å; Y592-I596 WeakPolarHBondContact O-CG1 3.29Å; Y592-I596 PolarHBondContact O-N 2.98Å; I596-R598 PolarHBondContact O-N 3.42Å; I596-S599 PolarHBondContact O-N 2.98Å; I596-M600 WeakPolarHBondContact O-CG 3.46Å; I596-M600 PolarHBondContact O-N 3Å; I596-M600 VanDerWaalsContact O-N 3.15Å; I596-F607 HydrophobicContact CD1-CD1 3.93Å; I596-F607 HydrophobicContact CD1-CE1 3.55Å; I596-F607 HydrophobicContact CD1-CZ 3.98Å; I596-V630 HydrophobicContact CG2-CG1 4.28Å; I596-V630 HydrophobicContact CG2-CG2 4.46Å; I596-V640 HydrophobicContact CD1-CG1 4.3Å; I596-V640 HydrophobicContact CD1-CG2 4.22Å; I596-V640 HydrophobicContact CG1-CG2 4.2Å; I596-V640 HydrophobicContact CG2-CG2 4.05Å
597	R	87	Confident	90.7	Very high	18 Å²	18	37 Å²	37	7%	0.068	19%	0.186	C	C	.	.	H	α-helix	trans	-60.5	-46.5	176.3	-163.5	-169.2	-60.8	104.1	19.7	110.9	E505 D509 R593 L594 S599 M600 E601	E505-R597 IonicContact OE1-CZ 3.75Å; E505-R597 IonicContact OE1-NE 3.5Å; E505-R597 PolarHBondContact OE1-NE 3.18Å; D509-R597 IonicContact OD1-NH2 2.72Å; D509-R597 PolarHBondContact OD1-NH2 2.72Å; D509-R597 IonicContact OD2-CZ 3.63Å; D509-R597 IonicContact OD2-NH1 2.82Å; D509-R597 PolarHBondContact OD2-NH1 2.75Å; D509-R597 IonicContact OD2-NH2 3.59Å; D509-R597 PolarHBondContact OD2-NH2 3.18Å; R593-R597 PolarHBondContact O-N 3.31Å; L594-R597 PolarHBondContact O-N 3.1Å; R597-S599 PolarHBondContact O-N 3.26Å; R597-M600 CarbonylContact O-C 3.13Å; R597-M600 WeakPolarHBondContact O-CA 3.26Å; R597-M600 WeakPolarHBondContact O-CB 3.46Å; R597-M600 PolarHBondContact O-N 3.25Å; R597-E601 VanDerWaalsContact CD-OE1 3.26Å; R597-E601 WeakPolarHBondContact CD-OE1 3.45Å; R597-E601 HydrophobicContact CG-CG 4.19Å; R597-E601 VanDerWaalsContact CG-OE1 3.27Å; R597-E601 WeakPolarHBondContact CG-OE1 3.35Å; R597-E601 WeakPolarHBondContact O-CG 3.29Å; R597-E601 PolarHBondContact O-N 3.04Å
598	R	88.3	Confident	90.9	Very high	37 Å²	37	36.9 Å²	36.9	14%	0.14	19%	0.185	C	C	.	.	H	α-helix	trans	-57.5	-44.5	176.2	-77.3	177.9	170.7	176.6	-2.2	112.7	L594 M595 I596 M600 E601 T602 D657 Y659	L594-R598 HydrophobicContact CD1-CG 4.32Å; L594-R598 WeakPolarHBondContact O-CB 3.41Å; L594-R598 WeakPolarHBondContact O-CG 3.42Å; L594-R598 PolarHBondContact O-N 2.8Å; M595-R598 PolarHBondContact O-N 2.62Å; I596-R598 PolarHBondContact O-N 3.42Å; R598-M600 PolarHBondContact O-N 3.08Å; R598-E601 PolarHBondContact O-N 2.94Å; R598-T602 WeakPolarHBondContact O-CG2 3.25Å; R598-T602 PolarHBondContact O-N 3.25Å; R598-T602 PolarHBondContact O-OG1 2.8Å; R598-D657 IonicContact CZ-OD2 3.07Å; R598-D657 IonicContact NH1-OD2 3.7Å; R598-D657 PolarHBondContact NH1-OD2 3Å; R598-D657 IonicContact NH2-OD1 3.41Å; R598-D657 PolarHBondContact NH2-OD1 2.87Å; R598-D657 IonicContact NH2-OD2 3.67Å; R598-D657 PolarHBondContact NH2-OD2 2.79Å; R598-Y659 WeakPolarHBondContact CD-OH 3.45Å; R598-Y659 PolarHBondContact NH1-OH 3.23Å
599	S	90.8	Very high	91.3	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-60.3	-30.4	175.2	-63.8	0	0	0	0	113	M595 I596 R597 T602 T604 K605 Q606	M595-S599 PolarHBondContact O-N 3.05Å; M595-S599 PolarHBondContact O-OG 2.83Å; I596-S599 PolarHBondContact O-N 2.98Å; R597-S599 PolarHBondContact O-N 3.26Å; S599-T602 PolarHBondContact O-OG1 3.16Å; S599-T604 PolarHBondContact O-N 3.35Å; S599-T604 PolarHBondContact O-OG1 2.8Å; S599-K605 WeakPolarHBondContact O-CA 3.32Å; S599-K605 PolarHBondContact O-N 3.49Å; S599-Q606 PolarHBondContact OG-O 3.09Å
600	M	89.9	Confident	91.6	Very high	67 Å²	67	28.4 Å²	28.4	33%	0.33	15%	0.148	S	C	.	.	H	α-helix	trans	-80.4	-39.9	173.8	-60.4	-63.6	-78.6	0	0	112.1	I596 R597 R598 G603 K605 V627 V630	I596-M600 WeakPolarHBondContact O-CG 3.46Å; I596-M600 PolarHBondContact O-N 3Å; I596-M600 VanDerWaalsContact O-N 3.15Å; R597-M600 CarbonylContact O-C 3.13Å; R597-M600 WeakPolarHBondContact O-CA 3.26Å; R597-M600 WeakPolarHBondContact O-CB 3.46Å; R597-M600 PolarHBondContact O-N 3.25Å; R598-M600 PolarHBondContact O-N 3.08Å; M600-G603 PolarHBondContact O-N 2.94Å; M600-K605 HydrophobicContact SD-CG 3.99Å; M600-V627 HydrophobicContact CE-CG1 4.47Å; M600-V627 HydrophobicContact SD-CB 4.23Å; M600-V627 HydrophobicContact SD-CG1 3.75Å; M600-V630 HydrophobicContact CE-CG2 3.95Å; M600-V630 HydrophobicContact CG-CG2 4.36Å; M600-V630 HydrophobicContact SD-CG2 4.03Å
601	E	86.4	Confident	92	Very high	64 Å²	64	27.2 Å²	27.2	30%	0.299	14%	0.139	S	C	.	.	H	α-helix	trans	-67.7	-38.1	179.5	-73.2	175.5	-118.4	0	0	113.9	K502 M559 R597 R598 G603	K502-E601 WeakPolarHBondContact CD-OE2 3.22Å; K502-E601 VanDerWaalsContact CE-OE2 3.29Å; K502-E601 WeakPolarHBondContact CE-OE2 3.41Å; K502-E601 IonicContact NZ-OE2 3.8Å; K502-E601 PolarHBondContact NZ-OE2 3.4Å; M559-E601 HydrophobicContact CE-CB 3.82Å; R597-E601 VanDerWaalsContact CD-OE1 3.26Å; R597-E601 WeakPolarHBondContact CD-OE1 3.45Å; R597-E601 HydrophobicContact CG-CG 4.19Å; R597-E601 VanDerWaalsContact CG-OE1 3.27Å; R597-E601 WeakPolarHBondContact CG-OE1 3.35Å; R597-E601 WeakPolarHBondContact O-CG 3.29Å; R597-E601 PolarHBondContact O-N 3.04Å; R598-E601 PolarHBondContact O-N 2.94Å; E601-G603 PolarHBondContact O-N 3.09Å
602	T	87.8	Confident	92.2	Very high	27 Å²	27	26.8 Å²	26.8	17%	0.166	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-9.4	175.3	55.4	0	0	0	0	112.4	M559 L562 R598 S599 T604	M559-T602 HydrophobicContact CE-CG2 3.63Å; L562-T602 HydrophobicContact CB-CG2 3.76Å; R598-T602 WeakPolarHBondContact O-CG2 3.25Å; R598-T602 PolarHBondContact O-N 3.25Å; R598-T602 PolarHBondContact O-OG1 2.8Å; S599-T602 PolarHBondContact O-OG1 3.16Å; T602-T604 PolarHBondContact O-N 3.49Å; T602-T604 PolarHBondContact OG1-N 2.9Å; T602-T604 PolarHBondContact OG1-OG1 2.91Å; T602-T604 VanDerWaalsContact OG1-OG1 3.09Å
603	G	89.8	Confident	92.2	Very high	54 Å²	54	29.1 Å²	29.1	56%	0.557	17%	0.165	S	C	*	.	S	Bend	trans	72.7	-2.4	-173.5	0	0	0	0	0	114.7	M600 E601 K605	M600-G603 PolarHBondContact O-N 2.94Å; E601-G603 PolarHBondContact O-N 3.09Å; G603-K605 VanDerWaalsContact C-N 3.31Å; G603-K605 PolarHBondContact O-N 3.41Å
604	T	92.4	Very high	92.1	Very high	28 Å²	28	37.4 Å²	37.4	17%	0.172	21%	0.205	C	C	.	.			trans	-66.1	-34.7	-178.9	60.8	0	0	0	0	112.4	S563 L565 S599 T602 Q606	S563-T604 WeakPolarHBondContact O-CG2 3.23Å; L565-T604 HydrophobicContact CD1-CG2 4.22Å; L565-T604 HydrophobicContact CD2-CG2 4.07Å; L565-T604 HydrophobicContact CG-CG2 3.98Å; S599-T604 PolarHBondContact O-N 3.35Å; S599-T604 PolarHBondContact O-OG1 2.8Å; T602-T604 PolarHBondContact O-N 3.49Å; T602-T604 PolarHBondContact OG1-N 2.9Å; T602-T604 PolarHBondContact OG1-OG1 2.91Å; T602-T604 VanDerWaalsContact OG1-OG1 3.09Å; T604-Q606 WeakPolarHBondContact O-CG 3.47Å; T604-Q606 PolarHBondContact O-N 2.83Å
605	K	95.3	Very high	92.1	Very high	95 Å²	95	45 Å²	45	41%	0.413	25%	0.245	S	C	.	.			trans	50.7	20.1	-173.1	-59.2	-174	-178.8	179.7	0	114	S599 M600 G603 E626 V627	S599-K605 WeakPolarHBondContact O-CA 3.32Å; S599-K605 PolarHBondContact O-N 3.49Å; M600-K605 HydrophobicContact SD-CG 3.99Å; G603-K605 VanDerWaalsContact C-N 3.31Å; G603-K605 PolarHBondContact O-N 3.41Å; K605-E626 WeakPolarHBondContact O-CA 3.22Å; K605-V627 HydrophobicContact CB-CB 4.3Å; K605-V627 WeakPolarHBondContact O-CB 3.25Å; K605-V627 WeakPolarHBondContact O-CG2 3.45Å; K605-V627 PolarHBondContact O-N 3.47Å
606	Q	96.1	Very high	91.9	Very high	36 Å²	36	49.6 Å²	49.6	17%	0.168	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	144.6	-171.6	-76.2	-179.8	0.7	0	0	111.7	L565 S599 T604 M624 L625 E626	L565-Q606 HydrophobicContact CD1-CB 3.9Å; L565-Q606 HydrophobicContact CD2-CB 4.32Å; S599-Q606 PolarHBondContact OG-O 3.09Å; T604-Q606 WeakPolarHBondContact O-CG 3.47Å; T604-Q606 PolarHBondContact O-N 2.83Å; Q606-M624 HydrophobicContact CB-CG 4.16Å; Q606-M624 HydrophobicContact CB-SD 4.03Å; Q606-M624 HydrophobicContact CG-CG 4.42Å; Q606-L625 VanDerWaalsContact CA-O 3.24Å; Q606-L625 WeakPolarHBondContact CA-O 3.49Å; Q606-E626 HydrophobicContact CG-CB 3.93Å; Q606-E626 HydrophobicContact CG-CG 4.16Å
607	F	97.1	Very high	91.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	150.9	175.5	66	-88	0	0	0	110.5	P570 F572 L585 M595 I596 M609 L625 V627 T642	P570-F607 HydrophobicContact CB-CB 4.26Å; P570-F607 HydrophobicContact CG-CB 3.74Å; P570-F607 WeakPolarHBondContact O-CB 3.35Å; F572-F607 HydrophobicContact CB-CD2 3.81Å; F572-F607 HydrophobicContact CB-CE2 3.7Å; F572-F607 HydrophobicContact CD2-CE2 4.46Å; F572-F607 HydrophobicContact CG-CE2 4.23Å; L585-F607 HydrophobicContact CD1-CE2 4.03Å; L585-F607 HydrophobicContact CD1-CZ 3.7Å; M595-F607 HydrophobicContact CE-CB 3.91Å; M595-F607 HydrophobicContact CE-CD1 4.12Å; M595-F607 HydrophobicContact CE-CD2 3.55Å; M595-F607 HydrophobicContact CE-CE2 4.05Å; M595-F607 HydrophobicContact CE-CG 3.59Å; I596-F607 HydrophobicContact CD1-CD1 3.93Å; I596-F607 HydrophobicContact CD1-CE1 3.55Å; I596-F607 HydrophobicContact CD1-CZ 3.98Å; F607-M609 HydrophobicContact CE2-CE 4.44Å; F607-L625 HydrophobicContact CE1-CB 4.29Å; F607-L625 HydrophobicContact CE2-CB 4.28Å; F607-L625 HydrophobicContact CE2-CD1 3.75Å; F607-L625 HydrophobicContact CE2-CG 4.49Å; F607-L625 HydrophobicContact CZ-CB 4.09Å; F607-L625 HydrophobicContact CZ-CD1 3.82Å; F607-L625 PolarHBondContact N-O 3.39Å; F607-L625 VanDerWaalsContact N-O 3.09Å; F607-L625 PolarHBondContact O-N 3.12Å; F607-V627 HydrophobicContact CD1-CG2 4.06Å; F607-V627 HydrophobicContact CE1-CG2 3.68Å; F607-T642 HydrophobicContact CE1-CG2 4.01Å; F607-T642 HydrophobicContact CZ-CG2 4.03Å
608	G	97.3	Very high	92.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	141.2	178.8	0	0	0	0	0	112.4	P570 I571 F572	P570-G608 PolarHBondContact O-N 2.82Å; I571-G608 CarbonylContact C-O 3.6Å; I571-G608 WeakPolarHBondContact CA-O 3.5Å; F572-G608 PolarHBondContact N-O 2.91Å
609	M	97.4	Very high	92.6	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.5	169.4	179.4	67.8	73.6	0	0	109.9	F572 C574 T575 A577 L585 F607 G622 C623 L625	F572-M609 HydrophobicContact CB-CE 4.15Å; F572-M609 HydrophobicContact CB-SD 4.24Å; F572-M609 HydrophobicContact CD1-CE 3.51Å; F572-M609 HydrophobicContact CD1-SD 3.8Å; F572-M609 HydrophobicContact CE1-CE 4.19Å; F572-M609 HydrophobicContact CG-CE 4.09Å; F572-M609 HydrophobicContact CG-SD 4.48Å; F572-M609 WeakPolarHBondContact O-CA 3.48Å; C574-M609 HydrophobicContact CB-CE 4.41Å; C574-M609 HydrophobicContact CB-SD 3.86Å; T575-M609 VanDerWaalsContact O-CG 3.29Å; T575-M609 WeakPolarHBondContact O-CG 3.4Å; A577-M609 HydrophobicContact CB-CB 3.97Å; A577-M609 HydrophobicContact CB-CG 3.82Å; L585-M609 HydrophobicContact CD1-CE 3.65Å; L585-M609 HydrophobicContact CD2-CE 3.9Å; L585-M609 HydrophobicContact CG-CE 4.4Å; F607-M609 HydrophobicContact CE2-CE 4.44Å; M609-G622 VanDerWaalsContact O-CA 3.27Å; M609-G622 WeakPolarHBondContact O-CA 2.95Å; M609-C623 PolarHBondContact N-O 3.49Å; M609-C623 PolarHBondContact O-N 3.38Å; M609-C623 VanDerWaalsContact O-N 3.08Å; M609-L625 HydrophobicContact CB-CD1 3.69Å; M609-L625 HydrophobicContact CB-CG 3.91Å; M609-L625 HydrophobicContact CE-CD1 3.64Å; M609-L625 HydrophobicContact CG-CD1 4.25Å
610	C	96.9	Very high	92.9	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.014	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	155.6	172.3	-69.7	0	0	0	0	110.7	I571 F572 V573 C574 F618	I571-C610 HydrophobicContact CG2-CB 4.13Å; F572-C610 PolarHBondContact O-N 3.21Å; F572-C610 VanDerWaalsContact O-N 3.08Å; V573-C610 WeakPolarHBondContact CA-O 3.36Å; C574-C610 PolarHBondContact N-O 3.36Å; C610-F618 HydrophobicContact CB-CB 3.98Å; C610-F618 HydrophobicContact CB-CD2 4.01Å; C610-F618 HydrophobicContact CB-CG 4.44Å
611	I	95.5	Very high	93.2	Very high	18 Å²	18	51.8 Å²	51.8	9%	0.092	29%	0.286	C	S	.	.			trans	-76.4	156.5	161.8	59.4	174.4	0	0	0	110.7	M576 F618 A619 N741 L745	M576-I611 HydrophobicContact CB-CG2 4.49Å; M576-I611 HydrophobicContact CG-CG2 3.74Å; M576-I611 HydrophobicContact SD-CB 4.47Å; M576-I611 HydrophobicContact SD-CD1 3.96Å; M576-I611 HydrophobicContact SD-CG1 4.17Å; M576-I611 HydrophobicContact SD-CG2 3.55Å; M576-I611 VanDerWaalsContact SD-CG2 3.55Å; I611-F618 WeakPolarHBondContact O-CA 3.43Å; I611-A619 HydrophobicContact CG1-CB 3.79Å; I611-A619 PolarHBondContact O-N 2.87Å; I611-N741 HydrophobicContact CD1-CB 3.92Å; I611-L745 HydrophobicContact CD1-CB 4.43Å; I611-L745 HydrophobicContact CD1-CD1 4.5Å; I611-L745 HydrophobicContact CD1-CD2 4.24Å
612	A	94.7	Very high	93.7	Very high	69 Å²	69	48.9 Å²	48.9	57%	0.57	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.3	148.7	172.9	0	0	0	0	0	111.8	V573 G617	V573-A612 HydrophobicContact CG1-CB 3.8Å; A612-G617 WeakPolarHBondContact CA-O 3.2Å
613	D	92.7	Very high	94.2	Very high	56 Å²	56	47.6 Å²	47.6	30%	0.299	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	132.6	170.6	-179.2	-78	0	0	0	108.2	L615 K616 G617	D613-L615 PolarHBondContact O-N 3.32Å; D613-L615 WeakPolarHBondContact OD1-CA 3.49Å; D613-L615 PolarHBondContact OD1-N 3.09Å; D613-K616 HydrophobicContact CB-CB 4.22Å; D613-K616 PolarHBondContact OD1-N 3.37Å; D613-G617 PolarHBondContact N-O 2.93Å; D613-G617 CarbonylContact O-C 3.34Å; D613-G617 WeakPolarHBondContact O-CA 3.43Å; D613-G617 PolarHBondContact O-N 3Å
614	E	87.1	Confident	94.6	Very high	203 Å²	203	45 Å²	45	95%	0.949	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-19.9	-172.5	-63.2	-177.2	167	0	0	113.7
615	L	87.9	Confident	94.8	Very high	165 Å²	165	43.7 Å²	43.7	86%	0.864	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-34.7	-176.4	-58.4	177.5	0	0	0	112.4	D613	D613-L615 PolarHBondContact O-N 3.32Å; D613-L615 WeakPolarHBondContact OD1-CA 3.49Å; D613-L615 PolarHBondContact OD1-N 3.09Å
616	K	87.7	Confident	94.9	Very high	96 Å²	96	42.9 Å²	42.9	42%	0.417	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-7	-177.6	-61.5	-179.1	176.2	-174.4	0	113.9	D613 F618 D620	D613-K616 HydrophobicContact CB-CB 4.22Å; D613-K616 PolarHBondContact OD1-N 3.37Å; K616-F618 WeakPolarHBondContact CB-O 3.48Å; K616-F618 PolarHBondContact O-N 3.04Å; K616-F618 VanDerWaalsContact O-N 3.08Å; K616-D620 IonicContact NZ-OD1 2.63Å; K616-D620 PolarHBondContact NZ-OD1 3.09Å; K616-D620 IonicContact NZ-OD2 2.68Å; K616-D620 PolarHBondContact NZ-OD2 3.11Å
617	G	90.9	Very high	95	Very high	39 Å²	39	41.3 Å²	41.3	40%	0.402	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	79.1	-38.8	-169.9	0	0	0	0	0	113.3	A612 D613	A612-G617 WeakPolarHBondContact CA-O 3.2Å; D613-G617 PolarHBondContact N-O 2.93Å; D613-G617 CarbonylContact O-C 3.34Å; D613-G617 WeakPolarHBondContact O-CA 3.43Å; D613-G617 PolarHBondContact O-N 3Å
