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ACD shelterin complex subunit and telomerase recruitment factor

Component of the shelterin complex (telosome) that is involved in the regulation of telomere length and protection. Shelterin associates with arrays of double-stranded TTAGGG repeats added by telomerase and protects chromosome ends. Without its protective activity, telomeres are no longer hidden from the DNA damage surveillance and chromosome ends are inappropriately processed by DNA repair pathways. Promotes binding of POT1 to single-stranded telomeric DNA. Modulates the inhibitory effects of POT1 on telomere elongation. The ACD-POT1 heterodimer enhances telomere elongation by recruiting telomerase to telomeres and increasing its processivity. May play a role in organogenesis.

AlphaFold DB , UniProt , Accession A0A096NR79, Species PAPAN (Papio anubis, Olive baboon), Gene ACD, Length 455 aa.

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(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	35.8	Very low	63.1	Low	248 Å²	248	120.1 Å²	120.1	100%	1.222	70%	0.702	S	S	*	*				0	91.5	0	-66.9	-145.3	-154	0	0	108	G3	M1-G3 PolarHBondContact O-N 2.89Å
2	A	41.7	Very low	65.6	Low	105 Å²	105	111.4 Å²	111.4	87%	0.868	65%	0.648	S	S	*	*			trans	-79.2	113.8	172.1	0	0	0	0	0	106.7	S4	A2-S4 PolarHBondContact O-N 2.95Å; A2-S4 VanDerWaalsContact O-N 3.14Å
3	G	39.7	Very low	67.9	Low	75 Å²	75	102.9 Å²	102.9	77%	0.773	60%	0.599	S	S	*	*			trans	-57.1	119.9	175.6	0	0	0	0	0	109	M1 G5	M1-G3 PolarHBondContact O-N 2.89Å; G3-G5 PolarHBondContact O-N 3.2Å
4	S	48.2	Very low	69.8	Low	127 Å²	127	101 Å²	101	89%	0.888	58%	0.577	S	S	*	*			trans	-69	70.1	173.3	-175.3	0	0	0	0	109.1	A2 R6	A2-S4 PolarHBondContact O-N 2.95Å; A2-S4 VanDerWaalsContact O-N 3.14Å; S4-R6 PolarHBondContact O-N 3.26Å
5	G	54.7	Low	71.4	Confident	65 Å²	65	104.1 Å²	104.1	67%	0.67	58%	0.584	S	S	*	*			trans	-69.3	112.3	172.7	0	0	0	0	0	108.7	G3 L7	G3-G5 PolarHBondContact O-N 3.2Å; G5-L7 PolarHBondContact O-N 3.39Å
6	R	64	Low	72.7	Confident	163 Å²	163	98.8 Å²	98.8	62%	0.615	55%	0.554	S	S	*	*			trans	-64.5	119.3	173	-170.3	176	179.4	-133.7	-4.2	107.9	S4 V8	S4-R6 PolarHBondContact O-N 3.26Å; R6-V8 PolarHBondContact O-N 3.29Å; R6-V8 VanDerWaalsContact O-N 3.11Å
7	L	67.4	Low	74	Confident	100 Å²	100	93.2 Å²	93.2	52%	0.524	52%	0.523	S	S	.	.			trans	-65.4	110.7	175.2	-73.5	168	0	0	0	108.6	G5 T128 Q130	G5-L7 PolarHBondContact O-N 3.39Å; L7-T128 HydrophobicContact CD1-CG2 3.79Å; L7-Q130 PolarHBondContact O-NE2 3.45Å
8	V	79.1	Confident	75	Confident	125 Å²	125	91.4 Å²	91.4	76%	0.758	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-89	117.4	179	-178.2	0	0	0	0	108.4	R6	R6-V8 PolarHBondContact O-N 3.29Å; R6-V8 VanDerWaalsContact O-N 3.11Å
9	L	82.4	Confident	75.8	Confident	27 Å²	27	88.4 Å²	88.4	14%	0.141	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-68	133.6	168.9	-65.9	175.4	0	0	0	109	A28 Q30 D62 L95	L9-A28 HydrophobicContact CD2-CB 3.85Å; L9-Q30 HydrophobicContact CD1-CB 4.07Å; L9-D62 WeakPolarHBondContact CB-O 3.25Å; L9-L95 HydrophobicContact CD1-CD2 3.92Å; L9-L95 HydrophobicContact CD2-CD1 4.48Å; L9-L95 HydrophobicContact CD2-CD2 3.96Å; L9-L95 HydrophobicContact CG-CD2 4.28Å
10	R	87.9	Confident	75.5	Confident	219 Å²	219	90.2 Å²	90.2	83%	0.826	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-80.1	127.7	169.4	-73.7	-169.6	176.9	-168	-0	108
11	P	93.3	Very high	75.3	Confident	67 Å²	67	93.2 Å²	93.2	44%	0.435	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-61	140.9	174.4	-21.6	34.3	0	0	0	110.6	D62 T64	P11-D62 WeakPolarHBondContact CA-OD2 3.38Å; P11-T64 WeakPolarHBondContact CG-OG1 3.46Å
12	W	93.8	Very high	77	Confident	16 Å²	16	87.4 Å²	87.4	6%	0.061	51%	0.509	C	S	.	.			trans	-150.4	-19.2	-177.1	62.2	-94.6	0	0	0	113.8	R14 E15 L16 R27 A28 D62 L98 L118	W12-R14 PolarHBondContact O-N 2.64Å; W12-E15 PolarHBondContact O-N 3.06Å; W12-L16 HydrophobicContact CE3-CB 4.15Å; W12-L16 HydrophobicContact CE3-CD2 3.91Å; W12-L16 HydrophobicContact CZ3-CD2 3.53Å; W12-L16 WeakPolarHBondContact O-CB 3.27Å; W12-L16 PolarHBondContact O-N 3.32Å; W12-R27 HydrophobicContact CD2-CB 3.76Å; W12-R27 HydrophobicContact CD2-CG 3.82Å; W12-R27 HydrophobicContact CE3-CB 4.08Å; W12-R27 HydrophobicContact CE3-CG 3.81Å; W12-R27 HydrophobicContact CG-CB 4.32Å; W12-R27 HydrophobicContact CG-CG 4.27Å; W12-R27 HydrophobicContact CH2-CB 4.05Å; W12-R27 HydrophobicContact CZ2-CB 3.73Å; W12-R27 HydrophobicContact CZ3-CB 4.21Å; W12-R27 HydrophobicContact CZ3-CG 4.17Å; W12-A28 PolarHBondContact NE1-O 3.48Å; W12-D62 HydrophobicContact CG-CB 4.32Å; W12-D62 PolarHBondContact N-OD2 3.37Å; W12-L98 HydrophobicContact CH2-CD1 3.54Å; W12-L98 HydrophobicContact CZ2-CD1 3.73Å; W12-L118 HydrophobicContact CH2-CD1 3.51Å; W12-L118 HydrophobicContact CZ3-CD1 3.76Å
13	I	94.9	Very high	78.5	Confident	1 Å²	1	83.7 Å²	83.7	1%	0.005	47%	0.474	C	S	.	.	H	α-helix	trans	-62.6	-49.7	-172	-69.5	166.5	0	0	0	110.8	E15 L16 I17 D62 Y65 V67 C138	I13-E15 PolarHBondContact O-N 3.39Å; I13-L16 PolarHBondContact O-N 2.96Å; I13-I17 HydrophobicContact CG2-CD1 3.88Å; I13-I17 WeakPolarHBondContact O-CG1 3.39Å; I13-I17 PolarHBondContact O-N 2.74Å; I13-D62 WeakPolarHBondContact CB-OD2 3.49Å; I13-D62 HydrophobicContact CD1-CB 3.69Å; I13-D62 HydrophobicContact CG1-CB 3.88Å; I13-D62 PolarHBondContact N-OD2 2.85Å; I13-Y65 WeakPolarHBondContact CD1-O 3.48Å; I13-V67 HydrophobicContact CD1-CB 4.23Å; I13-V67 HydrophobicContact CD1-CG1 3.68Å; I13-V67 HydrophobicContact CG1-CG1 3.98Å; I13-V67 HydrophobicContact CG2-CB 3.86Å; I13-V67 HydrophobicContact CG2-CG1 4.11Å; I13-V67 HydrophobicContact CG2-CG2 4.42Å; I13-C138 HydrophobicContact CG2-CB 3.62Å
14	R	94.9	Very high	80.2	Confident	76 Å²	76	85 Å²	85	29%	0.287	47%	0.472	S	S	.	.	H	α-helix	trans	-61	-46.4	179	176.1	-178.7	177.8	146.4	3.8	111.6	W12 L16 I17 L18 Y65 D141 D143 V144	W12-R14 PolarHBondContact O-N 2.64Å; R14-L16 VanDerWaalsContact C-N 3.31Å; R14-L16 PolarHBondContact O-N 3.35Å; R14-I17 PolarHBondContact O-N 3.12Å; R14-L18 HydrophobicContact CG-CD1 3.74Å; R14-L18 HydrophobicContact CG-CG 4.36Å; R14-L18 WeakPolarHBondContact O-CB 3.27Å; R14-L18 VanDerWaalsContact O-CG 3.27Å; R14-L18 WeakPolarHBondContact O-CG 3.31Å; R14-L18 PolarHBondContact O-N 2.99Å; R14-Y65 HydrophobicContact CB-CD2 4.1Å; R14-Y65 HydrophobicContact CB-CE2 3.92Å; R14-Y65 PolarHBondContact NH1-OH 3.14Å; R14-D141 IonicContact CZ-OD1 3.63Å; R14-D141 VanDerWaalsContact CZ-OD1 3.25Å; R14-D141 IonicContact CZ-OD2 3.25Å; R14-D141 IonicContact NE-OD1 3.84Å; R14-D141 VanDerWaalsContact NH1-CG 3.34Å; R14-D141 IonicContact NH1-OD1 2.63Å; R14-D141 PolarHBondContact NH1-OD1 2.84Å; R14-D141 IonicContact NH1-OD2 3.42Å; R14-D141 PolarHBondContact NH1-OD2 2.86Å; R14-D141 IonicContact NH2-OD1 3.76Å; R14-D141 PolarHBondContact NH2-OD1 2.95Å; R14-D141 IonicContact NH2-OD2 3.45Å; R14-D143 IonicContact CZ-OD2 3.62Å; R14-D143 IonicContact NH2-OD2 2.85Å; R14-D143 PolarHBondContact NH2-OD2 3.11Å; R14-V144 HydrophobicContact CG-CG2 4.46Å
15	E	93.3	Very high	82.1	Confident	148 Å²	148	81.1 Å²	81.1	69%	0.692	45%	0.445	S	S	*	.	H	α-helix	trans	-65.2	-37.6	-178.4	-67.1	-178.5	-178.4	0	0	111.5	W12 I13 G19	W12-E15 PolarHBondContact O-N 3.06Å; I13-E15 PolarHBondContact O-N 3.39Å; E15-G19 WeakPolarHBondContact O-CA 3.49Å; E15-G19 PolarHBondContact O-N 3.02Å
16	L	93.1	Very high	83.8	Confident	19 Å²	19	81.5 Å²	81.5	10%	0.099	44%	0.435	C	S	.	.	H	α-helix	trans	-64.9	-49.4	175.5	178.3	63.1	0	0	0	111.6	W12 I13 R14 L18 G19 L23 V103 L118	W12-L16 HydrophobicContact CE3-CB 4.15Å; W12-L16 HydrophobicContact CE3-CD2 3.91Å; W12-L16 HydrophobicContact CZ3-CD2 3.53Å; W12-L16 WeakPolarHBondContact O-CB 3.27Å; W12-L16 PolarHBondContact O-N 3.32Å; I13-L16 PolarHBondContact O-N 2.96Å; R14-L16 VanDerWaalsContact C-N 3.31Å; R14-L16 PolarHBondContact O-N 3.35Å; L16-L18 VanDerWaalsContact C-N 3.3Å; L16-L18 PolarHBondContact O-N 3.11Å; L16-G19 PolarHBondContact O-N 2.81Å; L16-L23 HydrophobicContact CD1-CD1 4.45Å; L16-L23 HydrophobicContact CD1-CD2 3.64Å; L16-L23 HydrophobicContact CD1-CG 3.61Å; L16-L23 HydrophobicContact CD2-CD1 3.65Å; L16-L23 HydrophobicContact CD2-CD2 3.93Å; L16-L23 HydrophobicContact CD2-CG 3.73Å; L16-L23 HydrophobicContact CG-CD2 4.32Å; L16-L23 HydrophobicContact CG-CG 4.32Å; L16-V103 HydrophobicContact CD1-CG2 4.33Å; L16-V103 HydrophobicContact CD2-CG2 3.82Å; L16-V103 HydrophobicContact CG-CG2 3.68Å; L16-L118 HydrophobicContact CD2-CD2 4.11Å
17	I	93.7	Very high	85.2	Confident	4 Å²	4	77.1 Å²	77.1	2%	0.021	42%	0.419	C	S	.	.	H	α-helix	trans	-63.8	-39.8	-178.5	-66.2	167	0	0	0	110.4	I13 R14 V103 F116 C138 V144 K147	I13-I17 HydrophobicContact CG2-CD1 3.88Å; I13-I17 WeakPolarHBondContact O-CG1 3.39Å; I13-I17 PolarHBondContact O-N 2.74Å; R14-I17 PolarHBondContact O-N 3.12Å; I17-V103 HydrophobicContact CG1-CG1 4.27Å; I17-F116 HydrophobicContact CD1-CB 4.21Å; I17-F116 HydrophobicContact CG2-CB 4.36Å; I17-F116 HydrophobicContact CG2-CD1 4.22Å; I17-F116 HydrophobicContact CG2-CD2 3.58Å; I17-F116 HydrophobicContact CG2-CE1 4.39Å; I17-F116 HydrophobicContact CG2-CE2 3.76Å; I17-F116 HydrophobicContact CG2-CG 3.81Å; I17-F116 HydrophobicContact CG2-CZ 4.19Å; I17-C138 HydrophobicContact CD1-CB 3.97Å; I17-V144 HydrophobicContact CD1-CG1 4.49Å; I17-V144 HydrophobicContact CG2-CG1 3.9Å; I17-V144 HydrophobicContact CG2-CG2 4.33Å; I17-K147 WeakPolarHBondContact O-CD 3.38Å; I17-K147 VanDerWaalsContact O-CE 3.25Å; I17-K147 WeakPolarHBondContact O-CE 3.4Å; I17-K147 PolarHBondContact O-NZ 2.99Å
18	L	93	Very high	86.4	Confident	61 Å²	61	74 Å²	74	32%	0.319	41%	0.408	S	S	.	.	H	α-helix	trans	-75.8	-29.3	178.7	-64.6	178.2	0	0	0	112.8	R14 L16 D143 V144 K147	R14-L18 HydrophobicContact CG-CD1 3.74Å; R14-L18 HydrophobicContact CG-CG 4.36Å; R14-L18 WeakPolarHBondContact O-CB 3.27Å; R14-L18 VanDerWaalsContact O-CG 3.27Å; R14-L18 WeakPolarHBondContact O-CG 3.31Å; R14-L18 PolarHBondContact O-N 2.99Å; L16-L18 VanDerWaalsContact C-N 3.3Å; L16-L18 PolarHBondContact O-N 3.11Å; L18-D143 HydrophobicContact CD1-CB 3.92Å; L18-D143 HydrophobicContact CD2-CB 4.01Å; L18-V144 HydrophobicContact CD2-CG2 4.29Å; L18-V144 HydrophobicContact CG-CG2 4.42Å; L18-K147 VanDerWaalsContact C-NZ 3.25Å; L18-K147 HydrophobicContact CD2-CB 4.21Å; L18-K147 HydrophobicContact CD2-CD 4.18Å; L18-K147 PolarHBondContact O-NZ 3.06Å
19	G	88.9	Confident	87.1	Confident	33 Å²	33	68.1 Å²	68.1	34%	0.34	37%	0.371	S	S	.	.	S	Bend	trans	-62.3	155	175.4	0	0	0	0	0	113.2	E15 L16 K147	E15-G19 WeakPolarHBondContact O-CA 3.49Å; E15-G19 PolarHBondContact O-N 3.02Å; L16-G19 PolarHBondContact O-N 2.81Å; G19-K147 PolarHBondContact O-NZ 2.82Å
20	S	69.7	Low	87.7	Confident	125 Å²	125	67.1 Å²	67.1	87%	0.874	37%	0.366	S	S	*	.	S	Bend	trans	-97.2	-4.1	175.7	51.7	0	0	0	0	113
21	E	71.6	Confident	88.1	Confident	153 Å²	153	56.7 Å²	56.7	72%	0.715	33%	0.327	S	S	*	.	S	Bend	trans	-101	141.6	-176.3	-65.7	-177.6	177.7	0	0	111.4
22	T	72.6	Confident	88.1	Confident	126 Å²	126	54.3 Å²	54.3	77%	0.773	31%	0.31	S	S	*	.			trans	-66.9	157.1	168.8	52.7	0	0	0	0	110.8	S24	T22-S24 PolarHBondContact O-N 3.02Å
23	L	71.6	Confident	88.2	Confident	28 Å²	28	58.5 Å²	58.5	15%	0.147	33%	0.331	C	S	.	.			trans	-61.3	111.9	-178	-82.7	171.8	0	0	0	112.3	L16 R27 C101	L16-L23 HydrophobicContact CD1-CD1 4.45Å; L16-L23 HydrophobicContact CD1-CD2 3.64Å; L16-L23 HydrophobicContact CD1-CG 3.61Å; L16-L23 HydrophobicContact CD2-CD1 3.65Å; L16-L23 HydrophobicContact CD2-CD2 3.93Å; L16-L23 HydrophobicContact CD2-CG 3.73Å; L16-L23 HydrophobicContact CG-CD2 4.32Å; L16-L23 HydrophobicContact CG-CG 4.32Å; L23-R27 HydrophobicContact CD1-CG 4.11Å; L23-R27 HydrophobicContact CD2-CG 3.49Å; L23-R27 VanDerWaalsContact CD2-CG 3.49Å; L23-R27 HydrophobicContact CG-CG 4.47Å; L23-C101 HydrophobicContact CD1-CB 4.39Å; L23-C101 WeakPolarHBondContact CD1-SG 3.05Å
24	S	77.4	Confident	88.1	Confident	103 Å²	103	58.9 Å²	58.9	72%	0.72	33%	0.333	S	S	*	.			trans	-86.4	-12.9	176.7	54.2	0	0	0	0	113.6	T22	T22-S24 PolarHBondContact O-N 3.02Å
25	S	86.4	Confident	88	Confident	45 Å²	45	59 Å²	59	32%	0.315	34%	0.339	S	S	.	.	S	Bend	trans	-148.4	150.1	-176.6	43.2	0	0	0	0	112	R27	S25-R27 PolarHBondContact O-NH1 2.77Å; S25-R27 PolarHBondContact OG-NH1 3.4Å; S25-R27 PolarHBondContact OG-NH2 3.39Å
26	P	90.9	Very high	87.9	Confident	73 Å²	73	56.9 Å²	56.9	47%	0.474	33%	0.329	S	S	.	.			trans	-57	148.1	179.7	-25.1	34	0	0	0	112.9	L97 L98	P26-L97 HydrophobicContact CB-CD1 3.95Å; P26-L97 HydrophobicContact CB-CG 4.2Å; P26-L98 CarbonylContact C-O 3.56Å; P26-L98 VanDerWaalsContact CA-O 3.25Å; P26-L98 WeakPolarHBondContact CA-O 3.39Å
27	R	92.6	Very high	87.7	Confident	71 Å²	71	57.7 Å²	57.7	27%	0.268	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.8	-178.9	-63.9	-64.7	-179.6	-115	1.7	110.8	W12 L23 S25 L98	W12-R27 HydrophobicContact CD2-CB 3.76Å; W12-R27 HydrophobicContact CD2-CG 3.82Å; W12-R27 HydrophobicContact CE3-CB 4.08Å; W12-R27 HydrophobicContact CE3-CG 3.81Å; W12-R27 HydrophobicContact CG-CB 4.32Å; W12-R27 HydrophobicContact CG-CG 4.27Å; W12-R27 HydrophobicContact CH2-CB 4.05Å; W12-R27 HydrophobicContact CZ2-CB 3.73Å; W12-R27 HydrophobicContact CZ3-CB 4.21Å; W12-R27 HydrophobicContact CZ3-CG 4.17Å; L23-R27 HydrophobicContact CD1-CG 4.11Å; L23-R27 HydrophobicContact CD2-CG 3.49Å; L23-R27 VanDerWaalsContact CD2-CG 3.49Å; L23-R27 HydrophobicContact CG-CG 4.47Å; S25-R27 PolarHBondContact O-NH1 2.77Å; S25-R27 PolarHBondContact OG-NH1 3.4Å; S25-R27 PolarHBondContact OG-NH2 3.39Å; R27-L98 PolarHBondContact N-O 2.86Å; R27-L98 PolarHBondContact O-N 3.35Å
28	A	93.5	Very high	87	Confident	35 Å²	35	57.8 Å²	57.8	29%	0.289	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	131.6	175.5	0	0	0	0	0	109.8	L9 W12 L97	L9-A28 HydrophobicContact CD2-CB 3.85Å; W12-A28 PolarHBondContact NE1-O 3.48Å; A28-L97 HydrophobicContact CB-CD1 4.23Å
29	G	94.3	Very high	86	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	169.4	170.9	0	0	0	0	0	110.9	S61 L95 L96	G29-S61 CarbonylContact C-O 3.52Å; G29-S61 WeakPolarHBondContact CA-O 3.4Å; G29-L95 CarbonylContact O-C 3.52Å; G29-L95 WeakPolarHBondContact O-CA 3.01Å; G29-L96 PolarHBondContact N-O 3.2Å; G29-L96 PolarHBondContact O-N 3.08Å
30	Q	95	Very high	84.9	Confident	7 Å²	7	61.6 Å²	61.6	3%	0.033	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	131.5	172.2	-175.7	-176.8	29	0	0	109	L9 L32 V60 S61 G93 L95 Q130 P131	L9-Q30 HydrophobicContact CD1-CB 4.07Å; Q30-L32 PolarHBondContact O-N 2.74Å; Q30-V60 CarbonylContact O-C 3.5Å; Q30-V60 WeakPolarHBondContact O-CA 3.31Å; Q30-S61 PolarHBondContact N-O 3.04Å; Q30-S61 PolarHBondContact O-N 3.43Å; Q30-G93 PolarHBondContact NE2-O 2.9Å; Q30-L95 HydrophobicContact CB-CD2 4.04Å; Q30-L95 HydrophobicContact CG-CD2 4.47Å; Q30-Q130 PolarHBondContact NE2-O 3.36Å; Q30-P131 PolarHBondContact NE2-O 3.12Å; Q30-P131 VanDerWaalsContact NE2-O 3.09Å
31	L	95.2	Very high	84.4	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	116.3	171.7	178.2	60.6	0	0	0	109.6	E33 V34 L58 F88 T91 G93 R94	L31-E33 WeakPolarHBondContact CD1-O 3.49Å; L31-V34 HydrophobicContact CD2-CG2 4.14Å; L31-L58 HydrophobicContact CD1-CB 3.8Å; L31-L58 HydrophobicContact CD1-CD1 4.19Å; L31-L58 HydrophobicContact CD1-CD2 4.04Å; L31-L58 HydrophobicContact CD1-CG 4.23Å; L31-F88 HydrophobicContact CD2-CB 4.11Å; L31-F88 HydrophobicContact CD2-CD1 4.32Å; L31-T91 VanDerWaalsContact CD2-OG1 3.25Å; L31-T91 WeakPolarHBondContact CD2-OG1 3.43Å; L31-G93 PolarHBondContact O-N 3.15Å; L31-R94 PolarHBondContact N-O 3.47Å
32	L	94.8	Very high	83.6	Confident	17 Å²	17	55.3 Å²	55.3	9%	0.089	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-44.1	178.5	-65.4	-173.8	0	0	0	112.5	Q30 L59 R132 V135	Q30-L32 PolarHBondContact O-N 2.74Å; L32-L59 HydrophobicContact CB-CB 4.48Å; L32-L59 HydrophobicContact CB-CD2 4.39Å; L32-L59 HydrophobicContact CB-CG 4.39Å; L32-L59 WeakPolarHBondContact CB-O 3.48Å; L32-L59 HydrophobicContact CD1-CD2 4.36Å; L32-L59 HydrophobicContact CD1-CG 4.41Å; L32-L59 PolarHBondContact N-O 2.95Å; L32-R132 HydrophobicContact CD2-CB 4.35Å; L32-R132 VanDerWaalsContact O-CD 3.32Å; L32-R132 WeakPolarHBondContact O-CD 3.23Å; L32-R132 PolarHBondContact O-NH1 2.93Å; L32-V135 HydrophobicContact CD1-CG2 3.73Å
33	E	94.8	Very high	82.5	Confident	103 Å²	103	54.9 Å²	54.9	48%	0.481	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	147.2	-172.1	-172	169.2	-166.9	0	0	110.6	L31 L35 L59	L31-E33 WeakPolarHBondContact CD1-O 3.49Å; E33-L35 HydrophobicContact CG-CD2 4.14Å; E33-L59 HydrophobicContact CB-CB 4.13Å; E33-L59 HydrophobicContact CB-CD2 4.43Å; E33-L59 PolarHBondContact O-N 3.39Å
34	V	94.2	Very high	81.5	Confident	9 Å²	9	55.7 Å²	55.7	6%	0.055	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	106.4	172	-175.9	0	0	0	0	107.8	L31 E37 L58 F88 R89 E92	L31-V34 HydrophobicContact CD2-CG2 4.14Å; V34-E37 HydrophobicContact CG1-CB 4.41Å; V34-L58 HydrophobicContact CB-CD2 4.32Å; V34-L58 HydrophobicContact CG1-CD2 3.96Å; V34-L58 HydrophobicContact CG2-CD2 4.08Å; V34-F88 HydrophobicContact CG1-CB 4.25Å; V34-F88 HydrophobicContact CG2-CB 3.57Å; V34-R89 HydrophobicContact CB-CG 4.48Å; V34-R89 HydrophobicContact CG1-CG 4.4Å; V34-E92 HydrophobicContact CG2-CG 4.4Å
35	L	91.6	Very high	80.1	Confident	80 Å²	80	57.8 Å²	57.8	42%	0.419	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-42.3	-177.4	-58.5	178.9	0	0	0	111.2	E33 T57 L59 R68	E33-L35 HydrophobicContact CG-CD2 4.14Å; L35-T57 WeakPolarHBondContact CA-O 3.19Å; L35-T57 HydrophobicContact CB-CG2 4.05Å; L35-T57 WeakPolarHBondContact CB-O 3.48Å; L35-T57 HydrophobicContact CD1-CG2 4.03Å; L35-T57 PolarHBondContact N-O 2.93Å; L35-L59 HydrophobicContact CD1-CB 4.46Å; L35-L59 HydrophobicContact CG-CB 4.43Å; L35-R68 HydrophobicContact CD1-CG 4.29Å
36	Q	90.9	Very high	78.5	Confident	103 Å²	103	59.4 Å²	59.4	48%	0.481	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	130.3	174.9	-177.7	59.5	58.4	0	0	108.6	A56 T57	Q36-A56 CarbonylContact O-C 3.55Å; Q36-A56 WeakPolarHBondContact O-CA 3.12Å; Q36-T57 PolarHBondContact N-O 3.3Å; Q36-T57 PolarHBondContact O-N 3.03Å
37	E	88.9	Confident	76.7	Confident	35 Å²	35	65.9 Å²	65.9	16%	0.164	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-92.4	146.2	174.8	-168.6	67.6	-100.4	0	0	109.3	V34 G87 F88 R89	V34-E37 HydrophobicContact CG1-CB 4.41Å; E37-G87 VanDerWaalsContact OE1-CA 3.31Å; E37-G87 WeakPolarHBondContact OE1-CA 3.29Å; E37-F88 VanDerWaalsContact CD-N 3.31Å; E37-F88 PolarHBondContact OE1-N 3.28Å; E37-F88 PolarHBondContact OE2-N 2.64Å; E37-R89 WeakPolarHBondContact OE2-CB 3.47Å; E37-R89 VanDerWaalsContact OE2-CG 3.25Å; E37-R89 WeakPolarHBondContact OE2-CG 3.37Å; E37-R89 PolarHBondContact OE2-N 2.82Å
38	A	80.4	Confident	74.8	Confident	7 Å²	7	64.9 Å²	64.9	6%	0.058	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-82.8	131.8	171.3	0	0	0	0	0	110.2	A56 L76	A38-A56 HydrophobicContact CB-CB 4.05Å; A38-L76 HydrophobicContact CB-CD1 3.23Å
39	E	72	Confident	72.8	Confident	122 Å²	122	68.8 Å²	68.8	57%	0.57	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-76.4	132.2	174.3	-163.2	166.5	-174.2	0	0	109.3	A41 R73	E39-A41 PolarHBondContact O-N 3.05Å; E39-R73 PolarHBondContact O-NH1 2.78Å
40	A	64.3	Low	70.5	Confident	52 Å²	52	76 Å²	76	43%	0.43	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-60.7	135.3	176.3	0	0	0	0	0	109.1	A42 F86	A40-A42 PolarHBondContact O-N 3.1Å; A40-F86 HydrophobicContact CB-CD1 3.78Å; A40-F86 HydrophobicContact CB-CE1 3.57Å; A40-F86 HydrophobicContact CB-CG 4.48Å; A40-F86 HydrophobicContact CB-CZ 4.1Å
41	A	60.2	Low	68.4	Low	64 Å²	64	77.3 Å²	77.3	53%	0.529	48%	0.482	S	S	.	.			trans	-61.8	103.2	177.2	0	0	0	0	0	108.7	E39 A43	E39-A41 PolarHBondContact O-N 3.05Å; A41-A43 PolarHBondContact O-N 3.22Å
42	A	54.9	Low	66.4	Low	82 Å²	82	79.5 Å²	79.5	68%	0.678	50%	0.498	S	S	*	.			trans	-70.3	114.7	176.8	0	0	0	0	0	108.2	A40 G44	A40-A42 PolarHBondContact O-N 3.1Å; A42-G44 VanDerWaalsContact C-N 3.29Å; A42-G44 PolarHBondContact O-N 2.86Å
43	A	48.4	Very low	64.9	Low	116 Å²	116	85.6 Å²	85.6	96%	0.959	53%	0.53	S	S	*	.	S	Bend	trans	-72.9	82.8	174.7	0	0	0	0	0	110.1	A41	A41-A43 PolarHBondContact O-N 3.22Å
44	G	51.2	Low	64	Low	46 Å²	46	84.5 Å²	84.5	47%	0.474	53%	0.53	S	S	.	.	S	Bend	trans	168.7	152.4	171.8	0	0	0	0	0	113.3	A42 S46	A42-G44 VanDerWaalsContact C-N 3.29Å; A42-G44 PolarHBondContact O-N 2.86Å; G44-S46 PolarHBondContact O-N 2.98Å
45	P	48.8	Very low	63.6	Low	147 Å²	147	84.5 Å²	84.5	96%	0.955	53%	0.532	S	S	*	.			trans	-65.8	104	174.7	26.7	-31.1	0	0	0	108.9
46	S	51.8	Low	63.6	Low	79 Å²	79	80.7 Å²	80.7	55%	0.552	51%	0.512	S	S	*	.			trans	-108	145.4	176.8	178.4	0	0	0	0	109	G44 A48	G44-S46 PolarHBondContact O-N 2.98Å; S46-A48 PolarHBondContact O-N 2.92Å; S46-A48 WeakPolarHBondContact OG-CB 3.14Å; S46-A48 PolarHBondContact OG-N 3.22Å
47	H	52.5	Low	63.8	Low	209 Å²	209	76.8 Å²	76.8	97%	0.968	50%	0.495	S	S	*	.	S	Bend	trans	-79	4.2	172.7	-85.4	-76.6	0	0	0	113.1
48	A	52.9	Low	64.1	Low	49 Å²	49	75.1 Å²	75.1	41%	0.405	49%	0.487	S	S	.	.	S	Bend	trans	-73.4	146.4	174.2	0	0	0	0	0	110.3	S46 D50	S46-A48 PolarHBondContact O-N 2.92Å; S46-A48 WeakPolarHBondContact OG-CB 3.14Å; S46-A48 PolarHBondContact OG-N 3.22Å; A48-D50 PolarHBondContact O-N 2.82Å
49	P	52	Low	64.9	Low	117 Å²	117	76.6 Å²	76.6	76%	0.76	49%	0.494	S	S	*	.			trans	-56	129.7	175.2	22.7	-31.2	0	0	0	109.8	A51	P49-A51 VanDerWaalsContact C-N 3.26Å; P49-A51 PolarHBondContact O-N 3.33Å
50	D	45.4	Very low	66.1	Low	152 Å²	152	70.8 Å²	70.8	81%	0.813	47%	0.467	S	S	*	.			trans	-62.5	84.8	177.1	-82.5	-36.6	0	0	0	109.9	A48	A48-D50 PolarHBondContact O-N 2.82Å
51	A	52.1	Low	67.5	Low	35 Å²	35	68.4 Å²	68.4	29%	0.289	45%	0.447	S	S	.	.			trans	-86.6	8.9	169.8	0	0	0	0	0	111.9	P49 D53 V54	P49-A51 VanDerWaalsContact C-N 3.26Å; P49-A51 PolarHBondContact O-N 3.33Å; A51-D53 PolarHBondContact O-N 2.83Å; A51-D53 VanDerWaalsContact O-N 3.11Å; A51-V54 PolarHBondContact O-N 2.82Å
52	S	53.4	Low	69.2	Low	46 Å²	46	65.4 Å²	65.4	32%	0.322	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.9	-171.2	58.7	0	0	0	0	114.5	R73	S52-R73 VanDerWaalsContact O-CD 3.27Å; S52-R73 WeakPolarHBondContact O-CD 3.45Å
53	D	61.9	Low	70.9	Confident	145 Å²	145	63.3 Å²	63.3	78%	0.775	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-6.5	178.2	-74.2	-11.6	0	0	0	113.4	A51	A51-D53 PolarHBondContact O-N 2.83Å; A51-D53 VanDerWaalsContact O-N 3.11Å
54	V	75.6	Confident	73	Confident	80 Å²	80	60.7 Å²	60.7	49%	0.485	38%	0.381	S	S	.	.			trans	-88.1	121.3	-176.6	-173	0	0	0	0	110.2	A51	A51-V54 PolarHBondContact O-N 2.82Å
55	G	86.3	Confident	75.2	Confident	9 Å²	9	60 Å²	60	9%	0.093	36%	0.364	C	S	.	.			trans	-71	-176.7	172.6	0	0	0	0	0	113.7	V71	G55-V71 CarbonylContact C-O 3.45Å; G55-V71 WeakPolarHBondContact CA-O 3.44Å
56	A	91.8	Very high	77.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	142.1	175.7	0	0	0	0	0	110.7	Q36 A38 V71 L76 F88	Q36-A56 CarbonylContact O-C 3.55Å; Q36-A56 WeakPolarHBondContact O-CA 3.12Å; A38-A56 HydrophobicContact CB-CB 4.05Å; A56-V71 HydrophobicContact CB-CB 4.3Å; A56-V71 PolarHBondContact N-O 2.89Å; A56-V71 PolarHBondContact O-N 3.12Å; A56-L76 HydrophobicContact CB-CD1 4.33Å; A56-L76 HydrophobicContact CB-CD2 4.5Å; A56-F88 HydrophobicContact CB-CD2 3.83Å; A56-F88 HydrophobicContact CB-CE2 3.67Å
57	T	94.9	Very high	79.6	Confident	20 Å²	20	49.9 Å²	49.9	12%	0.123	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	120.4	173.5	-54.6	0	0	0	0	110	L35 Q36 R68 C69	L35-T57 WeakPolarHBondContact CA-O 3.19Å; L35-T57 HydrophobicContact CB-CG2 4.05Å; L35-T57 WeakPolarHBondContact CB-O 3.48Å; L35-T57 HydrophobicContact CD1-CG2 4.03Å; L35-T57 PolarHBondContact N-O 2.93Å; Q36-T57 PolarHBondContact N-O 3.3Å; Q36-T57 PolarHBondContact O-N 3.03Å; T57-R68 HydrophobicContact CG2-CG 3.59Å; T57-C69 CarbonylContact C-O 3.44Å; T57-C69 WeakPolarHBondContact CA-O 3.45Å
58	L	95.8	Very high	81.7	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	153.4	-174.7	-53	-178.8	0	0	0	111	L31 V34 V60 R68 C69 V71 F88 L96	L31-L58 HydrophobicContact CD1-CB 3.8Å; L31-L58 HydrophobicContact CD1-CD1 4.19Å; L31-L58 HydrophobicContact CD1-CD2 4.04Å; L31-L58 HydrophobicContact CD1-CG 4.23Å; V34-L58 HydrophobicContact CB-CD2 4.32Å; V34-L58 HydrophobicContact CG1-CD2 3.96Å; V34-L58 HydrophobicContact CG2-CD2 4.08Å; L58-V60 HydrophobicContact CB-CG2 4.26Å; L58-R68 CarbonylContact O-C 3.58Å; L58-R68 WeakPolarHBondContact O-CA 3.16Å; L58-C69 HydrophobicContact CB-CB 4.39Å; L58-C69 PolarHBondContact N-O 2.61Å; L58-C69 PolarHBondContact O-N 3.49Å; L58-V71 HydrophobicContact CD1-CG2 3.6Å; L58-V71 HydrophobicContact CG-CG2 4.05Å; L58-F88 HydrophobicContact CD1-CD1 3.82Å; L58-F88 HydrophobicContact CD1-CD2 4.04Å; L58-F88 HydrophobicContact CD1-CE1 3.72Å; L58-F88 HydrophobicContact CD1-CE2 3.91Å; L58-F88 HydrophobicContact CD1-CG 3.97Å; L58-F88 HydrophobicContact CD1-CZ 3.75Å; L58-F88 HydrophobicContact CD2-CB 3.77Å; L58-F88 HydrophobicContact CD2-CD1 4.29Å; L58-F88 HydrophobicContact CD2-CD2 3.64Å; L58-F88 HydrophobicContact CD2-CE2 4.24Å; L58-F88 HydrophobicContact CD2-CG 3.64Å; L58-F88 HydrophobicContact CG-CD2 4.32Å; L58-F88 HydrophobicContact CG-CE2 4.45Å; L58-F88 HydrophobicContact CG-CG 4.44Å; L58-L96 HydrophobicContact CD1-CD2 4.14Å
59	L	96.8	Very high	83.7	Confident	39 Å²	39	39.9 Å²	39.9	20%	0.204	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	112.7	167.8	-170.7	64	0	0	0	109.1	L32 E33 L35	L32-L59 HydrophobicContact CB-CB 4.48Å; L32-L59 HydrophobicContact CB-CD2 4.39Å; L32-L59 HydrophobicContact CB-CG 4.39Å; L32-L59 WeakPolarHBondContact CB-O 3.48Å; L32-L59 HydrophobicContact CD1-CD2 4.36Å; L32-L59 HydrophobicContact CD1-CG 4.41Å; L32-L59 PolarHBondContact N-O 2.95Å; E33-L59 HydrophobicContact CB-CB 4.13Å; E33-L59 HydrophobicContact CB-CD2 4.43Å; E33-L59 PolarHBondContact O-N 3.39Å; L35-L59 HydrophobicContact CD1-CB 4.46Å; L35-L59 HydrophobicContact CG-CB 4.43Å
60	V	96.3	Very high	85.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.9	-174.5	-178.5	0	0	0	0	110.5	Q30 L58 S66 V67 C69 L96	Q30-V60 CarbonylContact O-C 3.5Å; Q30-V60 WeakPolarHBondContact O-CA 3.31Å; L58-V60 HydrophobicContact CB-CG2 4.26Å; V60-S66 CarbonylContact O-C 3.58Å; V60-S66 VanDerWaalsContact O-CA 3.23Å; V60-S66 WeakPolarHBondContact O-CA 3.21Å; V60-V67 PolarHBondContact N-O 3.06Å; V60-V67 PolarHBondContact O-N 2.91Å; V60-C69 HydrophobicContact CG2-CB 4.07Å; V60-C69 VanDerWaalsContact CG2-SG 3.58Å; V60-L96 HydrophobicContact CG2-CD2 3.97Å
61	S	95.6	Very high	88.1	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.007	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	139.1	178.8	175.1	0	0	0	0	112.5	G29 Q30 G63 Y65 V135	G29-S61 CarbonylContact C-O 3.52Å; G29-S61 WeakPolarHBondContact CA-O 3.4Å; Q30-S61 PolarHBondContact N-O 3.04Å; Q30-S61 PolarHBondContact O-N 3.43Å; S61-G63 VanDerWaalsContact C-N 3.32Å; S61-G63 PolarHBondContact OG-N 3.38Å; S61-Y65 VanDerWaalsContact CA-O 3.28Å; S61-Y65 WeakPolarHBondContact CA-O 3.45Å; S61-Y65 PolarHBondContact OG-O 2.64Å; S61-V135 WeakPolarHBondContact OG-CG2 3.47Å
62	D	94.1	Very high	90	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	17%	0.169	C	C	.	.			trans	-93.6	7.3	168.8	69	-0.3	0	0	0	112.9	L9 P11 W12 I13 T64 Y65	L9-D62 WeakPolarHBondContact CB-O 3.25Å; P11-D62 WeakPolarHBondContact CA-OD2 3.38Å; W12-D62 HydrophobicContact CG-CB 4.32Å; W12-D62 PolarHBondContact N-OD2 3.37Å; I13-D62 WeakPolarHBondContact CB-OD2 3.49Å; I13-D62 HydrophobicContact CD1-CB 3.69Å; I13-D62 HydrophobicContact CG1-CB 3.88Å; I13-D62 PolarHBondContact N-OD2 2.85Å; D62-T64 WeakPolarHBondContact OD1-CA 3.5Å; D62-T64 PolarHBondContact OD1-N 2.88Å; D62-Y65 PolarHBondContact N-O 3.1Å; D62-Y65 VanDerWaalsContact N-O 3.16Å; D62-Y65 PolarHBondContact OD1-N 3.11Å
63	G	91.3	Very high	91.6	Very high	38 Å²	38	28 Å²	28	39%	0.392	16%	0.159	S	C	.	.	S	Bend	trans	93.1	-13.1	-174.2	0	0	0	0	0	114.3	S61	S61-G63 VanDerWaalsContact C-N 3.32Å; S61-G63 PolarHBondContact OG-N 3.38Å
64	T	93.5	Very high	92.8	Very high	61 Å²	61	26.6 Å²	26.6	37%	0.374	15%	0.148	S	C	.	.	S	Bend	trans	-118.3	-46	176.8	-54.1	0	0	0	0	112	P11 D62 P136	P11-T64 WeakPolarHBondContact CG-OG1 3.46Å; D62-T64 WeakPolarHBondContact OD1-CA 3.5Å; D62-T64 PolarHBondContact OD1-N 2.88Å; T64-P136 WeakPolarHBondContact O-CD 3.25Å
65	Y	96.2	Very high	93.5	Very high	33 Å²	33	22.8 Å²	22.8	13%	0.129	13%	0.125	C	C	.	.			trans	-124.3	160.2	178.4	-65.2	-82.6	0	0	0	110.7	I13 R14 S61 D62 P136 C138 D141	I13-Y65 WeakPolarHBondContact CD1-O 3.48Å; R14-Y65 HydrophobicContact CB-CD2 4.1Å; R14-Y65 HydrophobicContact CB-CE2 3.92Å; R14-Y65 PolarHBondContact NH1-OH 3.14Å; S61-Y65 VanDerWaalsContact CA-O 3.28Å; S61-Y65 WeakPolarHBondContact CA-O 3.45Å; S61-Y65 PolarHBondContact OG-O 2.64Å; D62-Y65 PolarHBondContact N-O 3.1Å; D62-Y65 VanDerWaalsContact N-O 3.16Å; D62-Y65 PolarHBondContact OD1-N 3.11Å; Y65-P136 CarbonylContact C-O 3.58Å; Y65-P136 WeakPolarHBondContact CA-O 3.36Å; Y65-P136 HydrophobicContact CD1-CG 4.13Å; Y65-P136 HydrophobicContact CE1-CG 4.37Å; Y65-C138 HydrophobicContact CD1-CB 4.45Å; Y65-C138 HydrophobicContact CG-CB 4.42Å; Y65-D141 HydrophobicContact CE1-CB 4.01Å; Y65-D141 PolarHBondContact OH-OD2 3.4Å
66	S	96.3	Very high	93.6	Very high	11 Å²	11	22.4 Å²	22.4	8%	0.077	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	147	167	51	0	0	0	0	111.2	V60 P136 G137 C138	V60-S66 CarbonylContact O-C 3.58Å; V60-S66 VanDerWaalsContact O-CA 3.23Å; V60-S66 WeakPolarHBondContact O-CA 3.21Å; S66-P136 PolarHBondContact N-O 3.4Å; S66-P136 PolarHBondContact OG-O 3.35Å; S66-P136 VanDerWaalsContact OG-O 3.06Å; S66-G137 CarbonylContact O-C 3.59Å; S66-G137 WeakPolarHBondContact O-CA 3.22Å; S66-G137 WeakPolarHBondContact OG-CA 3.12Å; S66-C138 PolarHBondContact O-N 3.19Å; S66-C138 PolarHBondContact O-SG 3.42Å; S66-C138 VanDerWaalsContact O-SG 3.34Å
67	V	96.7	Very high	93.2	Very high	2 Å²	2	27 Å²	27	1%	0.012	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	144.8	177.1	66.2	0	0	0	0	109.8	I13 V60 L118	I13-V67 HydrophobicContact CD1-CB 4.23Å; I13-V67 HydrophobicContact CD1-CG1 3.68Å; I13-V67 HydrophobicContact CG1-CG1 3.98Å; I13-V67 HydrophobicContact CG2-CB 3.86Å; I13-V67 HydrophobicContact CG2-CG1 4.11Å; I13-V67 HydrophobicContact CG2-CG2 4.42Å; V60-V67 PolarHBondContact N-O 3.06Å; V60-V67 PolarHBondContact O-N 2.91Å; V67-L118 HydrophobicContact CG1-CD1 3.69Å; V67-L118 HydrophobicContact CG1-CG 4.15Å; V67-L118 HydrophobicContact CG2-CD1 4.38Å; V67-L118 HydrophobicContact CG2-CG 3.94Å
68	R	96.2	Very high	92.6	Very high	48 Å²	48	30.9 Å²	30.9	18%	0.181	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	129	172.8	-176	169.1	66.4	101.6	-2.6	108.9	L35 T57 L58 E115 Y117 L118	L35-R68 HydrophobicContact CD1-CG 4.29Å; T57-R68 HydrophobicContact CG2-CG 3.59Å; L58-R68 CarbonylContact O-C 3.58Å; L58-R68 WeakPolarHBondContact O-CA 3.16Å; R68-E115 IonicContact CZ-OE1 2.75Å; R68-E115 VanDerWaalsContact CZ-OE1 3.31Å; R68-E115 IonicContact NE-OE1 2.67Å; R68-E115 PolarHBondContact NE-OE1 2.73Å; R68-E115 IonicContact NH2-OE1 3.87Å; R68-E115 PolarHBondContact NH2-OE1 3.22Å; R68-E115 VanDerWaalsContact NH2-OE1 3.08Å; R68-Y117 WeakPolarHBondContact O-CA 3.45Å; R68-Y117 WeakPolarHBondContact O-CB 3.46Å; R68-L118 PolarHBondContact O-N 2.81Å
69	C	95.7	Very high	91.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	123.3	176.1	-64.5	0	0	0	0	109.5	T57 L58 V60 L118 V120	T57-C69 CarbonylContact C-O 3.44Å; T57-C69 WeakPolarHBondContact CA-O 3.45Å; L58-C69 HydrophobicContact CB-CB 4.39Å; L58-C69 PolarHBondContact N-O 2.61Å; L58-C69 PolarHBondContact O-N 3.49Å; V60-C69 HydrophobicContact CG2-CB 4.07Å; V60-C69 VanDerWaalsContact CG2-SG 3.58Å; C69-L118 CarbonylContact C-O 3.51Å; C69-L118 VanDerWaalsContact CA-O 3.26Å; C69-L118 WeakPolarHBondContact CA-O 3.48Å; C69-V120 HydrophobicContact CB-CG2 3.91Å
70	L	95.3	Very high	90.8	Very high	47 Å²	47	38.2 Å²	38.2	25%	0.246	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	107.5	169.9	179.4	65.4	0	0	0	108.2	Y117 L118 Q119 V120	L70-Y117 HydrophobicContact CB-CD2 4.21Å; L70-Y117 HydrophobicContact CB-CE2 4.2Å; L70-Y117 HydrophobicContact CD2-CE2 4.23Å; L70-L118 PolarHBondContact N-O 2.82Å; L70-Q119 CarbonylContact O-C 3.54Å; L70-Q119 WeakPolarHBondContact O-CA 3.16Å; L70-V120 PolarHBondContact O-N 3.27Å
71	V	94.3	Very high	89.7	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	117.6	174.5	-173.1	0	0	0	0	108	G55 A56 L58 A75 L76 F88 V120 F123	G55-V71 CarbonylContact C-O 3.45Å; G55-V71 WeakPolarHBondContact CA-O 3.44Å; A56-V71 HydrophobicContact CB-CB 4.3Å; A56-V71 PolarHBondContact N-O 2.89Å; A56-V71 PolarHBondContact O-N 3.12Å; L58-V71 HydrophobicContact CD1-CG2 3.6Å; L58-V71 HydrophobicContact CG-CG2 4.05Å; V71-A75 HydrophobicContact CG1-CB 3.79Å; V71-L76 HydrophobicContact CB-CD2 4.39Å; V71-L76 HydrophobicContact CG1-CD2 3.65Å; V71-L76 HydrophobicContact CG1-CG 3.92Å; V71-F88 HydrophobicContact CG1-CZ 4.4Å; V71-F88 HydrophobicContact CG2-CE2 4.31Å; V71-F88 HydrophobicContact CG2-CZ 4.17Å; V71-V120 HydrophobicContact CG2-CB 4.35Å; V71-F123 HydrophobicContact CG1-CD1 3.82Å; V71-F123 HydrophobicContact CG1-CE1 3.65Å
72	T	92.3	Very high	88.3	Confident	18 Å²	18	48.1 Å²	48.1	11%	0.11	25%	0.254	C	S	.	.			trans	-68.3	157.2	-177.1	56.6	0	0	0	0	111.5	E74 A75 L76 Q119 V120 D121	T72-E74 VanDerWaalsContact C-N 3.28Å; T72-E74 PolarHBondContact O-N 3.05Å; T72-E74 WeakPolarHBondContact OG1-CG 3.24Å; T72-E74 PolarHBondContact OG1-OE1 2.82Å; T72-A75 WeakPolarHBondContact O-CB 3.47Å; T72-A75 PolarHBondContact O-N 2.79Å; T72-A75 VanDerWaalsContact O-N 3.12Å; T72-A75 WeakPolarHBondContact OG1-CB 3.37Å; T72-A75 PolarHBondContact OG1-N 2.84Å; T72-L76 WeakPolarHBondContact O-CG 3.46Å; T72-L76 PolarHBondContact O-N 3.27Å; T72-Q119 HydrophobicContact CG2-CG 3.52Å; T72-V120 PolarHBondContact N-O 2.88Å; T72-V120 PolarHBondContact OG1-O 3.28Å; T72-D121 WeakPolarHBondContact CG2-OD1 3.45Å; T72-D121 PolarHBondContact OG1-OD1 2.85Å
73	R	87.5	Confident	86.2	Confident	34 Å²	34	57.7 Å²	57.7	13%	0.128	30%	0.299	C	S	.	.	H	α-helix	trans	-59.5	-42.6	179.4	-176.7	67.2	-156.6	-173.2	12.9	111.7	E39 S52 A75 L76 D77	E39-R73 PolarHBondContact O-NH1 2.78Å; S52-R73 VanDerWaalsContact O-CD 3.27Å; S52-R73 WeakPolarHBondContact O-CD 3.45Å; R73-A75 VanDerWaalsContact C-N 3.29Å; R73-A75 PolarHBondContact O-N 2.78Å; R73-L76 WeakPolarHBondContact O-CB 3.33Å; R73-L76 PolarHBondContact O-N 2.88Å; R73-L76 VanDerWaalsContact O-N 3.1Å; R73-D77 WeakPolarHBondContact CG-OD2 3.44Å; R73-D77 IonicContact CZ-OD1 3.14Å; R73-D77 IonicContact NE-OD1 2.81Å; R73-D77 PolarHBondContact NE-OD1 3.42Å; R73-D77 VanDerWaalsContact NE-OD1 3.12Å; R73-D77 IonicContact NE-OD2 3.6Å; R73-D77 PolarHBondContact NE-OD2 2.79Å; R73-D77 VanDerWaalsContact NE-OD2 3.14Å; R73-D77 IonicContact NH2-OD1 3.35Å; R73-D77 PolarHBondContact NH2-OD1 3.05Å; R73-D77 PolarHBondContact O-N 2.67Å
74	E	87.3	Confident	84.5	Confident	115 Å²	115	65.4 Å²	65.4	54%	0.537	32%	0.322	S	S	.	.	H	α-helix	trans	-57.5	-39	174.4	59.3	-171.7	170.8	0	0	112.9	T72 L76 T78	T72-E74 VanDerWaalsContact C-N 3.28Å; T72-E74 PolarHBondContact O-N 3.05Å; T72-E74 WeakPolarHBondContact OG1-CG 3.24Å; T72-E74 PolarHBondContact OG1-OE1 2.82Å; E74-L76 VanDerWaalsContact C-N 3.33Å; E74-L76 PolarHBondContact O-N 2.77Å; E74-T78 WeakPolarHBondContact O-CB 3.47Å; E74-T78 VanDerWaalsContact O-CG2 3.27Å; E74-T78 WeakPolarHBondContact O-CG2 3.38Å; E74-T78 PolarHBondContact O-N 2.82Å; E74-T78 PolarHBondContact O-OG1 2.79Å