618	F	95.9	Very high	94.9	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.018	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	157.9	174.1	63.1	-84.2	0	0	0	112.8	I571 V573 C610 I611 K616 V650 H653 N660 A662	I571-F618 HydrophobicContact CB-CE2 4.41Å; I571-F618 HydrophobicContact CB-CZ 4.42Å; I571-F618 HydrophobicContact CG1-CE2 3.96Å; I571-F618 HydrophobicContact CG1-CZ 4.05Å; I571-F618 HydrophobicContact CG2-CD2 3.9Å; I571-F618 HydrophobicContact CG2-CE2 4Å; I571-F618 HydrophobicContact CG2-CG 4.18Å; I571-F618 HydrophobicContact CG2-CZ 4.38Å; V573-F618 HydrophobicContact CG1-CB 4.17Å; V573-F618 HydrophobicContact CG2-CB 3.77Å; V573-F618 HydrophobicContact CG2-CD1 4.4Å; V573-F618 HydrophobicContact CG2-CG 4.29Å; C610-F618 HydrophobicContact CB-CB 3.98Å; C610-F618 HydrophobicContact CB-CD2 4.01Å; C610-F618 HydrophobicContact CB-CG 4.44Å; I611-F618 WeakPolarHBondContact O-CA 3.43Å; K616-F618 WeakPolarHBondContact CB-O 3.48Å; K616-F618 PolarHBondContact O-N 3.04Å; K616-F618 VanDerWaalsContact O-N 3.08Å; F618-V650 HydrophobicContact CD2-CG2 4.35Å; F618-V650 HydrophobicContact CE2-CG1 4.34Å; F618-V650 HydrophobicContact CE2-CG2 3.82Å; F618-H653 AromaticContact CD1-ND1 3.68Å; F618-H653 AromaticContact CD2-ND1 3.8Å; F618-H653 HydrophobicContact CE1-CB 4.1Å; F618-H653 AromaticContact CE1-ND1 3.23Å; F618-H653 WeakPolarHBondContact CE1-ND1 3.22Å; F618-H653 AromaticContact CE2-CE1 3.89Å; F618-H653 AromaticContact CE2-ND1 3.38Å; F618-H653 WeakPolarHBondContact CE2-ND1 3.35Å; F618-H653 AromaticContact CG-ND1 3.97Å; F618-H653 HydrophobicContact CZ-CB 4.04Å; F618-H653 AromaticContact CZ-CG 3.85Å; F618-H653 AromaticContact CZ-ND1 3.09Å; F618-H653 WeakPolarHBondContact CZ-ND1 3.47Å; F618-H653 PolarHBondContact O-CE1 3.37Å; F618-N660 HydrophobicContact CD1-CB 4.18Å; F618-N660 WeakPolarHBondContact CD1-ND2 3.49Å; F618-N660 HydrophobicContact CE1-CB 3.81Å; F618-A662 HydrophobicContact CE2-CB 4.22Å; F618-A662 HydrophobicContact CZ-CB 4.19Å
619	A	95.9	Very high	94.7	Very high	4 Å²	4	51.3 Å²	51.3	3%	0.033	27%	0.265	C	S	.	.			trans	-68.5	153.1	-175.5	0	0	0	0	0	114.4	I611 Y621 L745	I611-A619 HydrophobicContact CG1-CB 3.79Å; I611-A619 PolarHBondContact O-N 2.87Å; A619-Y621 PolarHBondContact O-N 3.36Å; A619-Y621 VanDerWaalsContact O-N 3.09Å; A619-L745 HydrophobicContact CB-CD1 4.06Å; A619-L745 HydrophobicContact CB-CD2 3.85Å
620	D	95.8	Very high	94.5	Very high	56 Å²	56	52.1 Å²	52.1	30%	0.299	27%	0.27	S	S	.	.	S	Bend	trans	-64.8	-7.8	178.4	-62.9	-59	0	0	0	115	K616 K649 V650 H653	K616-D620 IonicContact NZ-OD1 2.63Å; K616-D620 PolarHBondContact NZ-OD1 3.09Å; K616-D620 IonicContact NZ-OD2 2.68Å; K616-D620 PolarHBondContact NZ-OD2 3.11Å; D620-K649 CarbonylContact O-C 3.56Å; D620-K649 WeakPolarHBondContact O-CA 3.4Å; D620-V650 PolarHBondContact O-N 3.48Å; D620-H653 IonicContact OD1-NE2 3.98Å
621	Y	97.2	Very high	94.1	Very high	69 Å²	69	58.1 Å²	58.1	27%	0.271	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	145.6	-176.6	-62.8	-85.9	0	0	0	110.2	A619 F648 K649 L667 L745 A749	A619-Y621 PolarHBondContact O-N 3.36Å; A619-Y621 VanDerWaalsContact O-N 3.09Å; Y621-F648 WeakPolarHBondContact CA-O 3.39Å; Y621-K649 HydrophobicContact CD1-CB 3.88Å; Y621-K649 HydrophobicContact CD1-CG 4.19Å; Y621-K649 HydrophobicContact CE1-CB 3.71Å; Y621-K649 HydrophobicContact CE1-CD 3.81Å; Y621-K649 HydrophobicContact CE1-CG 3.69Å; Y621-L667 HydrophobicContact CD1-CD1 3.63Å; Y621-L667 HydrophobicContact CE1-CD1 3.83Å; Y621-L745 WeakPolarHBondContact O-CD1 3.39Å; Y621-A749 HydrophobicContact CD1-CB 3.71Å; Y621-A749 HydrophobicContact CD2-CB 3.93Å; Y621-A749 HydrophobicContact CE1-CB 3.79Å; Y621-A749 HydrophobicContact CE2-CB 4.03Å; Y621-A749 HydrophobicContact CG-CB 3.78Å
622	G	97.2	Very high	93.6	Very high	3 Å²	3	61.5 Å²	61.5	3%	0.031	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	-175.4	-178.4	0	0	0	0	0	113.1	M609 F648	M609-G622 VanDerWaalsContact O-CA 3.27Å; M609-G622 WeakPolarHBondContact O-CA 2.95Å; G622-F648 PolarHBondContact N-O 2.72Å; G622-F648 PolarHBondContact O-N 3.28Å
623	C	97.4	Very high	93	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132.4	175.4	-175	0	0	0	0	109.9	A577 M609 S646 F648	A577-C623 HydrophobicContact CB-CB 4Å; A577-C623 WeakPolarHBondContact O-CB 3.49Å; M609-C623 PolarHBondContact N-O 3.49Å; M609-C623 PolarHBondContact O-N 3.38Å; M609-C623 VanDerWaalsContact O-N 3.08Å; C623-S646 CarbonylContact C-O 3.55Å; C623-S646 WeakPolarHBondContact CA-O 3.44Å; C623-S646 PolarHBondContact SG-O 3.15Å; C623-S646 VanDerWaalsContact SG-O 3.35Å; C623-F648 VanDerWaalsContact C-CE1 3.46Å
624	M	97.4	Very high	92	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	125.1	171.1	-168.6	66.2	62.7	0	0	108.7	V569 Q606 V645 S646 F648 I664 Y666	V569-M624 HydrophobicContact CG1-CE 3.62Å; V569-M624 HydrophobicContact CG1-SD 4.21Å; V569-M624 HydrophobicContact CG2-CE 4.02Å; Q606-M624 HydrophobicContact CB-CG 4.16Å; Q606-M624 HydrophobicContact CB-SD 4.03Å; Q606-M624 HydrophobicContact CG-CG 4.42Å; M624-V645 PolarHBondContact O-N 2.87Å; M624-S646 PolarHBondContact N-O 2.87Å; M624-F648 HydrophobicContact CB-CD1 4.46Å; M624-F648 HydrophobicContact CE-CD1 4.37Å; M624-I664 HydrophobicContact CE-CD1 3.72Å; M624-Y666 HydrophobicContact CE-CE1 4.21Å
625	L	97.8	Very high	91.3	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	136.7	173.7	-64.1	-177.8	0	0	0	109.7	A577 C583 L585 Q606 F607 M609 I643	A577-L625 HydrophobicContact CB-CD2 3.77Å; A577-L625 HydrophobicContact CB-CG 4.47Å; C583-L625 HydrophobicContact CB-CD1 4.31Å; C583-L625 HydrophobicContact CB-CD2 4.12Å; L585-L625 HydrophobicContact CD1-CD1 4.38Å; Q606-L625 VanDerWaalsContact CA-O 3.24Å; Q606-L625 WeakPolarHBondContact CA-O 3.49Å; F607-L625 HydrophobicContact CE1-CB 4.29Å; F607-L625 HydrophobicContact CE2-CB 4.28Å; F607-L625 HydrophobicContact CE2-CD1 3.75Å; F607-L625 HydrophobicContact CE2-CG 4.49Å; F607-L625 HydrophobicContact CZ-CB 4.09Å; F607-L625 HydrophobicContact CZ-CD1 3.82Å; F607-L625 PolarHBondContact N-O 3.39Å; F607-L625 VanDerWaalsContact N-O 3.09Å; F607-L625 PolarHBondContact O-N 3.12Å; M609-L625 HydrophobicContact CB-CD1 3.69Å; M609-L625 HydrophobicContact CB-CG 3.91Å; M609-L625 HydrophobicContact CE-CD1 3.64Å; M609-L625 HydrophobicContact CG-CD1 4.25Å; L625-I643 CarbonylContact C-O 3.55Å; L625-I643 WeakPolarHBondContact CA-O 3.38Å
626	E	97.3	Very high	90.5	Very high	78 Å²	78	49.9 Å²	49.9	36%	0.364	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	132.1	169.3	-179.4	-179.6	156.9	0	0	110.8	K605 Q606 T642 I643 V645	K605-E626 WeakPolarHBondContact O-CA 3.22Å; Q606-E626 HydrophobicContact CG-CB 3.93Å; Q606-E626 HydrophobicContact CG-CG 4.16Å; E626-T642 CarbonylContact O-C 3.48Å; E626-T642 WeakPolarHBondContact O-CA 3.04Å; E626-T642 VanDerWaalsContact O-CB 3.3Å; E626-T642 WeakPolarHBondContact O-CB 3.2Å; E626-I643 HydrophobicContact CB-CG2 4.45Å; E626-I643 PolarHBondContact N-O 3.23Å; E626-I643 PolarHBondContact O-N 2.89Å; E626-V645 HydrophobicContact CB-CG2 3.5Å
627	V	97.1	Very high	90.4	Very high	3 Å²	3	50 Å²	50	2%	0.018	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	117.2	179.8	178.2	0	0	0	0	110.6	M600 K605 F607 V630 V640 T642	M600-V627 HydrophobicContact CE-CG1 4.47Å; M600-V627 HydrophobicContact SD-CB 4.23Å; M600-V627 HydrophobicContact SD-CG1 3.75Å; K605-V627 HydrophobicContact CB-CB 4.3Å; K605-V627 WeakPolarHBondContact O-CB 3.25Å; K605-V627 WeakPolarHBondContact O-CG2 3.45Å; K605-V627 PolarHBondContact O-N 3.47Å; F607-V627 HydrophobicContact CD1-CG2 4.06Å; F607-V627 HydrophobicContact CE1-CG2 3.68Å; V627-V630 HydrophobicContact CG1-CG2 3.31Å; V627-V640 HydrophobicContact CB-CG1 4.45Å; V627-V640 HydrophobicContact CG1-CG1 3.86Å; V627-V640 HydrophobicContact CG2-CG1 3.88Å; V627-T642 HydrophobicContact CG2-CG2 4.15Å
628	R	95.4	Very high	90.3	Very high	137 Å²	137	48.1 Å²	48.1	52%	0.517	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-46.6	178.3	-69	172.6	158.4	-171.2	-8.3	112.3	D641 I643	R628-D641 HydrophobicContact CB-CB 4.33Å; R628-D641 WeakPolarHBondContact CB-OD2 3.26Å; R628-D641 WeakPolarHBondContact CD-OD2 3.07Å; R628-D641 PolarHBondContact N-O 3.08Å; R628-I643 HydrophobicContact CG-CG2 4.41Å
629	D	94.3	Very high	90.2	Very high	72 Å²	72	50.7 Å²	50.7	39%	0.385	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	149.9	-177	-174.9	20.3	0	0	0	110.1	K631 D641	D629-K631 WeakPolarHBondContact OD2-CE 3.26Å; D629-K631 IonicContact OD2-NZ 2.72Å; D629-K631 PolarHBondContact OD2-NZ 2.9Å; D629-D641 HydrophobicContact CB-CB 4.28Å; D629-D641 PolarHBondContact O-N 3.16Å
630	V	91.9	Very high	90.2	Very high	19 Å²	19	50.5 Å²	50.5	12%	0.115	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	117	177	-168.8	0	0	0	0	110.6	I596 M600 V627 F632 V640	I596-V630 HydrophobicContact CG2-CG1 4.28Å; I596-V630 HydrophobicContact CG2-CG2 4.46Å; M600-V630 HydrophobicContact CE-CG2 3.95Å; M600-V630 HydrophobicContact CG-CG2 4.36Å; M600-V630 HydrophobicContact SD-CG2 4.03Å; V627-V630 HydrophobicContact CG1-CG2 3.31Å; V630-F632 HydrophobicContact CB-CE2 3.95Å; V630-F632 HydrophobicContact CB-CZ 4.25Å; V630-F632 HydrophobicContact CG1-CD1 4.29Å; V630-F632 HydrophobicContact CG1-CD2 3.96Å; V630-F632 HydrophobicContact CG1-CE1 3.86Å; V630-F632 HydrophobicContact CG1-CE2 3.49Å; V630-F632 VanDerWaalsContact CG1-CE2 3.49Å; V630-F632 HydrophobicContact CG1-CG 4.34Å; V630-F632 HydrophobicContact CG1-CZ 3.44Å; V630-F632 VanDerWaalsContact CG1-CZ 3.44Å; V630-V640 HydrophobicContact CG1-CG2 4.26Å; V630-V640 HydrophobicContact CG2-CG1 4.3Å
631	K	90	Very high	90.2	Very high	129 Å²	129	50.4 Å²	50.4	56%	0.561	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	102	176.3	-62.1	-179.3	-167.1	177.1	0	108.7	D629 S638 V639	D629-K631 WeakPolarHBondContact OD2-CE 3.26Å; D629-K631 IonicContact OD2-NZ 2.72Å; D629-K631 PolarHBondContact OD2-NZ 2.9Å; K631-S638 CarbonylContact O-C 3.5Å; K631-S638 VanDerWaalsContact O-CA 3.22Å; K631-S638 WeakPolarHBondContact O-CA 3.49Å; K631-V639 PolarHBondContact N-O 3.47Å; K631-V639 PolarHBondContact O-N 3.35Å
632	F	83.1	Confident	90.2	Very high	88 Å²	88	47.1 Å²	47.1	39%	0.386	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	145.3	174.4	-62.7	-81.7	0	0	0	111	V630 R637	V630-F632 HydrophobicContact CB-CE2 3.95Å; V630-F632 HydrophobicContact CB-CZ 4.25Å; V630-F632 HydrophobicContact CG1-CD1 4.29Å; V630-F632 HydrophobicContact CG1-CD2 3.96Å; V630-F632 HydrophobicContact CG1-CE1 3.86Å; V630-F632 HydrophobicContact CG1-CE2 3.49Å; V630-F632 VanDerWaalsContact CG1-CE2 3.49Å; V630-F632 HydrophobicContact CG1-CG 4.34Å; V630-F632 HydrophobicContact CG1-CZ 3.44Å; V630-F632 VanDerWaalsContact CG1-CZ 3.44Å; F632-R637 CarbonylContact C-O 3.46Å; F632-R637 WeakPolarHBondContact CA-O 3.32Å
633	F	82.8	Confident	90.1	Very high	83 Å²	83	48.4 Å²	48.4	36%	0.364	23%	0.232	S	C	.	.			trans	-107.8	158.7	177	-65.5	-80.3	0	0	0	111.3	D635 G636 R637 V639	F633-D635 PolarHBondContact O-N 2.73Å; F633-G636 WeakPolarHBondContact O-CA 3.39Å; F633-G636 PolarHBondContact O-N 3.18Å; F633-R637 HydrophobicContact CB-CB 4.34Å; F633-R637 HydrophobicContact CD2-CB 4.07Å; F633-R637 WeakPolarHBondContact CD2-O 3.24Å; F633-R637 PolarHBondContact N-O 2.77Å; F633-V639 HydrophobicContact CE2-CB 4.3Å; F633-V639 HydrophobicContact CE2-CG2 3.97Å; F633-V639 HydrophobicContact CZ-CG2 4.34Å
634	P	71.1	Confident	90.1	Very high	85 Å²	85	48.5 Å²	48.5	55%	0.552	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51	-36.7	177.7	-34.1	39.6	0	0	0	115.5	A526 G636	A526-P634 HydrophobicContact CB-CB 3.59Å; A526-P634 HydrophobicContact CB-CG 4.3Å; P634-G636 PolarHBondContact O-N 2.84Å
635	D	72.8	Confident	90	Very high	81 Å²	81	50.9 Å²	50.9	43%	0.433	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	9.7	178.4	59.2	24.7	0	0	0	114	F633 R637	F633-D635 PolarHBondContact O-N 2.73Å; D635-R637 VanDerWaalsContact C-N 3.3Å; D635-R637 VanDerWaalsContact CG-NE 3.27Å; D635-R637 PolarHBondContact O-N 3.05Å; D635-R637 VanDerWaalsContact OD1-CB 3.23Å; D635-R637 WeakPolarHBondContact OD1-CB 3.49Å; D635-R637 VanDerWaalsContact OD1-CG 3.22Å; D635-R637 WeakPolarHBondContact OD1-CG 3.4Å; D635-R637 PolarHBondContact OD1-N 3.31Å; D635-R637 VanDerWaalsContact OD1-N 3.07Å; D635-R637 IonicContact OD1-NE 3.31Å; D635-R637 PolarHBondContact OD1-NE 2.78Å; D635-R637 VanDerWaalsContact OD1-NE 3.13Å; D635-R637 IonicContact OD2-CZ 2.73Å; D635-R637 IonicContact OD2-NE 2.69Å; D635-R637 PolarHBondContact OD2-NE 3.4Å; D635-R637 IonicContact OD2-NH2 3.12Å; D635-R637 PolarHBondContact OD2-NH2 2.73Å
636	G	72.3	Confident	89.9	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.01	26%	0.258	C	S	.	.	S	Bend	trans	84.9	-14.4	179.9	0	0	0	0	0	115	R593 F633 P634	R593-G636 VanDerWaalsContact CD-C 3.48Å; R593-G636 WeakPolarHBondContact CD-O 3.45Å; F633-G636 WeakPolarHBondContact O-CA 3.39Å; F633-G636 PolarHBondContact O-N 3.18Å; P634-G636 PolarHBondContact O-N 2.84Å
637	R	85.1	Confident	89.8	Confident	98 Å²	98	48.6 Å²	48.6	37%	0.37	24%	0.24	S	C	.	.			trans	-56.9	159.8	175.3	-64.7	-174.7	-72.1	159.7	-13.5	111.3	H586 V587 F588 F632 F633 D635	H586-R637 PolarHBondContact NE2-NH1 2.93Å; V587-R637 WeakPolarHBondContact O-CA 3.42Å; F588-R637 HydrophobicContact CB-CG 3.83Å; F632-R637 CarbonylContact C-O 3.46Å; F632-R637 WeakPolarHBondContact CA-O 3.32Å; F633-R637 HydrophobicContact CB-CB 4.34Å; F633-R637 HydrophobicContact CD2-CB 4.07Å; F633-R637 WeakPolarHBondContact CD2-O 3.24Å; F633-R637 PolarHBondContact N-O 2.77Å; D635-R637 VanDerWaalsContact C-N 3.3Å; D635-R637 VanDerWaalsContact CG-NE 3.27Å; D635-R637 PolarHBondContact O-N 3.05Å; D635-R637 VanDerWaalsContact OD1-CB 3.23Å; D635-R637 WeakPolarHBondContact OD1-CB 3.49Å; D635-R637 VanDerWaalsContact OD1-CG 3.22Å; D635-R637 WeakPolarHBondContact OD1-CG 3.4Å; D635-R637 PolarHBondContact OD1-N 3.31Å; D635-R637 VanDerWaalsContact OD1-N 3.07Å; D635-R637 IonicContact OD1-NE 3.31Å; D635-R637 PolarHBondContact OD1-NE 2.78Å; D635-R637 VanDerWaalsContact OD1-NE 3.13Å; D635-R637 IonicContact OD2-CZ 2.73Å; D635-R637 IonicContact OD2-NE 2.69Å; D635-R637 PolarHBondContact OD2-NE 3.4Å; D635-R637 IonicContact OD2-NH2 3.12Å; D635-R637 PolarHBondContact OD2-NH2 2.73Å
638	S	88.6	Confident	89.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	150.3	169.8	55.5	0	0	0	0	112.9	H586 V587 K631	H586-S638 CarbonylContact C-O 3.58Å; H586-S638 WeakPolarHBondContact CA-O 3.49Å; V587-S638 PolarHBondContact N-O 2.78Å; V587-S638 PolarHBondContact O-N 3.34Å; K631-S638 CarbonylContact O-C 3.5Å; K631-S638 VanDerWaalsContact O-CA 3.22Å; K631-S638 WeakPolarHBondContact O-CA 3.49Å
639	V	94.3	Very high	89.9	Confident	58 Å²	58	45 Å²	45	35%	0.352	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.1	156.9	163	0	0	0	0	107.4	L585 H586 K631 F633	L585-V639 CarbonylContact O-C 3.55Å; L585-V639 WeakPolarHBondContact O-CA 3.36Å; H586-V639 HydrophobicContact CB-CG2 4.37Å; K631-V639 PolarHBondContact N-O 3.47Å; K631-V639 PolarHBondContact O-N 3.35Å; F633-V639 HydrophobicContact CE2-CB 4.3Å; F633-V639 HydrophobicContact CE2-CG2 3.97Å; F633-V639 HydrophobicContact CZ-CG2 4.34Å