75	A	88.8	Confident	83.1	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-65.5	-37.8	176.6	0	0	0	0	0	111.9	V71 T72 R73 T78 S79 V120 D121 F123	V71-A75 HydrophobicContact CG1-CB 3.79Å; T72-A75 WeakPolarHBondContact O-CB 3.47Å; T72-A75 PolarHBondContact O-N 2.79Å; T72-A75 VanDerWaalsContact O-N 3.12Å; T72-A75 WeakPolarHBondContact OG1-CB 3.37Å; T72-A75 PolarHBondContact OG1-N 2.84Å; R73-A75 VanDerWaalsContact C-N 3.29Å; R73-A75 PolarHBondContact O-N 2.78Å; A75-T78 PolarHBondContact O-OG1 2.75Å; A75-S79 WeakPolarHBondContact O-CB 3.44Å; A75-S79 PolarHBondContact O-N 2.98Å; A75-S79 PolarHBondContact O-OG 3.32Å; A75-V120 WeakPolarHBondContact CB-O 3.49Å; A75-D121 WeakPolarHBondContact CA-O 3.41Å; A75-D121 VanDerWaalsContact CB-C 3.47Å; A75-D121 WeakPolarHBondContact CB-O 3.42Å; A75-F123 HydrophobicContact CB-CD1 4.33Å; A75-F123 HydrophobicContact CB-CE1 4.45Å
76	L	88.3	Confident	81.9	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-72	-41.3	179.5	-62	170.7	0	0	0	112.3	A38 A56 V71 T72 R73 E74 T78 S79 W81 F88 F123	A38-L76 HydrophobicContact CB-CD1 3.23Å; A56-L76 HydrophobicContact CB-CD1 4.33Å; A56-L76 HydrophobicContact CB-CD2 4.5Å; V71-L76 HydrophobicContact CB-CD2 4.39Å; V71-L76 HydrophobicContact CG1-CD2 3.65Å; V71-L76 HydrophobicContact CG1-CG 3.92Å; T72-L76 WeakPolarHBondContact O-CG 3.46Å; T72-L76 PolarHBondContact O-N 3.27Å; R73-L76 WeakPolarHBondContact O-CB 3.33Å; R73-L76 PolarHBondContact O-N 2.88Å; R73-L76 VanDerWaalsContact O-N 3.1Å; E74-L76 VanDerWaalsContact C-N 3.33Å; E74-L76 PolarHBondContact O-N 2.77Å; L76-T78 VanDerWaalsContact C-N 3.33Å; L76-S79 PolarHBondContact O-N 3.17Å; L76-W81 HydrophobicContact CD2-CZ2 3.84Å; L76-W81 PolarHBondContact O-NE1 2.84Å; L76-F88 HydrophobicContact CD2-CE2 3.58Å; L76-F88 HydrophobicContact CD2-CZ 3.96Å; L76-F123 HydrophobicContact CD2-CE1 4.14Å; L76-F123 HydrophobicContact CD2-CZ 4.33Å
77	D	84.6	Confident	81.3	Confident	97 Å²	97	69.5 Å²	69.5	52%	0.519	34%	0.337	S	S	.	.	H	α-helix	trans	-73.6	-27.5	-178	-66.5	-28.1	0	0	0	111.9	R73	R73-D77 WeakPolarHBondContact CG-OD2 3.44Å; R73-D77 IonicContact CZ-OD1 3.14Å; R73-D77 IonicContact NE-OD1 2.81Å; R73-D77 PolarHBondContact NE-OD1 3.42Å; R73-D77 VanDerWaalsContact NE-OD1 3.12Å; R73-D77 IonicContact NE-OD2 3.6Å; R73-D77 PolarHBondContact NE-OD2 2.79Å; R73-D77 VanDerWaalsContact NE-OD2 3.14Å; R73-D77 IonicContact NH2-OD1 3.35Å; R73-D77 PolarHBondContact NH2-OD1 3.05Å; R73-D77 PolarHBondContact O-N 2.67Å
78	T	82.4	Confident	80.8	Confident	100 Å²	100	69.4 Å²	69.4	61%	0.613	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-6.4	174.8	55.7	0	0	0	0	113.9	E74 A75 L76	E74-T78 WeakPolarHBondContact O-CB 3.47Å; E74-T78 VanDerWaalsContact O-CG2 3.27Å; E74-T78 WeakPolarHBondContact O-CG2 3.38Å; E74-T78 PolarHBondContact O-N 2.82Å; E74-T78 PolarHBondContact O-OG1 2.79Å; A75-T78 PolarHBondContact O-OG1 2.75Å; L76-T78 VanDerWaalsContact C-N 3.33Å
79	S	81.7	Confident	80.4	Confident	22 Å²	22	75 Å²	75	15%	0.154	36%	0.357	C	S	.	.	S	Bend	trans	-81.8	131.9	-178.7	-71.8	0	0	0	0	111.9	A75 L76 W81 F123	A75-S79 WeakPolarHBondContact O-CB 3.44Å; A75-S79 PolarHBondContact O-N 2.98Å; A75-S79 PolarHBondContact O-OG 3.32Å; L76-S79 PolarHBondContact O-N 3.17Å; S79-W81 PolarHBondContact O-N 2.99Å; S79-F123 WeakPolarHBondContact OG-CE1 3.27Å; S79-F123 VanDerWaalsContact OG-CZ 3.31Å; S79-F123 WeakPolarHBondContact OG-CZ 3.4Å
80	D	73.4	Confident	79.9	Confident	171 Å²	171	78.3 Å²	78.3	91%	0.914	39%	0.392	S	S	*	.			trans	-76.8	86.9	173.3	-66.3	-37.8	0	0	0	109.7
81	W	73.1	Confident	79.6	Confident	56 Å²	56	76.4 Å²	76.4	21%	0.212	38%	0.382	C	S	.	.			trans	-72.9	132.7	172.2	-59.7	97.7	0	0	0	109.9	L76 S79 E83 F86 G87 F88 F123	L76-W81 HydrophobicContact CD2-CZ2 3.84Å; L76-W81 PolarHBondContact O-NE1 2.84Å; S79-W81 PolarHBondContact O-N 2.99Å; W81-E83 PolarHBondContact O-N 2.84Å; W81-F86 AromaticContact CD1-CD2 3.65Å; W81-F86 AromaticContact CD1-CE2 3.94Å; W81-F86 HydrophobicContact CD2-CD2 4.3Å; W81-F86 AromaticContact CG-CD2 3.99Å; W81-F86 HydrophobicContact CG-CD2 3.99Å; W81-F86 AromaticContact NE1-CD2 3.75Å; W81-F86 AromaticContact NE1-CE2 3.67Å; W81-G87 WeakPolarHBondContact CZ3-O 3.32Å; W81-F88 HydrophobicContact CH2-CD1 4.34Å; W81-F88 HydrophobicContact CH2-CD2 4.47Å; W81-F88 AromaticContact CH2-CE1 3.95Å; W81-F88 HydrophobicContact CH2-CE1 3.95Å; W81-F88 HydrophobicContact CH2-CE2 4.11Å; W81-F88 AromaticContact CH2-CZ 3.84Å; W81-F88 HydrophobicContact CH2-CZ 3.84Å; W81-F88 HydrophobicContact CZ2-CZ 4.42Å; W81-F123 HydrophobicContact CH2-CE2 4.25Å; W81-F123 AromaticContact CH2-CZ 3.82Å; W81-F123 HydrophobicContact CH2-CZ 3.82Å; W81-F123 AromaticContact CZ2-CZ 3.75Å; W81-F123 HydrophobicContact CZ2-CZ 3.75Å
82	E	64.6	Low	79.5	Confident	153 Å²	153	79.1 Å²	79.1	72%	0.715	40%	0.395	S	S	*	.			trans	-60.4	135.2	164	-69.5	-169.4	175.6	0	0	107.8	K84 E85	E82-K84 PolarHBondContact O-N 2.77Å; E82-E85 PolarHBondContact O-N 2.97Å
83	E	51.7	Low	79.4	Confident	202 Å²	202	78.3 Å²	78.3	94%	0.944	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-1.7	-164.6	-62.9	178.5	159.8	0	0	116.8	W81	W81-E83 PolarHBondContact O-N 2.84Å
84	K	54.2	Low	79.6	Confident	201 Å²	201	78.9 Å²	78.9	87%	0.874	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.3	-8.3	-178.2	-66	-179.6	-179.8	173.7	0	115.3	E82	E82-K84 PolarHBondContact O-N 2.77Å
85	E	64.6	Low	79.9	Confident	94 Å²	94	73.9 Å²	73.9	44%	0.439	37%	0.369	S	S	.	.			trans	-127	55.4	-171.2	-64.5	-175.7	-177.3	0	0	111.7	E82 G87 R94	E82-E85 PolarHBondContact O-N 2.97Å; E85-G87 PolarHBondContact O-N 2.83Å; E85-R94 IonicContact OE2-NH1 3.68Å; E85-R94 PolarHBondContact OE2-NH1 3.35Å
86	F	71.8	Confident	80.1	Confident	90 Å²	90	73.9 Å²	73.9	40%	0.395	37%	0.369	S	S	.	.			trans	-72.9	122.5	168.9	-174.5	-87.9	0	0	0	109.8	A40 W81	A40-F86 HydrophobicContact CB-CD1 3.78Å; A40-F86 HydrophobicContact CB-CE1 3.57Å; A40-F86 HydrophobicContact CB-CG 4.48Å; A40-F86 HydrophobicContact CB-CZ 4.1Å; W81-F86 AromaticContact CD1-CD2 3.65Å; W81-F86 AromaticContact CD1-CE2 3.94Å; W81-F86 HydrophobicContact CD2-CD2 4.3Å; W81-F86 AromaticContact CG-CD2 3.99Å; W81-F86 HydrophobicContact CG-CD2 3.99Å; W81-F86 AromaticContact NE1-CD2 3.75Å; W81-F86 AromaticContact NE1-CE2 3.67Å
87	G	82.6	Confident	80.3	Confident	6 Å²	6	76 Å²	76	6%	0.062	38%	0.38	C	S	.	.	S	Bend	trans	105.4	172.4	179.3	0	0	0	0	0	113.6	E37 W81 E85	E37-G87 VanDerWaalsContact OE1-CA 3.31Å; E37-G87 WeakPolarHBondContact OE1-CA 3.29Å; W81-G87 WeakPolarHBondContact CZ3-O 3.32Å; E85-G87 PolarHBondContact O-N 2.83Å
88	F	86.3	Confident	80.7	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.356	C	S	.	.	S	Bend	trans	-99.8	-17.3	-174.2	-63.5	-80.6	0	0	0	114	L31 V34 E37 A56 L58 V71 L76 W81 G90 T91 L96 F123	L31-F88 HydrophobicContact CD2-CB 4.11Å; L31-F88 HydrophobicContact CD2-CD1 4.32Å; V34-F88 HydrophobicContact CG1-CB 4.25Å; V34-F88 HydrophobicContact CG2-CB 3.57Å; E37-F88 VanDerWaalsContact CD-N 3.31Å; E37-F88 PolarHBondContact OE1-N 3.28Å; E37-F88 PolarHBondContact OE2-N 2.64Å; A56-F88 HydrophobicContact CB-CD2 3.83Å; A56-F88 HydrophobicContact CB-CE2 3.67Å; L58-F88 HydrophobicContact CD1-CD1 3.82Å; L58-F88 HydrophobicContact CD1-CD2 4.04Å; L58-F88 HydrophobicContact CD1-CE1 3.72Å; L58-F88 HydrophobicContact CD1-CE2 3.91Å; L58-F88 HydrophobicContact CD1-CG 3.97Å; L58-F88 HydrophobicContact CD1-CZ 3.75Å; L58-F88 HydrophobicContact CD2-CB 3.77Å; L58-F88 HydrophobicContact CD2-CD1 4.29Å; L58-F88 HydrophobicContact CD2-CD2 3.64Å; L58-F88 HydrophobicContact CD2-CE2 4.24Å; L58-F88 HydrophobicContact CD2-CG 3.64Å; L58-F88 HydrophobicContact CG-CD2 4.32Å; L58-F88 HydrophobicContact CG-CE2 4.45Å; L58-F88 HydrophobicContact CG-CG 4.44Å; V71-F88 HydrophobicContact CG1-CZ 4.4Å; V71-F88 HydrophobicContact CG2-CE2 4.31Å; V71-F88 HydrophobicContact CG2-CZ 4.17Å; L76-F88 HydrophobicContact CD2-CE2 3.58Å; L76-F88 HydrophobicContact CD2-CZ 3.96Å; W81-F88 HydrophobicContact CH2-CD1 4.34Å; W81-F88 HydrophobicContact CH2-CD2 4.47Å; W81-F88 AromaticContact CH2-CE1 3.95Å; W81-F88 HydrophobicContact CH2-CE1 3.95Å; W81-F88 HydrophobicContact CH2-CE2 4.11Å; W81-F88 AromaticContact CH2-CZ 3.84Å; W81-F88 HydrophobicContact CH2-CZ 3.84Å; W81-F88 HydrophobicContact CZ2-CZ 4.42Å; F88-G90 PolarHBondContact O-N 3.14Å; F88-T91 WeakPolarHBondContact CA-OG1 3.25Å; F88-T91 WeakPolarHBondContact O-CB 3.44Å; F88-T91 PolarHBondContact O-N 2.78Å; F88-T91 PolarHBondContact O-OG1 3.43Å; F88-L96 HydrophobicContact CE1-CD1 4.36Å; F88-F123 HydrophobicContact CE1-CD2 4.32Å; F88-F123 AromaticContact CE1-CE2 3.63Å; F88-F123 HydrophobicContact CE1-CE2 3.63Å; F88-F123 AromaticContact CE1-CZ 3.84Å; F88-F123 HydrophobicContact CE1-CZ 3.84Å; F88-F123 HydrophobicContact CZ-CD2 4.48Å; F88-F123 AromaticContact CZ-CE1 3.95Å; F88-F123 HydrophobicContact CZ-CE1 3.95Å; F88-F123 AromaticContact CZ-CE2 3.73Å; F88-F123 HydrophobicContact CZ-CE2 3.73Å; F88-F123 AromaticContact CZ-CZ 3.42Å; F88-F123 HydrophobicContact CZ-CZ 3.42Å; F88-F123 VanDerWaalsContact CZ-CZ 3.42Å
89	R	87.4	Confident	81.1	Confident	166 Å²	166	69.2 Å²	69.2	63%	0.626	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	127.8	176.8	-82.6	177.7	-173	-71.6	-2.7	111.3	V34 E37 T91	V34-R89 HydrophobicContact CB-CG 4.48Å; V34-R89 HydrophobicContact CG1-CG 4.4Å; E37-R89 WeakPolarHBondContact OE2-CB 3.47Å; E37-R89 VanDerWaalsContact OE2-CG 3.25Å; E37-R89 WeakPolarHBondContact OE2-CG 3.37Å; E37-R89 PolarHBondContact OE2-N 2.82Å; R89-T91 VanDerWaalsContact C-N 3.32Å
90	G	86	Confident	81.6	Confident	70 Å²	70	72.2 Å²	72.2	72%	0.722	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	-3.9	-175.4	0	0	0	0	0	114	F88 E92	F88-G90 PolarHBondContact O-N 3.14Å; G90-E92 VanDerWaalsContact C-OE2 3.3Å; G90-E92 WeakPolarHBondContact CA-OE2 2.97Å; G90-E92 PolarHBondContact N-OE2 2.89Å
91	T	89.1	Confident	82.5	Confident	6 Å²	6	64.3 Å²	64.3	4%	0.037	31%	0.31	C	S	.	.			trans	-100.3	8.1	174.9	72.9	0	0	0	0	112.6	L31 F88 R89 G93 R94 L125	L31-T91 VanDerWaalsContact CD2-OG1 3.25Å; L31-T91 WeakPolarHBondContact CD2-OG1 3.43Å; F88-T91 WeakPolarHBondContact CA-OG1 3.25Å; F88-T91 WeakPolarHBondContact O-CB 3.44Å; F88-T91 PolarHBondContact O-N 2.78Å; F88-T91 PolarHBondContact O-OG1 3.43Å; R89-T91 VanDerWaalsContact C-N 3.32Å; T91-G93 PolarHBondContact O-N 3.38Å; T91-R94 VanDerWaalsContact O-CB 3.22Å; T91-R94 WeakPolarHBondContact O-CB 3.42Å; T91-R94 WeakPolarHBondContact O-CG 3.39Å; T91-R94 PolarHBondContact O-N 2.86Å; T91-L125 HydrophobicContact CG2-CD2 3.73Å
92	E	92.6	Very high	83.3	Confident	59 Å²	59	62.6 Å²	62.6	28%	0.276	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	133.1	178.5	-56.5	88.1	164.4	0	0	111.1	V34 G90 R94	V34-E92 HydrophobicContact CG2-CG 4.4Å; G90-E92 VanDerWaalsContact C-OE2 3.3Å; G90-E92 WeakPolarHBondContact CA-OE2 2.97Å; G90-E92 PolarHBondContact N-OE2 2.89Å; E92-R94 VanDerWaalsContact C-N 3.34Å
93	G	89.9	Confident	84.7	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.01	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.6	-16.6	-173.1	0	0	0	0	0	113.6	Q30 L31 T91 Q130	Q30-G93 PolarHBondContact NE2-O 2.9Å; L31-G93 PolarHBondContact O-N 3.15Å; T91-G93 PolarHBondContact O-N 3.38Å; G93-Q130 PolarHBondContact O-N 2.75Å
94	R	91.6	Very high	86.7	Confident	46 Å²	46	51.7 Å²	51.7	17%	0.174	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	153.3	172.4	-66.2	-177.5	59.9	-178.8	-1.4	111.9	L31 E85 T91 E92 L125 L126 T128 E129	L31-R94 PolarHBondContact N-O 3.47Å; E85-R94 IonicContact OE2-NH1 3.68Å; E85-R94 PolarHBondContact OE2-NH1 3.35Å; T91-R94 VanDerWaalsContact O-CB 3.22Å; T91-R94 WeakPolarHBondContact O-CB 3.42Å; T91-R94 WeakPolarHBondContact O-CG 3.39Å; T91-R94 PolarHBondContact O-N 2.86Å; E92-R94 VanDerWaalsContact C-N 3.34Å; R94-L125 HydrophobicContact CB-CD1 4.09Å; R94-L126 PolarHBondContact NE-O 3.09Å; R94-L126 PolarHBondContact NH2-O 2.85Å; R94-T128 WeakPolarHBondContact CA-O 3.43Å; R94-E129 HydrophobicContact CG-CB 4.33Å; R94-E129 HydrophobicContact CG-CG 4.33Å
95	L	92.4	Very high	88.5	Confident	9 Å²	9	44 Å²	44	5%	0.047	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	131.4	173.2	-65.3	-175.8	0	0	0	110.8	L9 G29 Q30 L126 T128	L9-L95 HydrophobicContact CD1-CD2 3.92Å; L9-L95 HydrophobicContact CD2-CD1 4.48Å; L9-L95 HydrophobicContact CD2-CD2 3.96Å; L9-L95 HydrophobicContact CG-CD2 4.28Å; G29-L95 CarbonylContact O-C 3.52Å; G29-L95 WeakPolarHBondContact O-CA 3.01Å; Q30-L95 HydrophobicContact CB-CD2 4.04Å; Q30-L95 HydrophobicContact CG-CD2 4.47Å; L95-L126 HydrophobicContact CB-CB 4.08Å; L95-L126 HydrophobicContact CB-CD1 4.04Å; L95-L126 HydrophobicContact CB-CG 4.46Å; L95-L126 WeakPolarHBondContact O-CB 3.45Å; L95-L126 PolarHBondContact O-N 3.32Å; L95-T128 HydrophobicContact CD1-CG2 3.94Å; L95-T128 HydrophobicContact CG-CG2 4.36Å; L95-T128 PolarHBondContact N-O 3.08Å
96	L	93.1	Very high	89.8	Confident	1 Å²	1	42 Å²	42	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.9	175.5	-169.7	69.3	0	0	0	108.7	G29 L58 V60 F88 L98 F123 L125	G29-L96 PolarHBondContact N-O 3.2Å; G29-L96 PolarHBondContact O-N 3.08Å; L58-L96 HydrophobicContact CD1-CD2 4.14Å; V60-L96 HydrophobicContact CG2-CD2 3.97Å; F88-L96 HydrophobicContact CE1-CD1 4.36Å; L96-L98 HydrophobicContact CD2-CD2 3.62Å; L96-L98 HydrophobicContact CG-CD2 4Å; L96-F123 HydrophobicContact CD1-CB 4.23Å; L96-F123 HydrophobicContact CD1-CD2 3.45Å; L96-F123 VanDerWaalsContact CD1-CD2 3.45Å; L96-F123 HydrophobicContact CD1-CE2 4.18Å; L96-F123 HydrophobicContact CD1-CG 4.14Å; L96-L125 HydrophobicContact CD1-CD1 3.92Å
97	L	93.4	Very high	90.6	Very high	47 Å²	47	42.1 Å²	42.1	25%	0.246	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	106.2	173.1	-173	68.1	0	0	0	109	P26 A28 Q99 F123 S124 L126	P26-L97 HydrophobicContact CB-CD1 3.95Å; P26-L97 HydrophobicContact CB-CG 4.2Å; A28-L97 HydrophobicContact CB-CD1 4.23Å; L97-Q99 HydrophobicContact CG-CG 4.42Å; L97-Q99 PolarHBondContact O-N 3.35Å; L97-F123 CarbonylContact O-C 3.57Å; L97-F123 VanDerWaalsContact O-CA 3.24Å; L97-F123 WeakPolarHBondContact O-CA 3.44Å; L97-S124 PolarHBondContact N-O 2.82Å; L97-S124 PolarHBondContact O-N 3.11Å; L97-L126 HydrophobicContact CB-CD1 4.48Å; L97-L126 HydrophobicContact CB-CG 4.47Å
98	L	93.3	Very high	90.9	Very high	1 Å²	1	45 Å²	45	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	110.3	175	-54.4	174.8	0	0	0	108	W12 P26 R27 L96 L118 V120 F123	W12-L98 HydrophobicContact CH2-CD1 3.54Å; W12-L98 HydrophobicContact CZ2-CD1 3.73Å; P26-L98 CarbonylContact C-O 3.56Å; P26-L98 VanDerWaalsContact CA-O 3.25Å; P26-L98 WeakPolarHBondContact CA-O 3.39Å; R27-L98 PolarHBondContact N-O 2.86Å; R27-L98 PolarHBondContact O-N 3.35Å; L96-L98 HydrophobicContact CD2-CD2 3.62Å; L96-L98 HydrophobicContact CG-CD2 4Å; L98-L118 HydrophobicContact CD1-CD1 4.44Å; L98-V120 HydrophobicContact CD2-CB 4.41Å; L98-V120 HydrophobicContact CD2-CG1 3.71Å; L98-V120 HydrophobicContact CD2-CG2 3.77Å; L98-F123 HydrophobicContact CD2-CB 4.5Å
99	Q	91.1	Very high	90.8	Very high	52 Å²	52	51.6 Å²	51.6	24%	0.243	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-39.3	-176.1	-62.6	-177.5	-0.6	0	0	111.3	L97 R122 S124	L97-Q99 HydrophobicContact CG-CG 4.42Å; L97-Q99 PolarHBondContact O-N 3.35Å; Q99-R122 HydrophobicContact CB-CB 4.27Å; Q99-R122 HydrophobicContact CB-CG 4.23Å; Q99-R122 PolarHBondContact N-O 2.79Å; Q99-R122 VanDerWaalsContact OE1-NE 3.16Å; Q99-S124 PolarHBondContact NE2-OG 2.82Å
100	D	91.8	Very high	90.2	Very high	85 Å²	85	48 Å²	48	46%	0.455	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	118.9	176	-162.1	-1.3	0	0	0	109	D121 R122	D100-D121 PolarHBondContact O-N 3.17Å; D100-R122 HydrophobicContact CB-CB 3.76Å; D100-R122 PolarHBondContact N-O 2.74Å; D100-R122 VanDerWaalsContact N-O 3.12Å; D100-R122 PolarHBondContact O-N 3.1Å
101	C	91.2	Very high	89.8	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.034	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	145.6	173.4	50.7	0	0	0	0	112.7	L23 Q119 V120	L23-C101 HydrophobicContact CD1-CB 4.39Å; L23-C101 WeakPolarHBondContact CD1-SG 3.05Å; C101-Q119 CarbonylContact C-O 3.4Å; C101-Q119 WeakPolarHBondContact CA-O 3.4Å; C101-Q119 WeakPolarHBondContact CB-O 3.18Å; C101-V120 HydrophobicContact CB-CB 4.34Å; C101-V120 HydrophobicContact CB-CG2 3.95Å
102	G	91.8	Very high	89.6	Confident	21 Å²	21	51.2 Å²	51.2	22%	0.216	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	150	176.4	0	0	0	0	0	111.7	H104 L118 Q119	G102-H104 PolarHBondContact O-CD2 3.36Å; G102-L118 CarbonylContact O-C 3.46Å; G102-L118 VanDerWaalsContact O-CA 3.27Å; G102-L118 WeakPolarHBondContact O-CA 3.25Å; G102-Q119 PolarHBondContact N-O 2.75Å; G102-Q119 PolarHBondContact O-N 3.5Å
103	V	93.8	Very high	89.5	Confident	53 Å²	53	53 Å²	53	32%	0.321	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	126.8	169.2	-176.3	0	0	0	0	108.2	L16 I17 F116 L118	L16-V103 HydrophobicContact CD1-CG2 4.33Å; L16-V103 HydrophobicContact CD2-CG2 3.82Å; L16-V103 HydrophobicContact CG-CG2 3.68Å; I17-V103 HydrophobicContact CG1-CG1 4.27Å; V103-F116 HydrophobicContact CG1-CD1 3.71Å; V103-F116 HydrophobicContact CG1-CE1 4.31Å; V103-F116 HydrophobicContact CG1-CG 4.45Å; V103-L118 HydrophobicContact CB-CD2 4.24Å; V103-L118 HydrophobicContact CG2-CD2 3.67Å
104	H	92	Very high	89.6	Confident	72 Å²	72	54 Å²	54	33%	0.333	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	159.1	179	-66.4	-92.5	0	0	0	110.9	G102 F116 Y117 Q119	G102-H104 PolarHBondContact O-CD2 3.36Å; H104-F116 WeakPolarHBondContact O-CA 3.32Å; H104-Y117 HydrophobicContact CB-CD1 4.18Å; H104-Y117 HydrophobicContact CB-CD2 4.42Å; H104-Y117 HydrophobicContact CB-CE1 3.61Å; H104-Y117 HydrophobicContact CB-CE2 3.88Å; H104-Y117 VanDerWaalsContact CB-CZ 3.44Å; H104-Y117 PolarHBondContact N-O 3.41Å; H104-Y117 PolarHBondContact O-N 2.81Å; H104-Y117 VanDerWaalsContact O-O 3.14Å; H104-Q119 WeakPolarHBondContact CD2-CB 3.47Å
105	I	92.9	Very high	89.7	Confident	40 Å²	40	54.3 Å²	54.3	21%	0.205	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	124.4	178.2	-61.5	167.9	0	0	0	108.1	F116 L148 C151 L152	I105-F116 HydrophobicContact CD1-CE1 3.79Å; I105-F116 HydrophobicContact CD1-CZ 4.36Å; I105-F116 HydrophobicContact CG1-CD1 3.65Å; I105-F116 HydrophobicContact CG1-CE1 3.36Å; I105-F116 HydrophobicContact CG1-CZ 4.25Å; I105-L148 HydrophobicContact CG1-CD1 4.43Å; I105-L148 HydrophobicContact CG2-CD1 3.8Å; I105-C151 HydrophobicContact CD1-CB 3.36Å; I105-L152 HydrophobicContact CG2-CD2 3.98Å
106	Q	91.4	Very high	89.9	Confident	53 Å²	53	54.2 Å²	54.2	25%	0.248	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	120.3	165.8	-178	67.5	50.6	0	0	107.5	E109 A114 E115 Y117	Q106-E109 PolarHBondContact NE2-OE2 2.83Å; Q106-A114 CarbonylContact O-C 3.41Å; Q106-A114 WeakPolarHBondContact O-CA 3.26Å; Q106-A114 WeakPolarHBondContact O-CB 3.41Å; Q106-E115 HydrophobicContact CB-CG 4.11Å; Q106-E115 PolarHBondContact N-O 2.86Å; Q106-E115 PolarHBondContact O-N 3.34Å; Q106-Y117 HydrophobicContact CB-CD1 3.81Å; Q106-Y117 HydrophobicContact CB-CE1 3.87Å
107	V	90.1	Very high	90	Very high	92 Å²	92	55.5 Å²	55.5	56%	0.558	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-75	150.6	172.1	-174.4	0	0	0	0	109	E109 L152	V107-E109 PolarHBondContact O-N 2.89Å; V107-E109 VanDerWaalsContact O-N 3.11Å; V107-L152 HydrophobicContact CG2-CD2 4.29Å
108	A	87.9	Confident	90.1	Very high	66 Å²	66	53.4 Å²	53.4	55%	0.545	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-56.9	116.4	-179.1	0	0	0	0	0	111.2	A112 A114	A108-A112 VanDerWaalsContact CA-O 3.29Å; A108-A112 WeakPolarHBondContact CA-O 3.31Å; A108-A112 WeakPolarHBondContact CB-O 3.22Å; A108-A114 HydrophobicContact CB-CB 4.47Å
109	E	83.3	Confident	90.2	Very high	139 Å²	139	55.6 Å²	55.6	65%	0.65	36%	0.358	S	S	*	.	B	Isolated β-bridge	trans	-138.9	139.3	-175.4	-169.9	176.7	-178.8	0	0	109.6	Q106 V107 G111 A112	Q106-E109 PolarHBondContact NE2-OE2 2.83Å; V107-E109 PolarHBondContact O-N 2.89Å; V107-E109 VanDerWaalsContact O-N 3.11Å; E109-G111 PolarHBondContact O-N 3.46Å; E109-A112 PolarHBondContact N-O 2.9Å; E109-A112 WeakPolarHBondContact O-CB 3.27Å; E109-A112 PolarHBondContact O-N 3.48Å
110	G	74.9	Confident	90.4	Very high	91 Å²	91	53.1 Å²	53.1	94%	0.938	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	20.1	174.1	0	0	0	0	0	115.9
111	G	77.4	Confident	90.4	Very high	84 Å²	84	51 Å²	51	87%	0.866	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	-1.6	-176.6	0	0	0	0	0	114.9	E109	E109-G111 PolarHBondContact O-N 3.46Å
112	A	85.7	Confident	90.5	Very high	58 Å²	58	57.9 Å²	57.9	48%	0.479	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-79.8	138.7	167.9	0	0	0	0	0	110.3	A108 E109	A108-A112 VanDerWaalsContact CA-O 3.29Å; A108-A112 WeakPolarHBondContact CA-O 3.31Å; A108-A112 WeakPolarHBondContact CB-O 3.22Å; E109-A112 PolarHBondContact N-O 2.9Å; E109-A112 WeakPolarHBondContact O-CB 3.27Å; E109-A112 PolarHBondContact O-N 3.48Å
113	P	89.7	Confident	90.5	Very high	97 Å²	97	57.5 Å²	57.5	63%	0.63	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-67.9	159	174.7	30.8	-34.9	0	0	0	110.8
114	A	92.2	Very high	90.4	Very high	22 Å²	22	57 Å²	57	18%	0.182	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-62.6	144.8	170.9	0	0	0	0	0	110.4	Q106 A108 L148 L152	Q106-A114 CarbonylContact O-C 3.41Å; Q106-A114 WeakPolarHBondContact O-CA 3.26Å; Q106-A114 WeakPolarHBondContact O-CB 3.41Å; A108-A114 HydrophobicContact CB-CB 4.47Å; A114-L148 HydrophobicContact CB-CD2 4.41Å; A114-L148 VanDerWaalsContact O-CD2 3.32Å; A114-L148 WeakPolarHBondContact O-CD2 3.15Å; A114-L152 HydrophobicContact CB-CD1 3.69Å; A114-L152 HydrophobicContact CB-CD2 4.49Å
115	E	95.1	Very high	90.3	Very high	52 Å²	52	55.3 Å²	55.3	24%	0.243	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	154.6	-177.6	60.4	168.5	-154.9	0	0	112.9	R68 Q106 N139	R68-E115 IonicContact CZ-OE1 2.75Å; R68-E115 VanDerWaalsContact CZ-OE1 3.31Å; R68-E115 IonicContact NE-OE1 2.67Å; R68-E115 PolarHBondContact NE-OE1 2.73Å; R68-E115 IonicContact NH2-OE1 3.87Å; R68-E115 PolarHBondContact NH2-OE1 3.22Å; R68-E115 VanDerWaalsContact NH2-OE1 3.08Å; Q106-E115 HydrophobicContact CB-CG 4.11Å; Q106-E115 PolarHBondContact N-O 2.86Å; Q106-E115 PolarHBondContact O-N 3.34Å; E115-N139 HydrophobicContact CB-CB 4.49Å
116	F	95.6	Very high	90.1	Very high	7 Å²	7	56.1 Å²	56.1	3%	0.031	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	138.1	164.5	-71.9	-72.9	0	0	0	110.6	I17 V103 H104 I105 N139 V144 K147 L148	I17-F116 HydrophobicContact CD1-CB 4.21Å; I17-F116 HydrophobicContact CG2-CB 4.36Å; I17-F116 HydrophobicContact CG2-CD1 4.22Å; I17-F116 HydrophobicContact CG2-CD2 3.58Å; I17-F116 HydrophobicContact CG2-CE1 4.39Å; I17-F116 HydrophobicContact CG2-CE2 3.76Å; I17-F116 HydrophobicContact CG2-CG 3.81Å; I17-F116 HydrophobicContact CG2-CZ 4.19Å; V103-F116 HydrophobicContact CG1-CD1 3.71Å; V103-F116 HydrophobicContact CG1-CE1 4.31Å; V103-F116 HydrophobicContact CG1-CG 4.45Å; H104-F116 WeakPolarHBondContact O-CA 3.32Å; I105-F116 HydrophobicContact CD1-CE1 3.79Å; I105-F116 HydrophobicContact CD1-CZ 4.36Å; I105-F116 HydrophobicContact CG1-CD1 3.65Å; I105-F116 HydrophobicContact CG1-CE1 3.36Å; I105-F116 HydrophobicContact CG1-CZ 4.25Å; F116-N139 PolarHBondContact N-OD1 3.4Å; F116-N139 PolarHBondContact O-ND2 3.37Å; F116-V144 HydrophobicContact CD2-CG1 3.69Å; F116-V144 HydrophobicContact CE2-CG1 4.15Å; F116-K147 HydrophobicContact CE2-CB 4.48Å; F116-K147 HydrophobicContact CZ-CG 4.22Å; F116-L148 HydrophobicContact CD2-CB 4.03Å; F116-L148 HydrophobicContact CD2-CD1 3.99Å; F116-L148 HydrophobicContact CD2-CG 4.49Å; F116-L148 HydrophobicContact CE1-CD1 4.49Å; F116-L148 VanDerWaalsContact CE2-CA 3.46Å; F116-L148 HydrophobicContact CE2-CB 3.48Å; F116-L148 VanDerWaalsContact CE2-CB 3.48Å; F116-L148 HydrophobicContact CE2-CD1 3.88Å; F116-L148 HydrophobicContact CE2-CG 4.25Å; F116-L148 HydrophobicContact CG-CD1 4.38Å; F116-L148 HydrophobicContact CZ-CB 4.17Å; F116-L148 HydrophobicContact CZ-CD1 4.12Å
117	Y	95.5	Very high	89.8	Confident	29 Å²	29	59 Å²	59	11%	0.114	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	165.2	170.4	73.1	-83.7	0	0	0	109.9	R68 L70 H104 Q106	R68-Y117 WeakPolarHBondContact O-CA 3.45Å; R68-Y117 WeakPolarHBondContact O-CB 3.46Å; L70-Y117 HydrophobicContact CB-CD2 4.21Å; L70-Y117 HydrophobicContact CB-CE2 4.2Å; L70-Y117 HydrophobicContact CD2-CE2 4.23Å; H104-Y117 HydrophobicContact CB-CD1 4.18Å; H104-Y117 HydrophobicContact CB-CD2 4.42Å; H104-Y117 HydrophobicContact CB-CE1 3.61Å; H104-Y117 HydrophobicContact CB-CE2 3.88Å; H104-Y117 VanDerWaalsContact CB-CZ 3.44Å; H104-Y117 PolarHBondContact N-O 3.41Å; H104-Y117 PolarHBondContact O-N 2.81Å; H104-Y117 VanDerWaalsContact O-O 3.14Å; Q106-Y117 HydrophobicContact CB-CD1 3.81Å; Q106-Y117 HydrophobicContact CB-CE1 3.87Å
118	L	95.5	Very high	89.6	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.3	175.6	-58.6	-177.7	0	0	0	110.1	W12 L16 V67 R68 C69 L70 L98 G102 V103	W12-L118 HydrophobicContact CH2-CD1 3.51Å; W12-L118 HydrophobicContact CZ3-CD1 3.76Å; L16-L118 HydrophobicContact CD2-CD2 4.11Å; V67-L118 HydrophobicContact CG1-CD1 3.69Å; V67-L118 HydrophobicContact CG1-CG 4.15Å; V67-L118 HydrophobicContact CG2-CD1 4.38Å; V67-L118 HydrophobicContact CG2-CG 3.94Å; R68-L118 PolarHBondContact O-N 2.81Å; C69-L118 CarbonylContact C-O 3.51Å; C69-L118 VanDerWaalsContact CA-O 3.26Å; C69-L118 WeakPolarHBondContact CA-O 3.48Å; L70-L118 PolarHBondContact N-O 2.82Å; L98-L118 HydrophobicContact CD1-CD1 4.44Å; G102-L118 CarbonylContact O-C 3.46Å; G102-L118 VanDerWaalsContact O-CA 3.27Å; G102-L118 WeakPolarHBondContact O-CA 3.25Å; V103-L118 HydrophobicContact CB-CD2 4.24Å; V103-L118 HydrophobicContact CG2-CD2 3.67Å
119	Q	95.1	Very high	89.7	Confident	48 Å²	48	60.8 Å²	60.8	22%	0.224	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	130	164	-175.9	-179.8	-52.7	0	0	108.1	L70 T72 C101 G102 H104 D121	L70-Q119 CarbonylContact O-C 3.54Å; L70-Q119 WeakPolarHBondContact O-CA 3.16Å; T72-Q119 HydrophobicContact CG2-CG 3.52Å; C101-Q119 CarbonylContact C-O 3.4Å; C101-Q119 WeakPolarHBondContact CA-O 3.4Å; C101-Q119 WeakPolarHBondContact CB-O 3.18Å; G102-Q119 PolarHBondContact N-O 2.75Å; G102-Q119 PolarHBondContact O-N 3.5Å; H104-Q119 WeakPolarHBondContact CD2-CB 3.47Å; Q119-D121 PolarHBondContact NE2-OD1 3.04Å
120	V	94.8	Very high	89.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	111.1	-175.7	-176.8	0	0	0	0	109.1	C69 L70 V71 T72 A75 L98 C101 F123	C69-V120 HydrophobicContact CB-CG2 3.91Å; L70-V120 PolarHBondContact O-N 3.27Å; V71-V120 HydrophobicContact CG2-CB 4.35Å; T72-V120 PolarHBondContact N-O 2.88Å; T72-V120 PolarHBondContact OG1-O 3.28Å; A75-V120 WeakPolarHBondContact CB-O 3.49Å; L98-V120 HydrophobicContact CD2-CB 4.41Å; L98-V120 HydrophobicContact CD2-CG1 3.71Å; L98-V120 HydrophobicContact CD2-CG2 3.77Å; C101-V120 HydrophobicContact CB-CB 4.34Å; C101-V120 HydrophobicContact CB-CG2 3.95Å; V120-F123 HydrophobicContact CG1-CB 4.02Å
121	D	92.9	Very high	90.5	Very high	41 Å²	41	55.7 Å²	55.7	22%	0.219	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-18.3	-178.2	-53.9	-43.5	0	0	0	111.7	T72 A75 D100 Q119	T72-D121 WeakPolarHBondContact CG2-OD1 3.45Å; T72-D121 PolarHBondContact OG1-OD1 2.85Å; A75-D121 WeakPolarHBondContact CA-O 3.41Å; A75-D121 VanDerWaalsContact CB-C 3.47Å; A75-D121 WeakPolarHBondContact CB-O 3.42Å; D100-D121 PolarHBondContact O-N 3.17Å; Q119-D121 PolarHBondContact NE2-OD1 3.04Å
122	R	92.1	Very high	91.1	Very high	149 Å²	149	59 Å²	59	56%	0.562	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.6	132	174	-163.4	171.9	175.6	-125	-6.5	112.8	Q99 D100	Q99-R122 HydrophobicContact CB-CB 4.27Å; Q99-R122 HydrophobicContact CB-CG 4.23Å; Q99-R122 PolarHBondContact N-O 2.79Å; Q99-R122 VanDerWaalsContact OE1-NE 3.16Å; D100-R122 HydrophobicContact CB-CB 3.76Å; D100-R122 PolarHBondContact N-O 2.74Å; D100-R122 VanDerWaalsContact N-O 3.12Å; D100-R122 PolarHBondContact O-N 3.1Å
123	F	92.9	Very high	91.2	Very high	12 Å²	12	60.4 Å²	60.4	5%	0.053	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	171.4	179.1	74.2	-84.8	0	0	0	113.1	V71 A75 L76 S79 W81 F88 L96 L97 L98 V120	V71-F123 HydrophobicContact CG1-CD1 3.82Å; V71-F123 HydrophobicContact CG1-CE1 3.65Å; A75-F123 HydrophobicContact CB-CD1 4.33Å; A75-F123 HydrophobicContact CB-CE1 4.45Å; L76-F123 HydrophobicContact CD2-CE1 4.14Å; L76-F123 HydrophobicContact CD2-CZ 4.33Å; S79-F123 WeakPolarHBondContact OG-CE1 3.27Å; S79-F123 VanDerWaalsContact OG-CZ 3.31Å; S79-F123 WeakPolarHBondContact OG-CZ 3.4Å; W81-F123 HydrophobicContact CH2-CE2 4.25Å; W81-F123 AromaticContact CH2-CZ 3.82Å; W81-F123 HydrophobicContact CH2-CZ 3.82Å; W81-F123 AromaticContact CZ2-CZ 3.75Å; W81-F123 HydrophobicContact CZ2-CZ 3.75Å; F88-F123 HydrophobicContact CE1-CD2 4.32Å; F88-F123 AromaticContact CE1-CE2 3.63Å; F88-F123 HydrophobicContact CE1-CE2 3.63Å; F88-F123 AromaticContact CE1-CZ 3.84Å; F88-F123 HydrophobicContact CE1-CZ 3.84Å; F88-F123 HydrophobicContact CZ-CD2 4.48Å; F88-F123 AromaticContact CZ-CE1 3.95Å; F88-F123 HydrophobicContact CZ-CE1 3.95Å; F88-F123 AromaticContact CZ-CE2 3.73Å; F88-F123 HydrophobicContact CZ-CE2 3.73Å; F88-F123 AromaticContact CZ-CZ 3.42Å; F88-F123 HydrophobicContact CZ-CZ 3.42Å; F88-F123 VanDerWaalsContact CZ-CZ 3.42Å; L96-F123 HydrophobicContact CD1-CB 4.23Å; L96-F123 HydrophobicContact CD1-CD2 3.45Å; L96-F123 VanDerWaalsContact CD1-CD2 3.45Å; L96-F123 HydrophobicContact CD1-CE2 4.18Å; L96-F123 HydrophobicContact CD1-CG 4.14Å; L97-F123 CarbonylContact O-C 3.57Å; L97-F123 VanDerWaalsContact O-CA 3.24Å; L97-F123 WeakPolarHBondContact O-CA 3.44Å; L98-F123 HydrophobicContact CD2-CB 4.5Å; V120-F123 HydrophobicContact CG1-CB 4.02Å
124	S	91.3	Very high	91.3	Very high	42 Å²	42	67.9 Å²	67.9	29%	0.294	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	133.7	165.4	-59.2	0	0	0	0	110.6	L97 Q99	L97-S124 PolarHBondContact N-O 2.82Å; L97-S124 PolarHBondContact O-N 3.11Å; Q99-S124 PolarHBondContact NE2-OG 2.82Å
125	L	90.5	Very high	91.4	Very high	38 Å²	38	67.9 Å²	67.9	20%	0.199	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	119.2	178.3	-168.6	70.2	0	0	0	110.1	T91 R94 L96	T91-L125 HydrophobicContact CG2-CD2 3.73Å; R94-L125 HydrophobicContact CB-CD1 4.09Å; L96-L125 HydrophobicContact CD1-CD1 3.92Å
126	L	89.3	Confident	91.4	Very high	56 Å²	56	68.3 Å²	68.3	29%	0.293	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	149.7	-178.4	-56.8	179.8	0	0	0	110.6	R94 L95 L97 T128	R94-L126 PolarHBondContact NE-O 3.09Å; R94-L126 PolarHBondContact NH2-O 2.85Å; L95-L126 HydrophobicContact CB-CB 4.08Å; L95-L126 HydrophobicContact CB-CD1 4.04Å; L95-L126 HydrophobicContact CB-CG 4.46Å; L95-L126 WeakPolarHBondContact O-CB 3.45Å; L95-L126 PolarHBondContact O-N 3.32Å; L97-L126 HydrophobicContact CB-CD1 4.48Å; L97-L126 HydrophobicContact CB-CG 4.47Å; L126-T128 PolarHBondContact O-N 2.98Å
127	P	84.5	Confident	91.4	Very high	114 Å²	114	68.7 Å²	68.7	74%	0.74	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	-7.8	179.8	29.8	-36.2	0	0	0	113.3	E129	P127-E129 PolarHBondContact O-N 3.24Å
128	T	85.4	Confident	91.4	Very high	52 Å²	52	67.3 Å²	67.3	32%	0.319	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	117.1	-179.7	-56.2	0	0	0	0	110.7	L7 R94 L95 L126 Q130	L7-T128 HydrophobicContact CD1-CG2 3.79Å; R94-T128 WeakPolarHBondContact CA-O 3.43Å; L95-T128 HydrophobicContact CD1-CG2 3.94Å; L95-T128 HydrophobicContact CG-CG2 4.36Å; L95-T128 PolarHBondContact N-O 3.08Å; L126-T128 PolarHBondContact O-N 2.98Å; T128-Q130 HydrophobicContact CG2-CG 4.34Å
129	E	89.3	Confident	91.3	Very high	144 Å²	144	68.7 Å²	68.7	67%	0.673	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	136.6	170.7	-162.5	-175.1	155.9	0	0	110.7	R94 P127	R94-E129 HydrophobicContact CG-CB 4.33Å; R94-E129 HydrophobicContact CG-CG 4.33Å; P127-E129 PolarHBondContact O-N 3.24Å
130	Q	87.3	Confident	91.3	Very high	25 Å²	25	72.9 Å²	72.9	12%	0.117	36%	0.361	C	S	.	.			trans	-127	153.5	176.2	-65.9	-163.8	13.3	0	0	111.2	L7 Q30 G93 T128 R132	L7-Q130 PolarHBondContact O-NE2 3.45Å; Q30-Q130 PolarHBondContact NE2-O 3.36Å; G93-Q130 PolarHBondContact O-N 2.75Å; T128-Q130 HydrophobicContact CG2-CG 4.34Å; Q130-R132 PolarHBondContact O-N 3.26Å
131	P	88.3	Confident	91.4	Very high	98 Å²	98	73.9 Å²	73.9	64%	0.636	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-57.9	133.2	170.5	-22.7	33.2	0	0	0	111.1	Q30 L133	Q30-P131 PolarHBondContact NE2-O 3.12Å; Q30-P131 VanDerWaalsContact NE2-O 3.09Å; P131-L133 PolarHBondContact O-N 3.05Å
132	R	90.8	Very high	91.5	Very high	152 Å²	152	78.4 Å²	78.4	57%	0.574	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-74.4	123.7	177.7	-62.9	-174.9	-65.4	145.6	0.7	110	L32 Q130	L32-R132 HydrophobicContact CD2-CB 4.35Å; L32-R132 VanDerWaalsContact O-CD 3.32Å; L32-R132 WeakPolarHBondContact O-CD 3.23Å; L32-R132 PolarHBondContact O-NH1 2.93Å; Q130-R132 PolarHBondContact O-N 3.26Å
133	L	87.8	Confident	91.7	Very high	88 Å²	88	75.2 Å²	75.2	46%	0.461	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-100.7	137.7	173.6	-71	172.5	0	0	0	109.8	P131 V135	P131-L133 PolarHBondContact O-N 3.05Å; L133-V135 PolarHBondContact O-N 2.98Å
134	R	90.6	Very high	91.8	Very high	254 Å²	254	74.6 Å²	74.6	96%	0.958	38%	0.382	S	S	*	.			trans	-72.3	113.6	172.8	-172.1	175.3	-175.8	164.4	2.2	108.6
135	V	94.3	Very high	92	Very high	23 Å²	23	76.1 Å²	76.1	14%	0.139	38%	0.384	C	S	.	.			trans	-117.7	149.3	177.5	-68.4	0	0	0	0	110	L32 S61 L133	L32-V135 HydrophobicContact CD1-CG2 3.73Å; S61-V135 WeakPolarHBondContact OG-CG2 3.47Å; L133-V135 PolarHBondContact O-N 2.98Å
136	P	95.3	Very high	92.2	Very high	61 Å²	61	80.8 Å²	80.8	40%	0.396	40%	0.403	S	S	.	.			trans	-65.6	157.8	172	28.9	-36	0	0	0	111.6	T64 Y65 S66	T64-P136 WeakPolarHBondContact O-CD 3.25Å; Y65-P136 CarbonylContact C-O 3.58Å; Y65-P136 WeakPolarHBondContact CA-O 3.36Å; Y65-P136 HydrophobicContact CD1-CG 4.13Å; Y65-P136 HydrophobicContact CE1-CG 4.37Å; S66-P136 PolarHBondContact N-O 3.4Å; S66-P136 PolarHBondContact OG-O 3.35Å; S66-P136 VanDerWaalsContact OG-O 3.06Å
137	G	95.1	Very high	92.5	Very high	15 Å²	15	80.6 Å²	80.6	16%	0.155	40%	0.4	C	S	.	.	B	Isolated β-bridge	trans	-73.1	141.9	170.2	0	0	0	0	0	111	S66 N139 Q140	S66-G137 CarbonylContact O-C 3.59Å; S66-G137 WeakPolarHBondContact O-CA 3.22Å; S66-G137 WeakPolarHBondContact OG-CA 3.12Å; G137-N139 PolarHBondContact O-N 2.78Å; G137-Q140 WeakPolarHBondContact O-CB 3.38Å; G137-Q140 PolarHBondContact O-N 2.88Å
138	C	95.6	Very high	92.9	Very high	0 Å²	0	75.7 Å²	75.7	0%	0	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-58.2	-34.3	177.2	58.1	0	0	0	0	112.6	I13 I17 Y65 S66 Q140 D141 V144	I13-C138 HydrophobicContact CG2-CB 3.62Å; I17-C138 HydrophobicContact CD1-CB 3.97Å; Y65-C138 HydrophobicContact CD1-CB 4.45Å; Y65-C138 HydrophobicContact CG-CB 4.42Å; S66-C138 PolarHBondContact O-N 3.19Å; S66-C138 PolarHBondContact O-SG 3.42Å; S66-C138 VanDerWaalsContact O-SG 3.34Å; C138-Q140 PolarHBondContact O-N 3.08Å; C138-Q140 VanDerWaalsContact O-N 3.11Å; C138-D141 VanDerWaalsContact O-CB 3.23Å; C138-D141 WeakPolarHBondContact O-CB 3.5Å; C138-D141 PolarHBondContact O-N 3.01Å; C138-V144 WeakPolarHBondContact O-CB 3.46Å
139	N	94.9	Very high	93.2	Very high	31 Å²	31	80.3 Å²	80.3	17%	0.166	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-67.7	-5.9	175.8	-64.1	-60.8	0	0	0	114.2	E115 F116 G137 Q145	E115-N139 HydrophobicContact CB-CB 4.49Å; F116-N139 PolarHBondContact N-OD1 3.4Å; F116-N139 PolarHBondContact O-ND2 3.37Å; G137-N139 PolarHBondContact O-N 2.78Å; N139-Q145 WeakPolarHBondContact O-CG 3.44Å; N139-Q145 PolarHBondContact O-NE2 2.95Å
140	Q	94.4	Very high	93.4	Very high	135 Å²	135	77 Å²	77	63%	0.631	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-88.3	-10	171.1	-59.7	171.8	21.7	0	0	112.1	G137 C138	G137-Q140 WeakPolarHBondContact O-CB 3.38Å; G137-Q140 PolarHBondContact O-N 2.88Å; C138-Q140 PolarHBondContact O-N 3.08Å; C138-Q140 VanDerWaalsContact O-N 3.11Å