640	V	95.5	Very high	90.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	117	-176.1	-171.9	0	0	0	0	107.2	P584 L585 V587 I596 V627 V630 T642	P584-V640 WeakPolarHBondContact CA-O 3.42Å; L585-V640 HydrophobicContact CB-CB 4.46Å; L585-V640 PolarHBondContact N-O 3.27Å; L585-V640 PolarHBondContact O-N 2.95Å; V587-V640 HydrophobicContact CG2-CG2 3.86Å; I596-V640 HydrophobicContact CD1-CG1 4.3Å; I596-V640 HydrophobicContact CD1-CG2 4.22Å; I596-V640 HydrophobicContact CG1-CG2 4.2Å; I596-V640 HydrophobicContact CG2-CG2 4.05Å; V627-V640 HydrophobicContact CB-CG1 4.45Å; V627-V640 HydrophobicContact CG1-CG1 3.86Å; V627-V640 HydrophobicContact CG2-CG1 3.88Å; V630-V640 HydrophobicContact CG1-CG2 4.26Å; V630-V640 HydrophobicContact CG2-CG1 4.3Å; V640-T642 HydrophobicContact CB-CG2 4.39Å; V640-T642 HydrophobicContact CG1-CG2 3.51Å
641	D	95.8	Very high	90.3	Very high	54 Å²	54	45.5 Å²	45.5	29%	0.289	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	128.4	167.1	-176.3	42.9	0	0	0	108.9	R628 D629	R628-D641 HydrophobicContact CB-CB 4.33Å; R628-D641 WeakPolarHBondContact CB-OD2 3.26Å; R628-D641 WeakPolarHBondContact CD-OD2 3.07Å; R628-D641 PolarHBondContact N-O 3.08Å; D629-D641 HydrophobicContact CB-CB 4.28Å; D629-D641 PolarHBondContact O-N 3.16Å
642	T	97.1	Very high	90.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	161.9	179.2	79.3	0	0	0	0	112.1	P582 C583 F607 E626 V627 V640	P582-T642 CarbonylContact C-O 3.53Å; P582-T642 VanDerWaalsContact CA-O 3.32Å; P582-T642 WeakPolarHBondContact CA-O 3.43Å; C583-T642 WeakPolarHBondContact CB-OG1 3.27Å; C583-T642 PolarHBondContact N-O 3.33Å; C583-T642 PolarHBondContact O-OG1 3.36Å; F607-T642 HydrophobicContact CE1-CG2 4.01Å; F607-T642 HydrophobicContact CZ-CG2 4.03Å; E626-T642 CarbonylContact O-C 3.48Å; E626-T642 WeakPolarHBondContact O-CA 3.04Å; E626-T642 VanDerWaalsContact O-CB 3.3Å; E626-T642 WeakPolarHBondContact O-CB 3.2Å; V627-T642 HydrophobicContact CG2-CG2 4.15Å; V640-T642 HydrophobicContact CB-CG2 4.39Å; V640-T642 HydrophobicContact CG1-CG2 3.51Å
643	I	96.1	Very high	91.1	Very high	29 Å²	29	41.5 Å²	41.5	15%	0.149	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	141.5	169.1	-175.4	163.3	0	0	0	109.7	T580 L625 E626 R628 V645	T580-I643 WeakPolarHBondContact O-CD1 3.24Å; L625-I643 CarbonylContact C-O 3.55Å; L625-I643 WeakPolarHBondContact CA-O 3.38Å; E626-I643 HydrophobicContact CB-CG2 4.45Å; E626-I643 PolarHBondContact N-O 3.23Å; E626-I643 PolarHBondContact O-N 2.89Å; R628-I643 HydrophobicContact CG-CG2 4.41Å; I643-V645 PolarHBondContact O-N 2.99Å
644	G	96.2	Very high	91.6	Very high	2 Å²	2	39.1 Å²	39.1	2%	0.021	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	130.1	168.9	0	0	0	0	0	111.3	F578 P579 T580 I581	F578-G644 WeakPolarHBondContact O-CA 3.37Å; P579-G644 CarbonylContact C-O 3.47Å; P579-G644 WeakPolarHBondContact CA-O 3.47Å; T580-G644 PolarHBondContact N-O 3.49Å; I581-G644 PolarHBondContact O-N 3.03Å
645	V	94.9	Very high	92.6	Very high	51 Å²	51	41.4 Å²	41.4	31%	0.309	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-61.7	-179.7	179.1	0	0	0	0	110.4	M624 E626 I643	M624-V645 PolarHBondContact O-N 2.87Å; E626-V645 HydrophobicContact CB-CG2 3.5Å; I643-V645 PolarHBondContact O-N 2.99Å
646	S	95.6	Very high	93.4	Very high	31 Å²	31	40.8 Å²	40.8	22%	0.217	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	155.8	-172.7	-86.6	0	0	0	0	113.9	C623 M624 E725	C623-S646 CarbonylContact C-O 3.55Å; C623-S646 WeakPolarHBondContact CA-O 3.44Å; C623-S646 PolarHBondContact SG-O 3.15Å; C623-S646 VanDerWaalsContact SG-O 3.35Å; M624-S646 PolarHBondContact N-O 2.87Å; S646-E725 WeakPolarHBondContact CA-OE1 3.38Å; S646-E725 WeakPolarHBondContact CB-OE1 3.47Å; S646-E725 PolarHBondContact OG-OE1 2.82Å
647	R	96.8	Very high	94	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	150.7	174.4	-67.8	175.2	-62.5	159.8	0.8	111.5	P579 Y666 L667 D669 E725 L748 M750	P579-R647 HydrophobicContact CG-CG 3.75Å; R647-Y666 WeakPolarHBondContact O-CA 3.5Å; R647-L667 HydrophobicContact CB-CB 3.92Å; R647-L667 PolarHBondContact NE-O 2.77Å; R647-L667 PolarHBondContact NH2-O 2.71Å; R647-L667 PolarHBondContact O-N 3.19Å; R647-D669 IonicContact CZ-OD1 3.76Å; R647-D669 IonicContact NH1-OD1 2.81Å; R647-D669 IonicContact NH2-OD1 2.74Å; R647-D669 PolarHBondContact NH2-OD1 2.99Å; R647-E725 WeakPolarHBondContact CD-OE2 3.42Å; R647-E725 VanDerWaalsContact CG-OE2 3.26Å; R647-E725 WeakPolarHBondContact CG-OE2 3.29Å; R647-E725 IonicContact CZ-OE2 3.2Å; R647-E725 PolarHBondContact N-OE1 2.89Å; R647-E725 PolarHBondContact N-OE2 3.35Å; R647-E725 IonicContact NE-OE2 3.7Å; R647-E725 PolarHBondContact NE-OE2 3.43Å; R647-E725 IonicContact NH2-OE2 2.67Å; R647-L748 VanDerWaalsContact CD-O 3.3Å; R647-L748 WeakPolarHBondContact CD-O 3.34Å; R647-L748 HydrophobicContact CG-CD1 3.9Å; R647-L748 HydrophobicContact CG-CG 4.13Å; R647-L748 PolarHBondContact NH1-O 3.39Å; R647-M750 PolarHBondContact NH1-O 2.72Å
648	F	97.4	Very high	94.2	Very high	1 Å²	1	40.3 Å²	40.3	0%	0.004	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	160.4	172.2	68.3	-98.4	0	0	0	112.9	I571 Y621 G622 C623 M624 V650 I664 E665	I571-F648 HydrophobicContact CD1-CE2 4.16Å; I571-F648 HydrophobicContact CD1-CZ 3.82Å; Y621-F648 WeakPolarHBondContact CA-O 3.39Å; G622-F648 PolarHBondContact N-O 2.72Å; G622-F648 PolarHBondContact O-N 3.28Å; C623-F648 VanDerWaalsContact C-CE1 3.46Å; M624-F648 HydrophobicContact CB-CD1 4.46Å; M624-F648 HydrophobicContact CE-CD1 4.37Å; F648-V650 HydrophobicContact CD2-CG2 4.44Å; F648-V650 HydrophobicContact CE2-CG2 4.04Å; F648-I664 HydrophobicContact CB-CB 4.15Å; F648-I664 HydrophobicContact CB-CD1 3.69Å; F648-I664 HydrophobicContact CB-CG1 4.48Å; F648-I664 HydrophobicContact CD1-CD1 4.36Å; F648-I664 HydrophobicContact CD2-CB 4.08Å; F648-I664 HydrophobicContact CD2-CG2 3.6Å; F648-I664 HydrophobicContact CE2-CG2 4.02Å; F648-I664 HydrophobicContact CG-CB 4.3Å; F648-I664 HydrophobicContact CG-CD1 3.96Å; F648-I664 HydrophobicContact CG-CG2 4.16Å; F648-E665 CarbonylContact C-O 3.55Å; F648-E665 VanDerWaalsContact CA-O 3.29Å; F648-E665 WeakPolarHBondContact CA-O 3.03Å
649	K	97.1	Very high	94.3	Very high	64 Å²	64	40.6 Å²	40.6	28%	0.278	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	139.7	168.3	174.4	176.8	151	-133	0	109.3	D620 Y621 I664 E665 L667	D620-K649 CarbonylContact O-C 3.56Å; D620-K649 WeakPolarHBondContact O-CA 3.4Å; Y621-K649 HydrophobicContact CD1-CB 3.88Å; Y621-K649 HydrophobicContact CD1-CG 4.19Å; Y621-K649 HydrophobicContact CE1-CB 3.71Å; Y621-K649 HydrophobicContact CE1-CD 3.81Å; Y621-K649 HydrophobicContact CE1-CG 3.69Å; K649-I664 CarbonylContact O-C 3.54Å; K649-I664 VanDerWaalsContact O-CA 3.26Å; K649-I664 WeakPolarHBondContact O-CA 3.27Å; K649-E665 PolarHBondContact N-O 2.69Å; K649-E665 IonicContact NZ-OE2 2.76Å; K649-E665 PolarHBondContact NZ-OE2 3Å; K649-E665 PolarHBondContact O-N 2.84Å; K649-L667 HydrophobicContact CB-CD1 4.1Å; K649-L667 HydrophobicContact CB-CD2 4.11Å; K649-L667 HydrophobicContact CB-CG 4.18Å
650	V	97.2	Very high	94.4	Very high	10 Å²	10	39.1 Å²	39.1	6%	0.061	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	128.3	174.1	-179	0	0	0	0	109	F618 D620 F648 A662	F618-V650 HydrophobicContact CD2-CG2 4.35Å; F618-V650 HydrophobicContact CE2-CG1 4.34Å; F618-V650 HydrophobicContact CE2-CG2 3.82Å; D620-V650 PolarHBondContact O-N 3.48Å; F648-V650 HydrophobicContact CD2-CG2 4.44Å; F648-V650 HydrophobicContact CE2-CG2 4.04Å; V650-A662 HydrophobicContact CG1-CB 4.16Å; V650-A662 HydrophobicContact CG2-CB 4.4Å
651	L	96.6	Very high	94.4	Very high	90 Å²	90	39.7 Å²	39.7	47%	0.471	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-35.9	172	-61.1	-177.2	0	0	0	111.6	K663 E665	L651-K663 HydrophobicContact CB-CG 4.31Å; L651-K663 HydrophobicContact CD1-CG 4.37Å; L651-K663 PolarHBondContact N-O 3.48Å; L651-E665 HydrophobicContact CD1-CB 4.1Å; L651-E665 HydrophobicContact CD2-CB 3.93Å; L651-E665 HydrophobicContact CG-CB 4.02Å
652	S	95.9	Very high	94.4	Very high	60 Å²	60	37.2 Å²	37.2	42%	0.42	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	139.9	171.6	60.7	0	0	0	0	111.2	A662 K663	S652-A662 WeakPolarHBondContact O-CA 3.42Å; S652-K663 PolarHBondContact N-O 3.4Å; S652-K663 PolarHBondContact O-N 3.24Å; S652-K663 WeakPolarHBondContact OG-CB 3.29Å
653	H	95	Very high	94.4	Very high	73 Å²	73	41 Å²	41	34%	0.338	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	149.7	174.3	-53.7	-102.7	0	0	0	110.8	F618 D620	F618-H653 AromaticContact CD1-ND1 3.68Å; F618-H653 AromaticContact CD2-ND1 3.8Å; F618-H653 HydrophobicContact CE1-CB 4.1Å; F618-H653 AromaticContact CE1-ND1 3.23Å; F618-H653 WeakPolarHBondContact CE1-ND1 3.22Å; F618-H653 AromaticContact CE2-CE1 3.89Å; F618-H653 AromaticContact CE2-ND1 3.38Å; F618-H653 WeakPolarHBondContact CE2-ND1 3.35Å; F618-H653 AromaticContact CG-ND1 3.97Å; F618-H653 HydrophobicContact CZ-CB 4.04Å; F618-H653 AromaticContact CZ-CG 3.85Å; F618-H653 AromaticContact CZ-ND1 3.09Å; F618-H653 WeakPolarHBondContact CZ-ND1 3.47Å; F618-H653 PolarHBondContact O-CE1 3.37Å; D620-H653 IonicContact OD1-NE2 3.98Å
654	G	93.3	Very high	94.5	Very high	34 Å²	34	40 Å²	40	35%	0.351	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	-178	174.5	0	0	0	0	0	111.8	T661	G654-T661 PolarHBondContact N-O 3.36Å; G654-T661 PolarHBondContact O-N 3.07Å
655	Q	92	Very high	94.5	Very high	133 Å²	133	44 Å²	44	62%	0.621	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-148.4	137.2	175.8	-159.3	-176.7	12.1	0	0	110.1	G658 Y659 T661	Q655-G658 PolarHBondContact NE2-O 3.12Å; Q655-G658 VanDerWaalsContact NE2-O 3.11Å; Q655-Y659 WeakPolarHBondContact CA-O 3.26Å; Q655-Y659 WeakPolarHBondContact CG-O 3.34Å; Q655-T661 PolarHBondContact N-OG1 3.09Å
656	R	88.6	Confident	94.6	Very high	68 Å²	68	45.6 Å²	45.6	26%	0.257	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	132.6	177.9	-176	169.8	-80	-147.2	-8.6	109.7	E561 E568 G658 Y659 T661	E561-R656 IonicContact OE1-CZ 3.69Å; E561-R656 IonicContact OE1-NH1 2.85Å; E561-R656 PolarHBondContact OE1-NH1 2.71Å; E561-R656 IonicContact OE1-NH2 2.84Å; E561-R656 PolarHBondContact OE1-NH2 2.97Å; E568-R656 VanDerWaalsContact CD-NH2 3.3Å; E568-R656 IonicContact OE1-CZ 3.82Å; E568-R656 IonicContact OE1-NE 3.81Å; E568-R656 PolarHBondContact OE1-NE 2.99Å; E568-R656 IonicContact OE1-NH1 2.75Å; E568-R656 IonicContact OE1-NH2 3.66Å; E568-R656 PolarHBondContact OE1-NH2 3.5Å; E568-R656 IonicContact OE2-CZ 3.16Å; E568-R656 IonicContact OE2-NE 2.71Å; E568-R656 PolarHBondContact OE2-NE 3.48Å; E568-R656 VanDerWaalsContact OE2-NE 3.16Å; E568-R656 IonicContact OE2-NH1 3.05Å; E568-R656 PolarHBondContact OE2-NH1 3.2Å; E568-R656 IonicContact OE2-NH2 3.22Å; E568-R656 PolarHBondContact OE2-NH2 2.8Å; R656-G658 PolarHBondContact O-N 3.4Å; R656-Y659 PolarHBondContact N-O 3.21Å; R656-Y659 WeakPolarHBondContact O-CD1 3.26Å; R656-Y659 WeakPolarHBondContact O-CE1 3.46Å; R656-Y659 PolarHBondContact O-N 3.02Å; R656-Y659 VanDerWaalsContact O-O 3.13Å; R656-T661 HydrophobicContact CB-CG2 3.94Å
657	D	85.7	Confident	94.5	Very high	55 Å²	55	45.2 Å²	45.2	29%	0.294	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	42.4	35.1	-173.6	-61.3	-105.6	0	0	0	114.9	R506 L594 R598 Y659	R506-D657 WeakPolarHBondContact CD-OD1 3.39Å; R506-D657 IonicContact CZ-OD1 2.81Å; R506-D657 IonicContact NH1-OD1 3.19Å; R506-D657 PolarHBondContact NH1-OD1 3.02Å; L594-D657 HydrophobicContact CD2-CB 3.54Å; R598-D657 IonicContact CZ-OD2 3.07Å; R598-D657 IonicContact NH1-OD2 3.7Å; R598-D657 PolarHBondContact NH1-OD2 3Å; R598-D657 IonicContact NH2-OD1 3.41Å; R598-D657 PolarHBondContact NH2-OD1 2.87Å; R598-D657 IonicContact NH2-OD2 3.67Å; R598-D657 PolarHBondContact NH2-OD2 2.79Å; D657-Y659 HydrophobicContact CB-CE1 4.27Å; D657-Y659 PolarHBondContact O-N 3.12Å
658	G	87.9	Confident	94.4	Very high	33 Å²	33	51.3 Å²	51.3	34%	0.34	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	-11.5	177.1	0	0	0	0	0	116.5	R591 Q655 R656	R591-G658 VanDerWaalsContact CD-O 3.24Å; R591-G658 WeakPolarHBondContact CD-O 3.23Å; Q655-G658 PolarHBondContact NE2-O 3.12Å; Q655-G658 VanDerWaalsContact NE2-O 3.11Å; R656-G658 PolarHBondContact O-N 3.4Å
659	Y	92.2	Very high	94.1	Very high	7 Å²	7	52.2 Å²	52.2	3%	0.027	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	156.6	168.5	64.7	-95.5	0	0	0	111.3	P570 R591 L594 M595 R598 Q655 R656 D657 T661	P570-Y659 HydrophobicContact CB-CD2 4.27Å; P570-Y659 HydrophobicContact CB-CE2 3.84Å; R591-Y659 WeakPolarHBondContact O-CD1 3.21Å; L594-Y659 HydrophobicContact CD2-CE1 4.42Å; L594-Y659 HydrophobicContact CG-CE1 4.48Å; M595-Y659 HydrophobicContact CB-CD1 3.98Å; M595-Y659 HydrophobicContact CB-CD2 4.27Å; M595-Y659 HydrophobicContact CB-CE1 4.18Å; M595-Y659 HydrophobicContact CB-CE2 4.48Å; M595-Y659 HydrophobicContact CB-CG 4.04Å; M595-Y659 HydrophobicContact CG-CD1 4.42Å; M595-Y659 HydrophobicContact CG-CD2 3.82Å; M595-Y659 HydrophobicContact CG-CE2 3.96Å; M595-Y659 HydrophobicContact CG-CG 4.09Å; M595-Y659 HydrophobicContact SD-CD2 4.42Å; R598-Y659 WeakPolarHBondContact CD-OH 3.45Å; R598-Y659 PolarHBondContact NH1-OH 3.23Å; Q655-Y659 WeakPolarHBondContact CA-O 3.26Å; Q655-Y659 WeakPolarHBondContact CG-O 3.34Å; R656-Y659 PolarHBondContact N-O 3.21Å; R656-Y659 WeakPolarHBondContact O-CD1 3.26Å; R656-Y659 WeakPolarHBondContact O-CE1 3.46Å; R656-Y659 PolarHBondContact O-N 3.02Å; R656-Y659 VanDerWaalsContact O-O 3.13Å; D657-Y659 HydrophobicContact CB-CE1 4.27Å; D657-Y659 PolarHBondContact O-N 3.12Å; Y659-T661 HydrophobicContact CD2-CG2 4.27Å; Y659-T661 HydrophobicContact CE2-CG2 3.87Å
660	N	95.3	Very high	93.9	Very high	27 Å²	27	57.5 Å²	57.5	14%	0.144	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	146.9	-176.9	-66.6	-7.7	0	0	0	110.6	I571 V573 F618	I571-N660 HydrophobicContact CB-CB 4.08Å; I571-N660 PolarHBondContact N-O 3.01Å; V573-N660 WeakPolarHBondContact CG2-ND2 3.43Å; F618-N660 HydrophobicContact CD1-CB 4.18Å; F618-N660 WeakPolarHBondContact CD1-ND2 3.49Å; F618-N660 HydrophobicContact CE1-CB 3.81Å
661	T	95.7	Very high	93.7	Very high	11 Å²	11	63.2 Å²	63.2	7%	0.067	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	161.7	171	55.2	0	0	0	0	111	V569 G654 Q655 R656 Y659	V569-T661 CarbonylContact O-C 3.58Å; V569-T661 WeakPolarHBondContact O-CA 3.42Å; G654-T661 PolarHBondContact N-O 3.36Å; G654-T661 PolarHBondContact O-N 3.07Å; Q655-T661 PolarHBondContact N-OG1 3.09Å; R656-T661 HydrophobicContact CB-CG2 3.94Å; Y659-T661 HydrophobicContact CD2-CG2 4.27Å; Y659-T661 HydrophobicContact CE2-CG2 3.87Å
662	A	96.5	Very high	93.5	Very high	2 Å²	2	60.3 Å²	60.3	2%	0.017	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	144.7	173.5	0	0	0	0	0	112.3	V569 I571 F618 V650 S652 I664	V569-A662 WeakPolarHBondContact CB-O 3.46Å; V569-A662 PolarHBondContact N-O 3.45Å; V569-A662 PolarHBondContact O-N 2.7Å; I571-A662 HydrophobicContact CD1-CB 3.91Å; I571-A662 HydrophobicContact CG1-CB 3.75Å; F618-A662 HydrophobicContact CE2-CB 4.22Å; F618-A662 HydrophobicContact CZ-CB 4.19Å; V650-A662 HydrophobicContact CG1-CB 4.16Å; V650-A662 HydrophobicContact CG2-CB 4.4Å; S652-A662 WeakPolarHBondContact O-CA 3.42Å; A662-I664 HydrophobicContact CB-CG2 3.81Å
663	K	97	Very high	93.4	Very high	80 Å²	80	65.3 Å²	65.3	35%	0.348	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	132.7	153.9	-177.3	167.5	-177.6	155.6	0	107.7	N566 L651 S652	N566-K663 WeakPolarHBondContact O-CA 3.42Å; N566-K663 WeakPolarHBondContact O-CG 3.02Å; L651-K663 HydrophobicContact CB-CG 4.31Å; L651-K663 HydrophobicContact CD1-CG 4.37Å; L651-K663 PolarHBondContact N-O 3.48Å; S652-K663 PolarHBondContact N-O 3.4Å; S652-K663 PolarHBondContact O-N 3.24Å; S652-K663 WeakPolarHBondContact OG-CB 3.29Å