141	D	96.4	Very high	93.4	Very high	21 Å²	21	76.9 Å²	76.9	11%	0.112	37%	0.368	C	S	.	.	S	Bend	trans	-75.7	135	177.1	-170.1	-97.5	0	0	0	111.3	R14 Y65 C138 D143 V144 Q145	R14-D141 IonicContact CZ-OD1 3.63Å; R14-D141 VanDerWaalsContact CZ-OD1 3.25Å; R14-D141 IonicContact CZ-OD2 3.25Å; R14-D141 IonicContact NE-OD1 3.84Å; R14-D141 VanDerWaalsContact NH1-CG 3.34Å; R14-D141 IonicContact NH1-OD1 2.63Å; R14-D141 PolarHBondContact NH1-OD1 2.84Å; R14-D141 IonicContact NH1-OD2 3.42Å; R14-D141 PolarHBondContact NH1-OD2 2.86Å; R14-D141 IonicContact NH2-OD1 3.76Å; R14-D141 PolarHBondContact NH2-OD1 2.95Å; R14-D141 IonicContact NH2-OD2 3.45Å; Y65-D141 HydrophobicContact CE1-CB 4.01Å; Y65-D141 PolarHBondContact OH-OD2 3.4Å; C138-D141 VanDerWaalsContact O-CB 3.23Å; C138-D141 WeakPolarHBondContact O-CB 3.5Å; C138-D141 PolarHBondContact O-N 3.01Å; D141-D143 VanDerWaalsContact C-N 3.35Å; D141-D143 PolarHBondContact O-N 2.9Å; D141-D143 PolarHBondContact OD1-N 2.84Å; D141-D143 VanDerWaalsContact OD1-N 3.14Å; D141-V144 HydrophobicContact CB-CB 4.09Å; D141-V144 HydrophobicContact CB-CG2 3.93Å; D141-V144 PolarHBondContact O-N 3.08Å; D141-Q145 WeakPolarHBondContact O-CG 3.43Å; D141-Q145 PolarHBondContact O-N 2.97Å
142	L	95.6	Very high	93.5	Very high	137 Å²	137	73.7 Å²	73.7	72%	0.717	35%	0.346	S	S	*	.	H	α-helix	trans	-64.6	-36.6	-174.2	-68.1	173.6	0	0	0	113.1	K146	L142-K146 WeakPolarHBondContact O-CB 3.28Å; L142-K146 PolarHBondContact O-N 2.87Å
143	D	96	Very high	93.4	Very high	81 Å²	81	72.5 Å²	72.5	43%	0.433	35%	0.347	S	S	.	.	H	α-helix	trans	-73.2	-37.2	-180	-67.6	-24.6	0	0	0	110.5	R14 L18 D141 K146 K147	R14-D143 IonicContact CZ-OD2 3.62Å; R14-D143 IonicContact NH2-OD2 2.85Å; R14-D143 PolarHBondContact NH2-OD2 3.11Å; L18-D143 HydrophobicContact CD1-CB 3.92Å; L18-D143 HydrophobicContact CD2-CB 4.01Å; D141-D143 VanDerWaalsContact C-N 3.35Å; D141-D143 PolarHBondContact O-N 2.9Å; D141-D143 PolarHBondContact OD1-N 2.84Å; D141-D143 VanDerWaalsContact OD1-N 3.14Å; D143-K146 PolarHBondContact O-N 3.39Å; D143-K147 PolarHBondContact O-N 2.82Å
144	V	95.6	Very high	93.1	Very high	0 Å²	0	74.2 Å²	74.2	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-64.9	-44.6	174.4	175	0	0	0	0	110.7	R14 I17 L18 F116 C138 D141 K146 K147 L148	R14-V144 HydrophobicContact CG-CG2 4.46Å; I17-V144 HydrophobicContact CD1-CG1 4.49Å; I17-V144 HydrophobicContact CG2-CG1 3.9Å; I17-V144 HydrophobicContact CG2-CG2 4.33Å; L18-V144 HydrophobicContact CD2-CG2 4.29Å; L18-V144 HydrophobicContact CG-CG2 4.42Å; F116-V144 HydrophobicContact CD2-CG1 3.69Å; F116-V144 HydrophobicContact CE2-CG1 4.15Å; C138-V144 WeakPolarHBondContact O-CB 3.46Å; D141-V144 HydrophobicContact CB-CB 4.09Å; D141-V144 HydrophobicContact CB-CG2 3.93Å; D141-V144 PolarHBondContact O-N 3.08Å; V144-K146 VanDerWaalsContact C-N 3.33Å; V144-K146 PolarHBondContact O-N 2.72Å; V144-K147 PolarHBondContact O-N 2.84Å; V144-L148 WeakPolarHBondContact O-CB 3.46Å; V144-L148 PolarHBondContact O-N 2.81Å
145	Q	95.4	Very high	92.3	Very high	74 Å²	74	66.9 Å²	66.9	35%	0.346	33%	0.329	S	S	.	.	H	α-helix	trans	-59.8	-44.4	175.1	-75.4	-178.6	-4.5	0	0	111.6	N139 D141 K147 L148 Y149	N139-Q145 WeakPolarHBondContact O-CG 3.44Å; N139-Q145 PolarHBondContact O-NE2 2.95Å; D141-Q145 WeakPolarHBondContact O-CG 3.43Å; D141-Q145 PolarHBondContact O-N 2.97Å; Q145-K147 PolarHBondContact O-N 3.16Å; Q145-L148 WeakPolarHBondContact O-CB 3.25Å; Q145-L148 PolarHBondContact O-N 3.49Å; Q145-Y149 WeakPolarHBondContact O-CD2 3.28Å; Q145-Y149 PolarHBondContact O-N 3.23Å
146	K	94.8	Very high	91	Very high	135 Å²	135	71.1 Å²	71.1	59%	0.587	35%	0.35	S	S	*	.	H	α-helix	trans	-58.5	-49.5	176.9	-172.8	-176.1	173.9	-168.5	0	111.2	L142 D143 V144 L148 Y149 D150	L142-K146 WeakPolarHBondContact O-CB 3.28Å; L142-K146 PolarHBondContact O-N 2.87Å; D143-K146 PolarHBondContact O-N 3.39Å; V144-K146 VanDerWaalsContact C-N 3.33Å; V144-K146 PolarHBondContact O-N 2.72Å; K146-L148 VanDerWaalsContact C-N 3.27Å; K146-L148 PolarHBondContact O-N 3.01Å; K146-Y149 PolarHBondContact O-N 3.12Å; K146-D150 VanDerWaalsContact O-CG 3.24Å; K146-D150 PolarHBondContact O-N 3.26Å
147	K	94.8	Very high	89.5	Confident	53 Å²	53	71.7 Å²	71.7	23%	0.23	36%	0.355	C	S	.	.	H	α-helix	trans	-61.1	-36.7	177.5	-171.9	173.5	179.9	177.2	0	112.3	I17 L18 G19 F116 D143 V144 Q145 D150 C151	I17-K147 WeakPolarHBondContact O-CD 3.38Å; I17-K147 VanDerWaalsContact O-CE 3.25Å; I17-K147 WeakPolarHBondContact O-CE 3.4Å; I17-K147 PolarHBondContact O-NZ 2.99Å; L18-K147 VanDerWaalsContact C-NZ 3.25Å; L18-K147 HydrophobicContact CD2-CB 4.21Å; L18-K147 HydrophobicContact CD2-CD 4.18Å; L18-K147 PolarHBondContact O-NZ 3.06Å; G19-K147 PolarHBondContact O-NZ 2.82Å; F116-K147 HydrophobicContact CE2-CB 4.48Å; F116-K147 HydrophobicContact CZ-CG 4.22Å; D143-K147 PolarHBondContact O-N 2.82Å; V144-K147 PolarHBondContact O-N 2.84Å; Q145-K147 PolarHBondContact O-N 3.16Å; K147-D150 PolarHBondContact O-N 3.03Å; K147-C151 PolarHBondContact O-N 2.87Å; K147-C151 PolarHBondContact O-SG 2.97Å
148	L	93.8	Very high	87.8	Confident	10 Å²	10	77 Å²	77	5%	0.052	38%	0.376	C	S	.	.	H	α-helix	trans	-61.1	-47.7	176.8	-179.4	63.9	0	0	0	111.2	I105 A114 F116 V144 Q145 K146 C151 L152	I105-L148 HydrophobicContact CG1-CD1 4.43Å; I105-L148 HydrophobicContact CG2-CD1 3.8Å; A114-L148 HydrophobicContact CB-CD2 4.41Å; A114-L148 VanDerWaalsContact O-CD2 3.32Å; A114-L148 WeakPolarHBondContact O-CD2 3.15Å; F116-L148 HydrophobicContact CD2-CB 4.03Å; F116-L148 HydrophobicContact CD2-CD1 3.99Å; F116-L148 HydrophobicContact CD2-CG 4.49Å; F116-L148 HydrophobicContact CE1-CD1 4.49Å; F116-L148 VanDerWaalsContact CE2-CA 3.46Å; F116-L148 HydrophobicContact CE2-CB 3.48Å; F116-L148 VanDerWaalsContact CE2-CB 3.48Å; F116-L148 HydrophobicContact CE2-CD1 3.88Å; F116-L148 HydrophobicContact CE2-CG 4.25Å; F116-L148 HydrophobicContact CG-CD1 4.38Å; F116-L148 HydrophobicContact CZ-CB 4.17Å; F116-L148 HydrophobicContact CZ-CD1 4.12Å; V144-L148 WeakPolarHBondContact O-CB 3.46Å; V144-L148 PolarHBondContact O-N 2.81Å; Q145-L148 WeakPolarHBondContact O-CB 3.25Å; Q145-L148 PolarHBondContact O-N 3.49Å; K146-L148 VanDerWaalsContact C-N 3.27Å; K146-L148 PolarHBondContact O-N 3.01Å; L148-C151 PolarHBondContact O-N 2.84Å; L148-L152 HydrophobicContact CD1-CD1 4.28Å; L148-L152 HydrophobicContact CD1-CG 4.44Å; L148-L152 HydrophobicContact CG-CD1 4.05Å; L148-L152 WeakPolarHBondContact O-CB 3.42Å; L148-L152 VanDerWaalsContact O-CG 3.25Å; L148-L152 WeakPolarHBondContact O-CG 3.3Å; L148-L152 PolarHBondContact O-N 3.2Å
149	Y	91.9	Very high	85.7	Confident	149 Å²	149	81 Å²	81	58%	0.584	41%	0.405	S	S	*	.	H	α-helix	trans	-64.2	-41.9	177	-75.6	-70.2	0	0	0	111.8	Q145 K146 C151 L152 E153	Q145-Y149 WeakPolarHBondContact O-CD2 3.28Å; Q145-Y149 PolarHBondContact O-N 3.23Å; K146-Y149 PolarHBondContact O-N 3.12Å; Y149-C151 PolarHBondContact O-N 2.95Å; Y149-L152 PolarHBondContact O-N 2.76Å; Y149-E153 WeakPolarHBondContact O-CG 3.43Å; Y149-E153 PolarHBondContact O-N 3.22Å
150	D	92.4	Very high	83.5	Confident	74 Å²	74	83.3 Å²	83.3	40%	0.396	42%	0.42	S	S	.	.	H	α-helix	trans	-58.3	-47.7	176.4	-63.7	-22.4	0	0	0	110.7	K146 K147 L152 E153 E154	K146-D150 VanDerWaalsContact O-CG 3.24Å; K146-D150 PolarHBondContact O-N 3.26Å; K147-D150 PolarHBondContact O-N 3.03Å; D150-L152 PolarHBondContact O-N 2.82Å; D150-E153 PolarHBondContact O-N 3.35Å; D150-E154 WeakPolarHBondContact O-CG 3.46Å; D150-E154 PolarHBondContact O-N 3.49Å
151	C	88.8	Confident	81.1	Confident	24 Å²	24	81.5 Å²	81.5	16%	0.162	42%	0.422	C	S	.	.	H	α-helix	trans	-65.5	-37.9	177.4	-65.9	0	0	0	0	113	I105 K147 L148 Y149 E154 H155	I105-C151 HydrophobicContact CD1-CB 3.36Å; K147-C151 PolarHBondContact O-N 2.87Å; K147-C151 PolarHBondContact O-SG 2.97Å; L148-C151 PolarHBondContact O-N 2.84Å; Y149-C151 PolarHBondContact O-N 2.95Å; C151-E154 PolarHBondContact O-N 2.72Å; C151-H155 PolarHBondContact O-CD2 3.33Å; C151-H155 PolarHBondContact O-N 3.38Å
152	L	89.8	Confident	78.9	Confident	31 Å²	31	84.4 Å²	84.4	16%	0.162	44%	0.444	C	S	.	.	H	α-helix	trans	-66.5	-38.9	176	-72.2	170	0	0	0	111.6	I105 V107 A114 L148 Y149 D150 H155 L156	I105-L152 HydrophobicContact CG2-CD2 3.98Å; V107-L152 HydrophobicContact CG2-CD2 4.29Å; A114-L152 HydrophobicContact CB-CD1 3.69Å; A114-L152 HydrophobicContact CB-CD2 4.49Å; L148-L152 HydrophobicContact CD1-CD1 4.28Å; L148-L152 HydrophobicContact CD1-CG 4.44Å; L148-L152 HydrophobicContact CG-CD1 4.05Å; L148-L152 WeakPolarHBondContact O-CB 3.42Å; L148-L152 VanDerWaalsContact O-CG 3.25Å; L148-L152 WeakPolarHBondContact O-CG 3.3Å; L148-L152 PolarHBondContact O-N 3.2Å; Y149-L152 PolarHBondContact O-N 2.76Å; D150-L152 PolarHBondContact O-N 2.82Å; L152-H155 PolarHBondContact O-N 3.49Å; L152-L156 WeakPolarHBondContact O-CB 3.46Å; L152-L156 VanDerWaalsContact O-CG 3.29Å; L152-L156 WeakPolarHBondContact O-CG 3.37Å; L152-L156 PolarHBondContact O-N 3.43Å
153	E	87.6	Confident	76.8	Confident	127 Å²	127	82.2 Å²	82.2	59%	0.593	43%	0.433	S	S	*	.	H	α-helix	trans	-63.7	-39.6	174.5	-77.8	-173.1	176.2	0	0	111.8	Y149 D150 L156 S157	Y149-E153 WeakPolarHBondContact O-CG 3.43Å; Y149-E153 PolarHBondContact O-N 3.22Å; D150-E153 PolarHBondContact O-N 3.35Å; E153-L156 PolarHBondContact O-N 2.95Å; E153-S157 VanDerWaalsContact O-CB 3.28Å; E153-S157 WeakPolarHBondContact O-CB 3.13Å; E153-S157 PolarHBondContact O-N 3.18Å; E153-S157 PolarHBondContact O-OG 3.01Å
154	E	83	Confident	74.6	Confident	124 Å²	124	83 Å²	83	58%	0.579	45%	0.451	S	S	*	.	H	α-helix	trans	-61.8	-49.7	173.6	-72.8	174.5	177.2	0	0	111.5	D150 C151 L156 S157 E158	D150-E154 WeakPolarHBondContact O-CG 3.46Å; D150-E154 PolarHBondContact O-N 3.49Å; C151-E154 PolarHBondContact O-N 2.72Å; E154-L156 VanDerWaalsContact C-N 3.31Å; E154-L156 PolarHBondContact O-N 3.16Å; E154-S157 WeakPolarHBondContact O-CB 3.31Å; E154-S157 PolarHBondContact O-N 3.02Å; E154-E158 WeakPolarHBondContact O-CG 3.45Å; E154-E158 PolarHBondContact O-N 2.94Å
155	H	72.6	Confident	72.7	Confident	99 Å²	99	86.3 Å²	86.3	46%	0.458	48%	0.484	S	S	.	.	H	α-helix	trans	-59.2	-39.5	176.9	-78.3	-60.1	0	0	0	112.9	C151 L152 S159	C151-H155 PolarHBondContact O-CD2 3.33Å; C151-H155 PolarHBondContact O-N 3.38Å; L152-H155 PolarHBondContact O-N 3.49Å; H155-S159 WeakPolarHBondContact O-CB 3.29Å; H155-S159 PolarHBondContact O-N 3.41Å; H155-S159 VanDerWaalsContact O-N 3.08Å; H155-S159 PolarHBondContact O-OG 3.4Å
156	L	68	Low	71	Confident	113 Å²	113	85.4 Å²	85.4	59%	0.592	48%	0.482	S	S	*	.	H	α-helix	trans	-69.2	-37.3	174.2	-70.5	174.5	0	0	0	111.8	L152 E153 E154 S159 T160	L152-L156 WeakPolarHBondContact O-CB 3.46Å; L152-L156 VanDerWaalsContact O-CG 3.29Å; L152-L156 WeakPolarHBondContact O-CG 3.37Å; L152-L156 PolarHBondContact O-N 3.43Å; E153-L156 PolarHBondContact O-N 2.95Å; E154-L156 VanDerWaalsContact C-N 3.31Å; E154-L156 PolarHBondContact O-N 3.16Å; L156-S159 PolarHBondContact O-N 3.02Å; L156-T160 VanDerWaalsContact O-CB 3.28Å; L156-T160 WeakPolarHBondContact O-CB 3.37Å; L156-T160 WeakPolarHBondContact O-CG2 3.35Å; L156-T160 PolarHBondContact O-N 3.37Å; L156-T160 PolarHBondContact O-OG1 3.02Å
157	S	63.3	Low	70	Confident	72 Å²	72	81.3 Å²	81.3	50%	0.503	47%	0.47	S	S	.	.	H	α-helix	trans	-67.8	-39.7	179	-61.1	0	0	0	0	111.9	E153 E154 T160 S161	E153-S157 VanDerWaalsContact O-CB 3.28Å; E153-S157 WeakPolarHBondContact O-CB 3.13Å; E153-S157 PolarHBondContact O-N 3.18Å; E153-S157 PolarHBondContact O-OG 3.01Å; E154-S157 WeakPolarHBondContact O-CB 3.31Å; E154-S157 PolarHBondContact O-N 3.02Å; S157-T160 WeakPolarHBondContact CA-OG1 3.32Å; S157-T160 PolarHBondContact O-N 3.31Å; S157-T160 PolarHBondContact O-OG1 3.47Å; S157-S161 WeakPolarHBondContact O-CB 3.46Å; S157-S161 PolarHBondContact O-N 3.48Å
158	E	59.2	Low	69	Low	126 Å²	126	85.2 Å²	85.2	59%	0.589	49%	0.493	S	S	*	.	H	α-helix	trans	-64.2	-44.9	172.2	-71.3	-179.1	165.7	0	0	111.3	E154 T160 S161	E154-E158 WeakPolarHBondContact O-CG 3.45Å; E154-E158 PolarHBondContact O-N 2.94Å; E158-T160 VanDerWaalsContact C-N 3.31Å; E158-T160 PolarHBondContact O-N 3.07Å; E158-S161 PolarHBondContact O-N 3.27Å; E158-S161 PolarHBondContact O-OG 2.9Å
159	S	52.5	Low	68.1	Low	86 Å²	86	88 Å²	88	60%	0.601	51%	0.513	S	S	*	.	H	α-helix	trans	-68.5	-26.8	179.1	-55.5	0	0	0	0	113.4	H155 L156	H155-S159 WeakPolarHBondContact O-CB 3.29Å; H155-S159 PolarHBondContact O-N 3.41Å; H155-S159 VanDerWaalsContact O-N 3.08Å; H155-S159 PolarHBondContact O-OG 3.4Å; L156-S159 PolarHBondContact O-N 3.02Å
160	T	46.8	Very low	67.3	Low	79 Å²	79	85.3 Å²	85.3	49%	0.485	51%	0.506	S	S	.	.	H	α-helix	trans	-94.2	-11.2	178.9	53.8	0	0	0	0	113.6	L156 S157 E158 S162 N163 A164	L156-T160 VanDerWaalsContact O-CB 3.28Å; L156-T160 WeakPolarHBondContact O-CB 3.37Å; L156-T160 WeakPolarHBondContact O-CG2 3.35Å; L156-T160 PolarHBondContact O-N 3.37Å; L156-T160 PolarHBondContact O-OG1 3.02Å; S157-T160 WeakPolarHBondContact CA-OG1 3.32Å; S157-T160 PolarHBondContact O-N 3.31Å; S157-T160 PolarHBondContact O-OG1 3.47Å; E158-T160 VanDerWaalsContact C-N 3.31Å; E158-T160 PolarHBondContact O-N 3.07Å; T160-S162 PolarHBondContact O-N 3.47Å; T160-S162 VanDerWaalsContact O-N 3.15Å; T160-N163 PolarHBondContact O-N 3.36Å; T160-N163 VanDerWaalsContact O-N 3.09Å; T160-A164 PolarHBondContact O-N 3.48Å
161	S	45.7	Very low	66.4	Low	97 Å²	97	85.6 Å²	85.6	68%	0.678	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.8	179.8	72.4	0	0	0	0	114.1	S157 E158	S157-S161 WeakPolarHBondContact O-CB 3.46Å; S157-S161 PolarHBondContact O-N 3.48Å; E158-S161 PolarHBondContact O-N 3.27Å; E158-S161 PolarHBondContact O-OG 2.9Å
162	S	49.1	Very low	65.7	Low	82 Å²	82	89 Å²	89	57%	0.573	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-30.1	175.3	174.1	0	0	0	0	113.6	T160	T160-S162 PolarHBondContact O-N 3.47Å; T160-S162 VanDerWaalsContact O-N 3.15Å
163	N	51.6	Low	65	Low	90 Å²	90	91.6 Å²	91.6	48%	0.481	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-5.5	-161.7	-64	-9.5	0	0	0	113.9	T160 G165	T160-N163 PolarHBondContact O-N 3.36Å; T160-N163 VanDerWaalsContact O-N 3.09Å; N163-G165 PolarHBondContact O-N 2.89Å
164	A	50.3	Low	64.3	Low	99 Å²	99	90 Å²	90	82%	0.818	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	68.1	174.6	0	0	0	0	0	111.1	T160	T160-A164 PolarHBondContact O-N 3.48Å
165	G	56.4	Low	63.3	Low	68 Å²	68	88.4 Å²	88.4	70%	0.701	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	160	-8.6	176.3	0	0	0	0	0	116	N163 S167	N163-G165 PolarHBondContact O-N 2.89Å; G165-S167 PolarHBondContact O-N 2.79Å
166	L	58.8	Low	63	Low	56 Å²	56	92 Å²	92	29%	0.293	53%	0.533	S	S	.	.			trans	-72.9	121	179.7	-60.6	177	0	0	0	109.9	Q170	L166-Q170 HydrophobicContact CB-CB 4.32Å; L166-Q170 HydrophobicContact CD2-CB 4.14Å
167	S	74.3	Confident	62.7	Low	49 Å²	49	94.5 Å²	94.5	34%	0.343	54%	0.542	S	S	.	.			trans	-60.6	149.4	165.4	63.1	0	0	0	0	109.3	G165 S169 Q170 L171	G165-S167 PolarHBondContact O-N 2.79Å; S167-S169 WeakPolarHBondContact CB-OG 3.34Å; S167-S169 PolarHBondContact O-N 3.02Å; S167-S169 PolarHBondContact OG-OG 2.93Å; S167-Q170 PolarHBondContact O-N 3.34Å; S167-Q170 WeakPolarHBondContact OG-CG 3.15Å; S167-Q170 PolarHBondContact OG-N 3.27Å; S167-Q170 PolarHBondContact OG-OE1 2.99Å; S167-L171 PolarHBondContact O-N 2.83Å
168	L	73.4	Confident	63.2	Low	135 Å²	135	94.3 Å²	94.3	71%	0.707	54%	0.535	S	S	*	.	H	α-helix	trans	-47.9	-35.2	175.9	-173.4	80.9	0	0	0	112.1	L172	L168-L172 HydrophobicContact CG-CD1 4.23Å; L168-L172 VanDerWaalsContact O-CG 3.24Å; L168-L172 WeakPolarHBondContact O-CG 3.39Å; L168-L172 PolarHBondContact O-N 3.3Å; L168-L172 VanDerWaalsContact O-N 3.13Å
169	S	74.6	Confident	63.5	Low	67 Å²	67	95.7 Å²	95.7	47%	0.469	54%	0.541	S	S	.	.	H	α-helix	trans	-62.4	-42.2	174.5	31	0	0	0	0	113.9	S167 L172 D173	S167-S169 WeakPolarHBondContact CB-OG 3.34Å; S167-S169 PolarHBondContact O-N 3.02Å; S167-S169 PolarHBondContact OG-OG 2.93Å; S169-L172 PolarHBondContact O-N 3.04Å; S169-D173 PolarHBondContact O-N 3.13Å
170	Q	74.7	Confident	64.2	Low	93 Å²	93	99.7 Å²	99.7	44%	0.435	55%	0.55	S	S	.	*	H	α-helix	trans	-69.9	-37.2	-179.8	-73.9	162.5	-47	0	0	111.9	L166 S167 L172 D173 E174	L166-Q170 HydrophobicContact CB-CB 4.32Å; L166-Q170 HydrophobicContact CD2-CB 4.14Å; S167-Q170 PolarHBondContact O-N 3.34Å; S167-Q170 WeakPolarHBondContact OG-CG 3.15Å; S167-Q170 PolarHBondContact OG-N 3.27Å; S167-Q170 PolarHBondContact OG-OE1 2.99Å; Q170-L172 VanDerWaalsContact C-N 3.33Å; Q170-L172 PolarHBondContact O-N 3.21Å; Q170-D173 PolarHBondContact O-N 3.11Å; Q170-E174 PolarHBondContact O-N 2.96Å
171	L	74.1	Confident	65.4	Low	80 Å²	80	101.8 Å²	101.8	42%	0.419	55%	0.554	S	S	.	*	H	α-helix	trans	-64.5	-39	173.7	-174.8	69	0	0	0	111.9	S167 D173 M175	S167-L171 PolarHBondContact O-N 2.83Å; L171-D173 VanDerWaalsContact C-N 3.34Å; L171-M175 WeakPolarHBondContact O-CB 3.32Å; L171-M175 WeakPolarHBondContact O-CG 3.35Å; L171-M175 PolarHBondContact O-N 3.42Å
172	L	74.4	Confident	66.7	Low	97 Å²	97	101.1 Å²	101.1	51%	0.508	54%	0.541	S	S	.	.	H	α-helix	trans	-70.8	-29.3	176.8	-71.1	172.1	0	0	0	112.8	L168 S169 Q170 R176	L168-L172 HydrophobicContact CG-CD1 4.23Å; L168-L172 VanDerWaalsContact O-CG 3.24Å; L168-L172 WeakPolarHBondContact O-CG 3.39Å; L168-L172 PolarHBondContact O-N 3.3Å; L168-L172 VanDerWaalsContact O-N 3.13Å; S169-L172 PolarHBondContact O-N 3.04Å; Q170-L172 VanDerWaalsContact C-N 3.33Å; Q170-L172 PolarHBondContact O-N 3.21Å; L172-R176 WeakPolarHBondContact O-CB 3.49Å; L172-R176 PolarHBondContact O-N 3.3Å
173	D	75.3	Confident	68.1	Low	84 Å²	84	98.7 Å²	98.7	45%	0.449	53%	0.529	S	S	.	.	H	α-helix	trans	-76.2	-40.9	174.4	-77.2	-22.7	0	0	0	111.7	S169 Q170 L171 M175 R176 E177	S169-D173 PolarHBondContact O-N 3.13Å; Q170-D173 PolarHBondContact O-N 3.11Å; L171-D173 VanDerWaalsContact C-N 3.34Å; D173-M175 VanDerWaalsContact C-N 3.35Å; D173-M175 PolarHBondContact O-N 3.16Å; D173-R176 WeakPolarHBondContact O-CA 3.44Å; D173-R176 VanDerWaalsContact O-CB 3.31Å; D173-R176 WeakPolarHBondContact O-CB 3.43Å; D173-R176 PolarHBondContact O-N 2.98Å; D173-E177 PolarHBondContact O-N 3.34Å
174	E	71.1	Confident	69.4	Low	94 Å²	94	97.3 Å²	97.3	44%	0.439	53%	0.529	S	S	.	.	H	α-helix	trans	-62.6	-40.7	172	-79.7	177.7	173.5	0	0	112	Q170 R176 E177 D178	Q170-E174 PolarHBondContact O-N 2.96Å; E174-R176 PolarHBondContact O-N 3.5Å; E174-E177 PolarHBondContact O-N 3.13Å; E174-E177 VanDerWaalsContact O-N 3.16Å; E174-D178 PolarHBondContact O-N 3.15Å; E174-D178 VanDerWaalsContact O-N 3.08Å