664	I	97.3	Very high	93.3	Very high	8 Å²	8	64.5 Å²	64.5	4%	0.041	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	165.5	-170.8	70.1	159.8	0	0	0	113.8	N566 V569 M624 F648 K649 A662 Y666	N566-I664 PolarHBondContact O-N 3.3Å; V569-I664 HydrophobicContact CB-CG2 4.25Å; V569-I664 HydrophobicContact CG2-CD1 3.74Å; V569-I664 HydrophobicContact CG2-CG1 3.72Å; V569-I664 HydrophobicContact CG2-CG2 4.03Å; M624-I664 HydrophobicContact CE-CD1 3.72Å; F648-I664 HydrophobicContact CB-CB 4.15Å; F648-I664 HydrophobicContact CB-CD1 3.69Å; F648-I664 HydrophobicContact CB-CG1 4.48Å; F648-I664 HydrophobicContact CD1-CD1 4.36Å; F648-I664 HydrophobicContact CD2-CB 4.08Å; F648-I664 HydrophobicContact CD2-CG2 3.6Å; F648-I664 HydrophobicContact CE2-CG2 4.02Å; F648-I664 HydrophobicContact CG-CB 4.3Å; F648-I664 HydrophobicContact CG-CD1 3.96Å; F648-I664 HydrophobicContact CG-CG2 4.16Å; K649-I664 CarbonylContact O-C 3.54Å; K649-I664 VanDerWaalsContact O-CA 3.26Å; K649-I664 WeakPolarHBondContact O-CA 3.27Å; A662-I664 HydrophobicContact CB-CG2 3.81Å; I664-Y666 HydrophobicContact CD1-CD1 4.37Å; I664-Y666 HydrophobicContact CD1-CD2 4.32Å; I664-Y666 HydrophobicContact CD1-CE1 3.98Å; I664-Y666 HydrophobicContact CD1-CE2 3.91Å
665	E	96.7	Very high	93.1	Very high	87 Å²	87	71.4 Å²	71.4	41%	0.407	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	121.7	168.7	174.9	176.3	-136.1	0	0	107	F648 K649 L651	F648-E665 CarbonylContact C-O 3.55Å; F648-E665 VanDerWaalsContact CA-O 3.29Å; F648-E665 WeakPolarHBondContact CA-O 3.03Å; K649-E665 PolarHBondContact N-O 2.69Å; K649-E665 IonicContact NZ-OE2 2.76Å; K649-E665 PolarHBondContact NZ-OE2 3Å; K649-E665 PolarHBondContact O-N 2.84Å; L651-E665 HydrophobicContact CD1-CB 4.1Å; L651-E665 HydrophobicContact CD2-CB 3.93Å; L651-E665 HydrophobicContact CG-CB 4.02Å
666	Y	96.2	Very high	93.1	Very high	84 Å²	84	70.1 Å²	70.1	33%	0.329	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	148.4	176.7	-73.1	-80.4	0	0	0	111.3	N566 M624 R647 I664	N566-Y666 WeakPolarHBondContact OD1-CE2 3.31Å; M624-Y666 HydrophobicContact CE-CE1 4.21Å; R647-Y666 WeakPolarHBondContact O-CA 3.5Å; I664-Y666 HydrophobicContact CD1-CD1 4.37Å; I664-Y666 HydrophobicContact CD1-CD2 4.32Å; I664-Y666 HydrophobicContact CD1-CE1 3.98Å; I664-Y666 HydrophobicContact CD1-CE2 3.91Å
667	L	94.8	Very high	93.2	Very high	22 Å²	22	69.1 Å²	69.1	12%	0.115	34%	0.341	C	S	.	.			trans	-117.4	97.4	-172.9	-67.4	-179.1	0	0	0	113	Y621 R647 K649	Y621-L667 HydrophobicContact CD1-CD1 3.63Å; Y621-L667 HydrophobicContact CE1-CD1 3.83Å; R647-L667 HydrophobicContact CB-CB 3.92Å; R647-L667 PolarHBondContact NE-O 2.77Å; R647-L667 PolarHBondContact NH2-O 2.71Å; R647-L667 PolarHBondContact O-N 3.19Å; K649-L667 HydrophobicContact CB-CD1 4.1Å; K649-L667 HydrophobicContact CB-CD2 4.11Å; K649-L667 HydrophobicContact CB-CG 4.18Å
668	E	93.6	Very high	93.6	Very high	128 Å²	128	70 Å²	70	60%	0.598	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-88.9	152.1	171.5	-53.9	-168.7	166.9	0	0	111.8	P724	E668-P724 HydrophobicContact CB-CB 4.03Å; E668-P724 HydrophobicContact CG-CB 3.74Å
669	D	92.4	Very high	93.8	Very high	20 Å²	20	73.7 Å²	73.7	11%	0.107	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-74.8	134.7	169.7	-81.3	-3.5	0	0	0	111.6	R647 K671 P724 R756	R647-D669 IonicContact CZ-OD1 3.76Å; R647-D669 IonicContact NH1-OD1 2.81Å; R647-D669 IonicContact NH2-OD1 2.74Å; R647-D669 PolarHBondContact NH2-OD1 2.99Å; D669-K671 PolarHBondContact O-N 3.4Å; D669-P724 PolarHBondContact N-O 2.89Å; D669-R756 IonicContact OD1-CZ 3.74Å; D669-R756 IonicContact OD1-NH1 2.67Å; D669-R756 PolarHBondContact OD1-NH1 2.9Å; D669-R756 IonicContact OD1-NH2 2.75Å; D669-R756 IonicContact OD2-CZ 2.7Å; D669-R756 IonicContact OD2-NH1 2.64Å; D669-R756 PolarHBondContact OD2-NH1 3.09Å; D669-R756 IonicContact OD2-NH2 3.28Å; D669-R756 PolarHBondContact OD2-NH2 3.14Å
670	R	92.6	Very high	93.9	Very high	176 Å²	176	73.5 Å²	73.5	66%	0.664	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-67.8	118.5	173	-65.4	175.2	176.7	-169.1	-2.8	109.6	N751	R670-N751 WeakPolarHBondContact CG-O 3.36Å; R670-N751 PolarHBondContact N-O 3.33Å; R670-N751 PolarHBondContact NE-ND2 3.48Å
671	K	92.9	Very high	93.9	Very high	129 Å²	129	75.2 Å²	75.2	56%	0.561	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-71.3	138.9	175	-54.5	-161.3	-176.4	-152.8	0	110.5	D669 Q721	D669-K671 PolarHBondContact O-N 3.4Å; K671-Q721 HydrophobicContact CD-CB 4.47Å; K671-Q721 WeakPolarHBondContact CE-O 3.33Å; K671-Q721 PolarHBondContact NZ-O 2.71Å
672	V	92.9	Very high	93.8	Very high	29 Å²	29	81.6 Å²	81.6	18%	0.176	39%	0.392	C	S	.	.			trans	-115.5	152.3	172.9	-59.2	0	0	0	0	110.8	E676 L677 L680 Q721	V672-E676 HydrophobicContact CB-CB 4.01Å; V672-E676 HydrophobicContact CG2-CB 4.23Å; V672-L677 HydrophobicContact CG2-CB 4.45Å; V672-L680 HydrophobicContact CG2-CB 4.22Å; V672-L680 HydrophobicContact CG2-CD2 3.52Å; V672-Q721 PolarHBondContact O-NE2 3.03Å
673	E	91.9	Very high	93.8	Very high	166 Å²	166	82.7 Å²	82.7	78%	0.776	40%	0.397	S	S	*	.			trans	-131.1	175.9	-175.7	-63.4	-174	178.3	0	0	110.7	E675 E676 L677	E673-E675 PolarHBondContact O-N 3.16Å; E673-E676 PolarHBondContact O-N 2.82Å; E673-L677 PolarHBondContact O-N 2.89Å
674	G	92.9	Very high	93.7	Very high	56 Å²	56	78.9 Å²	78.9	58%	0.577	38%	0.381	S	S	*	.	H	α-helix	trans	59.6	-134.3	174.9	0	0	0	0	0	114	E676 L677 V678	G674-E676 VanDerWaalsContact C-N 3.34Å; G674-E676 PolarHBondContact O-N 3.29Å; G674-L677 PolarHBondContact O-N 2.97Å; G674-V678 PolarHBondContact O-N 3.31Å
675	E	90.9	Very high	93.6	Very high	178 Å²	178	81.3 Å²	81.3	83%	0.832	39%	0.394	S	S	*	.	H	α-helix	trans	-65.9	-34.8	-177.2	-60.3	-170.9	158.3	0	0	112.7	E673 L677 V678 E679	E673-E675 PolarHBondContact O-N 3.16Å; E675-L677 VanDerWaalsContact C-N 3.29Å; E675-L677 PolarHBondContact O-N 3.09Å; E675-V678 PolarHBondContact O-N 3.11Å; E675-V678 VanDerWaalsContact O-N 3.12Å; E675-E679 PolarHBondContact O-N 2.92Å
676	E	90.6	Very high	93.6	Very high	107 Å²	107	79.2 Å²	79.2	50%	0.5	39%	0.388	S	S	.	.	H	α-helix	trans	-65.1	-34	178.2	-65.2	-160.1	155.5	0	0	112.3	V672 E673 G674 E679 L680	V672-E676 HydrophobicContact CB-CB 4.01Å; V672-E676 HydrophobicContact CG2-CB 4.23Å; E673-E676 PolarHBondContact O-N 2.82Å; G674-E676 VanDerWaalsContact C-N 3.34Å; G674-E676 PolarHBondContact O-N 3.29Å; E676-E679 PolarHBondContact O-N 2.75Å; E676-L680 VanDerWaalsContact O-CB 3.3Å; E676-L680 WeakPolarHBondContact O-CB 3.46Å; E676-L680 PolarHBondContact O-N 3.03Å
677	L	91.9	Very high	93.5	Very high	47 Å²	47	75.2 Å²	75.2	25%	0.246	37%	0.373	C	S	.	.	H	α-helix	trans	-65.4	-39.9	172.7	178.9	55.7	0	0	0	111.6	V672 E673 G674 E675 E679 L680 L681	V672-L677 HydrophobicContact CG2-CB 4.45Å; E673-L677 PolarHBondContact O-N 2.89Å; G674-L677 PolarHBondContact O-N 2.97Å; E675-L677 VanDerWaalsContact C-N 3.29Å; E675-L677 PolarHBondContact O-N 3.09Å; L677-E679 VanDerWaalsContact C-N 3.33Å; L677-E679 PolarHBondContact O-N 2.88Å; L677-L680 PolarHBondContact O-N 3.42Å; L677-L681 HydrophobicContact CD1-CD1 4.09Å; L677-L681 HydrophobicContact CD1-CG 4.02Å; L677-L681 HydrophobicContact CG-CD1 4.08Å; L677-L681 HydrophobicContact CG-CG 4.48Å; L677-L681 VanDerWaalsContact O-CG 3.32Å; L677-L681 WeakPolarHBondContact O-CG 3.24Å; L677-L681 PolarHBondContact O-N 3.27Å
678	V	92.8	Very high	93.6	Very high	72 Å²	72	75.5 Å²	75.5	44%	0.436	37%	0.373	S	S	.	.	H	α-helix	trans	-66.3	-35.5	176.6	177.8	0	0	0	0	111.4	G674 E675 K682	G674-V678 PolarHBondContact O-N 3.31Å; E675-V678 PolarHBondContact O-N 3.11Å; E675-V678 VanDerWaalsContact O-N 3.12Å; V678-K682 HydrophobicContact CG1-CD 4.41Å; V678-K682 WeakPolarHBondContact O-CD 3.43Å; V678-K682 VanDerWaalsContact O-CG 3.25Å; V678-K682 WeakPolarHBondContact O-CG 3.44Å; V678-K682 PolarHBondContact O-N 3.46Å
679	E	93.8	Very high	93.7	Very high	112 Å²	112	73.3 Å²	73.3	52%	0.523	37%	0.365	S	S	.	.	H	α-helix	trans	-68	-44	169.5	-67.9	-160	145.3	0	0	112.6	E675 E676 L677 L681 K682 L683 K754	E675-E679 PolarHBondContact O-N 2.92Å; E676-E679 PolarHBondContact O-N 2.75Å; L677-E679 VanDerWaalsContact C-N 3.33Å; L677-E679 PolarHBondContact O-N 2.88Å; E679-L681 PolarHBondContact O-N 3.44Å; E679-K682 PolarHBondContact O-N 2.98Å; E679-L683 WeakPolarHBondContact O-CB 3.39Å; E679-L683 PolarHBondContact O-N 3.43Å; E679-K754 WeakPolarHBondContact OE2-CE 3.31Å; E679-K754 IonicContact OE2-NZ 2.66Å; E679-K754 PolarHBondContact OE2-NZ 3.45Å
680	L	94	Very high	93.8	Very high	2 Å²	2	74.8 Å²	74.8	1%	0.01	37%	0.371	C	S	.	.	H	α-helix	trans	-61	-44.7	-178.8	177.6	60.5	0	0	0	111.6	V672 E676 L677 L683 H684 Q721 L753 K754 L757	V672-L680 HydrophobicContact CG2-CB 4.22Å; V672-L680 HydrophobicContact CG2-CD2 3.52Å; E676-L680 VanDerWaalsContact O-CB 3.3Å; E676-L680 WeakPolarHBondContact O-CB 3.46Å; E676-L680 PolarHBondContact O-N 3.03Å; L677-L680 PolarHBondContact O-N 3.42Å; L680-L683 PolarHBondContact O-N 3.03Å; L680-H684 VanDerWaalsContact O-CB 3.25Å; L680-H684 WeakPolarHBondContact O-CB 3.18Å; L680-H684 PolarHBondContact O-N 3.25Å; L680-Q721 HydrophobicContact CD2-CG 4.1Å; L680-L753 HydrophobicContact CD1-CB 4.32Å; L680-L753 HydrophobicContact CD1-CD2 4.26Å; L680-L753 HydrophobicContact CD1-CG 4.09Å; L680-L753 HydrophobicContact CD2-CD2 4.35Å; L680-K754 HydrophobicContact CD1-CB 4.16Å; L680-L757 HydrophobicContact CD1-CD1 3.76Å
681	L	94.2	Very high	93.8	Very high	64 Å²	64	66.4 Å²	66.4	34%	0.335	34%	0.34	S	S	.	.	H	α-helix	trans	-63.5	-44.2	177.5	-69.8	168.6	0	0	0	111.8	L677 E679 L683 H684 D685 P720	L677-L681 HydrophobicContact CD1-CD1 4.09Å; L677-L681 HydrophobicContact CD1-CG 4.02Å; L677-L681 HydrophobicContact CG-CD1 4.08Å; L677-L681 HydrophobicContact CG-CG 4.48Å; L677-L681 VanDerWaalsContact O-CG 3.32Å; L677-L681 WeakPolarHBondContact O-CG 3.24Å; L677-L681 PolarHBondContact O-N 3.27Å; E679-L681 PolarHBondContact O-N 3.44Å; L681-L683 VanDerWaalsContact C-N 3.31Å; L681-L683 PolarHBondContact O-N 2.96Å; L681-H684 PolarHBondContact O-N 3.45Å; L681-D685 WeakPolarHBondContact O-CB 3.3Å; L681-D685 PolarHBondContact O-N 2.86Å; L681-P720 HydrophobicContact CD2-CG 3.84Å
682	K	94.6	Very high	93.9	Very high	145 Å²	145	63.1 Å²	63.1	63%	0.63	33%	0.328	S	S	*	.	H	α-helix	trans	-61.6	-38.3	174.9	-70.9	168.3	-174.1	170.5	0	112.2	V678 E679 S686	V678-K682 HydrophobicContact CG1-CD 4.41Å; V678-K682 WeakPolarHBondContact O-CD 3.43Å; V678-K682 VanDerWaalsContact O-CG 3.25Å; V678-K682 WeakPolarHBondContact O-CG 3.44Å; V678-K682 PolarHBondContact O-N 3.46Å; E679-K682 PolarHBondContact O-N 2.98Å; K682-S686 VanDerWaalsContact O-CB 3.27Å; K682-S686 WeakPolarHBondContact O-CB 3.27Å; K682-S686 PolarHBondContact O-N 3.49Å; K682-S686 VanDerWaalsContact O-N 3.13Å
683	L	95.5	Very high	93.9	Very high	24 Å²	24	66.8 Å²	66.8	13%	0.126	35%	0.347	C	S	.	.	H	α-helix	trans	-70.2	-46.5	176.4	177.9	65.5	0	0	0	111.6	E679 L680 L681 S686 V687 K754 L757 I758	E679-L683 WeakPolarHBondContact O-CB 3.39Å; E679-L683 PolarHBondContact O-N 3.43Å; L680-L683 PolarHBondContact O-N 3.03Å; L681-L683 VanDerWaalsContact C-N 3.31Å; L681-L683 PolarHBondContact O-N 2.96Å; L683-S686 PolarHBondContact O-N 3.32Å; L683-V687 HydrophobicContact CD1-CG2 3.87Å; L683-V687 HydrophobicContact CG-CG2 4.37Å; L683-V687 WeakPolarHBondContact O-CB 3.27Å; L683-V687 VanDerWaalsContact O-CG2 3.27Å; L683-V687 WeakPolarHBondContact O-CG2 3.48Å; L683-V687 PolarHBondContact O-N 2.85Å; L683-K754 HydrophobicContact CD2-CG 4.09Å; L683-L757 HydrophobicContact CD2-CB 3.81Å; L683-L757 HydrophobicContact CD2-CD1 4.34Å; L683-L757 HydrophobicContact CG-CB 4Å; L683-L757 HydrophobicContact CG-CD1 4.31Å; L683-I758 HydrophobicContact CD2-CG1 3.97Å
684	H	95.6	Very high	93.9	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-53.8	-54	177.1	171.6	-102.1	0	0	0	111	L680 L681 S686 V687 Y688 K716 D717 W729 L757	L680-H684 VanDerWaalsContact O-CB 3.25Å; L680-H684 WeakPolarHBondContact O-CB 3.18Å; L680-H684 PolarHBondContact O-N 3.25Å; L681-H684 PolarHBondContact O-N 3.45Å; H684-S686 PolarHBondContact O-N 3.27Å; H684-V687 PolarHBondContact O-N 3.26Å; H684-Y688 WeakPolarHBondContact O-CB 3.33Å; H684-Y688 PolarHBondContact O-N 2.9Å; H684-K716 VanDerWaalsContact CE1-CG 3.49Å; H684-K716 WeakPolarHBondContact CE1-CG 3.21Å; H684-D717 PolarHBondContact CE1-O 3.02Å; H684-W729 AromaticContact CD2-CE2 3.97Å; H684-W729 AromaticContact CD2-CZ2 3.59Å; H684-W729 AromaticContact CD2-NE1 3.71Å; H684-W729 AromaticContact CE1-NE1 3.92Å; H684-W729 AromaticContact NE2-CE2 3.68Å; H684-W729 AromaticContact NE2-CZ2 3.78Å; H684-W729 AromaticContact NE2-NE1 2.98Å; H684-W729 PolarHBondContact NE2-NE1 2.72Å; H684-L757 HydrophobicContact CB-CD1 3.98Å
685	D	94.9	Very high	93.9	Very high	59 Å²	59	57.5 Å²	57.5	32%	0.316	29%	0.287	S	S	.	.	H	α-helix	trans	-57.6	-51.2	177.2	-81.4	14.9	0	0	0	111.8	L681 V687 Y688 D689 K716	L681-D685 WeakPolarHBondContact O-CB 3.3Å; L681-D685 PolarHBondContact O-N 2.86Å; D685-V687 VanDerWaalsContact C-N 3.28Å; D685-V687 PolarHBondContact O-N 2.8Å; D685-Y688 PolarHBondContact O-N 3.13Å; D685-D689 PolarHBondContact O-N 3.02Å; D685-K716 WeakPolarHBondContact OD1-CD 3.21Å; D685-K716 WeakPolarHBondContact OD1-CE 3.5Å; D685-K716 IonicContact OD1-NZ 2.61Å; D685-K716 PolarHBondContact OD1-NZ 2.98Å; D685-K716 IonicContact OD2-NZ 3Å; D685-K716 PolarHBondContact OD2-NZ 2.9Å
686	S	95.6	Very high	93.9	Very high	42 Å²	42	52.5 Å²	52.5	29%	0.294	27%	0.269	S	S	.	.	H	α-helix	trans	-58.9	-39	179.7	-174.4	0	0	0	0	112.5	K682 L683 H684 Q690	K682-S686 VanDerWaalsContact O-CB 3.27Å; K682-S686 WeakPolarHBondContact O-CB 3.27Å; K682-S686 PolarHBondContact O-N 3.49Å; K682-S686 VanDerWaalsContact O-N 3.13Å; L683-S686 PolarHBondContact O-N 3.32Å; H684-S686 PolarHBondContact O-N 3.27Å; S686-Q690 VanDerWaalsContact C-NE2 3.31Å; S686-Q690 WeakPolarHBondContact O-CG 3.48Å; S686-Q690 PolarHBondContact O-N 3.19Å; S686-Q690 VanDerWaalsContact O-N 3.11Å; S686-Q690 PolarHBondContact O-NE2 3.28Å; S686-Q690 PolarHBondContact OG-NE2 2.82Å
687	V	96.1	Very high	93.9	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-78.5	-35.7	-179.6	-179.1	0	0	0	0	111.7	L683 H684 D685 Q690 A691 W729 L757 I760 R761 L764	L683-V687 HydrophobicContact CD1-CG2 3.87Å; L683-V687 HydrophobicContact CG-CG2 4.37Å; L683-V687 WeakPolarHBondContact O-CB 3.27Å; L683-V687 VanDerWaalsContact O-CG2 3.27Å; L683-V687 WeakPolarHBondContact O-CG2 3.48Å; L683-V687 PolarHBondContact O-N 2.85Å; H684-V687 PolarHBondContact O-N 3.26Å; D685-V687 VanDerWaalsContact C-N 3.28Å; D685-V687 PolarHBondContact O-N 2.8Å; V687-Q690 PolarHBondContact O-N 3.07Å; V687-A691 WeakPolarHBondContact O-CB 3.28Å; V687-A691 PolarHBondContact O-N 3.07Å; V687-W729 HydrophobicContact CB-CH2 4.12Å; V687-W729 HydrophobicContact CG1-CH2 3.81Å; V687-W729 HydrophobicContact CG1-CZ3 4.23Å; V687-L757 HydrophobicContact CB-CD2 4.21Å; V687-L757 HydrophobicContact CG1-CD2 4.22Å; V687-I760 HydrophobicContact CG1-CB 4.44Å; V687-I760 HydrophobicContact CG1-CG2 3.71Å; V687-R761 HydrophobicContact CG1-CB 4.39Å; V687-R761 HydrophobicContact CG2-CB 3.79Å; V687-R761 HydrophobicContact CG2-CG 3.95Å; V687-L764 HydrophobicContact CG1-CD1 4.16Å
688	Y	96.3	Very high	93.8	Very high	29 Å²	29	48.7 Å²	48.7	11%	0.114	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-46.9	170.9	-175.8	-85.6	0	0	0	110.9	H684 D685 Q690 A691 N692 P714 K716 W729	H684-Y688 WeakPolarHBondContact O-CB 3.33Å; H684-Y688 PolarHBondContact O-N 2.9Å; D685-Y688 PolarHBondContact O-N 3.13Å; Y688-Q690 VanDerWaalsContact C-N 3.33Å; Y688-Q690 PolarHBondContact O-N 3.21Å; Y688-A691 WeakPolarHBondContact O-CB 3.29Å; Y688-A691 PolarHBondContact O-N 3.02Å; Y688-A691 VanDerWaalsContact O-N 3.09Å; Y688-N692 HydrophobicContact CE1-CB 4.25Å; Y688-N692 WeakPolarHBondContact O-CB 3.34Å; Y688-N692 PolarHBondContact O-N 2.92Å; Y688-P714 WeakPolarHBondContact CE2-O 3.39Å; Y688-P714 PolarHBondContact OH-O 2.9Å; Y688-P714 VanDerWaalsContact OH-O 3.06Å; Y688-K716 HydrophobicContact CD1-CB 3.87Å; Y688-K716 HydrophobicContact CD1-CD 3.93Å; Y688-K716 HydrophobicContact CD1-CG 4.07Å; Y688-K716 HydrophobicContact CD2-CB 3.77Å; Y688-K716 HydrophobicContact CD2-CD 4.49Å; Y688-K716 HydrophobicContact CD2-CG 3.86Å; Y688-K716 HydrophobicContact CE1-CB 3.81Å; Y688-K716 HydrophobicContact CE2-CB 3.7Å; Y688-K716 HydrophobicContact CE2-CG 4.31Å; Y688-K716 HydrophobicContact CG-CB 3.86Å; Y688-K716 HydrophobicContact CG-CD 3.86Å; Y688-K716 HydrophobicContact CG-CG 3.73Å; Y688-K716 PolarHBondContact OH-N 3.39Å; Y688-W729 HydrophobicContact CD2-CB 4.41Å; Y688-W729 AromaticContact CD2-CD1 3.8Å; Y688-W729 AromaticContact CD2-CD2 3.63Å; Y688-W729 HydrophobicContact CD2-CD2 3.63Å; Y688-W729 AromaticContact CD2-CE2 3.69Å; Y688-W729 HydrophobicContact CD2-CE3 4.18Å; Y688-W729 AromaticContact CD2-CG 3.72Å; Y688-W729 HydrophobicContact CD2-CG 3.72Å; Y688-W729 HydrophobicContact CD2-CZ2 4.27Å; Y688-W729 AromaticContact CD2-NE1 3.77Å; Y688-W729 HydrophobicContact CE2-CB 4.17Å; Y688-W729 HydrophobicContact CE2-CD2 4.28Å; Y688-W729 AromaticContact CE2-CG 3.93Å; Y688-W729 HydrophobicContact CE2-CG 3.93Å
689	D	94.7	Very high	93.6	Very high	81 Å²	81	52.7 Å²	52.7	43%	0.433	27%	0.269	S	S	.	.	H	α-helix	trans	-64.1	-38.2	178.1	-69.7	-20.4	0	0	0	111.7	D685 N693	D685-D689 PolarHBondContact O-N 3.02Å; D689-N693 VanDerWaalsContact O-CB 3.27Å; D689-N693 WeakPolarHBondContact O-CB 3.25Å; D689-N693 PolarHBondContact O-N 3.34Å; D689-N693 PolarHBondContact O-ND2 2.87Å
690	Q	94.3	Very high	93.4	Very high	52 Å²	52	53.1 Å²	53.1	24%	0.243	28%	0.275	C	S	.	.	H	α-helix	trans	-62.9	-39.2	171.5	-79.3	162.3	100.8	0	0	112.1	S686 V687 Y688 W694 R761 L764	S686-Q690 VanDerWaalsContact C-NE2 3.31Å; S686-Q690 WeakPolarHBondContact O-CG 3.48Å; S686-Q690 PolarHBondContact O-N 3.19Å; S686-Q690 VanDerWaalsContact O-N 3.11Å; S686-Q690 PolarHBondContact O-NE2 3.28Å; S686-Q690 PolarHBondContact OG-NE2 2.82Å; V687-Q690 PolarHBondContact O-N 3.07Å; Y688-Q690 VanDerWaalsContact C-N 3.33Å; Y688-Q690 PolarHBondContact O-N 3.21Å; Q690-W694 VanDerWaalsContact O-CB 3.31Å; Q690-W694 WeakPolarHBondContact O-CB 3.46Å; Q690-W694 PolarHBondContact O-N 3.35Å; Q690-R761 VanDerWaalsContact NE2-NE 3.15Å; Q690-L764 HydrophobicContact CB-CD1 4.08Å
691	A	94.4	Very high	93.2	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-68.9	-45.8	177.8	0	0	0	0	0	112.4	V687 Y688 W694 F695 W729 L733 L764	V687-A691 WeakPolarHBondContact O-CB 3.28Å; V687-A691 PolarHBondContact O-N 3.07Å; Y688-A691 WeakPolarHBondContact O-CB 3.29Å; Y688-A691 PolarHBondContact O-N 3.02Å; Y688-A691 VanDerWaalsContact O-N 3.09Å; A691-W694 PolarHBondContact O-N 3.49Å; A691-F695 WeakPolarHBondContact O-CB 3.41Å; A691-F695 PolarHBondContact O-N 3.08Å; A691-W729 HydrophobicContact CB-CZ3 4.23Å; A691-L733 HydrophobicContact CB-CD1 4.44Å; A691-L733 HydrophobicContact CB-CD2 3.66Å; A691-L764 HydrophobicContact CB-CD1 4.06Å
692	N	94.2	Very high	92.8	Very high	60 Å²	60	59.3 Å²	59.3	32%	0.321	31%	0.306	S	S	.	.	H	α-helix	trans	-62.5	-47.5	176.8	-176.5	33.8	0	0	0	111.2	Y688 W694 F695 T696 L713	Y688-N692 HydrophobicContact CE1-CB 4.25Å; Y688-N692 WeakPolarHBondContact O-CB 3.34Å; Y688-N692 PolarHBondContact O-N 2.92Å; N692-W694 VanDerWaalsContact C-N 3.32Å; N692-W694 PolarHBondContact O-N 2.67Å; N692-F695 PolarHBondContact O-N 3.28Å; N692-F695 VanDerWaalsContact O-N 3.16Å; N692-T696 WeakPolarHBondContact O-CG2 3.37Å; N692-T696 PolarHBondContact O-N 2.84Å; N692-T696 PolarHBondContact O-OG1 2.85Å; N692-T696 VanDerWaalsContact O-OG1 3.07Å; N692-L713 HydrophobicContact CB-CD2 4.14Å
693	N	93.1	Very high	92.6	Very high	105 Å²	105	55 Å²	55	56%	0.561	29%	0.288	S	S	*	.	H	α-helix	trans	-61.1	-38.3	174.9	-77.2	-57.8	0	0	0	112.5	D689 T696 S697	D689-N693 VanDerWaalsContact O-CB 3.27Å; D689-N693 WeakPolarHBondContact O-CB 3.25Å; D689-N693 PolarHBondContact O-N 3.34Å; D689-N693 PolarHBondContact O-ND2 2.87Å; N693-T696 WeakPolarHBondContact CA-OG1 3.39Å; N693-T696 PolarHBondContact O-OG1 3.32Å; N693-S697 VanDerWaalsContact O-CB 3.26Å; N693-S697 WeakPolarHBondContact O-CB 3.37Å; N693-S697 PolarHBondContact O-N 3.4Å; N693-S697 VanDerWaalsContact O-N 3.09Å; N693-S697 PolarHBondContact O-OG 2.79Å
694	W	92.4	Very high	92.3	Very high	12 Å²	12	57.4 Å²	57.4	5%	0.045	31%	0.306	C	S	.	.	H	α-helix	trans	-62.9	-45.2	172.8	166	85.5	0	0	0	111.7	Q690 A691 N692 S697 L698 L733 V736 L737 L764 T768	Q690-W694 VanDerWaalsContact O-CB 3.31Å; Q690-W694 WeakPolarHBondContact O-CB 3.46Å; Q690-W694 PolarHBondContact O-N 3.35Å; A691-W694 PolarHBondContact O-N 3.49Å; N692-W694 VanDerWaalsContact C-N 3.32Å; N692-W694 PolarHBondContact O-N 2.67Å; W694-S697 PolarHBondContact O-N 2.85Å; W694-S697 PolarHBondContact O-OG 3.35Å; W694-L698 HydrophobicContact CH2-CD1 4.17Å; W694-L698 HydrophobicContact CZ2-CD1 4.32Å; W694-L698 HydrophobicContact CZ2-CD2 4.41Å; W694-L698 HydrophobicContact CZ3-CD1 4.39Å; W694-L698 PolarHBondContact O-N 3.02Å; W694-L733 HydrophobicContact CE3-CD1 3.91Å; W694-L733 HydrophobicContact CH2-CD1 4.33Å; W694-L733 HydrophobicContact CZ3-CD1 3.59Å; W694-V736 HydrophobicContact CH2-CG1 3.97Å; W694-L737 HydrophobicContact CH2-CD2 3.84Å; W694-L737 HydrophobicContact CH2-CG 4.44Å; W694-L737 HydrophobicContact CZ2-CD2 3.55Å; W694-L737 HydrophobicContact CZ3-CD2 4.46Å; W694-L764 HydrophobicContact CB-CD2 4.09Å; W694-L764 HydrophobicContact CD2-CD2 4.15Å; W694-L764 HydrophobicContact CE3-CD2 4.4Å; W694-L764 HydrophobicContact CG-CD2 4.01Å; W694-T768 HydrophobicContact CB-CG2 4.41Å; W694-T768 HydrophobicContact CG-CG2 4.48Å
695	F	91.6	Very high	92	Very high	15 Å²	15	63.9 Å²	63.9	7%	0.066	34%	0.337	C	S	.	.	H	α-helix	trans	-68.1	-41.5	-179.1	179.4	-111.2	0	0	0	112.7	A691 N692 S697 L698 K703 I706 L707 L713 W732	A691-F695 WeakPolarHBondContact O-CB 3.41Å; A691-F695 PolarHBondContact O-N 3.08Å; N692-F695 PolarHBondContact O-N 3.28Å; N692-F695 VanDerWaalsContact O-N 3.16Å; F695-S697 VanDerWaalsContact C-N 3.26Å; F695-S697 PolarHBondContact O-N 3.39Å; F695-L698 HydrophobicContact CD2-CD1 3.65Å; F695-L698 HydrophobicContact CE2-CD1 4.22Å; F695-L698 WeakPolarHBondContact O-CB 3.25Å; F695-L698 PolarHBondContact O-N 2.84Å; F695-K703 HydrophobicContact CE1-CG 4.48Å; F695-K703 HydrophobicContact CE2-CG 4.07Å; F695-K703 HydrophobicContact CZ-CG 3.87Å; F695-I706 HydrophobicContact CE2-CB 4.48Å; F695-I706 HydrophobicContact CE2-CG2 3.98Å; F695-L707 HydrophobicContact CZ-CD2 3.91Å; F695-L707 HydrophobicContact CZ-CG 4.17Å; F695-L713 HydrophobicContact CD1-CB 4.4Å; F695-W732 AromaticContact CD2-CH2 3.73Å; F695-W732 HydrophobicContact CD2-CH2 3.73Å; F695-W732 HydrophobicContact CD2-CZ3 4.39Å; F695-W732 AromaticContact CE2-CH2 3.71Å; F695-W732 HydrophobicContact CE2-CH2 3.71Å; F695-W732 HydrophobicContact CE2-CZ2 4.36Å; F695-W732 HydrophobicContact CG-CH2 4.36Å; F695-W732 HydrophobicContact CZ-CH2 4.29Å
696	T	91.2	Very high	91.8	Very high	74 Å²	74	62.1 Å²	62.1	45%	0.454	33%	0.327	S	S	.	.	H	α-helix	trans	-67.8	-26.5	174.6	56	0	0	0	0	112.6	N692 N693 L698	N692-T696 WeakPolarHBondContact O-CG2 3.37Å; N692-T696 PolarHBondContact O-N 2.84Å; N692-T696 PolarHBondContact O-OG1 2.85Å; N692-T696 VanDerWaalsContact O-OG1 3.07Å; N693-T696 WeakPolarHBondContact CA-OG1 3.39Å; N693-T696 PolarHBondContact O-OG1 3.32Å; T696-L698 VanDerWaalsContact C-N 3.3Å; T696-L698 PolarHBondContact O-N 2.85Å
697	S	90.8	Very high	91.5	Very high	60 Å²	60	62.6 Å²	62.6	42%	0.42	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	2.5	173.6	81.7	0	0	0	0	115.4	N693 W694 F695 R771	N693-S697 VanDerWaalsContact O-CB 3.26Å; N693-S697 WeakPolarHBondContact O-CB 3.37Å; N693-S697 PolarHBondContact O-N 3.4Å; N693-S697 VanDerWaalsContact O-N 3.09Å; N693-S697 PolarHBondContact O-OG 2.79Å; W694-S697 PolarHBondContact O-N 2.85Å; W694-S697 PolarHBondContact O-OG 3.35Å; F695-S697 VanDerWaalsContact C-N 3.26Å; F695-S697 PolarHBondContact O-N 3.39Å; S697-R771 PolarHBondContact O-NH1 3.37Å; S697-R771 PolarHBondContact OG-NH1 3.47Å
698	L	89.3	Confident	91.1	Very high	14 Å²	14	67.7 Å²	67.7	7%	0.073	36%	0.361	C	S	.	.	S	Bend	trans	-75.3	145.7	174.9	-73	165.4	0	0	0	110.9	W694 F695 T696 M702 K703 I706	W694-L698 HydrophobicContact CH2-CD1 4.17Å; W694-L698 HydrophobicContact CZ2-CD1 4.32Å; W694-L698 HydrophobicContact CZ2-CD2 4.41Å; W694-L698 HydrophobicContact CZ3-CD1 4.39Å; W694-L698 PolarHBondContact O-N 3.02Å; F695-L698 HydrophobicContact CD2-CD1 3.65Å; F695-L698 HydrophobicContact CE2-CD1 4.22Å; F695-L698 WeakPolarHBondContact O-CB 3.25Å; F695-L698 PolarHBondContact O-N 2.84Å; T696-L698 VanDerWaalsContact C-N 3.3Å; T696-L698 PolarHBondContact O-N 2.85Å; L698-M702 HydrophobicContact CD2-CE 4.13Å; L698-M702 HydrophobicContact CD2-SD 4.3Å; L698-K703 HydrophobicContact CB-CB 4.32Å; L698-I706 HydrophobicContact CD1-CD1 3.7Å
699	K	89.4	Confident	90.6	Very high	155 Å²	155	72.6 Å²	72.6	67%	0.674	39%	0.385	S	S	*	.			trans	-62.6	142.8	170.1	-64.6	-177.2	178.3	-177.6	0	109.5	N701 M702 K703	K699-N701 VanDerWaalsContact CB-OD1 3.26Å; K699-N701 WeakPolarHBondContact CB-OD1 3.5Å; K699-N701 PolarHBondContact O-N 3.03Å; K699-N701 VanDerWaalsContact O-N 3.12Å; K699-M702 PolarHBondContact O-N 3.24Å; K699-K703 PolarHBondContact O-N 2.98Å
700	D	89	Confident	90.2	Very high	121 Å²	121	71.5 Å²	71.5	65%	0.647	38%	0.377	S	S	*	.	H	α-helix	trans	-58	-33.3	-170.7	-59.5	-65.4	0	0	0	113.4	K703 S704	D700-K703 PolarHBondContact O-N 2.79Å; D700-S704 WeakPolarHBondContact O-CB 3.27Å; D700-S704 PolarHBondContact O-N 3.03Å; D700-S704 PolarHBondContact O-OG 3.49Å
701	N	89.3	Confident	89.9	Confident	105 Å²	105	70.4 Å²	70.4	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-61.6	-47.4	174.9	65.4	-26.8	0	0	0	113	K699 K703 Q705	K699-N701 VanDerWaalsContact CB-OD1 3.26Å; K699-N701 WeakPolarHBondContact CB-OD1 3.5Å; K699-N701 PolarHBondContact O-N 3.03Å; K699-N701 VanDerWaalsContact O-N 3.12Å; N701-K703 VanDerWaalsContact C-N 3.35Å; N701-Q705 WeakPolarHBondContact O-CG 3.5Å; N701-Q705 PolarHBondContact O-N 2.82Å; N701-Q705 VanDerWaalsContact O-N 3.12Å
702	M	86.5	Confident	89.7	Confident	92 Å²	92	77.2 Å²	77.2	45%	0.453	41%	0.411	S	S	.	.	H	α-helix	trans	-65.6	-41.3	175.6	-62.3	-179.7	72	0	0	110.9	L698 K699 Q705 I706	L698-M702 HydrophobicContact CD2-CE 4.13Å; L698-M702 HydrophobicContact CD2-SD 4.3Å; K699-M702 PolarHBondContact O-N 3.24Å; M702-Q705 PolarHBondContact O-N 2.81Å; M702-I706 WeakPolarHBondContact O-CD1 3.3Å; M702-I706 VanDerWaalsContact O-CG1 3.29Å; M702-I706 WeakPolarHBondContact O-CG1 3.37Å; M702-I706 PolarHBondContact O-N 2.83Å
703	K	89.7	Confident	89.7	Confident	55 Å²	55	75.4 Å²	75.4	24%	0.239	40%	0.401	C	S	.	.	H	α-helix	trans	-62.7	-45.5	179.7	-165.6	177.7	-179	-177.9	0	111.4	F695 L698 K699 D700 N701 I706 L707	F695-K703 HydrophobicContact CE1-CG 4.48Å; F695-K703 HydrophobicContact CE2-CG 4.07Å; F695-K703 HydrophobicContact CZ-CG 3.87Å; L698-K703 HydrophobicContact CB-CB 4.32Å; K699-K703 PolarHBondContact O-N 2.98Å; D700-K703 PolarHBondContact O-N 2.79Å; N701-K703 VanDerWaalsContact C-N 3.35Å; K703-I706 PolarHBondContact O-N 2.93Å; K703-L707 HydrophobicContact CG-CD1 4.38Å; K703-L707 WeakPolarHBondContact O-CB 3.3Å; K703-L707 VanDerWaalsContact O-CG 3.25Å; K703-L707 WeakPolarHBondContact O-CG 3.47Å; K703-L707 PolarHBondContact O-N 3.05Å
704	S	90.3	Very high	89.7	Confident	74 Å²	74	72.2 Å²	72.2	52%	0.517	39%	0.386	S	S	.	.	H	α-helix	trans	-62.8	-40.3	174.7	-64.9	0	0	0	0	112.8	D700 L707 S708	D700-S704 WeakPolarHBondContact O-CB 3.27Å; D700-S704 PolarHBondContact O-N 3.03Å; D700-S704 PolarHBondContact O-OG 3.49Å; S704-L707 PolarHBondContact O-N 2.97Å; S704-S708 VanDerWaalsContact O-CB 3.26Å; S704-S708 WeakPolarHBondContact O-CB 3.38Å; S704-S708 PolarHBondContact O-N 3.47Å
705	Q	89.8	Confident	89.7	Confident	136 Å²	136	76.1 Å²	76.1	64%	0.636	42%	0.415	S	S	*	.	H	α-helix	trans	-62.2	-44.6	175.1	-75.3	173.1	-25.7	0	0	112	N701 M702 S708 H709	N701-Q705 WeakPolarHBondContact O-CG 3.5Å; N701-Q705 PolarHBondContact O-N 2.82Å; N701-Q705 VanDerWaalsContact O-N 3.12Å; M702-Q705 PolarHBondContact O-N 2.81Å; Q705-S708 PolarHBondContact O-N 3.39Å; Q705-H709 PolarHBondContact O-N 3.43Å
706	I	89.6	Confident	89.6	Confident	23 Å²	23	78.8 Å²	78.8	12%	0.118	43%	0.427	C	S	.	.	H	α-helix	trans	-63.8	-48.9	177.4	-68.1	162.3	0	0	0	110.6	F695 L698 M702 K703 S708 H709 F710 W732 V736	F695-I706 HydrophobicContact CE2-CB 4.48Å; F695-I706 HydrophobicContact CE2-CG2 3.98Å; L698-I706 HydrophobicContact CD1-CD1 3.7Å; M702-I706 WeakPolarHBondContact O-CD1 3.3Å; M702-I706 VanDerWaalsContact O-CG1 3.29Å; M702-I706 WeakPolarHBondContact O-CG1 3.37Å; M702-I706 PolarHBondContact O-N 2.83Å; K703-I706 PolarHBondContact O-N 2.93Å; I706-S708 VanDerWaalsContact C-N 3.25Å; I706-S708 PolarHBondContact O-N 3.45Å; I706-H709 PolarHBondContact O-N 3.42Å; I706-H709 VanDerWaalsContact O-N 3.14Å; I706-F710 HydrophobicContact CG2-CD2 4.43Å; I706-F710 PolarHBondContact O-N 2.91Å; I706-W732 HydrophobicContact CG2-CH2 3.73Å; I706-W732 HydrophobicContact CG2-CZ2 3.58Å; I706-V736 HydrophobicContact CB-CG1 4.45Å; I706-V736 HydrophobicContact CD1-CG1 3.7Å; I706-V736 HydrophobicContact CG1-CG1 3.86Å; I706-V736 HydrophobicContact CG2-CG1 3.71Å; I706-V736 HydrophobicContact CG2-CG2 3.96Å
707	L	90.6	Very high	89.4	Confident	51 Å²	51	77.7 Å²	77.7	27%	0.267	42%	0.418	S	S	.	.	H	α-helix	trans	-58.2	-37.4	177	-71.1	174	0	0	0	112.4	F695 K703 S704 H709 G711 H712	F695-L707 HydrophobicContact CZ-CD2 3.91Å; F695-L707 HydrophobicContact CZ-CG 4.17Å; K703-L707 HydrophobicContact CG-CD1 4.38Å; K703-L707 WeakPolarHBondContact O-CB 3.3Å; K703-L707 VanDerWaalsContact O-CG 3.25Å; K703-L707 WeakPolarHBondContact O-CG 3.47Å; K703-L707 PolarHBondContact O-N 3.05Å; S704-L707 PolarHBondContact O-N 2.97Å; L707-H709 VanDerWaalsContact C-N 3.3Å; L707-H709 PolarHBondContact O-N 2.74Å; L707-G711 VanDerWaalsContact O-CA 3.28Å; L707-G711 WeakPolarHBondContact O-CA 3.29Å; L707-G711 PolarHBondContact O-N 3.47Å; L707-H712 HydrophobicContact CD2-CB 4.21Å