175	M	63.9	Low	70.6	Confident	91 Å²	91	97.1 Å²	97.1	45%	0.448	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-26.3	171.8	-83.9	-164.9	56.2	0	0	113.5	L171 D173 L185	L171-M175 WeakPolarHBondContact O-CB 3.32Å; L171-M175 WeakPolarHBondContact O-CG 3.35Å; L171-M175 PolarHBondContact O-N 3.42Å; D173-M175 VanDerWaalsContact C-N 3.35Å; D173-M175 PolarHBondContact O-N 3.16Å; M175-L185 HydrophobicContact CE-CD1 4.27Å
176	R	64.7	Low	71.8	Confident	173 Å²	173	97.1 Å²	97.1	65%	0.653	50%	0.501	S	S	*	.	H	α-helix	trans	-79	-31.9	175.1	-177.6	-175.3	-61.8	-149.7	-0.1	111.4	L172 D173 E174 D178	L172-R176 WeakPolarHBondContact O-CB 3.49Å; L172-R176 PolarHBondContact O-N 3.3Å; D173-R176 WeakPolarHBondContact O-CA 3.44Å; D173-R176 VanDerWaalsContact O-CB 3.31Å; D173-R176 WeakPolarHBondContact O-CB 3.43Å; D173-R176 PolarHBondContact O-N 2.98Å; E174-R176 PolarHBondContact O-N 3.5Å; R176-D178 VanDerWaalsContact C-N 3.34Å
177	E	63.3	Low	72.6	Confident	167 Å²	167	98.2 Å²	98.2	78%	0.78	51%	0.512	S	S	*	.	H	α-helix	trans	-69.9	-32.6	174.8	-73.9	-179.6	171.9	0	0	111.8	D173 E174 Q179	D173-E177 PolarHBondContact O-N 3.34Å; E174-E177 PolarHBondContact O-N 3.13Å; E174-E177 VanDerWaalsContact O-N 3.16Å; E177-Q179 PolarHBondContact O-N 3.25Å
178	D	72.9	Confident	72.8	Confident	67 Å²	67	100.9 Å²	100.9	36%	0.358	52%	0.522	S	S	.	.			trans	-82.7	67	171.5	-158.4	-21.6	0	0	0	111.9	E174 R176 E180 H181 Q182	E174-D178 PolarHBondContact O-N 3.15Å; E174-D178 VanDerWaalsContact O-N 3.08Å; R176-D178 VanDerWaalsContact C-N 3.34Å; D178-E180 PolarHBondContact O-N 3.08Å; D178-E180 VanDerWaalsContact O-N 3.15Å; D178-H181 HydrophobicContact CB-CB 4.25Å; D178-H181 PolarHBondContact O-N 3.37Å; D178-H181 IonicContact OD1-CG 3.37Å; D178-H181 PolarHBondContact OD1-N 3.4Å; D178-H181 VanDerWaalsContact OD1-N 3.08Å; D178-H181 IonicContact OD1-ND1 3.39Å; D178-H181 PolarHBondContact OD1-ND1 2.84Å; D178-H181 VanDerWaalsContact OD1-ND1 3.08Å; D178-H181 IonicContact OD2-CE1 2.72Å; D178-H181 IonicContact OD2-CG 3.08Å; D178-H181 IonicContact OD2-ND1 3.12Å; D178-H181 PolarHBondContact OD2-ND1 2.7Å; D178-Q182 WeakPolarHBondContact O-CB 3.38Å; D178-Q182 PolarHBondContact O-N 2.79Å
179	Q	65.1	Low	73	Confident	155 Å²	155	96.9 Å²	96.9	72%	0.724	51%	0.508	S	S	*	.	H	α-helix	trans	-58.8	-26.2	-178.1	-172.6	166.1	69.1	0	0	112.7	E177 G183	E177-Q179 PolarHBondContact O-N 3.25Å; Q179-G183 PolarHBondContact O-N 3.38Å
180	E	68.2	Low	73	Confident	170 Å²	170	99 Å²	99	79%	0.794	51%	0.51	S	S	*	.	H	α-helix	trans	-76.1	-45.3	177.3	-66.6	-176.2	178.8	0	0	111.6	D178 G183 A184	D178-E180 PolarHBondContact O-N 3.08Å; D178-E180 VanDerWaalsContact O-N 3.15Å; E180-G183 PolarHBondContact O-N 2.97Å; E180-A184 WeakPolarHBondContact O-CB 3.49Å; E180-A184 PolarHBondContact O-N 3.05Å
181	H	70.9	Confident	72.9	Confident	123 Å²	123	98.2 Å²	98.2	57%	0.569	52%	0.515	S	S	*	.	H	α-helix	trans	-67.8	-38.6	173	-82	85.7	0	0	0	112.5	D178 G183 A184 L185	D178-H181 HydrophobicContact CB-CB 4.25Å; D178-H181 PolarHBondContact O-N 3.37Å; D178-H181 IonicContact OD1-CG 3.37Å; D178-H181 PolarHBondContact OD1-N 3.4Å; D178-H181 VanDerWaalsContact OD1-N 3.08Å; D178-H181 IonicContact OD1-ND1 3.39Å; D178-H181 PolarHBondContact OD1-ND1 2.84Å; D178-H181 VanDerWaalsContact OD1-ND1 3.08Å; D178-H181 IonicContact OD2-CE1 2.72Å; D178-H181 IonicContact OD2-CG 3.08Å; D178-H181 IonicContact OD2-ND1 3.12Å; D178-H181 PolarHBondContact OD2-ND1 2.7Å; H181-G183 VanDerWaalsContact C-N 3.33Å; H181-A184 PolarHBondContact O-N 3.4Å; H181-L185 WeakPolarHBondContact O-CB 3.44Å; H181-L185 WeakPolarHBondContact O-CG 3.41Å; H181-L185 PolarHBondContact O-N 2.88Å
182	Q	73.8	Confident	72.5	Confident	84 Å²	84	99 Å²	99	39%	0.393	53%	0.526	S	S	.	.	H	α-helix	trans	-62.1	-44.3	173.4	-172	-178.8	5.3	0	0	110.6	D178 L185 V186	D178-Q182 WeakPolarHBondContact O-CB 3.38Å; D178-Q182 PolarHBondContact O-N 2.79Å; Q182-L185 PolarHBondContact O-N 2.67Å; Q182-V186 HydrophobicContact CG-CG2 4.48Å; Q182-V186 WeakPolarHBondContact O-CB 3.5Å; Q182-V186 VanDerWaalsContact O-CG2 3.25Å; Q182-V186 WeakPolarHBondContact O-CG2 3.24Å; Q182-V186 PolarHBondContact O-N 3.44Å
183	G	77.8	Confident	72.1	Confident	31 Å²	31	101 Å²	101	32%	0.32	54%	0.537	S	S	.	.	H	α-helix	trans	-60.2	-44.8	174.8	0	0	0	0	0	112.2	Q179 E180 H181 L185 V186 C187	Q179-G183 PolarHBondContact O-N 3.38Å; E180-G183 PolarHBondContact O-N 2.97Å; H181-G183 VanDerWaalsContact C-N 3.33Å; G183-L185 PolarHBondContact O-N 3.34Å; G183-V186 PolarHBondContact O-N 3.02Å; G183-C187 VanDerWaalsContact O-CB 3.29Å; G183-C187 WeakPolarHBondContact O-CB 3.32Å; G183-C187 PolarHBondContact O-N 3.43Å; G183-C187 PolarHBondContact O-SG 2.96Å
184	A	79.3	Confident	71.3	Confident	60 Å²	60	101 Å²	101	50%	0.496	54%	0.54	S	S	.	.	H	α-helix	trans	-63.7	-40.7	176.7	0	0	0	0	0	112.5	E180 H181 C187 L188	E180-A184 WeakPolarHBondContact O-CB 3.49Å; E180-A184 PolarHBondContact O-N 3.05Å; H181-A184 PolarHBondContact O-N 3.4Å; A184-C187 PolarHBondContact O-N 2.81Å; A184-L188 VanDerWaalsContact O-CB 3.22Å; A184-L188 WeakPolarHBondContact O-CB 3.49Å; A184-L188 PolarHBondContact O-N 3.42Å
185	L	76.3	Confident	70.6	Confident	96 Å²	96	103.6 Å²	103.6	50%	0.503	56%	0.556	S	S	.	*	H	α-helix	trans	-66.7	-40.5	175.4	-80.7	164.7	0	0	0	112.3	M175 H181 Q182 G183 L188 A189	M175-L185 HydrophobicContact CE-CD1 4.27Å; H181-L185 WeakPolarHBondContact O-CB 3.44Å; H181-L185 WeakPolarHBondContact O-CG 3.41Å; H181-L185 PolarHBondContact O-N 2.88Å; Q182-L185 PolarHBondContact O-N 2.67Å; G183-L185 PolarHBondContact O-N 3.34Å; L185-L188 PolarHBondContact O-N 2.94Å; L185-A189 VanDerWaalsContact O-CB 3.27Å; L185-A189 WeakPolarHBondContact O-CB 3.22Å; L185-A189 PolarHBondContact O-N 3.26Å
186	V	80.7	Confident	70.1	Confident	68 Å²	68	108.1 Å²	108.1	41%	0.412	58%	0.576	S	S	.	*	H	α-helix	trans	-65.6	-46.9	174.6	170.8	0	0	0	0	110	Q182 G183 L188 A189 E190	Q182-V186 HydrophobicContact CG-CG2 4.48Å; Q182-V186 WeakPolarHBondContact O-CB 3.5Å; Q182-V186 VanDerWaalsContact O-CG2 3.25Å; Q182-V186 WeakPolarHBondContact O-CG2 3.24Å; Q182-V186 PolarHBondContact O-N 3.44Å; G183-V186 PolarHBondContact O-N 3.02Å; V186-L188 VanDerWaalsContact C-N 3.29Å; V186-L188 PolarHBondContact O-N 2.67Å; V186-A189 PolarHBondContact O-N 2.8Å; V186-E190 HydrophobicContact CG1-CG 4.29Å; V186-E190 VanDerWaalsContact O-CB 3.31Å; V186-E190 WeakPolarHBondContact O-CB 3.29Å; V186-E190 VanDerWaalsContact O-CG 3.32Å; V186-E190 WeakPolarHBondContact O-CG 3.47Å; V186-E190 PolarHBondContact O-N 2.9Å
187	C	76.5	Confident	69.6	Low	79 Å²	79	102.2 Å²	102.2	53%	0.534	57%	0.569	S	S	.	*	H	α-helix	trans	-61.1	-37.1	175	-72.2	0	0	0	0	112.3	G183 A184 S191	G183-C187 VanDerWaalsContact O-CB 3.29Å; G183-C187 WeakPolarHBondContact O-CB 3.32Å; G183-C187 PolarHBondContact O-N 3.43Å; G183-C187 PolarHBondContact O-SG 2.96Å; A184-C187 PolarHBondContact O-N 2.81Å; C187-S191 WeakPolarHBondContact O-CB 3.28Å; C187-S191 PolarHBondContact O-N 3.26Å
188	L	77.9	Confident	68.8	Low	105 Å²	105	99.9 Å²	99.9	55%	0.55	57%	0.569	S	S	.	*	H	α-helix	trans	-68.6	-44.3	175.3	-174.4	73.2	0	0	0	110.9	A184 L185 V186 S191 C192	A184-L188 VanDerWaalsContact O-CB 3.22Å; A184-L188 WeakPolarHBondContact O-CB 3.49Å; A184-L188 PolarHBondContact O-N 3.42Å; L185-L188 PolarHBondContact O-N 2.94Å; V186-L188 VanDerWaalsContact C-N 3.29Å; V186-L188 PolarHBondContact O-N 2.67Å; L188-S191 WeakPolarHBondContact O-CB 3.22Å; L188-S191 PolarHBondContact O-N 3.35Å; L188-C192 WeakPolarHBondContact O-CB 3.25Å; L188-C192 PolarHBondContact O-N 3.22Å; L188-C192 PolarHBondContact O-SG 2.97Å
189	A	77.4	Confident	67.7	Low	50 Å²	50	103.3 Å²	103.3	41%	0.413	60%	0.596	S	S	.	*	H	α-helix	trans	-63.3	-44.8	176	0	0	0	0	0	111	L185 V186 C192 L193	L185-A189 VanDerWaalsContact O-CB 3.27Å; L185-A189 WeakPolarHBondContact O-CB 3.22Å; L185-A189 PolarHBondContact O-N 3.26Å; V186-A189 PolarHBondContact O-N 2.8Å; A189-C192 WeakPolarHBondContact O-CB 3.44Å; A189-C192 PolarHBondContact O-N 2.89Å; A189-L193 WeakPolarHBondContact O-CB 3.27Å; A189-L193 WeakPolarHBondContact O-CD1 3.4Å; A189-L193 WeakPolarHBondContact O-CG 3.4Å; A189-L193 PolarHBondContact O-N 3.46Å
190	E	75.8	Confident	67	Low	112 Å²	112	101.9 Å²	101.9	52%	0.523	60%	0.598	S	S	.	*	H	α-helix	trans	-60.1	-47.5	172.8	-75.7	-177.3	173.2	0	0	110.2	V186 C192 L193 T194	V186-E190 HydrophobicContact CG1-CG 4.29Å; V186-E190 VanDerWaalsContact O-CB 3.31Å; V186-E190 WeakPolarHBondContact O-CB 3.29Å; V186-E190 VanDerWaalsContact O-CG 3.32Å; V186-E190 WeakPolarHBondContact O-CG 3.47Å; V186-E190 PolarHBondContact O-N 2.9Å; E190-C192 VanDerWaalsContact C-N 3.25Å; E190-C192 PolarHBondContact O-N 3.23Å; E190-L193 CarbonylContact O-C 3.56Å; E190-L193 WeakPolarHBondContact O-CA 3.48Å; E190-L193 WeakPolarHBondContact O-CB 3.25Å; E190-L193 PolarHBondContact O-N 3.06Å; E190-T194 PolarHBondContact O-N 3.37Å; E190-T194 PolarHBondContact O-OG1 2.89Å
191	S	70.8	Confident	66.3	Low	76 Å²	76	97.9 Å²	97.9	53%	0.531	59%	0.594	S	S	.	*	H	α-helix	trans	-58.6	-33.4	173.9	172.2	0	0	0	0	113.5	C187 L188 L193 T194	C187-S191 WeakPolarHBondContact O-CB 3.28Å; C187-S191 PolarHBondContact O-N 3.26Å; L188-S191 WeakPolarHBondContact O-CB 3.22Å; L188-S191 PolarHBondContact O-N 3.35Å; S191-L193 VanDerWaalsContact C-N 3.26Å; S191-T194 WeakPolarHBondContact CA-OG1 3.46Å
192	C	66.6	Low	65.5	Low	97 Å²	97	96.2 Å²	96.2	66%	0.655	59%	0.594	S	S	*	*	H	α-helix	trans	-73.8	-22.2	174.3	-67.6	0	0	0	0	112.1	L188 A189 E190	L188-C192 WeakPolarHBondContact O-CB 3.25Å; L188-C192 PolarHBondContact O-N 3.22Å; L188-C192 PolarHBondContact O-SG 2.97Å; A189-C192 WeakPolarHBondContact O-CB 3.44Å; A189-C192 PolarHBondContact O-N 2.89Å; E190-C192 VanDerWaalsContact C-N 3.25Å; E190-C192 PolarHBondContact O-N 3.23Å
193	L	65.1	Low	64.5	Low	140 Å²	140	98 Å²	98	73%	0.733	61%	0.613	S	S	*	*	H	α-helix	trans	-98.3	-30.1	-178.5	-66.8	168.2	0	0	0	112.6	A189 E190 S191 L195	A189-L193 WeakPolarHBondContact O-CB 3.27Å; A189-L193 WeakPolarHBondContact O-CD1 3.4Å; A189-L193 WeakPolarHBondContact O-CG 3.4Å; A189-L193 PolarHBondContact O-N 3.46Å; E190-L193 CarbonylContact O-C 3.56Å; E190-L193 WeakPolarHBondContact O-CA 3.48Å; E190-L193 WeakPolarHBondContact O-CB 3.25Å; E190-L193 PolarHBondContact O-N 3.06Å; S191-L193 VanDerWaalsContact C-N 3.26Å; L193-L195 PolarHBondContact O-N 3.45Å; L193-L195 VanDerWaalsContact O-N 3.17Å
194	T	58.6	Low	63.3	Low	84 Å²	84	101.6 Å²	101.6	52%	0.515	62%	0.624	S	S	.	*			trans	-80	92.8	171.1	35.6	0	0	0	0	109	E190 S191 E196	E190-T194 PolarHBondContact O-N 3.37Å; E190-T194 PolarHBondContact O-OG1 2.89Å; S191-T194 WeakPolarHBondContact CA-OG1 3.46Å; T194-E196 PolarHBondContact O-N 2.79Å
195	L	56.4	Low	62.4	Low	148 Å²	148	102.8 Å²	102.8	78%	0.775	63%	0.626	S	S	*	*			trans	-66.8	74.6	160.8	-83.7	132.4	0	0	0	109.5	L193 G197	L193-L195 PolarHBondContact O-N 3.45Å; L193-L195 VanDerWaalsContact O-N 3.17Å; L195-G197 PolarHBondContact O-N 3.3Å
196	E	54	Low	61.5	Low	186 Å²	186	104.7 Å²	104.7	87%	0.869	63%	0.632	S	S	*	*			trans	-85.1	97.3	167.7	-73.7	-134.4	152.2	0	0	110	T194	T194-E196 PolarHBondContact O-N 2.79Å
197	G	54	Low	59.9	Low	49 Å²	49	110.1 Å²	110.1	51%	0.505	65%	0.645	S	S	.	*	S	Bend	trans	178.2	147.4	169.9	0	0	0	0	0	110.1	L195 C199	L195-G197 PolarHBondContact O-N 3.3Å; G197-C199 PolarHBondContact O-N 2.67Å; G197-C199 VanDerWaalsContact O-N 3.1Å
198	P	47.6	Very low	59	Low	118 Å²	118	107.4 Å²	107.4	77%	0.766	63%	0.628	S	S	*	*	S	Bend	trans	-56.5	123.1	178.4	23.4	-30.9	0	0	0	108.5	T200	P198-T200 PolarHBondContact O-N 3.14Å; P198-T200 PolarHBondContact O-OG1 3.45Å; P198-T200 VanDerWaalsContact O-OG1 3.11Å
199	C	49	Very low	58.1	Low	139 Å²	139	103.8 Å²	103.8	94%	0.939	61%	0.613	S	S	*	*			trans	-45.2	82.6	-169.9	-55.8	0	0	0	0	112.9	G197	G197-C199 PolarHBondContact O-N 2.67Å; G197-C199 VanDerWaalsContact O-N 3.1Å
200	T	49.6	Very low	57.1	Low	125 Å²	125	104.8 Å²	104.8	77%	0.767	62%	0.618	S	S	*	*			trans	-100.8	112.5	162.3	-41.2	0	0	0	0	102.6	P198	P198-T200 PolarHBondContact O-N 3.14Å; P198-T200 PolarHBondContact O-OG1 3.45Å; P198-T200 VanDerWaalsContact O-OG1 3.11Å
201	A	54.3	Low	56	Low	86 Å²	86	108.4 Å²	108.4	71%	0.711	63%	0.626	S	S	*	*			trans	-43	128.9	-177.7	0	0	0	0	0	109.2
202	P	53.6	Low	55.4	Low	87 Å²	87	108.5 Å²	108.5	57%	0.565	63%	0.626	S	S	*	*			trans	-52.8	143.5	-179.3	21.4	-31.5	0	0	0	108.5	L204	P202-L204 PolarHBondContact O-N 3.42Å
203	P	53.5	Low	54.9	Low	123 Å²	123	112.5 Å²	112.5	80%	0.799	63%	0.632	S	S	*	*			trans	-52.6	114.7	178.7	21	-30.6	0	0	0	107.5	T205	P203-T205 PolarHBondContact O-N 3.4Å
204	L	52.8	Low	54.4	Low	105 Å²	105	108.3 Å²	108.3	55%	0.55	62%	0.618	S	S	.	*			trans	-55.3	111.2	-169.6	-153.1	72.1	0	0	0	107	P202 A208 A209	P202-L204 PolarHBondContact O-N 3.42Å; L204-A208 HydrophobicContact CD1-CB 3.86Å; L204-A208 HydrophobicContact CG-CB 3.77Å; L204-A209 HydrophobicContact CB-CB 4.49Å; L204-A209 VanDerWaalsContact CD2-CA 3.44Å; L204-A209 HydrophobicContact CD2-CB 3.74Å; L204-A209 HydrophobicContact CG-CB 4.18Å
205	T	61.1	Low	54.1	Low	85 Å²	85	109.9 Å²	109.9	52%	0.521	63%	0.627	S	S	.	*			trans	-53.6	148.6	177.8	61.1	0	0	0	0	108.2	P203 W207 A208 A209	P203-T205 PolarHBondContact O-N 3.4Å; T205-W207 CarbonylContact O-C 3.56Å; T205-W207 PolarHBondContact O-N 2.9Å; T205-A208 CarbonylContact O-C 3.55Å; T205-A208 WeakPolarHBondContact O-CA 3.23Å; T205-A208 PolarHBondContact O-N 2.74Å; T205-A208 WeakPolarHBondContact OG1-CB 3.49Å; T205-A208 PolarHBondContact OG1-N 2.98Å; T205-A208 VanDerWaalsContact OG1-N 3.12Å; T205-A209 PolarHBondContact O-N 2.94Å
206	H	57.2	Low	54.1	Low	136 Å²	136	106.3 Å²	106.3	63%	0.63	63%	0.626	S	S	*	*	H	α-helix	trans	-53.3	-27.5	179.2	65.3	-86.5	0	0	0	112.2	S210	H206-S210 VanDerWaalsContact O-CB 3.25Å; H206-S210 WeakPolarHBondContact O-CB 3.36Å; H206-S210 PolarHBondContact O-N 3.11Å; H206-S210 PolarHBondContact O-OG 2.97Å
207	W	47.2	Very low	54.1	Low	182 Å²	182	105.4 Å²	105.4	69%	0.689	62%	0.622	S	S	*	*	H	α-helix	trans	-68.7	-48.6	169.5	-76	98.8	0	0	0	113.9	T205 A209 S210 R211	T205-W207 CarbonylContact O-C 3.56Å; T205-W207 PolarHBondContact O-N 2.9Å; W207-A209 VanDerWaalsContact C-N 3.34Å; W207-S210 PolarHBondContact O-N 3.16Å; W207-R211 WeakPolarHBondContact O-CB 3.43Å; W207-R211 PolarHBondContact O-N 2.8Å
208	A	56.1	Low	54.2	Low	23 Å²	23	107.5 Å²	107.5	19%	0.19	64%	0.635	C	S	.	*	H	α-helix	trans	-64.5	-39.2	175.9	0	0	0	0	0	111.5	L204 T205 R211 C212	L204-A208 HydrophobicContact CD1-CB 3.86Å; L204-A208 HydrophobicContact CG-CB 3.77Å; T205-A208 CarbonylContact O-C 3.55Å; T205-A208 WeakPolarHBondContact O-CA 3.23Å; T205-A208 PolarHBondContact O-N 2.74Å; T205-A208 WeakPolarHBondContact OG1-CB 3.49Å; T205-A208 PolarHBondContact OG1-N 2.98Å; T205-A208 VanDerWaalsContact OG1-N 3.12Å; A208-R211 PolarHBondContact O-N 3.22Å; A208-C212 WeakPolarHBondContact O-CB 3.17Å; A208-C212 PolarHBondContact O-N 3.04Å; A208-C212 PolarHBondContact O-SG 2.83Å
209	A	58.9	Low	54.6	Low	28 Å²	28	108 Å²	108	23%	0.231	64%	0.635	C	S	.	*	H	α-helix	trans	-64.5	-39.3	173.7	0	0	0	0	0	112.3	L204 T205 W207 K213	L204-A209 HydrophobicContact CB-CB 4.49Å; L204-A209 VanDerWaalsContact CD2-CA 3.44Å; L204-A209 HydrophobicContact CD2-CB 3.74Å; L204-A209 HydrophobicContact CG-CB 4.18Å; T205-A209 PolarHBondContact O-N 2.94Å; W207-A209 VanDerWaalsContact C-N 3.34Å; A209-K213 WeakPolarHBondContact O-CB 3.43Å; A209-K213 VanDerWaalsContact O-CG 3.3Å; A209-K213 WeakPolarHBondContact O-CG 3.49Å; A209-K213 PolarHBondContact O-N 2.81Å
210	S	56.5	Low	54.8	Low	72 Å²	72	111 Å²	111	50%	0.503	63%	0.628	S	S	.	*	H	α-helix	trans	-68.5	-40.4	174.5	-64.1	0	0	0	0	112.2	H206 W207 K213 A214	H206-S210 VanDerWaalsContact O-CB 3.25Å; H206-S210 WeakPolarHBondContact O-CB 3.36Å; H206-S210 PolarHBondContact O-N 3.11Å; H206-S210 PolarHBondContact O-OG 2.97Å; W207-S210 PolarHBondContact O-N 3.16Å; S210-K213 PolarHBondContact O-N 2.99Å; S210-A214 WeakPolarHBondContact O-CB 3.28Å; S210-A214 PolarHBondContact O-N 2.88Å
211	R	54.2	Low	55.2	Low	188 Å²	188	110.4 Å²	110.4	71%	0.709	63%	0.625	S	S	*	*	H	α-helix	trans	-63.2	-45	173.7	-91.7	178.7	50	-155.7	-9.5	112.6	W207 A208 K213 A214 T215	W207-R211 WeakPolarHBondContact O-CB 3.43Å; W207-R211 PolarHBondContact O-N 2.8Å; A208-R211 PolarHBondContact O-N 3.22Å; R211-K213 VanDerWaalsContact C-N 3.32Å; R211-K213 PolarHBondContact O-N 3.33Å; R211-A214 CarbonylContact O-C 3.46Å; R211-A214 WeakPolarHBondContact O-CA 3.41Å; R211-A214 PolarHBondContact O-N 2.92Å; R211-A214 VanDerWaalsContact O-N 3.11Å; R211-T215 PolarHBondContact O-N 3Å; R211-T215 PolarHBondContact O-OG1 3.31Å
212	C	56.3	Low	55.2	Low	77 Å²	77	108.8 Å²	108.8	52%	0.52	61%	0.606	S	S	.	*	H	α-helix	trans	-63.8	-37.8	177	-71.1	0	0	0	0	111.7	A208 A214 T215	A208-C212 WeakPolarHBondContact O-CB 3.17Å; A208-C212 PolarHBondContact O-N 3.04Å; A208-C212 PolarHBondContact O-SG 2.83Å; C212-A214 VanDerWaalsContact C-N 3.31Å; C212-A214 PolarHBondContact O-N 3.39Å; C212-T215 VanDerWaalsContact CA-OG1 3.28Å; C212-T215 WeakPolarHBondContact CA-OG1 3.49Å; C212-T215 WeakPolarHBondContact O-CB 3.48Å; C212-T215 PolarHBondContact O-N 3.44Å; C212-T215 PolarHBondContact O-OG1 3.46Å
213	K	58	Low	55.6	Low	181 Å²	181	107.6 Å²	107.6	79%	0.787	60%	0.598	S	S	*	*	H	α-helix	trans	-65.9	-31.7	171.6	-76.6	177.8	179.4	-177.5	0	112.9	A209 S210 R211 T215	A209-K213 WeakPolarHBondContact O-CB 3.43Å; A209-K213 VanDerWaalsContact O-CG 3.3Å; A209-K213 WeakPolarHBondContact O-CG 3.49Å; A209-K213 PolarHBondContact O-N 2.81Å; S210-K213 PolarHBondContact O-N 2.99Å; R211-K213 VanDerWaalsContact C-N 3.32Å; R211-K213 PolarHBondContact O-N 3.33Å; K213-T215 VanDerWaalsContact C-N 3.32Å