708	S	87.1	Confident	89.1	Confident	107 Å²	107	83.1 Å²	83.1	75%	0.748	44%	0.441	S	S	*	.	H	α-helix	trans	-73.4	-13.9	179.9	-172.4	0	0	0	0	114.8	S704 Q705 I706	S704-S708 VanDerWaalsContact O-CB 3.26Å; S704-S708 WeakPolarHBondContact O-CB 3.38Å; S704-S708 PolarHBondContact O-N 3.47Å; Q705-S708 PolarHBondContact O-N 3.39Å; I706-S708 VanDerWaalsContact C-N 3.25Å; I706-S708 PolarHBondContact O-N 3.45Å
709	H	84.4	Confident	89.1	Confident	132 Å²	132	86.2 Å²	86.2	61%	0.611	46%	0.458	S	S	*	.	H	α-helix	trans	-120	-40.4	-175.7	-165.2	80.2	0	0	0	113.3	Q705 I706 L707	Q705-H709 PolarHBondContact O-N 3.43Å; I706-H709 PolarHBondContact O-N 3.42Å; I706-H709 VanDerWaalsContact O-N 3.14Å; L707-H709 VanDerWaalsContact C-N 3.3Å; L707-H709 PolarHBondContact O-N 2.74Å
710	F	86.3	Confident	88.9	Confident	59 Å²	59	78.9 Å²	78.9	26%	0.259	43%	0.427	S	S	.	.	H	α-helix	trans	-110.2	-1.7	-178.6	-58.9	-79.9	0	0	0	113.3	I581 I706 W732 A735 V736	I581-F710 HydrophobicContact CG2-CD1 4.28Å; I706-F710 HydrophobicContact CG2-CD2 4.43Å; I706-F710 PolarHBondContact O-N 2.91Å; F710-W732 PolarHBondContact O-NE1 2.89Å; F710-A735 HydrophobicContact CD1-CB 4.2Å; F710-A735 HydrophobicContact CE1-CB 3.85Å; F710-V736 HydrophobicContact CB-CG2 3.89Å; F710-V736 HydrophobicContact CD1-CG2 4.21Å; F710-V736 HydrophobicContact CD2-CG2 3.61Å; F710-V736 HydrophobicContact CE2-CG2 4.09Å; F710-V736 HydrophobicContact CG-CG2 3.65Å
711	G	89.1	Confident	89	Confident	29 Å²	29	74.2 Å²	74.2	30%	0.299	40%	0.401	S	S	.	.			trans	69.4	-163.7	-173.3	0	0	0	0	0	113.2	L707 W732	L707-G711 VanDerWaalsContact O-CA 3.28Å; L707-G711 WeakPolarHBondContact O-CA 3.29Å; L707-G711 PolarHBondContact O-N 3.47Å; G711-W732 WeakPolarHBondContact O-CZ2 3.39Å
712	H	91	Very high	88.9	Confident	143 Å²	143	72.1 Å²	72.1	66%	0.662	40%	0.398	S	S	*	.	S	Bend	trans	-76.9	149.2	178.3	-69.2	-103.4	0	0	0	111.8	L707 P714 W732	L707-H712 HydrophobicContact CD2-CB 4.21Å; H712-P714 WeakPolarHBondContact O-CD 3.18Å; H712-W732 PolarHBondContact O-NE1 2.81Å
713	L	93.3	Very high	89.1	Confident	22 Å²	22	71.5 Å²	71.5	12%	0.115	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-51.8	121.3	165.2	175.4	67.2	0	0	0	108.9	N692 F695 W729 W732	N692-L713 HydrophobicContact CB-CD2 4.14Å; F695-L713 HydrophobicContact CD1-CB 4.4Å; L713-W729 HydrophobicContact CD1-CB 4.15Å; L713-W732 HydrophobicContact CB-CE3 4.27Å; L713-W732 HydrophobicContact CB-CH2 4.04Å; L713-W732 HydrophobicContact CB-CZ2 4.32Å; L713-W732 HydrophobicContact CB-CZ3 4.01Å; L713-W732 HydrophobicContact CD1-CD2 4.2Å; L713-W732 HydrophobicContact CD1-CE3 3.47Å; L713-W732 VanDerWaalsContact CD1-CE3 3.47Å; L713-W732 HydrophobicContact CD1-CZ3 3.7Å; L713-W732 HydrophobicContact CG-CE3 4.48Å; L713-W732 HydrophobicContact CG-CZ3 4.42Å
714	P	93.9	Very high	89	Confident	37 Å²	37	71.3 Å²	71.3	24%	0.24	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-59.5	150.5	179.1	-25.3	34.3	0	0	0	112.2	Y688 H712 A728 W729 W732	Y688-P714 WeakPolarHBondContact CE2-O 3.39Å; Y688-P714 PolarHBondContact OH-O 2.9Å; Y688-P714 VanDerWaalsContact OH-O 3.06Å; H712-P714 WeakPolarHBondContact O-CD 3.18Å; P714-A728 HydrophobicContact CB-CB 4.41Å; P714-A728 HydrophobicContact CG-CB 4.4Å; P714-W729 HydrophobicContact CB-CB 4.15Å; P714-W729 HydrophobicContact CG-CB 4.37Å; P714-W732 HydrophobicContact CG-CB 4.18Å; P714-W732 HydrophobicContact CG-CG 4.35Å
715	S	91.4	Very high	89	Confident	94 Å²	94	68.2 Å²	68.2	66%	0.657	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-59.6	147.5	174.2	49.6	0	0	0	0	111.9	D717	S715-D717 PolarHBondContact O-N 3.19Å
716	K	90.3	Very high	89	Confident	71 Å²	71	62 Å²	62	31%	0.309	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-60.7	122.2	174.4	-166.4	179.6	70.2	162	0	111.1	H684 D685 Y688	H684-K716 VanDerWaalsContact CE1-CG 3.49Å; H684-K716 WeakPolarHBondContact CE1-CG 3.21Å; D685-K716 WeakPolarHBondContact OD1-CD 3.21Å; D685-K716 WeakPolarHBondContact OD1-CE 3.5Å; D685-K716 IonicContact OD1-NZ 2.61Å; D685-K716 PolarHBondContact OD1-NZ 2.98Å; D685-K716 IonicContact OD2-NZ 3Å; D685-K716 PolarHBondContact OD2-NZ 2.9Å; Y688-K716 HydrophobicContact CD1-CB 3.87Å; Y688-K716 HydrophobicContact CD1-CD 3.93Å; Y688-K716 HydrophobicContact CD1-CG 4.07Å; Y688-K716 HydrophobicContact CD2-CB 3.77Å; Y688-K716 HydrophobicContact CD2-CD 4.49Å; Y688-K716 HydrophobicContact CD2-CG 3.86Å; Y688-K716 HydrophobicContact CE1-CB 3.81Å; Y688-K716 HydrophobicContact CE2-CB 3.7Å; Y688-K716 HydrophobicContact CE2-CG 4.31Å; Y688-K716 HydrophobicContact CG-CB 3.86Å; Y688-K716 HydrophobicContact CG-CD 3.86Å; Y688-K716 HydrophobicContact CG-CG 3.73Å; Y688-K716 PolarHBondContact OH-N 3.39Å
717	D	87	Confident	89.2	Confident	52 Å²	52	61 Å²	61	28%	0.278	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-65	141.3	176.5	-59.2	-81.7	0	0	0	111.9	H684 S715 P727	H684-D717 PolarHBondContact CE1-O 3.02Å; S715-D717 PolarHBondContact O-N 3.19Å; D717-P727 WeakPolarHBondContact OD2-CB 3.26Å
718	L	84.1	Confident	89.3	Confident	173 Å²	173	59.8 Å²	59.8	91%	0.906	35%	0.346	S	S	*	.	S	Bend	trans	-79.2	-37.4	178.5	-65.9	178	0	0	0	112.5
719	D	88.5	Confident	89.6	Confident	79 Å²	79	54.7 Å²	54.7	42%	0.422	31%	0.31	S	S	.	.	S	Bend	trans	-118.9	105.5	165	172.6	16.3	0	0	0	108.2	Q721 A722	D719-Q721 PolarHBondContact O-N 2.81Å; D719-Q721 WeakPolarHBondContact OD1-CA 3.44Å; D719-Q721 WeakPolarHBondContact OD1-CB 3.46Å; D719-Q721 PolarHBondContact OD1-N 3.22Å; D719-A722 HydrophobicContact CB-CB 4.15Å; D719-A722 WeakPolarHBondContact O-CB 3.47Å; D719-A722 PolarHBondContact O-N 3.16Å; D719-A722 PolarHBondContact OD2-N 3.06Å
720	P	86.5	Confident	90.2	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.013	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-2.1	-179.9	32.8	-36.5	0	0	0	113.7	L681 P727 L753	L681-P720 HydrophobicContact CD2-CG 3.84Å; P720-P727 HydrophobicContact CB-CG 3.55Å; P720-P727 WeakPolarHBondContact O-CD 3.47Å; P720-L753 HydrophobicContact CB-CD2 3.96Å
721	Q	90.8	Very high	90.6	Very high	22 Å²	22	45.6 Å²	45.6	10%	0.103	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	7.1	175.1	-50.9	-168.9	116.6	0	0	113	K671 V672 L680 D719	K671-Q721 HydrophobicContact CD-CB 4.47Å; K671-Q721 WeakPolarHBondContact CE-O 3.33Å; K671-Q721 PolarHBondContact NZ-O 2.71Å; V672-Q721 PolarHBondContact O-NE2 3.03Å; L680-Q721 HydrophobicContact CD2-CG 4.1Å; D719-Q721 PolarHBondContact O-N 2.81Å; D719-Q721 WeakPolarHBondContact OD1-CA 3.44Å; D719-Q721 WeakPolarHBondContact OD1-CB 3.46Å; D719-Q721 PolarHBondContact OD1-N 3.22Å
722	A	87.8	Confident	90.9	Very high	61 Å²	61	44.4 Å²	44.4	50%	0.504	26%	0.255	S	S	.	.	S	Bend	trans	-65.7	-40.5	179.7	0	0	0	0	0	112.3	D719	D719-A722 HydrophobicContact CB-CB 4.15Å; D719-A722 WeakPolarHBondContact O-CB 3.47Å; D719-A722 PolarHBondContact O-N 3.16Å; D719-A722 PolarHBondContact OD2-N 3.06Å
723	V	88.8	Confident	91	Very high	79 Å²	79	37.7 Å²	37.7	48%	0.479	22%	0.224	S	C	.	.	S	Bend	trans	-97.3	135.7	179.6	-176.2	0	0	0	0	109.7	E725 G726	V723-E725 HydrophobicContact CG1-CB 4.29Å; V723-E725 PolarHBondContact O-N 3.29Å; V723-G726 PolarHBondContact O-N 3.4Å
724	P	89.2	Confident	91.1	Very high	51 Å²	51	36.6 Å²	36.6	33%	0.331	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-25.9	-179.7	-24.7	34.4	0	0	0	114.9	E668 D669 G726	E668-P724 HydrophobicContact CB-CB 4.03Å; E668-P724 HydrophobicContact CG-CB 3.74Å; D669-P724 PolarHBondContact N-O 2.89Å; P724-G726 VanDerWaalsContact C-N 3.29Å
725	E	89.4	Confident	91	Very high	10 Å²	10	35.8 Å²	35.8	5%	0.047	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-3.9	174.7	-55.4	-60.2	161.4	0	0	113.4	P579 S646 R647 V723 W731 R756	P579-E725 HydrophobicContact CB-CB 4.01Å; P579-E725 HydrophobicContact CB-CG 4.06Å; P579-E725 HydrophobicContact CG-CB 4.12Å; P579-E725 HydrophobicContact CG-CG 4.07Å; S646-E725 WeakPolarHBondContact CA-OE1 3.38Å; S646-E725 WeakPolarHBondContact CB-OE1 3.47Å; S646-E725 PolarHBondContact OG-OE1 2.82Å; R647-E725 WeakPolarHBondContact CD-OE2 3.42Å; R647-E725 VanDerWaalsContact CG-OE2 3.26Å; R647-E725 WeakPolarHBondContact CG-OE2 3.29Å; R647-E725 IonicContact CZ-OE2 3.2Å; R647-E725 PolarHBondContact N-OE1 2.89Å; R647-E725 PolarHBondContact N-OE2 3.35Å; R647-E725 IonicContact NE-OE2 3.7Å; R647-E725 PolarHBondContact NE-OE2 3.43Å; R647-E725 IonicContact NH2-OE2 2.67Å; V723-E725 HydrophobicContact CG1-CB 4.29Å; V723-E725 PolarHBondContact O-N 3.29Å; E725-W731 VanDerWaalsContact O-CE2 3.29Å; E725-W731 VanDerWaalsContact O-CZ2 3.26Å; E725-W731 WeakPolarHBondContact O-CZ2 3.29Å; E725-W731 PolarHBondContact O-NE1 3.22Å; E725-R756 PolarHBondContact O-NH2 2.89Å
726	G	90.3	Very high	91	Very high	6 Å²	6	32.2 Å²	32.2	6%	0.062	19%	0.189	C	C	.	.			trans	68	-166	-172.1	0	0	0	0	0	114.1	V723 P724	V723-G726 PolarHBondContact O-N 3.4Å; P724-G726 VanDerWaalsContact C-N 3.29Å
727	P	93.3	Very high	91	Very high	2 Å²	2	29 Å²	29	1%	0.013	18%	0.175	C	C	.	.			trans	-64.5	131.5	-167.8	-26	36.9	0	0	0	114.5	D717 P720 W729 C730 L753	D717-P727 WeakPolarHBondContact OD2-CB 3.26Å; P720-P727 HydrophobicContact CB-CG 3.55Å; P720-P727 WeakPolarHBondContact O-CD 3.47Å; P727-W729 VanDerWaalsContact C-N 3.25Å; P727-W729 VanDerWaalsContact CB-CD1 3.47Å; P727-W729 HydrophobicContact CB-CG 4.29Å; P727-W729 VanDerWaalsContact CB-NE1 3.3Å; P727-W729 PolarHBondContact O-N 2.75Å; P727-C730 WeakPolarHBondContact O-CB 3.43Å; P727-C730 PolarHBondContact O-N 3.04Å; P727-C730 VanDerWaalsContact O-N 3.1Å; P727-L753 HydrophobicContact CG-CD1 4.28Å; P727-L753 HydrophobicContact CG-CD2 4.13Å
728	A	92.7	Very high	90.9	Very high	24 Å²	24	31.8 Å²	31.8	20%	0.198	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-34.3	-179.5	0	0	0	0	0	112.7	T580 P714 C730 W731 W732	T580-A728 HydrophobicContact CG2-CB 3.99Å; P714-A728 HydrophobicContact CB-CB 4.41Å; P714-A728 HydrophobicContact CG-CB 4.4Å; A728-C730 VanDerWaalsContact C-N 3.26Å; A728-C730 PolarHBondContact O-N 3.5Å; A728-W731 PolarHBondContact O-N 2.92Å; A728-W732 PolarHBondContact O-N 2.97Å
729	W	94.5	Very high	91.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.4	-28.1	178.4	71.8	-98.3	0	0	0	113.2	H684 V687 Y688 A691 L713 P714 P727 L733 L757	H684-W729 AromaticContact CD2-CE2 3.97Å; H684-W729 AromaticContact CD2-CZ2 3.59Å; H684-W729 AromaticContact CD2-NE1 3.71Å; H684-W729 AromaticContact CE1-NE1 3.92Å; H684-W729 AromaticContact NE2-CE2 3.68Å; H684-W729 AromaticContact NE2-CZ2 3.78Å; H684-W729 AromaticContact NE2-NE1 2.98Å; H684-W729 PolarHBondContact NE2-NE1 2.72Å; V687-W729 HydrophobicContact CB-CH2 4.12Å; V687-W729 HydrophobicContact CG1-CH2 3.81Å; V687-W729 HydrophobicContact CG1-CZ3 4.23Å; Y688-W729 HydrophobicContact CD2-CB 4.41Å; Y688-W729 AromaticContact CD2-CD1 3.8Å; Y688-W729 AromaticContact CD2-CD2 3.63Å; Y688-W729 HydrophobicContact CD2-CD2 3.63Å; Y688-W729 AromaticContact CD2-CE2 3.69Å; Y688-W729 HydrophobicContact CD2-CE3 4.18Å; Y688-W729 AromaticContact CD2-CG 3.72Å; Y688-W729 HydrophobicContact CD2-CG 3.72Å; Y688-W729 HydrophobicContact CD2-CZ2 4.27Å; Y688-W729 AromaticContact CD2-NE1 3.77Å; Y688-W729 HydrophobicContact CE2-CB 4.17Å; Y688-W729 HydrophobicContact CE2-CD2 4.28Å; Y688-W729 AromaticContact CE2-CG 3.93Å; Y688-W729 HydrophobicContact CE2-CG 3.93Å; A691-W729 HydrophobicContact CB-CZ3 4.23Å; L713-W729 HydrophobicContact CD1-CB 4.15Å; P714-W729 HydrophobicContact CB-CB 4.15Å; P714-W729 HydrophobicContact CG-CB 4.37Å; P727-W729 VanDerWaalsContact C-N 3.25Å; P727-W729 VanDerWaalsContact CB-CD1 3.47Å; P727-W729 HydrophobicContact CB-CG 4.29Å; P727-W729 VanDerWaalsContact CB-NE1 3.3Å; P727-W729 PolarHBondContact O-N 2.75Å; W729-L733 HydrophobicContact CE3-CD2 4.39Å; W729-L733 HydrophobicContact CZ3-CD2 4.09Å; W729-L733 WeakPolarHBondContact O-CB 3.24Å; W729-L733 PolarHBondContact O-N 3.48Å; W729-L757 HydrophobicContact CH2-CD2 3.57Å; W729-L757 HydrophobicContact CZ2-CD2 3.74Å
730	C	95.1	Very high	91.2	Very high	0 Å²	0	29 Å²	29	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.9	-43.8	174.3	-70.6	0	0	0	0	111	P727 A728 L733 L734 I760	P727-C730 WeakPolarHBondContact O-CB 3.43Å; P727-C730 PolarHBondContact O-N 3.04Å; P727-C730 VanDerWaalsContact O-N 3.1Å; A728-C730 VanDerWaalsContact C-N 3.26Å; A728-C730 PolarHBondContact O-N 3.5Å; C730-L733 PolarHBondContact O-N 3.33Å; C730-L734 VanDerWaalsContact O-CG 3.28Å; C730-L734 WeakPolarHBondContact O-CG 3.36Å; C730-L734 PolarHBondContact O-N 3.42Å; C730-I760 HydrophobicContact CB-CD1 3.86Å
731	W	95.3	Very high	91.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-71.2	-40.9	-179.8	-58.7	124.9	0	0	0	112.1	F578 P579 I581 E725 A728 L733 L734 A735 L748 R756	F578-W731 HydrophobicContact CB-CB 4.05Å; F578-W731 HydrophobicContact CB-CE3 4.38Å; F578-W731 AromaticContact CD1-CE3 3.87Å; F578-W731 HydrophobicContact CD1-CE3 3.87Å; F578-W731 HydrophobicContact CD1-CZ3 4.35Å; P579-W731 HydrophobicContact CB-CG 4.23Å; P579-W731 HydrophobicContact CG-CD2 4.32Å; P579-W731 HydrophobicContact CG-CG 4.44Å; P579-W731 WeakPolarHBondContact O-CB 3.47Å; I581-W731 HydrophobicContact CG1-CB 4.34Å; E725-W731 VanDerWaalsContact O-CE2 3.29Å; E725-W731 VanDerWaalsContact O-CZ2 3.26Å; E725-W731 WeakPolarHBondContact O-CZ2 3.29Å; E725-W731 PolarHBondContact O-NE1 3.22Å; A728-W731 PolarHBondContact O-N 2.92Å; W731-L733 VanDerWaalsContact C-N 3.32Å; W731-L733 PolarHBondContact O-N 3Å; W731-L734 HydrophobicContact CE3-CD1 3.7Å; W731-L734 HydrophobicContact CZ3-CD1 3.73Å; W731-L734 PolarHBondContact O-N 2.86Å; W731-A735 PolarHBondContact O-N 3.16Å; W731-L748 HydrophobicContact CE3-CD1 4.42Å; W731-L748 HydrophobicContact CH2-CD1 4.42Å; W731-L748 HydrophobicContact CZ3-CD1 3.93Å; W731-R756 VanDerWaalsContact CH2-CD 3.45Å; W731-R756 VanDerWaalsContact CZ2-CZ 3.48Å; W731-R756 VanDerWaalsContact CZ2-NE 3.28Å
732	W	95.4	Very high	91.3	Very high	5 Å²	5	41.4 Å²	41.4	2%	0.019	23%	0.228	C	C	.	.	H	α-helix	trans	-56.5	-47.6	171.7	-174.5	96	0	0	0	111.1	I581 F695 I706 F710 G711 H712 L713 P714 A728 L734 A735 V736	I581-W732 HydrophobicContact CD1-CB 3.97Å; F695-W732 AromaticContact CD2-CH2 3.73Å; F695-W732 HydrophobicContact CD2-CH2 3.73Å; F695-W732 HydrophobicContact CD2-CZ3 4.39Å; F695-W732 AromaticContact CE2-CH2 3.71Å; F695-W732 HydrophobicContact CE2-CH2 3.71Å; F695-W732 HydrophobicContact CE2-CZ2 4.36Å; F695-W732 HydrophobicContact CG-CH2 4.36Å; F695-W732 HydrophobicContact CZ-CH2 4.29Å; I706-W732 HydrophobicContact CG2-CH2 3.73Å; I706-W732 HydrophobicContact CG2-CZ2 3.58Å; F710-W732 PolarHBondContact O-NE1 2.89Å; G711-W732 WeakPolarHBondContact O-CZ2 3.39Å; H712-W732 PolarHBondContact O-NE1 2.81Å; L713-W732 HydrophobicContact CB-CE3 4.27Å; L713-W732 HydrophobicContact CB-CH2 4.04Å; L713-W732 HydrophobicContact CB-CZ2 4.32Å; L713-W732 HydrophobicContact CB-CZ3 4.01Å; L713-W732 HydrophobicContact CD1-CD2 4.2Å; L713-W732 HydrophobicContact CD1-CE3 3.47Å; L713-W732 VanDerWaalsContact CD1-CE3 3.47Å; L713-W732 HydrophobicContact CD1-CZ3 3.7Å; L713-W732 HydrophobicContact CG-CE3 4.48Å; L713-W732 HydrophobicContact CG-CZ3 4.42Å; P714-W732 HydrophobicContact CG-CB 4.18Å; P714-W732 HydrophobicContact CG-CG 4.35Å; A728-W732 PolarHBondContact O-N 2.97Å; W732-L734 PolarHBondContact O-N 3.28Å; W732-A735 PolarHBondContact O-N 3.44Å; W732-V736 HydrophobicContact CD2-CG2 3.98Å; W732-V736 HydrophobicContact CE3-CG2 4.07Å; W732-V736 HydrophobicContact CH2-CG1 4.37Å; W732-V736 HydrophobicContact CH2-CG2 4.08Å; W732-V736 HydrophobicContact CZ2-CG2 3.99Å; W732-V736 HydrophobicContact CZ3-CB 4.36Å; W732-V736 HydrophobicContact CZ3-CG1 4.44Å; W732-V736 HydrophobicContact CZ3-CG2 4.11Å; W732-V736 VanDerWaalsContact O-CG2 3.24Å; W732-V736 WeakPolarHBondContact O-CG2 3.38Å; W732-V736 PolarHBondContact O-N 3.08Å