214	A	53.5	Low	55.8	Low	52 Å²	52	105.4 Å²	105.4	43%	0.43	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-81.4	-5.3	174.7	0	0	0	0	0	113.8	S210 R211 C212 G216 E217	S210-A214 WeakPolarHBondContact O-CB 3.28Å; S210-A214 PolarHBondContact O-N 2.88Å; R211-A214 CarbonylContact O-C 3.46Å; R211-A214 WeakPolarHBondContact O-CA 3.41Å; R211-A214 PolarHBondContact O-N 2.92Å; R211-A214 VanDerWaalsContact O-N 3.11Å; C212-A214 VanDerWaalsContact C-N 3.31Å; C212-A214 PolarHBondContact O-N 3.39Å; A214-G216 PolarHBondContact O-N 3.28Å; A214-G216 VanDerWaalsContact O-N 3.13Å; A214-E217 PolarHBondContact O-N 3.09Å
215	T	51.8	Low	56.1	Low	117 Å²	117	104.8 Å²	104.8	72%	0.718	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-73	-5.3	-177.3	-43.5	0	0	0	0	112.7	R211 C212 K213	R211-T215 PolarHBondContact O-N 3Å; R211-T215 PolarHBondContact O-OG1 3.31Å; C212-T215 VanDerWaalsContact CA-OG1 3.28Å; C212-T215 WeakPolarHBondContact CA-OG1 3.49Å; C212-T215 WeakPolarHBondContact O-CB 3.48Å; C212-T215 PolarHBondContact O-N 3.44Å; C212-T215 PolarHBondContact O-OG1 3.46Å; K213-T215 VanDerWaalsContact C-N 3.32Å
216	G	56.2	Low	56.2	Low	73 Å²	73	106.5 Å²	106.5	75%	0.753	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-102	-15.4	171.8	0	0	0	0	0	115	A214	A214-G216 PolarHBondContact O-N 3.28Å; A214-G216 VanDerWaalsContact O-N 3.13Å
217	E	55.7	Low	56.6	Low	168 Å²	168	103.8 Å²	103.8	79%	0.785	58%	0.583	S	S	*	*	S	Bend	trans	-134.3	115.6	-177.7	-77.2	-173	157.8	0	0	110.7	A214	A214-E217 PolarHBondContact O-N 3.09Å
218	A	54.6	Low	57.2	Low	93 Å²	93	98 Å²	98	77%	0.769	57%	0.57	S	S	*	*			trans	67.6	96.4	177.1	0	0	0	0	0	115.7	Y220	A218-Y220 PolarHBondContact O-N 3.06Å; A218-Y220 VanDerWaalsContact O-N 3.16Å
219	V	55.8	Low	57.3	Low	127 Å²	127	99.3 Å²	99.3	77%	0.77	57%	0.573	S	S	*	*			trans	-40.9	123.7	144.8	176.6	0	0	0	0	106.9	T221	V219-T221 VanDerWaalsContact C-N 3.31Å; V219-T221 PolarHBondContact O-N 2.7Å; V219-T221 PolarHBondContact O-OG1 2.84Å
220	Y	54.9	Low	57.8	Low	203 Å²	203	100.5 Å²	100.5	80%	0.796	58%	0.58	S	S	*	*			trans	-55.8	100.4	176.8	-177.5	-100.7	0	0	0	108.1	A218 V222	A218-Y220 PolarHBondContact O-N 3.06Å; A218-Y220 VanDerWaalsContact O-N 3.16Å; Y220-V222 HydrophobicContact CD1-CG2 3.64Å; Y220-V222 HydrophobicContact CE1-CG2 3.23Å
221	T	57.3	Low	58.5	Low	113 Å²	113	105 Å²	105	69%	0.693	59%	0.592	S	S	*	*			trans	-98.5	104.7	-173.4	-54.9	0	0	0	0	106	V219 P223	V219-T221 VanDerWaalsContact C-N 3.31Å; V219-T221 PolarHBondContact O-N 2.7Å; V219-T221 PolarHBondContact O-OG1 2.84Å; T221-P223 WeakPolarHBondContact O-CD 3.11Å
222	V	54.2	Low	59.3	Low	52 Å²	52	101.2 Å²	101.2	32%	0.315	59%	0.586	S	S	.	*			trans	-78.6	118.1	171.7	-177.4	0	0	0	0	107.2	Y220 S224 M226 L227	Y220-V222 HydrophobicContact CD1-CG2 3.64Å; Y220-V222 HydrophobicContact CE1-CG2 3.23Å; V222-S224 PolarHBondContact O-N 2.89Å; V222-M226 HydrophobicContact CG1-CB 3.95Å; V222-M226 HydrophobicContact CG1-CE 4.43Å; V222-L227 HydrophobicContact CG1-CD2 3.93Å; V222-L227 HydrophobicContact CG1-CG 4.02Å
223	P	61.3	Low	59.9	Low	61 Å²	61	101.1 Å²	101.1	40%	0.396	58%	0.581	S	S	.	*			trans	-54.1	134.8	172.9	-23.3	34	0	0	0	110.2	T221 S225 M226	T221-P223 WeakPolarHBondContact O-CD 3.11Å; P223-S225 PolarHBondContact O-N 3.31Å; P223-M226 VanDerWaalsContact CD-CE 3.44Å; P223-M226 HydrophobicContact CG-CE 4.01Å; P223-M226 WeakPolarHBondContact O-CB 3.45Å; P223-M226 PolarHBondContact O-N 3.47Å
224	S	58.2	Low	60.4	Low	77 Å²	77	97.7 Å²	97.7	54%	0.538	57%	0.568	S	S	.	*	H	α-helix	trans	-55.9	-27.7	179.8	53.1	0	0	0	0	113	V222 M226 L227 C228	V222-S224 PolarHBondContact O-N 2.89Å; S224-M226 PolarHBondContact O-N 2.99Å; S224-L227 WeakPolarHBondContact O-CB 3.26Å; S224-L227 PolarHBondContact O-N 3.01Å; S224-C228 PolarHBondContact O-N 3.48Å; S224-C228 VanDerWaalsContact O-N 3.1Å
225	S	58.3	Low	61.1	Low	92 Å²	92	100.4 Å²	100.4	64%	0.643	57%	0.574	S	S	*	*	H	α-helix	trans	-62.1	-26.6	173.2	56.1	0	0	0	0	114.1	P223 L227	P223-S225 PolarHBondContact O-N 3.31Å; S225-L227 VanDerWaalsContact C-N 3.34Å
226	M	63.3	Low	62.1	Low	122 Å²	122	99 Å²	99	60%	0.601	56%	0.561	S	S	*	*	H	α-helix	trans	-82.3	-14.8	173.5	-69.6	-153.3	-86.2	0	0	112.8	V222 P223 S224	V222-M226 HydrophobicContact CG1-CB 3.95Å; V222-M226 HydrophobicContact CG1-CE 4.43Å; P223-M226 VanDerWaalsContact CD-CE 3.44Å; P223-M226 HydrophobicContact CG-CE 4.01Å; P223-M226 WeakPolarHBondContact O-CB 3.45Å; P223-M226 PolarHBondContact O-N 3.47Å; S224-M226 PolarHBondContact O-N 2.99Å
227	L	65.5	Low	62.4	Low	79 Å²	79	98.5 Å²	98.5	41%	0.414	54%	0.541	S	S	.	.	H	α-helix	trans	-91.2	-25.4	176.7	-59.6	175.9	0	0	0	112	V222 S224 S225 M438	V222-L227 HydrophobicContact CG1-CD2 3.93Å; V222-L227 HydrophobicContact CG1-CG 4.02Å; S224-L227 WeakPolarHBondContact O-CB 3.26Å; S224-L227 PolarHBondContact O-N 3.01Å; S225-L227 VanDerWaalsContact C-N 3.34Å; L227-M438 HydrophobicContact CB-CE 4.35Å; L227-M438 HydrophobicContact CD1-CE 3.99Å
228	C	60.2	Low	62.6	Low	59 Å²	59	94.6 Å²	94.6	40%	0.399	53%	0.532	S	S	.	.	S	Bend	trans	-94.2	150.5	179.6	-65.1	0	0	0	0	112.7	S224	S224-C228 PolarHBondContact O-N 3.48Å; S224-C228 VanDerWaalsContact O-N 3.1Å
229	I	59.6	Low	62.8	Low	52 Å²	52	94.4 Å²	94.4	27%	0.267	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-77.2	130.3	169.3	-57.7	175.2	0	0	0	107.5	D233 Q234 L237	I229-D233 HydrophobicContact CG2-CB 3.46Å; I229-D233 VanDerWaalsContact CG2-CB 3.46Å; I229-Q234 HydrophobicContact CB-CG 3.98Å; I229-Q234 HydrophobicContact CG2-CB 4.5Å; I229-Q234 HydrophobicContact CG2-CG 3.59Å; I229-L237 HydrophobicContact CD1-CD1 4.05Å; I229-L237 HydrophobicContact CG2-CD1 4.17Å
230	S	68.3	Low	63.1	Low	52 Å²	52	93.4 Å²	93.4	36%	0.364	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-65.1	154.5	178.2	78.9	0	0	0	0	110.8	N232 D233 Q234	S230-N232 PolarHBondContact O-N 3.4Å; S230-D233 WeakPolarHBondContact CB-OD2 3.34Å; S230-D233 PolarHBondContact O-N 2.63Å; S230-D233 PolarHBondContact OG-N 2.97Å; S230-D233 PolarHBondContact OG-OD2 3.41Å; S230-Q234 PolarHBondContact O-N 3.03Å
231	E	71.8	Confident	62.9	Low	166 Å²	166	85.9 Å²	85.9	78%	0.776	50%	0.5	S	S	*	.	H	α-helix	trans	-59.9	-32.7	-179.8	-162.8	168.5	-160.7	0	0	111.9	Q234 L235	E231-Q234 PolarHBondContact O-N 3.02Å; E231-L235 WeakPolarHBondContact O-CG 3.4Å; E231-L235 PolarHBondContact O-N 3.3Å
232	N	71.5	Confident	63	Low	109 Å²	109	87 Å²	87	58%	0.583	51%	0.509	S	S	*	.	H	α-helix	trans	-66.2	-43.4	173.7	-167.5	43.2	0	0	0	112	S230 Q234 L235 I236	S230-N232 PolarHBondContact O-N 3.4Å; N232-Q234 VanDerWaalsContact C-N 3.33Å; N232-Q234 PolarHBondContact O-N 3.5Å; N232-L235 PolarHBondContact O-N 2.98Å; N232-I236 VanDerWaalsContact O-CG1 3.31Å; N232-I236 WeakPolarHBondContact O-CG1 3.38Å; N232-I236 PolarHBondContact O-N 2.9Å
233	D	67.8	Low	62.1	Low	75 Å²	75	90.2 Å²	90.2	40%	0.401	53%	0.532	S	S	.	.	H	α-helix	trans	-70.2	-32.1	177.7	-59.7	-35.1	0	0	0	111.6	I229 S230 I236 L237	I229-D233 HydrophobicContact CG2-CB 3.46Å; I229-D233 VanDerWaalsContact CG2-CB 3.46Å; S230-D233 WeakPolarHBondContact CB-OD2 3.34Å; S230-D233 PolarHBondContact O-N 2.63Å; S230-D233 PolarHBondContact OG-N 2.97Å; S230-D233 PolarHBondContact OG-OD2 3.41Å; D233-I236 PolarHBondContact O-N 3.46Å; D233-L237 WeakPolarHBondContact O-CB 3.38Å; D233-L237 WeakPolarHBondContact O-CG 3.48Å; D233-L237 PolarHBondContact O-N 3.17Å
234	Q	68.4	Low	61.1	Low	109 Å²	109	96 Å²	96	51%	0.509	55%	0.554	S	S	.	*	H	α-helix	trans	-67.5	-37.4	171.4	-76.8	-139.7	55.6	0	0	112.6	I229 S230 E231 N232 I236 L237 S238	I229-Q234 HydrophobicContact CB-CG 3.98Å; I229-Q234 HydrophobicContact CG2-CB 4.5Å; I229-Q234 HydrophobicContact CG2-CG 3.59Å; S230-Q234 PolarHBondContact O-N 3.03Å; E231-Q234 PolarHBondContact O-N 3.02Å; N232-Q234 VanDerWaalsContact C-N 3.33Å; N232-Q234 PolarHBondContact O-N 3.5Å; Q234-I236 VanDerWaalsContact C-N 3.34Å; Q234-L237 PolarHBondContact O-N 3.37Å; Q234-S238 WeakPolarHBondContact O-CB 3.13Å; Q234-S238 PolarHBondContact O-N 2.93Å; Q234-S238 PolarHBondContact O-OG 3.3Å
235	L	69.3	Low	60.5	Low	109 Å²	109	103.2 Å²	103.2	57%	0.571	57%	0.57	S	S	*	*	H	α-helix	trans	-64.6	-39.3	173.2	-76.7	169.3	0	0	0	111.7	E231 N232 S238 S239	E231-L235 WeakPolarHBondContact O-CG 3.4Å; E231-L235 PolarHBondContact O-N 3.3Å; N232-L235 PolarHBondContact O-N 2.98Å; L235-S238 WeakPolarHBondContact CA-OG 3.37Å; L235-S238 PolarHBondContact O-N 3.45Å; L235-S238 PolarHBondContact O-OG 2.88Å; L235-S239 VanDerWaalsContact O-CB 3.26Å; L235-S239 WeakPolarHBondContact O-CB 3.35Å; L235-S239 PolarHBondContact O-N 3.46Å; L235-S239 PolarHBondContact O-OG 3.06Å
236	I	71.1	Confident	59.4	Low	87 Å²	87	104.8 Å²	104.8	45%	0.446	58%	0.575	S	S	.	*	H	α-helix	trans	-64	-47.5	174.3	-65.1	164	0	0	0	110.2	N232 D233 Q234 S238 S239 L240	N232-I236 VanDerWaalsContact O-CG1 3.31Å; N232-I236 WeakPolarHBondContact O-CG1 3.38Å; N232-I236 PolarHBondContact O-N 2.9Å; D233-I236 PolarHBondContact O-N 3.46Å; Q234-I236 VanDerWaalsContact C-N 3.34Å; I236-S238 VanDerWaalsContact C-N 3.33Å; I236-S238 PolarHBondContact O-N 2.89Å; I236-S239 PolarHBondContact O-N 2.86Å; I236-S239 PolarHBondContact O-OG 3.07Å; I236-L240 PolarHBondContact O-N 3.02Å
237	L	63.2	Low	58.3	Low	63 Å²	63	108 Å²	108	33%	0.33	59%	0.589	S	S	.	*	H	α-helix	trans	-64.2	-34.4	178.6	-72	169.8	0	0	0	113.5	I229 D233 Q234	I229-L237 HydrophobicContact CD1-CD1 4.05Å; I229-L237 HydrophobicContact CG2-CD1 4.17Å; D233-L237 WeakPolarHBondContact O-CB 3.38Å; D233-L237 WeakPolarHBondContact O-CG 3.48Å; D233-L237 PolarHBondContact O-N 3.17Å; Q234-L237 PolarHBondContact O-N 3.37Å
238	S	61.1	Low	56.5	Low	86 Å²	86	107.4 Å²	107.4	60%	0.601	60%	0.602	S	S	*	*	H	α-helix	trans	-82.6	-21.1	177.7	51.5	0	0	0	0	113.5	Q234 L235 I236 L240	Q234-S238 WeakPolarHBondContact O-CB 3.13Å; Q234-S238 PolarHBondContact O-N 2.93Å; Q234-S238 PolarHBondContact O-OG 3.3Å; L235-S238 WeakPolarHBondContact CA-OG 3.37Å; L235-S238 PolarHBondContact O-N 3.45Å; L235-S238 PolarHBondContact O-OG 2.88Å; I236-S238 VanDerWaalsContact C-N 3.33Å; I236-S238 PolarHBondContact O-N 2.89Å; S238-L240 VanDerWaalsContact C-N 3.31Å
239	S	57.9	Low	55.6	Low	90 Å²	90	111 Å²	111	63%	0.629	62%	0.624	S	S	*	*	H	α-helix	trans	-74.8	-17.6	173.3	75.2	0	0	0	0	114	L235 I236 G241	L235-S239 VanDerWaalsContact O-CB 3.26Å; L235-S239 WeakPolarHBondContact O-CB 3.35Å; L235-S239 PolarHBondContact O-N 3.46Å; L235-S239 PolarHBondContact O-OG 3.06Å; I236-S239 PolarHBondContact O-N 2.86Å; I236-S239 PolarHBondContact O-OG 3.07Å; S239-G241 PolarHBondContact O-N 2.96Å
240	L	61.1	Low	54.2	Low	106 Å²	106	117.5 Å²	117.5	56%	0.555	65%	0.653	S	S	*	*	S	Bend	trans	-76.4	53.6	175.1	-69.2	163.9	0	0	0	111.4	I236 S238	I236-L240 PolarHBondContact O-N 3.02Å; S238-L240 VanDerWaalsContact C-N 3.31Å
241	G	51.3	Low	52.9	Low	45 Å²	45	122.6 Å²	122.6	46%	0.464	68%	0.676	S	S	.	*			trans	-53.9	156.1	-175.6	0	0	0	0	0	114.1	S239 C243	S239-G241 PolarHBondContact O-N 2.96Å; G241-C243 PolarHBondContact O-N 2.92Å
242	P	59.5	Low	51.3	Low	135 Å²	135	119.6 Å²	119.6	88%	0.877	67%	0.671	S	S	*	*			trans	-76.5	86.9	-173.1	30	-33.4	0	0	0	112.4
243	C	35.8	Very low	49.9	Very low	121 Å²	121	120.1 Å²	120.1	82%	0.818	68%	0.68	S	S	*	*			trans	-148.4	123	166.7	-80.2	0	0	0	0	107.8	G241	G241-C243 PolarHBondContact O-N 2.92Å
244	Q	40.5	Very low	48.5	Very low	181 Å²	181	122.4 Å²	122.4	85%	0.846	70%	0.699	S	S	*	*			cis	-134.1	133.5	35.5	-64.5	-175.2	33.8	0	0	112.3
245	R	45.8	Very low	46.9	Very low	230 Å²	230	124.7 Å²	124.7	87%	0.868	72%	0.715	S	S	*	*			trans	-64.7	160.4	148.3	-82.2	175.9	-118.7	123.2	1.6	108.8
246	T	34.4	Very low	45.6	Very low	124 Å²	124	125.2 Å²	125.2	76%	0.761	73%	0.725	S	S	*	*			trans	78.1	122.1	179.8	11.4	0	0	0	0	114.4
247	Q	40	Very low	44.1	Very low	191 Å²	191	125.2 Å²	125.2	89%	0.893	74%	0.737	S	S	*	*			cis	-145.6	138.1	12.6	-79.4	-180	-12.3	0	0	110.3
248	G	28.6	Very low	43	Very low	66 Å²	66	130.5 Å²	130.5	68%	0.68	77%	0.765	S	S	*	*	S	Bend	trans	-148.4	149.8	162.7	0	0	0	0	0	108.6
249	P	39.7	Very low	41.8	Very low	134 Å²	134	135.4 Å²	135.4	87%	0.87	78%	0.779	S	S	*	*			trans	-60.8	139.1	-162.6	-21.9	33.5	0	0	0	114.2
250	E	31.4	Very low	40.7	Very low	188 Å²	188	138.1 Å²	138.1	88%	0.879	79%	0.786	S	S	*	*			trans	-33	120.7	177.8	-165.2	-175.8	137.4	0	0	115.8
251	L	39.9	Very low	39.2	Very low	159 Å²	159	140.4 Å²	140.4	83%	0.832	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-102.8	144.6	156	-82.6	167.9	0	0	0	108.6
252	P	39.7	Very low	38.3	Very low	103 Å²	103	143.8 Å²	143.8	67%	0.669	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-67.5	158.9	-175.2	28.3	-33.1	0	0	0	112.3
253	P	40.5	Very low	37	Very low	120 Å²	120	145.2 Å²	145.2	78%	0.779	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-70.4	154.8	-164.5	28.1	-35.1	0	0	0	113.7
254	P	40.2	Very low	36.6	Very low	124 Å²	124	146.8 Å²	146.8	81%	0.805	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-77.2	143.5	177.7	31.6	-32.7	0	0	0	112.3
255	D	34.3	Very low	36	Very low	157 Å²	157	145.6 Å²	145.6	84%	0.84	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-65.5	135.7	175.5	-139.8	-8.4	0	0	0	110.9	A257	D255-A257 PolarHBondContact O-N 3.35Å; D255-A257 VanDerWaalsContact O-N 3.14Å
256	P	42.5	Very low	35.1	Very low	120 Å²	120	142.1 Å²	142.1	78%	0.779	82%	0.816	S	S	*	*	S	Bend	trans	-87.3	87.9	-171.2	33.4	-28.7	0	0	0	110.9
257	A	39	Very low	34.6	Very low	86 Å²	86	140.6 Å²	140.6	71%	0.711	82%	0.816	S	S	*	*	S	Bend	trans	-137	-0.1	170.7	0	0	0	0	0	115.7	D255	D255-A257 PolarHBondContact O-N 3.35Å; D255-A257 VanDerWaalsContact O-N 3.14Å
258	L	39.2	Very low	33.8	Very low	174 Å²	174	136.9 Å²	136.9	91%	0.911	81%	0.811	S	S	*	*			trans	-137.7	54.9	178	-67.2	176.4	0	0	0	112
259	Q	36.6	Very low	34.1	Very low	190 Å²	190	139.1 Å²	139.1	89%	0.888	81%	0.814	S	S	*	*			trans	-119	88.7	156.9	-71.7	-163.9	57.7	0	0	107.7
260	D	33.8	Very low	33.3	Very low	147 Å²	147	137.9 Å²	137.9	79%	0.786	81%	0.808	S	S	*	*			trans	-155.2	130.5	131.4	-124.2	-12.4	0	0	0	111.9
261	L	31.5	Very low	33	Very low	153 Å²	153	134.3 Å²	134.3	80%	0.801	80%	0.804	S	S	*	*			trans	88.3	83.9	160	-45.7	-177.7	0	0	0	118.7
262	S	30.5	Very low	32.9	Very low	116 Å²	116	132.1 Å²	132.1	81%	0.811	80%	0.799	S	S	*	*			trans	-62.1	126.7	147.5	-64.7	0	0	0	0	111.9
263	L	33.9	Very low	32.2	Very low	165 Å²	165	132.5 Å²	132.5	86%	0.864	80%	0.804	S	S	*	*			trans	36.6	115.7	142.6	-60.9	170.8	0	0	0	119.5
264	T	27.2	Very low	31.6	Very low	155 Å²	155	132.4 Å²	132.4	95%	0.951	81%	0.806	S	S	*	*			trans	-157.1	149.4	131.8	-3.9	0	0	0	0	113.3
265	L	27.7	Very low	30.9	Very low	155 Å²	155	132.2 Å²	132.2	81%	0.812	81%	0.808	S	S	*	*			trans	-76.8	152.1	-168	-104.5	161.8	0	0	0	114.8
266	I	27.7	Very low	30.4	Very low	157 Å²	157	128.3 Å²	128.3	81%	0.805	80%	0.804	S	S	*	*			trans	96.2	130.9	148.3	-59.2	149.4	0	0	0	119.7
267	A	22.9	Very low	29.5	Very low	92 Å²	92	129.1 Å²	129.1	76%	0.76	81%	0.807	S	S	*	*			trans	101.9	109.7	156	0	0	0	0	0	118.9
268	S	23	Very low	29.9	Very low	114 Å²	114	130.5 Å²	130.5	80%	0.797	81%	0.809	S	S	*	*			trans	-54.2	161.2	148.7	-53.4	0	0	0	0	110.8
269	P	34.9	Very low	29.1	Very low	113 Å²	113	127 Å²	127	73%	0.734	81%	0.806	S	S	*	*			cis	-147.8	178.2	34.2	36.9	-13.2	0	0	0	118.4
270	S	22.8	Very low	28.6	Very low	108 Å²	108	125.8 Å²	125.8	76%	0.755	80%	0.804	S	S	*	*			trans	74.1	114.3	147.1	38.3	0	0	0	0	121.8
271	S	24.9	Very low	28.8	Very low	113 Å²	113	124.9 Å²	124.9	79%	0.79	81%	0.806	S	S	*	*			trans	-31.2	171.7	149.2	-43.2	0	0	0	0	116
272	P	38.9	Very low	28.4	Very low	113 Å²	113	120.8 Å²	120.8	73%	0.734	80%	0.801	S	S	*	*			cis	-152.5	171.2	25.2	43	-20.6	0	0	0	120.3
273	S	24.8	Very low	28.1	Very low	111 Å²	111	123.4 Å²	123.4	78%	0.776	80%	0.8	S	S	*	*			trans	81	121.2	137	-73.7	0	0	0	0	123.9
274	S	26.9	Very low	27.8	Very low	118 Å²	118	121.9 Å²	121.9	83%	0.825	79%	0.79	S	S	*	*				75	142	127.7	-146.3	0	0	0	0	117.4
275	S	26	Very low	27.8	Very low	120 Å²	120	119.8 Å²	119.8	84%	0.839	78%	0.782	S	S	*	*			cis	-169.7	161.1	19.6	-175.3	0	0	0	0	108.6
276	G	23.9	Very low	27.8	Very low	74 Å²	74	116.9 Å²	116.9	76%	0.763	77%	0.774	S	S	*	*			trans	122.5	103.6	144.8	0	0	0	0	0	119.3
277	T	23.9	Very low	27.8	Very low	137 Å²	137	118 Å²	118	84%	0.84	78%	0.776	S	S	*	*			trans	-89.3	-174.2	153.1	-3.2	0	0	0	0	109.4
278	P	47.2	Very low	27.9	Very low	116 Å²	116	122 Å²	122	75%	0.753	78%	0.779	S	S	*	*			cis	-134.7	179.4	-31.1	32.4	-12.9	0	0	0	112.9
279	A	22.5	Very low	28.2	Very low	101 Å²	101	121.9 Å²	121.9	84%	0.835	78%	0.779	S	S	*	*			trans	170.5	131.5	135	0	0	0	0	0	115.1
280	L	26.6	Very low	27.8	Very low	164 Å²	164	119.5 Å²	119.5	86%	0.859	78%	0.775	S	S	*	*			trans	-87.6	174.1	157.3	-81.5	167.4	0	0	0	109.1
281	P	37.1	Very low	28.1	Very low	128 Å²	128	121 Å²	121	83%	0.831	78%	0.779	S	S	*	*			cis	-157.9	-178.6	40.8	41.1	-16.6	0	0	0	119.8
282	G	23.8	Very low	28.3	Very low	66 Å²	66	121.4 Å²	121.4	68%	0.68	78%	0.782	S	S	*	*			trans	132.9	97.3	148.8	0	0	0	0	0	116.5
283	H	24	Very low	27.8	Very low	171 Å²	171	124.3 Å²	124.3	79%	0.792	79%	0.789	S	S	*	*				64.3	129.3	96.5	-98.9	-114.1	0	0	0	114.5
284	M	27.9	Very low	27.9	Very low	134 Å²	134	123.8 Å²	123.8	66%	0.66	79%	0.786	S	S	*	*			cis	-167	159.4	12.4	-85.4	-81.5	94.2	0	0	113.2
285	S	25.9	Very low	27.9	Very low	111 Å²	111	125.5 Å²	125.5	78%	0.776	79%	0.785	S	S	*	*			trans	63.5	139.3	145.4	65.2	0	0	0	0	120
286	S	27.8	Very low	28.3	Very low	94 Å²	94	127.1 Å²	127.1	66%	0.657	78%	0.783	S	S	*	*			cis	-162.6	150	22.2	162.9	0	0	0	0	110.2
287	E	27.4	Very low	28.9	Very low	180 Å²	180	129.2 Å²	129.2	84%	0.841	78%	0.784	S	S	*	*			trans	21.3	139.6	153.5	-69	140.2	103.2	0	0	120.9
288	E	26.7	Very low	29.2	Very low	175 Å²	175	126.8 Å²	126.8	82%	0.818	78%	0.778	S	S	*	*				-168.4	139.4	55.3	174.7	-172.8	145.6	0	0	111
289	S	28.2	Very low	28.3	Very low	113 Å²	113	129.8 Å²	129.8	79%	0.79	79%	0.786	S	S	*	*			trans	44.1	131.8	149.8	-48.8	0	0	0	0	121.1
290	G	27.4	Very low	28.6	Very low	63 Å²	63	130.5 Å²	130.5	65%	0.649	79%	0.785	S	S	*	*			cis	-178.8	176.5	11	0	0	0	0	0	112.5
291	T	27.7	Very low	28.6	Very low	140 Å²	140	131.1 Å²	131.1	86%	0.859	79%	0.788	S	S	*	*			trans	67.4	90	170.6	62.7	0	0	0	0	117.7
292	S	29.1	Very low	28.2	Very low	120 Å²	120	129.7 Å²	129.7	84%	0.839	79%	0.787	S	S	*	*			trans	-141.2	111.9	150.5	-72	0	0	0	0	107.9