733	L	94.4	Very high	91.5	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-66.4	-36	-179.5	-175.4	63.4	0	0	0	112.6	A691 W694 W729 C730 W731 V736 L737 I760 L764	A691-L733 HydrophobicContact CB-CD1 4.44Å; A691-L733 HydrophobicContact CB-CD2 3.66Å; W694-L733 HydrophobicContact CE3-CD1 3.91Å; W694-L733 HydrophobicContact CH2-CD1 4.33Å; W694-L733 HydrophobicContact CZ3-CD1 3.59Å; W729-L733 HydrophobicContact CE3-CD2 4.39Å; W729-L733 HydrophobicContact CZ3-CD2 4.09Å; W729-L733 WeakPolarHBondContact O-CB 3.24Å; W729-L733 PolarHBondContact O-N 3.48Å; C730-L733 PolarHBondContact O-N 3.33Å; W731-L733 VanDerWaalsContact C-N 3.32Å; W731-L733 PolarHBondContact O-N 3Å; L733-V736 PolarHBondContact O-N 2.86Å; L733-L737 HydrophobicContact CD1-CD1 3.84Å; L733-L737 HydrophobicContact CD1-CD2 4.4Å; L733-L737 HydrophobicContact CD1-CG 3.88Å; L733-L737 HydrophobicContact CD2-CD1 4.36Å; L733-L737 HydrophobicContact CG-CD1 3.65Å; L733-L737 HydrophobicContact CG-CG 4.16Å; L733-L737 VanDerWaalsContact O-CB 3.3Å; L733-L737 WeakPolarHBondContact O-CB 3.43Å; L733-L737 WeakPolarHBondContact O-CD1 3.41Å; L733-L737 WeakPolarHBondContact O-CG 3.17Å; L733-L737 PolarHBondContact O-N 3.22Å; L733-I760 HydrophobicContact CD2-CG2 3.53Å; L733-L764 HydrophobicContact CD1-CD2 4.28Å; L733-L764 HydrophobicContact CD2-CD1 4.15Å; L733-L764 HydrophobicContact CD2-CD2 4.25Å; L733-L764 HydrophobicContact CD2-CG 4.39Å
734	L	93.6	Very high	91.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-70.4	-29.2	175.6	-73.2	166.2	0	0	0	113.5	F578 C730 W731 W732 L739 Q744 I747 I760	F578-L734 HydrophobicContact CD1-CB 4.34Å; F578-L734 HydrophobicContact CE1-CB 3.96Å; F578-L734 HydrophobicContact CZ-CB 4.23Å; C730-L734 VanDerWaalsContact O-CG 3.28Å; C730-L734 WeakPolarHBondContact O-CG 3.36Å; C730-L734 PolarHBondContact O-N 3.42Å; W731-L734 HydrophobicContact CE3-CD1 3.7Å; W731-L734 HydrophobicContact CZ3-CD1 3.73Å; W731-L734 PolarHBondContact O-N 2.86Å; W732-L734 PolarHBondContact O-N 3.28Å; L734-L739 HydrophobicContact CD2-CD1 3.98Å; L734-Q744 PolarHBondContact O-NE2 2.88Å; L734-I747 HydrophobicContact CD1-CB 4.46Å; L734-I747 HydrophobicContact CD1-CG2 3.6Å; L734-I747 HydrophobicContact CD2-CB 4.3Å; L734-I747 HydrophobicContact CD2-CD1 3.78Å; L734-I747 HydrophobicContact CD2-CG2 3.93Å; L734-I747 HydrophobicContact CG-CG2 4.44Å; L734-I760 HydrophobicContact CD1-CD1 4.18Å; L734-I760 HydrophobicContact CD1-CG1 4.48Å; L734-I760 HydrophobicContact CD2-CG1 4.06Å; L734-I760 HydrophobicContact CG-CD1 4.29Å; L734-I760 HydrophobicContact CG-CG1 4.23Å
735	A	92.1	Very high	91.9	Very high	19 Å²	19	36.2 Å²	36.2	16%	0.157	19%	0.191	C	C	.	.	H	α-helix	trans	-75.5	-34.6	173.2	0	0	0	0	0	112.7	F578 I581 F710 W731 W732	F578-A735 HydrophobicContact CD2-CB 3.85Å; F578-A735 HydrophobicContact CE2-CB 4.03Å; I581-A735 HydrophobicContact CG1-CB 4.35Å; I581-A735 HydrophobicContact CG2-CB 4.21Å; F710-A735 HydrophobicContact CD1-CB 4.2Å; F710-A735 HydrophobicContact CE1-CB 3.85Å; W731-A735 PolarHBondContact O-N 3.16Å; W732-A735 PolarHBondContact O-N 3.44Å
736	V	91.8	Very high	92.2	Very high	19 Å²	19	39.6 Å²	39.6	12%	0.115	21%	0.212	C	C	.	.	H	α-helix	trans	-85.7	-30	-177.2	177	0	0	0	0	113.1	W694 I706 F710 W732 L733	W694-V736 HydrophobicContact CH2-CG1 3.97Å; I706-V736 HydrophobicContact CB-CG1 4.45Å; I706-V736 HydrophobicContact CD1-CG1 3.7Å; I706-V736 HydrophobicContact CG1-CG1 3.86Å; I706-V736 HydrophobicContact CG2-CG1 3.71Å; I706-V736 HydrophobicContact CG2-CG2 3.96Å; F710-V736 HydrophobicContact CB-CG2 3.89Å; F710-V736 HydrophobicContact CD1-CG2 4.21Å; F710-V736 HydrophobicContact CD2-CG2 3.61Å; F710-V736 HydrophobicContact CE2-CG2 4.09Å; F710-V736 HydrophobicContact CG-CG2 3.65Å; W732-V736 HydrophobicContact CD2-CG2 3.98Å; W732-V736 HydrophobicContact CE3-CG2 4.07Å; W732-V736 HydrophobicContact CH2-CG1 4.37Å; W732-V736 HydrophobicContact CH2-CG2 4.08Å; W732-V736 HydrophobicContact CZ2-CG2 3.99Å; W732-V736 HydrophobicContact CZ3-CB 4.36Å; W732-V736 HydrophobicContact CZ3-CG1 4.44Å; W732-V736 HydrophobicContact CZ3-CG2 4.11Å; W732-V736 VanDerWaalsContact O-CG2 3.24Å; W732-V736 WeakPolarHBondContact O-CG2 3.38Å; W732-V736 PolarHBondContact O-N 3.08Å; L733-V736 PolarHBondContact O-N 2.86Å
737	L	90.4	Very high	92.4	Very high	5 Å²	5	39.8 Å²	39.8	3%	0.026	21%	0.212	C	C	.	.	S	Bend	trans	-72.1	137.5	-179	-77	169.5	0	0	0	112	W694 L733 L739 V763 L764 V767	W694-L737 HydrophobicContact CH2-CD2 3.84Å; W694-L737 HydrophobicContact CH2-CG 4.44Å; W694-L737 HydrophobicContact CZ2-CD2 3.55Å; W694-L737 HydrophobicContact CZ3-CD2 4.46Å; L733-L737 HydrophobicContact CD1-CD1 3.84Å; L733-L737 HydrophobicContact CD1-CD2 4.4Å; L733-L737 HydrophobicContact CD1-CG 3.88Å; L733-L737 HydrophobicContact CD2-CD1 4.36Å; L733-L737 HydrophobicContact CG-CD1 3.65Å; L733-L737 HydrophobicContact CG-CG 4.16Å; L733-L737 VanDerWaalsContact O-CB 3.3Å; L733-L737 WeakPolarHBondContact O-CB 3.43Å; L733-L737 WeakPolarHBondContact O-CD1 3.41Å; L733-L737 WeakPolarHBondContact O-CG 3.17Å; L733-L737 PolarHBondContact O-N 3.22Å; L737-L739 VanDerWaalsContact C-N 3.27Å; L737-L739 HydrophobicContact CB-CD1 4.36Å; L737-L739 HydrophobicContact CB-CG 4.29Å; L737-L739 PolarHBondContact O-N 3.38Å; L737-V763 HydrophobicContact CD1-CG1 3.84Å; L737-L764 HydrophobicContact CD1-CD2 4.48Å; L737-V767 HydrophobicContact CD2-CG1 4.39Å; L737-V767 HydrophobicContact CD2-CG2 4.33Å
738	P	85.1	Confident	92.5	Very high	109 Å²	109	39.8 Å²	39.8	71%	0.708	21%	0.212	S	C	*	.			trans	-75	80	178.5	31.9	-35.5	0	0	0	110.7
739	L	88.6	Confident	92.6	Very high	37 Å²	37	40 Å²	40	19%	0.194	21%	0.213	C	C	.	.			trans	-109.2	149.5	178	-75.4	173.7	0	0	0	110.9	L734 L737 A743 Q744 V763	L734-L739 HydrophobicContact CD2-CD1 3.98Å; L737-L739 VanDerWaalsContact C-N 3.27Å; L737-L739 HydrophobicContact CB-CD1 4.36Å; L737-L739 HydrophobicContact CB-CG 4.29Å; L737-L739 PolarHBondContact O-N 3.38Å; L739-A743 HydrophobicContact CD2-CB 4.41Å; L739-Q744 HydrophobicContact CB-CG 3.71Å; L739-Q744 HydrophobicContact CD1-CG 4.2Å; L739-V763 HydrophobicContact CD1-CG1 4.25Å; L739-V763 HydrophobicContact CD1-CG2 4.34Å; L739-V763 HydrophobicContact CD2-CB 4.48Å; L739-V763 HydrophobicContact CD2-CG1 3.7Å; L739-V763 HydrophobicContact CD2-CG2 3.87Å; L739-V763 HydrophobicContact CG-CG1 4.13Å
740	E	90.1	Very high	92.7	Very high	156 Å²	156	42.1 Å²	42.1	73%	0.729	22%	0.224	S	C	*	.			trans	-69.4	142.1	168.3	-66.2	173.5	-168.9	0	0	110.4	R742 A743 Q744	E740-R742 PolarHBondContact O-N 3.11Å; E740-A743 WeakPolarHBondContact O-CA 3.38Å; E740-A743 WeakPolarHBondContact O-CB 3.13Å; E740-A743 PolarHBondContact O-N 3.24Å; E740-Q744 PolarHBondContact O-N 3.4Å; E740-Q744 VanDerWaalsContact O-N 3.08Å
741	N	89.8	Confident	92.6	Very high	83 Å²	83	44.8 Å²	44.8	44%	0.444	24%	0.238	S	C	.	.	H	α-helix	trans	-50.5	-36.1	-179.2	-61.6	6.9	0	0	0	112.8	M576 I611 A743 Q744 L745	M576-N741 HydrophobicContact CG-CB 4.23Å; I611-N741 HydrophobicContact CD1-CB 3.92Å; N741-A743 PolarHBondContact O-N 3.39Å; N741-Q744 PolarHBondContact O-N 3.13Å; N741-L745 VanDerWaalsContact O-CB 3.28Å; N741-L745 WeakPolarHBondContact O-CB 3.09Å; N741-L745 PolarHBondContact O-N 2.67Å
742	R	89.3	Confident	92.6	Very high	203 Å²	203	46.1 Å²	46.1	77%	0.766	25%	0.248	S	C	*	.	H	α-helix	trans	-64.3	-37.9	177.2	-173.4	174.6	-177.5	147.9	3.3	112.9	E740 T746	E740-R742 PolarHBondContact O-N 3.11Å; R742-T746 WeakPolarHBondContact O-CB 3.37Å; R742-T746 PolarHBondContact O-N 3.49Å; R742-T746 VanDerWaalsContact O-N 3.1Å; R742-T746 PolarHBondContact O-OG1 2.59Å
743	A	91.9	Very high	92.5	Very high	36 Å²	36	46.1 Å²	46.1	30%	0.298	25%	0.248	S	C	.	.	H	α-helix	trans	-71.8	-42.8	174.9	0	0	0	0	0	111	L739 E740 N741 T746 I747	L739-A743 HydrophobicContact CD2-CB 4.41Å; E740-A743 WeakPolarHBondContact O-CA 3.38Å; E740-A743 WeakPolarHBondContact O-CB 3.13Å; E740-A743 PolarHBondContact O-N 3.24Å; N741-A743 PolarHBondContact O-N 3.39Å; A743-T746 PolarHBondContact O-N 3.43Å; A743-I747 WeakPolarHBondContact O-CG1 3.38Å; A743-I747 PolarHBondContact O-N 3.42Å; A743-I747 VanDerWaalsContact O-N 3.11Å
744	Q	93.7	Very high	92.6	Very high	16 Å²	16	48.6 Å²	48.6	8%	0.075	26%	0.258	C	S	.	.	H	α-helix	trans	-58.6	-47.8	174.1	-73.5	177.1	-37.3	0	0	111.9	M576 F578 L734 L739 E740 N741 T746 I747 L748	M576-Q744 HydrophobicContact CE-CB 4.11Å; M576-Q744 HydrophobicContact CG-CB 4.07Å; F578-Q744 HydrophobicContact CE1-CB 4.34Å; F578-Q744 HydrophobicContact CZ-CB 3.93Å; F578-Q744 HydrophobicContact CZ-CG 3.98Å; L734-Q744 PolarHBondContact O-NE2 2.88Å; L739-Q744 HydrophobicContact CB-CG 3.71Å; L739-Q744 HydrophobicContact CD1-CG 4.2Å; E740-Q744 PolarHBondContact O-N 3.4Å; E740-Q744 VanDerWaalsContact O-N 3.08Å; N741-Q744 PolarHBondContact O-N 3.13Å; Q744-T746 VanDerWaalsContact C-N 3.35Å; Q744-T746 PolarHBondContact O-N 3.03Å; Q744-I747 PolarHBondContact O-N 2.8Å; Q744-I747 VanDerWaalsContact O-N 3.16Å; Q744-L748 PolarHBondContact O-N 2.81Å
745	L	94	Very high	92.6	Very high	30 Å²	30	52.7 Å²	52.7	16%	0.157	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-43	176.6	-172.4	76.8	0	0	0	112.1	M576 I611 A619 Y621 N741 I747 L748 A749	M576-L745 HydrophobicContact CE-CB 4.26Å; M576-L745 HydrophobicContact CE-CD1 4.22Å; M576-L745 HydrophobicContact SD-CB 4.16Å; M576-L745 HydrophobicContact SD-CD1 4.14Å; I611-L745 HydrophobicContact CD1-CB 4.43Å; I611-L745 HydrophobicContact CD1-CD1 4.5Å; I611-L745 HydrophobicContact CD1-CD2 4.24Å; A619-L745 HydrophobicContact CB-CD1 4.06Å; A619-L745 HydrophobicContact CB-CD2 3.85Å; Y621-L745 WeakPolarHBondContact O-CD1 3.39Å; N741-L745 VanDerWaalsContact O-CB 3.28Å; N741-L745 WeakPolarHBondContact O-CB 3.09Å; N741-L745 PolarHBondContact O-N 2.67Å; L745-I747 VanDerWaalsContact C-N 3.25Å; L745-I747 PolarHBondContact O-N 2.82Å; L745-L748 PolarHBondContact O-N 3.31Å; L745-A749 PolarHBondContact O-N 2.92Å; L745-A749 VanDerWaalsContact O-N 3.08Å
746	T	94.8	Very high	92.8	Very high	81 Å²	81	51.8 Å²	51.8	50%	0.497	27%	0.273	S	S	.	.	H	α-helix	trans	-62.6	-33.1	177.8	-57.9	0	0	0	0	111.8	R742 A743 Q744 M750	R742-T746 WeakPolarHBondContact O-CB 3.37Å; R742-T746 PolarHBondContact O-N 3.49Å; R742-T746 VanDerWaalsContact O-N 3.1Å; R742-T746 PolarHBondContact O-OG1 2.59Å; A743-T746 PolarHBondContact O-N 3.43Å; Q744-T746 VanDerWaalsContact C-N 3.35Å; Q744-T746 PolarHBondContact O-N 3.03Å; T746-M750 HydrophobicContact CG2-CE 4.41Å; T746-M750 WeakPolarHBondContact O-CG 3.47Å
747	I	94.9	Very high	93	Very high	10 Å²	10	50.9 Å²	50.9	5%	0.051	27%	0.268	C	S	.	.	H	α-helix	trans	-82.2	-34.9	177.1	-60.7	168.5	0	0	0	111.6	L734 A743 Q744 L745 A749 M750 R756 A759	L734-I747 HydrophobicContact CD1-CB 4.46Å; L734-I747 HydrophobicContact CD1-CG2 3.6Å; L734-I747 HydrophobicContact CD2-CB 4.3Å; L734-I747 HydrophobicContact CD2-CD1 3.78Å; L734-I747 HydrophobicContact CD2-CG2 3.93Å; L734-I747 HydrophobicContact CG-CG2 4.44Å; A743-I747 WeakPolarHBondContact O-CG1 3.38Å; A743-I747 PolarHBondContact O-N 3.42Å; A743-I747 VanDerWaalsContact O-N 3.11Å; Q744-I747 PolarHBondContact O-N 2.8Å; Q744-I747 VanDerWaalsContact O-N 3.16Å; L745-I747 VanDerWaalsContact C-N 3.25Å; L745-I747 PolarHBondContact O-N 2.82Å; I747-A749 VanDerWaalsContact C-N 3.29Å; I747-A749 PolarHBondContact O-N 3.42Å; I747-M750 HydrophobicContact CG1-CE 4.18Å; I747-M750 HydrophobicContact CG2-SD 4.33Å; I747-M750 WeakPolarHBondContact O-CB 3.39Å; I747-M750 PolarHBondContact O-N 3.01Å; I747-R756 HydrophobicContact CG2-CG 3.72Å; I747-A759 HydrophobicContact CD1-CB 4.11Å; I747-A759 HydrophobicContact CG1-CB 4.04Å
748	L	94.8	Very high	93.3	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-56.7	-45.2	173.4	-167.1	79.4	0	0	0	110.9	M576 F578 R647 W731 Q744 L745 M750	M576-L748 HydrophobicContact CE-CB 4.34Å; M576-L748 HydrophobicContact CE-CD2 3.99Å; F578-L748 HydrophobicContact CD1-CD1 3.69Å; F578-L748 HydrophobicContact CE1-CD1 4.23Å; R647-L748 VanDerWaalsContact CD-O 3.3Å; R647-L748 WeakPolarHBondContact CD-O 3.34Å; R647-L748 HydrophobicContact CG-CD1 3.9Å; R647-L748 HydrophobicContact CG-CG 4.13Å; R647-L748 PolarHBondContact NH1-O 3.39Å; W731-L748 HydrophobicContact CE3-CD1 4.42Å; W731-L748 HydrophobicContact CH2-CD1 4.42Å; W731-L748 HydrophobicContact CZ3-CD1 3.93Å; Q744-L748 PolarHBondContact O-N 2.81Å; L745-L748 PolarHBondContact O-N 3.31Å; L748-M750 PolarHBondContact O-N 2.76Å; L748-M750 VanDerWaalsContact O-N 3.13Å
749	A	95.8	Very high	93.7	Very high	28 Å²	28	49 Å²	49	23%	0.231	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-3.5	-179.2	0	0	0	0	0	115.2	Y621 L745 I747 N751	Y621-A749 HydrophobicContact CD1-CB 3.71Å; Y621-A749 HydrophobicContact CD2-CB 3.93Å; Y621-A749 HydrophobicContact CE1-CB 3.79Å; Y621-A749 HydrophobicContact CE2-CB 4.03Å; Y621-A749 HydrophobicContact CG-CB 3.78Å; L745-A749 PolarHBondContact O-N 2.92Å; L745-A749 VanDerWaalsContact O-N 3.08Å; I747-A749 VanDerWaalsContact C-N 3.29Å; I747-A749 PolarHBondContact O-N 3.42Å; A749-N751 PolarHBondContact O-N 3.32Å
750	M	95.4	Very high	94	Very high	45 Å²	45	47.2 Å²	47.2	22%	0.222	24%	0.244	C	C	.	.			trans	-79.9	112.7	-179.4	-64.3	-179.4	179.2	0	0	112	R647 T746 I747 L748 S752 D755 R756 A759	R647-M750 PolarHBondContact NH1-O 2.72Å; T746-M750 HydrophobicContact CG2-CE 4.41Å; T746-M750 WeakPolarHBondContact O-CG 3.47Å; I747-M750 HydrophobicContact CG1-CE 4.18Å; I747-M750 HydrophobicContact CG2-SD 4.33Å; I747-M750 WeakPolarHBondContact O-CB 3.39Å; I747-M750 PolarHBondContact O-N 3.01Å; L748-M750 PolarHBondContact O-N 2.76Å; L748-M750 VanDerWaalsContact O-N 3.13Å; M750-S752 PolarHBondContact O-N 3.2Å; M750-D755 HydrophobicContact SD-CB 4.46Å; M750-R756 HydrophobicContact CB-CB 4.3Å; M750-R756 PolarHBondContact O-NH1 3.16Å; M750-R756 HydrophobicContact SD-CB 4.22Å; M750-A759 HydrophobicContact CE-CB 4.11Å; M750-A759 HydrophobicContact SD-CB 4.23Å
751	N	94.1	Very high	94.3	Very high	57 Å²	57	44.2 Å²	44.2	31%	0.305	23%	0.226	S	C	.	.			trans	-86.4	16.7	171.5	64.9	2.4	0	0	0	113.9	R670 A749	R670-N751 WeakPolarHBondContact CG-O 3.36Å; R670-N751 PolarHBondContact N-O 3.33Å; R670-N751 PolarHBondContact NE-ND2 3.48Å; A749-N751 PolarHBondContact O-N 3.32Å
752	S	94.9	Very high	94.4	Very high	28 Å²	28	49 Å²	49	20%	0.196	24%	0.238	C	C	.	.			trans	-124.3	113.4	176.2	166.4	0	0	0	0	108.4	M750 K754 D755 R756	M750-S752 PolarHBondContact O-N 3.2Å; S752-K754 VanDerWaalsContact C-N 3.27Å; S752-K754 PolarHBondContact O-N 2.95Å; S752-D755 WeakPolarHBondContact CB-OD2 3.27Å; S752-D755 PolarHBondContact O-N 3.01Å; S752-D755 PolarHBondContact OG-N 3.35Å; S752-D755 PolarHBondContact OG-OD2 3.49Å; S752-R756 WeakPolarHBondContact O-CB 3.5Å; S752-R756 PolarHBondContact O-N 3.06Å
753	L	94.3	Very high	94.5	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.026	21%	0.208	C	C	.	.	H	α-helix	trans	-64.8	-34.5	177.6	-178	59.1	0	0	0	111.4	L680 P720 P727 D755 R756 L757	L680-L753 HydrophobicContact CD1-CB 4.32Å; L680-L753 HydrophobicContact CD1-CD2 4.26Å; L680-L753 HydrophobicContact CD1-CG 4.09Å; L680-L753 HydrophobicContact CD2-CD2 4.35Å; P720-L753 HydrophobicContact CB-CD2 3.96Å; P727-L753 HydrophobicContact CG-CD1 4.28Å; P727-L753 HydrophobicContact CG-CD2 4.13Å; L753-D755 PolarHBondContact O-N 3.32Å; L753-R756 PolarHBondContact O-N 3.15Å; L753-L757 HydrophobicContact CD1-CD1 4.2Å; L753-L757 HydrophobicContact CD1-CG 4.06Å; L753-L757 HydrophobicContact CG-CD1 3.9Å; L753-L757 HydrophobicContact CG-CG 4.26Å; L753-L757 WeakPolarHBondContact O-CB 3.15Å; L753-L757 VanDerWaalsContact O-CG 3.25Å; L753-L757 WeakPolarHBondContact O-CG 3.47Å; L753-L757 PolarHBondContact O-N 2.71Å
754	K	94.6	Very high	94.5	Very high	52 Å²	52	38.8 Å²	38.8	23%	0.226	19%	0.194	C	C	.	.	H	α-helix	trans	-59	-48	176.9	-164.7	173.6	-173.5	172.2	0	110.9	E679 L680 L683 S752 L757 I758	E679-K754 WeakPolarHBondContact OE2-CE 3.31Å; E679-K754 IonicContact OE2-NZ 2.66Å; E679-K754 PolarHBondContact OE2-NZ 3.45Å; L680-K754 HydrophobicContact CD1-CB 4.16Å; L683-K754 HydrophobicContact CD2-CG 4.09Å; S752-K754 VanDerWaalsContact C-N 3.27Å; S752-K754 PolarHBondContact O-N 2.95Å; K754-L757 PolarHBondContact O-N 3.49Å; K754-I758 VanDerWaalsContact O-CG1 3.29Å; K754-I758 WeakPolarHBondContact O-CG1 3.49Å; K754-I758 PolarHBondContact O-N 2.86Å
755	D	95	Very high	94.3	Very high	87 Å²	87	40.7 Å²	40.7	47%	0.465	21%	0.205	S	C	.	.	H	α-helix	trans	-71.2	-38	178.4	-64.8	-61.9	0	0	0	112.5	M750 S752 L753 L757 I758 A759	M750-D755 HydrophobicContact SD-CB 4.46Å; S752-D755 WeakPolarHBondContact CB-OD2 3.27Å; S752-D755 PolarHBondContact O-N 3.01Å; S752-D755 PolarHBondContact OG-N 3.35Å; S752-D755 PolarHBondContact OG-OD2 3.49Å; L753-D755 PolarHBondContact O-N 3.32Å; D755-L757 PolarHBondContact O-N 3.05Å; D755-I758 PolarHBondContact O-N 3.08Å; D755-A759 WeakPolarHBondContact O-CB 3.41Å; D755-A759 PolarHBondContact O-N 3.4Å
756	R	95.6	Very high	94	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.7	-43.4	174.3	-176.5	151	85.7	-94.9	2	111.9	D669 E725 W731 I747 M750 S752 L753 A759 I760	D669-R756 IonicContact OD1-CZ 3.74Å; D669-R756 IonicContact OD1-NH1 2.67Å; D669-R756 PolarHBondContact OD1-NH1 2.9Å; D669-R756 IonicContact OD1-NH2 2.75Å; D669-R756 IonicContact OD2-CZ 2.7Å; D669-R756 IonicContact OD2-NH1 2.64Å; D669-R756 PolarHBondContact OD2-NH1 3.09Å; D669-R756 IonicContact OD2-NH2 3.28Å; D669-R756 PolarHBondContact OD2-NH2 3.14Å; E725-R756 PolarHBondContact O-NH2 2.89Å; W731-R756 VanDerWaalsContact CH2-CD 3.45Å; W731-R756 VanDerWaalsContact CZ2-CZ 3.48Å; W731-R756 VanDerWaalsContact CZ2-NE 3.28Å; I747-R756 HydrophobicContact CG2-CG 3.72Å; M750-R756 HydrophobicContact CB-CB 4.3Å; M750-R756 PolarHBondContact O-NH1 3.16Å; M750-R756 HydrophobicContact SD-CB 4.22Å; S752-R756 WeakPolarHBondContact O-CB 3.5Å; S752-R756 PolarHBondContact O-N 3.06Å; L753-R756 PolarHBondContact O-N 3.15Å; R756-A759 PolarHBondContact O-N 3.06Å; R756-I760 HydrophobicContact CG-CD1 4Å; R756-I760 WeakPolarHBondContact O-CB 3.48Å; R756-I760 WeakPolarHBondContact O-CG1 3.49Å; R756-I760 PolarHBondContact O-N 3.36Å
757	L	96.1	Very high	93.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.6	-39.2	174	-72	167.8	0	0	0	112.3	L680 L683 H684 V687 W729 L753 K754 D755 R761	L680-L757 HydrophobicContact CD1-CD1 3.76Å; L683-L757 HydrophobicContact CD2-CB 3.81Å; L683-L757 HydrophobicContact CD2-CD1 4.34Å; L683-L757 HydrophobicContact CG-CB 4Å; L683-L757 HydrophobicContact CG-CD1 4.31Å; H684-L757 HydrophobicContact CB-CD1 3.98Å; V687-L757 HydrophobicContact CB-CD2 4.21Å; V687-L757 HydrophobicContact CG1-CD2 4.22Å; W729-L757 HydrophobicContact CH2-CD2 3.57Å; W729-L757 HydrophobicContact CZ2-CD2 3.74Å; L753-L757 HydrophobicContact CD1-CD1 4.2Å; L753-L757 HydrophobicContact CD1-CG 4.06Å; L753-L757 HydrophobicContact CG-CD1 3.9Å; L753-L757 HydrophobicContact CG-CG 4.26Å; L753-L757 WeakPolarHBondContact O-CB 3.15Å; L753-L757 VanDerWaalsContact O-CG 3.25Å; L753-L757 WeakPolarHBondContact O-CG 3.47Å; L753-L757 PolarHBondContact O-N 2.71Å; K754-L757 PolarHBondContact O-N 3.49Å; D755-L757 PolarHBondContact O-N 3.05Å; L757-R761 VanDerWaalsContact O-CB 3.29Å; L757-R761 WeakPolarHBondContact O-CB 3.36Å; L757-R761 PolarHBondContact O-N 3.31Å
758	I	96.1	Very high	92.9	Very high	55 Å²	55	45 Å²	45	28%	0.282	22%	0.223	S	C	.	.	H	α-helix	trans	-62.7	-42.7	173.5	-70.7	164.4	0	0	0	110.9	L683 K754 D755 R761 R762	L683-I758 HydrophobicContact CD2-CG1 3.97Å; K754-I758 VanDerWaalsContact O-CG1 3.29Å; K754-I758 WeakPolarHBondContact O-CG1 3.49Å; K754-I758 PolarHBondContact O-N 2.86Å; D755-I758 PolarHBondContact O-N 3.08Å; I758-R761 PolarHBondContact O-N 2.86Å; I758-R762 WeakPolarHBondContact O-CG 3.28Å; I758-R762 PolarHBondContact O-N 3.34Å
759	A	94.9	Very high	92	Very high	18 Å²	18	54.9 Å²	54.9	15%	0.149	26%	0.26	C	S	.	.	H	α-helix	trans	-63.3	-51	176.9	0	0	0	0	0	111.5	I747 M750 D755 R756 R761 R762 V763	I747-A759 HydrophobicContact CD1-CB 4.11Å; I747-A759 HydrophobicContact CG1-CB 4.04Å; M750-A759 HydrophobicContact CE-CB 4.11Å; M750-A759 HydrophobicContact SD-CB 4.23Å; D755-A759 WeakPolarHBondContact O-CB 3.41Å; D755-A759 PolarHBondContact O-N 3.4Å; R756-A759 PolarHBondContact O-N 3.06Å; A759-R761 VanDerWaalsContact C-N 3.3Å; A759-R761 PolarHBondContact O-N 3.5Å; A759-R762 WeakPolarHBondContact O-CB 3.42Å; A759-R762 PolarHBondContact O-N 3.1Å; A759-R762 VanDerWaalsContact O-N 3.14Å; A759-V763 WeakPolarHBondContact O-CG2 3.33Å; A759-V763 PolarHBondContact O-N 3.08Å; A759-V763 VanDerWaalsContact O-N 3.09Å
760	I	94.9	Very high	90.3	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-54.6	-45.7	174.6	-75.1	162.5	0	0	0	111	V687 C730 L733 L734 R756 R762 V763 L764	V687-I760 HydrophobicContact CG1-CB 4.44Å; V687-I760 HydrophobicContact CG1-CG2 3.71Å; C730-I760 HydrophobicContact CB-CD1 3.86Å; L733-I760 HydrophobicContact CD2-CG2 3.53Å; L734-I760 HydrophobicContact CD1-CD1 4.18Å; L734-I760 HydrophobicContact CD1-CG1 4.48Å; L734-I760 HydrophobicContact CD2-CG1 4.06Å; L734-I760 HydrophobicContact CG-CD1 4.29Å; L734-I760 HydrophobicContact CG-CG1 4.23Å; R756-I760 HydrophobicContact CG-CD1 4Å; R756-I760 WeakPolarHBondContact O-CB 3.48Å; R756-I760 WeakPolarHBondContact O-CG1 3.49Å; R756-I760 PolarHBondContact O-N 3.36Å; I760-R762 PolarHBondContact O-N 3.11Å; I760-V763 PolarHBondContact O-N 2.72Å; I760-V763 VanDerWaalsContact O-N 3.16Å; I760-L764 HydrophobicContact CG2-CD1 4.03Å; I760-L764 HydrophobicContact CG2-CG 4.41Å; I760-L764 PolarHBondContact O-N 2.98Å
761	R	94.9	Very high	88.4	Confident	93 Å²	93	63.4 Å²	63.4	35%	0.351	29%	0.288	S	S	.	.	H	α-helix	trans	-60.3	-42.1	178.4	-165.2	-179.8	-175.7	176.2	1.3	112.5	V687 Q690 L757 I758 A759 V763 L764 I765	V687-R761 HydrophobicContact CG1-CB 4.39Å; V687-R761 HydrophobicContact CG2-CB 3.79Å; V687-R761 HydrophobicContact CG2-CG 3.95Å; Q690-R761 VanDerWaalsContact NE2-NE 3.15Å; L757-R761 VanDerWaalsContact O-CB 3.29Å; L757-R761 WeakPolarHBondContact O-CB 3.36Å; L757-R761 PolarHBondContact O-N 3.31Å; I758-R761 PolarHBondContact O-N 2.86Å; A759-R761 VanDerWaalsContact C-N 3.3Å; A759-R761 PolarHBondContact O-N 3.5Å; R761-V763 VanDerWaalsContact C-N 3.33Å; R761-V763 PolarHBondContact O-N 3.03Å; R761-L764 PolarHBondContact O-N 2.84Å; R761-I765 HydrophobicContact CG-CD1 4.04Å; R761-I765 WeakPolarHBondContact O-CB 3.42Å; R761-I765 VanDerWaalsContact O-CG1 3.27Å; R761-I765 WeakPolarHBondContact O-CG1 3.12Å; R761-I765 PolarHBondContact O-N 3.09Å
762	R	92.8	Very high	86	Confident	183 Å²	183	66.3 Å²	66.3	69%	0.691	31%	0.31	S	S	*	.	H	α-helix	trans	-62	-40.7	175.9	-71.3	170.3	-177.1	-176.4	3.7	111.3	I758 A759 I760 F766	I758-R762 WeakPolarHBondContact O-CG 3.28Å; I758-R762 PolarHBondContact O-N 3.34Å; A759-R762 WeakPolarHBondContact O-CB 3.42Å; A759-R762 PolarHBondContact O-N 3.1Å; A759-R762 VanDerWaalsContact O-N 3.14Å; I760-R762 PolarHBondContact O-N 3.11Å; R762-F766 WeakPolarHBondContact O-CB 3.47Å; R762-F766 PolarHBondContact O-N 3.08Å
763	V	92	Very high	83.2	Confident	22 Å²	22	80.2 Å²	80.2	13%	0.133	36%	0.358	C	S	.	.	H	α-helix	trans	-65.5	-47.6	175.5	179.7	0	0	0	0	111.5	L737 L739 A759 I760 R761 I765 F766 V767	L737-V763 HydrophobicContact CD1-CG1 3.84Å; L739-V763 HydrophobicContact CD1-CG1 4.25Å; L739-V763 HydrophobicContact CD1-CG2 4.34Å; L739-V763 HydrophobicContact CD2-CB 4.48Å; L739-V763 HydrophobicContact CD2-CG1 3.7Å; L739-V763 HydrophobicContact CD2-CG2 3.87Å; L739-V763 HydrophobicContact CG-CG1 4.13Å; A759-V763 WeakPolarHBondContact O-CG2 3.33Å; A759-V763 PolarHBondContact O-N 3.08Å; A759-V763 VanDerWaalsContact O-N 3.09Å; I760-V763 PolarHBondContact O-N 2.72Å; I760-V763 VanDerWaalsContact O-N 3.16Å; R761-V763 VanDerWaalsContact C-N 3.33Å; R761-V763 PolarHBondContact O-N 3.03Å; V763-I765 VanDerWaalsContact C-N 3.31Å; V763-I765 PolarHBondContact O-N 3.35Å; V763-F766 WeakPolarHBondContact O-CB 3.43Å; V763-F766 PolarHBondContact O-N 2.63Å; V763-V767 HydrophobicContact CG1-CG2 4.02Å; V763-V767 WeakPolarHBondContact O-CG2 3.44Å; V763-V767 PolarHBondContact O-N 3.05Å
764	L	91.4	Very high	82.7	Confident	4 Å²	4	84 Å²	84	2%	0.021	38%	0.375	C	S	.	.	H	α-helix	trans	-56.4	-44.4	176.9	-74.7	171.6	0	0	0	111.9	V687 Q690 A691 W694 L733 L737 I760 R761 F766 V767 T768	V687-L764 HydrophobicContact CG1-CD1 4.16Å; Q690-L764 HydrophobicContact CB-CD1 4.08Å; A691-L764 HydrophobicContact CB-CD1 4.06Å; W694-L764 HydrophobicContact CB-CD2 4.09Å; W694-L764 HydrophobicContact CD2-CD2 4.15Å; W694-L764 HydrophobicContact CE3-CD2 4.4Å; W694-L764 HydrophobicContact CG-CD2 4.01Å; L733-L764 HydrophobicContact CD1-CD2 4.28Å; L733-L764 HydrophobicContact CD2-CD1 4.15Å; L733-L764 HydrophobicContact CD2-CD2 4.25Å; L733-L764 HydrophobicContact CD2-CG 4.39Å; L737-L764 HydrophobicContact CD1-CD2 4.48Å; I760-L764 HydrophobicContact CG2-CD1 4.03Å; I760-L764 HydrophobicContact CG2-CG 4.41Å; I760-L764 PolarHBondContact O-N 2.98Å; R761-L764 PolarHBondContact O-N 2.84Å; L764-F766 VanDerWaalsContact C-N 3.33Å; L764-F766 PolarHBondContact O-N 3.21Å; L764-V767 PolarHBondContact O-N 3.14Å; L764-T768 WeakPolarHBondContact O-CB 3.23Å; L764-T768 WeakPolarHBondContact O-CG2 3.44Å; L764-T768 PolarHBondContact O-N 3.16Å; L764-T768 PolarHBondContact O-OG1 3.02Å
765	I	89.8	Confident	82	Confident	56 Å²	56	85.7 Å²	85.7	29%	0.287	38%	0.382	S	S	.	.	H	α-helix	trans	-63.2	-37.4	176.1	-69.3	167	0	0	0	111.6	R761 V763 T768 R769	R761-I765 HydrophobicContact CG-CD1 4.04Å; R761-I765 WeakPolarHBondContact O-CB 3.42Å; R761-I765 VanDerWaalsContact O-CG1 3.27Å; R761-I765 WeakPolarHBondContact O-CG1 3.12Å; R761-I765 PolarHBondContact O-N 3.09Å; V763-I765 VanDerWaalsContact C-N 3.31Å; V763-I765 PolarHBondContact O-N 3.35Å; I765-T768 WeakPolarHBondContact CA-OG1 3.3Å; I765-T768 PolarHBondContact O-OG1 3.29Å; I765-R769 VanDerWaalsContact O-CB 3.31Å; I765-R769 WeakPolarHBondContact O-CB 3.4Å; I765-R769 WeakPolarHBondContact O-CD 3.49Å; I765-R769 WeakPolarHBondContact O-CG 3.36Å; I765-R769 PolarHBondContact O-N 2.88Å
766	F	86.7	Confident	81.3	Confident	119 Å²	119	85.6 Å²	85.6	52%	0.522	38%	0.378	S	S	.	.	H	α-helix	trans	-70.5	-47.1	177.3	-176.7	-106.8	0	0	0	112.4	R762 V763 L764 R769 K770	R762-F766 WeakPolarHBondContact O-CB 3.47Å; R762-F766 PolarHBondContact O-N 3.08Å; V763-F766 WeakPolarHBondContact O-CB 3.43Å; V763-F766 PolarHBondContact O-N 2.63Å; L764-F766 VanDerWaalsContact C-N 3.33Å; L764-F766 PolarHBondContact O-N 3.21Å; F766-R769 PolarHBondContact O-N 2.87Å; F766-K770 HydrophobicContact CD1-CD 4.43Å; F766-K770 HydrophobicContact CE1-CD 3.85Å; F766-K770 HydrophobicContact CE2-CD 4.32Å; F766-K770 HydrophobicContact CZ-CD 3.81Å; F766-K770 WeakPolarHBondContact O-CB 3.5Å; F766-K770 PolarHBondContact O-N 2.68Å
767	V	84.9	Confident	80.5	Confident	29 Å²	29	90.6 Å²	90.6	18%	0.176	40%	0.4	C	S	.	.	H	α-helix	trans	-68.6	-35.1	-178.3	174.1	0	0	0	0	111.9	L737 V763 L764	L737-V767 HydrophobicContact CD2-CG1 4.39Å; L737-V767 HydrophobicContact CD2-CG2 4.33Å; V763-V767 HydrophobicContact CG1-CG2 4.02Å; V763-V767 WeakPolarHBondContact O-CG2 3.44Å; V763-V767 PolarHBondContact O-N 3.05Å; L764-V767 PolarHBondContact O-N 3.14Å
768	T	82.1	Confident	79.5	Confident	64 Å²	64	96.3 Å²	96.3	39%	0.393	43%	0.425	S	S	.	.	H	α-helix	trans	-69	-40.8	172.6	48.7	0	0	0	0	112.4	W694 L764 I765	W694-T768 HydrophobicContact CB-CG2 4.41Å; W694-T768 HydrophobicContact CG-CG2 4.48Å; L764-T768 WeakPolarHBondContact O-CB 3.23Å; L764-T768 WeakPolarHBondContact O-CG2 3.44Å; L764-T768 PolarHBondContact O-N 3.16Å; L764-T768 PolarHBondContact O-OG1 3.02Å; I765-T768 WeakPolarHBondContact CA-OG1 3.3Å; I765-T768 PolarHBondContact O-OG1 3.29Å
769	R	76.4	Confident	78.4	Confident	207 Å²	207	99.1 Å²	99.1	78%	0.781	44%	0.435	S	S	*	.	H	α-helix	trans	-70.9	-26.5	178.4	-74.2	173.8	-179.5	-175.7	1.3	114.5	I765 F766 R771	I765-R769 VanDerWaalsContact O-CB 3.31Å; I765-R769 WeakPolarHBondContact O-CB 3.4Å; I765-R769 WeakPolarHBondContact O-CD 3.49Å; I765-R769 WeakPolarHBondContact O-CG 3.36Å; I765-R769 PolarHBondContact O-N 2.88Å; F766-R769 PolarHBondContact O-N 2.87Å; R769-R771 VanDerWaalsContact C-N 3.33Å; R769-R771 PolarHBondContact O-N 2.82Å
770	K	58.8	Low	77.2	Confident	150 Å²	150	104.9 Å²	104.9	65%	0.652	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-2.9	-178.2	-98	-166.8	172.1	-172.4	0	115.3	F766 P772	F766-K770 HydrophobicContact CD1-CD 4.43Å; F766-K770 HydrophobicContact CE1-CD 3.85Å; F766-K770 HydrophobicContact CE2-CD 4.32Å; F766-K770 HydrophobicContact CZ-CD 3.81Å; F766-K770 WeakPolarHBondContact O-CB 3.5Å; F766-K770 PolarHBondContact O-N 2.68Å; K770-P772 VanDerWaalsContact O-CD 3.3Å; K770-P772 WeakPolarHBondContact O-CD 3.48Å
771	R	55.3	Low	75.8	Confident	102 Å²	102	112.9 Å²	112.9	39%	0.385	49%	0.49	S	S	.	.			trans	-77	117	172.7	-63.6	-174.3	-173.5	170.2	5.6	109.8	S697 R769	S697-R771 PolarHBondContact O-NH1 3.37Å; S697-R771 PolarHBondContact OG-NH1 3.47Å; R769-R771 VanDerWaalsContact C-N 3.33Å; R769-R771 PolarHBondContact O-N 2.82Å
772	P	44	Very low	74.2	Confident	118 Å²	118	114.6 Å²	114.6	77%	0.766	50%	0.502	S	S	*	.			trans	-61.7	154.1	157.9	29.7	-33.7	0	0	0	109.2	K770	K770-P772 VanDerWaalsContact O-CD 3.3Å; K770-P772 WeakPolarHBondContact O-CD 3.48Å
773	R	36.7	Very low	72.6	Confident	321 Å²	321	108.4 Å²	108.4	100%	1.211	48%	0.484	S	S	*	.			trans	-70.2	0	176.2	-73.9	-178	171.4	178.5	-3.6	111.2

Retrieved 773 of 773 residues in 406.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).