293	I	28.8	Very low	28.5	Very low	174 Å²	174	131.1 Å²	131.1	89%	0.892	79%	0.793	S	S	*	*			trans	-97.1	106	172	-35.9	172	0	0	0	105.6
294	S	26.4	Very low	28.9	Very low	101 Å²	101	129 Å²	129	71%	0.706	79%	0.794	S	S	*	*			trans	-97.8	122.1	164.9	-67.2	0	0	0	0	109.1
295	L	27.3	Very low	28.8	Very low	153 Å²	153	129.9 Å²	129.9	80%	0.801	80%	0.801	S	S	*	*				30.3	111.5	126.1	-54.5	173.9	0	0	0	115.1
296	L	35	Very low	29.7	Very low	154 Å²	154	129.9 Å²	129.9	81%	0.806	80%	0.799	S	S	*	*				165.2	172.8	78.8	-74.8	-174.6	0	0	0	106.3
297	P	36.5	Very low	29.6	Very low	119 Å²	119	128.9 Å²	128.9	77%	0.773	80%	0.804	S	S	*	*			cis	-140.3	177.3	18.7	38.1	-15.8	0	0	0	116.7
298	A	29.7	Very low	29.6	Very low	86 Å²	86	128.9 Å²	128.9	71%	0.711	80%	0.804	S	S	*	*			trans	-52.2	139.8	171.3	0	0	0	0	0	114.1
299	L	29.1	Very low	29.6	Very low	178 Å²	178	131.4 Å²	131.4	93%	0.932	81%	0.806	S	S	*	*			trans	-131.3	112.3	153	-78.4	175.4	0	0	0	110
300	S	28	Very low	29.5	Very low	116 Å²	116	131.1 Å²	131.1	81%	0.811	80%	0.804	S	S	*	*			trans	-68.1	144.4	173.5	-64.3	0	0	0	0	112
301	L	27.3	Very low	29.6	Very low	177 Å²	177	133.4 Å²	133.4	93%	0.927	81%	0.81	S	S	*	*			trans	-51.8	126.7	163.5	-170.5	69.8	0	0	0	112.2
302	A	28.1	Very low	29.6	Very low	98 Å²	98	132.1 Å²	132.1	81%	0.81	81%	0.807	S	S	*	*			trans	-148.9	119.3	159.6	0	0	0	0	0	110.5
303	A	30.3	Very low	29.6	Very low	97 Å²	97	135.2 Å²	135.2	80%	0.802	81%	0.808	S	S	*	*			trans	-73.6	158.7	175.5	0	0	0	0	0	111.9
304	P	32.4	Very low	30.3	Very low	125 Å²	125	131.8 Å²	131.8	81%	0.812	80%	0.797	S	S	*	*			trans	-101.2	139.2	177.7	36.1	-27.5	0	0	0	112.3
305	D	25.9	Very low	31.3	Very low	153 Å²	153	132.4 Å²	132.4	82%	0.818	80%	0.799	S	S	*	*			trans	-176.3	175.6	139.2	-142.8	13.9	0	0	0	110.3
306	P	44.2	Very low	32	Very low	111 Å²	111	130.7 Å²	130.7	72%	0.721	80%	0.797	S	S	*	*			cis	-121.4	172.3	-44.8	16	5.7	0	0	0	111.9
307	G	25.5	Very low	31.7	Very low	74 Å²	74	127.8 Å²	127.8	76%	0.763	79%	0.794	S	S	*	*			trans	155.7	111.1	151.4	0	0	0	0	0	120.6
308	Q	28.1	Very low	31.3	Very low	180 Å²	180	129.7 Å²	129.7	84%	0.841	80%	0.797	S	S	*	*			trans	68.1	111	146.8	-64.3	-142.6	-50.4	0	0	121.5
309	R	27.4	Very low	30.9	Very low	228 Å²	228	131.1 Å²	131.1	86%	0.86	80%	0.8	S	S	*	*				59	120.1	90	-110.9	-175.3	-168.2	-163.5	3.7	112.9
310	S	26.3	Very low	30.9	Very low	106 Å²	106	128.2 Å²	128.2	74%	0.741	79%	0.794	S	S	*	*				-177.6	151.7	62.7	-52.5	0	0	0	0	113.5
311	S	28.6	Very low	30.8	Very low	111 Å²	111	127.1 Å²	127.1	78%	0.776	79%	0.792	S	S	*	*			trans	71.5	118.3	146.9	-158	0	0	0	0	118.8
312	S	28.1	Very low	31.2	Very low	114 Å²	114	124.6 Å²	124.6	80%	0.797	79%	0.787	S	S	*	*				-161.7	146.4	68	-55	0	0	0	0	113.3
313	Q	29.3	Very low	31.2	Very low	185 Å²	185	124.2 Å²	124.2	86%	0.864	78%	0.783	S	S	*	*			trans	-91.2	-175.8	-174.1	-109.2	-169.5	-66.4	0	0	113.3
314	P	42.4	Very low	31.7	Very low	102 Å²	102	124.8 Å²	124.8	66%	0.662	78%	0.779	S	S	*	*			cis	-143.9	-146.9	-29.5	44.8	-22.9	0	0	0	114.2
315	P	46.9	Very low	31.5	Very low	114 Å²	114	126.8 Å²	126.8	74%	0.74	78%	0.782	S	S	*	*				-126.5	-153.3	-125.2	40.5	-12.7	0	0	0	112.9
316	P	43.3	Very low	31.8	Very low	117 Å²	117	126.8 Å²	126.8	76%	0.76	78%	0.781	S	S	*	*				-150.1	152.9	64.2	33.6	-8.2	0	0	0	117.2
317	A	29.4	Very low	31.2	Very low	92 Å²	92	127.4 Å²	127.4	76%	0.76	78%	0.784	S	S	*	*				78	146.4	104.2	0	0	0	0	0	116.4
318	I	28	Very low	31.2	Very low	160 Å²	160	135.2 Å²	135.2	82%	0.821	79%	0.791	S	S	*	*			cis	-157.2	152.1	37.6	-59.3	167.2	0	0	0	111.8
319	C	21.4	Very low	31.3	Very low	115 Å²	115	131.9 Å²	131.9	78%	0.777	79%	0.787	S	S	*	*			trans	-53.2	163.1	174.9	-48.4	0	0	0	0	116.7
320	S	27.1	Very low	31.7	Very low	117 Å²	117	127 Å²	127	82%	0.818	79%	0.785	S	S	*	*				-177.6	149.7	68.8	-57.2	0	0	0	0	113.2
321	A	26	Very low	31.8	Very low	93 Å²	93	130.5 Å²	130.5	77%	0.769	79%	0.789	S	S	*	*			trans	-86.7	-175.3	161.7	0	0	0	0	0	110.2
322	P	37	Very low	32.2	Very low	125 Å²	125	130.5 Å²	130.5	81%	0.812	79%	0.787	S	S	*	*			cis	-143.6	-176.6	14.8	38.4	-14.3	0	0	0	117.7
323	A	27.2	Very low	32.1	Very low	89 Å²	89	129.7 Å²	129.7	74%	0.736	78%	0.781	S	S	*	*			trans	-60.8	-176.2	171.9	0	0	0	0	0	113.8
324	P	41	Very low	31.9	Very low	110 Å²	110	129.8 Å²	129.8	71%	0.714	78%	0.782	S	S	*	*			cis	-152.3	-169.5	19.8	34	-5.8	0	0	0	118.2
325	L	28.1	Very low	31.1	Very low	167 Å²	167	131.1 Å²	131.1	87%	0.874	79%	0.788	S	S	*	*			trans	101.3	128.6	150	-60.5	169.4	0	0	0	122.2
326	I	32.7	Very low	30.5	Very low	153 Å²	153	131.1 Å²	131.1	79%	0.785	79%	0.788	S	S	*	*			trans	-77.5	154.1	167.3	-61.4	164.1	0	0	0	110.4
327	P	32.1	Very low	29.7	Very low	123 Å²	123	130.9 Å²	130.9	80%	0.799	79%	0.789	S	S	*	*			trans	-137.2	159.5	132.1	24.6	-4.5	0	0	0	115.7
328	R	24.6	Very low	29.5	Very low	238 Å²	238	131.9 Å²	131.9	90%	0.898	79%	0.791	S	S	*	*			trans	-69.1	155.8	-173.2	-66.8	168.4	163.4	175.9	-6.7	114.8
329	S	30.1	Very low	30.2	Very low	110 Å²	110	129.4 Å²	129.4	77%	0.769	79%	0.785	S	S	*	*			trans	-57.2	159.9	166	52.9	0	0	0	0	114.6
330	P	35.3	Very low	30.4	Very low	125 Å²	125	130.2 Å²	130.2	81%	0.812	78%	0.781	S	S	*	*				-144.1	151.5	99.3	34.2	-16.9	0	0	0	115.8
331	H	28.1	Very low	30.3	Very low	180 Å²	180	132.5 Å²	132.5	83%	0.833	78%	0.779	S	S	*	*			trans	-60.5	163.4	163.7	-94.1	-59.4	0	0	0	111.9
332	P	38.9	Very low	30.1	Very low	111 Å²	111	133.4 Å²	133.4	72%	0.721	78%	0.78	S	S	*	*				-152.7	170.6	50.3	39.1	-16	0	0	0	119.8
333	S	24.1	Very low	29.5	Very low	98 Å²	98	133 Å²	133	69%	0.685	78%	0.778	S	S	*	*			trans	66.5	141.9	145.7	56.3	0	0	0	0	123.4
334	Q	25.6	Very low	29.6	Very low	186 Å²	186	134 Å²	134	87%	0.869	78%	0.776	S	S	*	*			trans	110.5	99	156	-54.5	-161.9	49.3	0	0	117.2
335	T	25.9	Very low	29	Very low	131 Å²	131	134.8 Å²	134.8	80%	0.804	78%	0.781	S	S	*	*			trans	-65.4	159	140.4	31.8	0	0	0	0	109.2
336	P	34.8	Very low	28.8	Very low	114 Å²	114	132.7 Å²	132.7	74%	0.74	77%	0.77	S	S	*	*			cis	-146.3	-166.7	41.6	37.6	-14.4	0	0	0	115.6
337	S	25.3	Very low	28.5	Very low	111 Å²	111	134 Å²	134	78%	0.776	78%	0.778	S	S	*	*			trans	89.1	101.5	158.3	53.8	0	0	0	0	120.2
338	S	26.4	Very low	28.2	Very low	113 Å²	113	133 Å²	133	79%	0.79	77%	0.773	S	S	*	*			trans	-59.5	172.1	136.9	-34.9	0	0	0	0	110
339	P	42.4	Very low	28.8	Very low	109 Å²	109	127.5 Å²	127.5	71%	0.708	77%	0.769	S	S	*	*			cis	-142.1	-178.3	18.8	33.5	-9.3	0	0	0	114.6
340	L	25.2	Very low	28.5	Very low	131 Å²	131	133.6 Å²	133.6	69%	0.686	78%	0.775	S	S	*	*				159.3	122	124	-81.5	164.6	0	0	0	112.4
341	Q	24.4	Very low	28	Very low	166 Å²	166	130.4 Å²	130.4	78%	0.776	77%	0.765	S	S	*	*			trans	46.6	117.8	132.2	-63.2	173.4	-1.9	0	0	117.3
342	S	22.7	Very low	27.9	Very low	112 Å²	112	130.3 Å²	130.3	78%	0.783	76%	0.764	S	S	*	*				153.8	149.8	86	59.3	0	0	0	0	104.8
343	C	25	Very low	27.4	Very low	116 Å²	116	131 Å²	131	78%	0.784	77%	0.766	S	S	*	*			cis	-148.4	144.7	17.5	-65.6	0	0	0	0	107.7
344	T	28.6	Very low	27.6	Very low	111 Å²	111	132.1 Å²	132.1	68%	0.681	77%	0.771	S	S	*	*			trans	-67.5	161.7	148.4	31.6	0	0	0	0	109.9
345	P	28.9	Very low	27.6	Very low	126 Å²	126	128 Å²	128	82%	0.818	76%	0.763	S	S	*	*				-126.7	135.9	106.9	32.1	-23.6	0	0	0	112.4
346	N	23.7	Very low	27.9	Very low	123 Å²	123	126.8 Å²	126.8	66%	0.658	76%	0.757	S	S	*	*			trans	-60.4	139.8	167.8	-71.1	-68.8	0	0	0	111.5
347	L	26.7	Very low	27.5	Very low	180 Å²	180	130.5 Å²	130.5	94%	0.942	76%	0.764	S	S	*	*			trans	-133.2	105.9	144.2	-72.6	176.2	0	0	0	107.8
348	S	25.4	Very low	27.6	Very low	101 Å²	101	134.7 Å²	134.7	71%	0.706	77%	0.772	S	S	*	*			trans	-129.4	168.2	164.3	-58.6	0	0	0	0	106.9
349	P	36.3	Very low	27.5	Very low	123 Å²	123	134 Å²	134	80%	0.799	77%	0.773	S	S	*	*			cis	-131.1	145.8	-43.3	32.3	-17	0	0	0	109.5
350	R	25.3	Very low	26.8	Very low	239 Å²	239	136.5 Å²	136.5	90%	0.902	78%	0.779	S	S	*	*			trans	-103.9	98.9	167.3	-166.3	164.9	166.7	-179.4	-6.4	108.8
351	G	23.5	Very low	26.8	Very low	58 Å²	58	136 Å²	136	60%	0.598	78%	0.781	S	S	*	*			trans	-67	150.1	-178.4	0	0	0	0	0	113.2
352	H	26.3	Very low	26.9	Very low	178 Å²	178	134.7 Å²	134.7	82%	0.824	79%	0.785	S	S	*	*			trans	-145.7	111.2	142.6	-95	-68.6	0	0	0	108
353	V	28.8	Very low	27.2	Very low	124 Å²	124	139.3 Å²	139.3	75%	0.752	79%	0.785	S	S	*	*			trans	-89.5	142.6	153.7	174.8	0	0	0	0	105.9
354	P	28	Very low	27.3	Very low	122 Å²	122	139.8 Å²	139.8	79%	0.792	79%	0.787	S	S	*	*				-129.9	142.6	118.5	28.5	-14.7	0	0	0	111.8
355	S	25.5	Very low	27.3	Very low	101 Å²	101	142.2 Å²	142.2	71%	0.706	79%	0.791	S	S	*	*			trans	-91.6	-172.8	173.3	81.6	0	0	0	0	110.1
356	P	33.3	Very low	27.1	Very low	104 Å²	104	145.7 Å²	145.7	68%	0.675	79%	0.793	S	S	*	*				-97.9	149.6	-126.6	39.1	-27.3	0	0	0	113.3
357	H	25.5	Very low	27.2	Very low	193 Å²	193	145.6 Å²	145.6	89%	0.894	80%	0.799	S	S	*	*			trans	-139.2	128.5	155.2	-78.5	-56.5	0	0	0	111.9
358	Q	28.4	Very low	27.1	Very low	199 Å²	199	141.9 Å²	141.9	93%	0.93	79%	0.788	S	S	*	*			trans	-49.5	135.6	168	-68.7	163.6	-10.6	0	0	111.2
359	A	23.6	Very low	27.2	Very low	98 Å²	98	145.3 Å²	145.3	81%	0.81	80%	0.797	S	S	*	*			trans	-141.7	127	157.3	0	0	0	0	0	109.4
360	L	27.3	Very low	26.7	Very low	162 Å²	162	147.9 Å²	147.9	85%	0.848	80%	0.799	S	S	*	*			trans	-53.2	137.5	175	-94.9	80.2	0	0	0	112.7
361	V	26.5	Very low	26.8	Very low	119 Å²	119	146 Å²	146	72%	0.721	80%	0.798	S	S	*	*			trans	39.9	113.3	131.4	-170.9	0	0	0	0	117.6
362	T	25.9	Very low	27.1	Very low	140 Å²	140	151 Å²	151	86%	0.859	80%	0.803	S	S	*	*				-159	116.8	126.9	5.6	0	0	0	0	110.4
363	R	28.7	Very low	27.1	Very low	208 Å²	208	151.2 Å²	151.2	79%	0.785	80%	0.804	S	S	*	*			trans	-63.8	153.5	173.8	-96.5	175.8	166.1	174.2	-4.2	111.3
364	P	26.8	Very low	27.1	Very low	127 Å²	127	153.7 Å²	153.7	83%	0.825	81%	0.805	S	S	*	*			trans	-108.8	119.2	131.6	16.3	1.2	0	0	0	109.4
365	Q	28.4	Very low	27.1	Very low	162 Å²	162	154.3 Å²	154.3	76%	0.757	81%	0.806	S	S	*	*			trans	-70	134.9	171.9	-72.6	177.5	-45	0	0	110.1
366	K	25.5	Very low	27.1	Very low	198 Å²	198	152.7 Å²	152.7	86%	0.861	81%	0.805	S	S	*	*			trans	-123.2	138.1	158.5	-154.8	170	-177.2	-176	0	106.8	S368	K366-S368 PolarHBondContact O-N 2.9Å
367	P	25.6	Very low	26.9	Very low	122 Å²	122	155.7 Å²	155.7	79%	0.792	82%	0.815	S	S	*	*			trans	-78.1	124	-154.1	17.3	-8.5	0	0	0	111.6
368	S	24.3	Very low	27	Very low	102 Å²	102	152.3 Å²	152.3	71%	0.713	81%	0.81	S	S	*	*			trans	-75.5	118.8	162.9	179.1	0	0	0	0	107.9	K366 E370	K366-S368 PolarHBondContact O-N 2.9Å; S368-E370 VanDerWaalsContact C-N 3.34Å; S368-E370 PolarHBondContact O-N 2.97Å
369	L	27.2	Very low	27	Very low	172 Å²	172	149.4 Å²	149.4	90%	0.901	81%	0.81	S	S	*	*			trans	-71.1	92.7	166.4	-89.4	152.1	0	0	0	107.8	F371	L369-F371 PolarHBondContact O-N 3.5Å
370	E	26.1	Very low	27.2	Very low	178 Å²	178	153.5 Å²	153.5	83%	0.832	81%	0.81	S	S	*	*			trans	-71.4	108.7	166.7	-70.8	179.9	168.8	0	0	108.6	S368	S368-E370 VanDerWaalsContact C-N 3.34Å; S368-E370 PolarHBondContact O-N 2.97Å
371	F	26.9	Very low	27.3	Very low	200 Å²	200	152.4 Å²	152.4	88%	0.877	81%	0.805	S	S	*	*			trans	-87	126.1	165	-140.8	-96.1	0	0	0	109.3	L369 E373	L369-F371 PolarHBondContact O-N 3.5Å; F371-E373 PolarHBondContact O-N 3.38Å
372	K	30.7	Very low	27.4	Very low	162 Å²	162	156.4 Å²	156.4	70%	0.704	82%	0.815	S	S	*	*			trans	-80.7	113.2	-168.2	-142.3	169.1	-174.5	173.8	0	109.2	F374	K372-F374 HydrophobicContact CB-CD2 4.36Å; K372-F374 HydrophobicContact CB-CE2 4.08Å; K372-F374 HydrophobicContact CD-CE2 4.14Å; K372-F374 HydrophobicContact CD-CZ 4.34Å; K372-F374 HydrophobicContact CG-CE2 4.32Å; K372-F374 WeakPolarHBondContact O-CD2 3.3Å; K372-F374 PolarHBondContact O-N 3.23Å; K372-F374 VanDerWaalsContact O-N 3.16Å
373	E	25.8	Very low	27.6	Very low	183 Å²	183	161.1 Å²	161.1	86%	0.855	82%	0.818	S	S	*	*			trans	-56.5	111.8	168.9	-173	-178.9	-173.5	0	0	109.8	F371	F371-E373 PolarHBondContact O-N 3.38Å
374	F	28	Very low	27.6	Very low	176 Å²	176	157.1 Å²	157.1	77%	0.772	82%	0.818	S	S	*	*			trans	-102.9	112.1	171.7	-86.9	-79.1	0	0	0	110.7	K372 G376	K372-F374 HydrophobicContact CB-CD2 4.36Å; K372-F374 HydrophobicContact CB-CE2 4.08Å; K372-F374 HydrophobicContact CD-CE2 4.14Å; K372-F374 HydrophobicContact CD-CZ 4.34Å; K372-F374 HydrophobicContact CG-CE2 4.32Å; K372-F374 WeakPolarHBondContact O-CD2 3.3Å; K372-F374 PolarHBondContact O-N 3.23Å; K372-F374 VanDerWaalsContact O-N 3.16Å; F374-G376 PolarHBondContact O-N 3.26Å
375	V	28	Very low	27.6	Very low	135 Å²	135	156.6 Å²	156.6	82%	0.818	82%	0.818	S	S	*	*			trans	-59.3	116.3	172.2	173.9	0	0	0	0	111.6
376	G	26.8	Very low	27.9	Very low	66 Å²	66	154.6 Å²	154.6	68%	0.68	82%	0.819	S	S	*	*			trans	68.2	113	131.5	0	0	0	0	0	120.4	F374	F374-G376 PolarHBondContact O-N 3.26Å
377	L	29.7	Very low	28.3	Very low	168 Å²	168	156.5 Å²	156.5	88%	0.88	82%	0.821	S	S	*	*			trans	-140.6	134.4	146.3	-90.3	164.6	0	0	0	110.5
378	P	27.2	Very low	28.4	Very low	121 Å²	121	157.8 Å²	157.8	79%	0.786	83%	0.826	S	S	*	*			trans	-88.5	122.9	-173.3	32.4	-30.4	0	0	0	112.2	K380	P378-K380 PolarHBondContact O-N 3.31Å
379	C	28.5	Very low	28.7	Very low	138 Å²	138	156.1 Å²	156.1	93%	0.932	83%	0.826	S	S	*	*			trans	-74	112.1	170.6	-73.5	0	0	0	0	110.8
380	K	28.3	Very low	29.1	Very low	185 Å²	185	152.8 Å²	152.8	80%	0.804	82%	0.823	S	S	*	*			trans	-79.7	130.2	177	-126.8	174.8	178	172.5	0	110.4	P378	P378-K380 PolarHBondContact O-N 3.31Å
381	N	29.3	Very low	29.2	Very low	139 Å²	139	151.6 Å²	151.6	74%	0.743	83%	0.828	S	S	*	*			trans	52.3	102.8	147.6	-57.7	-21.4	0	0	0	119.2
382	Q	28	Very low	29.5	Very low	203 Å²	203	152 Å²	152	95%	0.949	83%	0.829	S	S	*	*			trans	-135	129	134.4	-70.6	-165.5	34.3	0	0	110.8
383	R	29.2	Very low	29.8	Very low	239 Å²	239	148 Å²	148	90%	0.902	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-87	144	-172.5	-162.7	-178.8	-164.1	-174.1	5	109.6
384	P	29.5	Very low	30	Very low	123 Å²	123	144 Å²	144	80%	0.799	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-78.3	140.4	-177.5	-4.1	21.2	0	0	0	112.1
385	S	26.8	Very low	30.6	Very low	117 Å²	117	145.3 Å²	145.3	82%	0.818	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-81.1	147.4	169.7	-65	0	0	0	0	111.5
386	P	34.4	Very low	30.9	Very low	120 Å²	120	145.1 Å²	145.1	78%	0.779	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-92.4	136.2	-164.4	34.6	-32.5	0	0	0	114.6
387	R	33	Very low	31.4	Very low	238 Å²	238	147.2 Å²	147.2	90%	0.898	83%	0.832	S	S	*	*			trans	46.1	123	133.6	-127.5	178.6	-168.9	-178.3	3.1	119.4
388	T	28.1	Very low	31.8	Very low	148 Å²	148	145.4 Å²	145.4	91%	0.908	83%	0.832	S	S	*	*			trans	-139.2	136.7	138.2	-45.1	0	0	0	0	109.7
389	G	30.9	Very low	32.5	Very low	68 Å²	68	148.9 Å²	148.9	70%	0.701	83%	0.83	S	S	*	*			trans	-81.6	175.8	-162.2	0	0	0	0	0	116.5
390	A	36	Very low	33.6	Very low	101 Å²	101	148.3 Å²	148.3	84%	0.835	82%	0.822	S	S	*	*			trans	-61.1	147.2	-169.6	0	0	0	0	0	116.3
391	T	28.9	Very low	34.1	Very low	153 Å²	153	148.8 Å²	148.8	94%	0.939	82%	0.819	S	S	*	*			trans	-143.8	145.9	146.4	10	0	0	0	0	111.4
392	K	33.2	Very low	35.2	Very low	209 Å²	209	148.3 Å²	148.3	91%	0.909	81%	0.812	S	S	*	*			trans	-87.7	132	-163.2	-174.4	-178.8	-177.6	-176.5	0	110.6
393	G	36.2	Very low	36.7	Very low	79 Å²	79	142.5 Å²	142.5	81%	0.814	79%	0.792	S	S	*	*			trans	37.1	106.9	151.9	0	0	0	0	0	120.2
394	A	30.4	Very low	38.6	Very low	98 Å²	98	135 Å²	135	81%	0.81	77%	0.774	S	S	*	*			trans	-153.4	130.8	141.5	0	0	0	0	0	107.9	E396	A394-E396 PolarHBondContact O-N 3.48Å
395	Q	40.1	Very low	40.5	Very low	203 Å²	203	136.1 Å²	136.1	95%	0.949	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-58.9	118.9	170.6	-81.5	176	-15.6	0	0	108.8
396	E	33.8	Very low	42.9	Very low	132 Å²	132	138.4 Å²	138.4	62%	0.617	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-94.7	127.7	174.7	-157.3	165.9	162.1	0	0	108.7	A394 R399	A394-E396 PolarHBondContact O-N 3.48Å; E396-R399 IonicContact OE1-CZ 3.19Å; E396-R399 IonicContact OE1-NE 3.38Å; E396-R399 PolarHBondContact OE1-NE 2.85Å; E396-R399 IonicContact OE1-NH2 2.7Å; E396-R399 PolarHBondContact OE1-NH2 3.21Å; E396-R399 IonicContact OE2-NH2 3.55Å
397	P	38.5	Very low	44.7	Very low	109 Å²	109	136.3 Å²	136.3	71%	0.708	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-65.4	149.8	178.2	26.9	-31.9	0	0	0	110.1	R399	P397-R399 PolarHBondContact O-N 2.97Å
398	C	37.3	Very low	46.5	Very low	130 Å²	130	137.7 Å²	137.7	88%	0.878	74%	0.742	S	S	*	*			trans	-38.4	109.9	179.6	-75.5	0	0	0	0	111.1	V400	C398-V400 PolarHBondContact O-N 3.03Å
399	R	41.9	Very low	48.9	Very low	195 Å²	195	136.8 Å²	136.8	74%	0.736	73%	0.732	S	S	*	*			trans	-65.1	110.4	172.5	-72.4	-165.2	176.5	-178.4	3.2	107.2	E396 P397 W401	E396-R399 IonicContact OE1-CZ 3.19Å; E396-R399 IonicContact OE1-NE 3.38Å; E396-R399 PolarHBondContact OE1-NE 2.85Å; E396-R399 IonicContact OE1-NH2 2.7Å; E396-R399 PolarHBondContact OE1-NH2 3.21Å; E396-R399 IonicContact OE2-NH2 3.55Å; P397-R399 PolarHBondContact O-N 2.97Å; R399-W401 PolarHBondContact O-N 3.42Å
400	V	51.5	Low	51	Low	126 Å²	126	135.5 Å²	135.5	76%	0.764	72%	0.718	S	S	*	*			trans	-47.2	116.9	162	169.1	0	0	0	0	106.3	C398 E402	C398-V400 PolarHBondContact O-N 3.03Å; V400-E402 PolarHBondContact O-N 3.39Å
401	W	38.7	Very low	52.7	Low	194 Å²	194	133 Å²	133	74%	0.735	70%	0.695	S	S	*	*			trans	-63.9	103.7	176.6	-173.3	94.8	0	0	0	107.2	R399 P403	R399-W401 PolarHBondContact O-N 3.42Å; W401-P403 HydrophobicContact CE3-CB 4.28Å; W401-P403 HydrophobicContact CE3-CG 4.08Å; W401-P403 HydrophobicContact CH2-CB 3.89Å; W401-P403 HydrophobicContact CH2-CG 4.47Å; W401-P403 HydrophobicContact CZ3-CB 3.5Å; W401-P403 VanDerWaalsContact CZ3-CB 3.5Å; W401-P403 HydrophobicContact CZ3-CG 3.59Å
402	E	52.3	Low	55	Low	130 Å²	130	128 Å²	128	61%	0.607	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-78.5	127.2	165.8	-83.6	-153.8	-173.2	0	0	108	V400 K405	V400-E402 PolarHBondContact O-N 3.39Å; E402-K405 WeakPolarHBondContact OE2-CE 3.43Å; E402-K405 IonicContact OE2-NZ 2.74Å; E402-K405 PolarHBondContact OE2-NZ 2.96Å
403	P	60.9	Low	56.7	Low	80 Å²	80	121.8 Å²	121.8	52%	0.519	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-55.1	136.1	174.1	-15.5	22.7	0	0	0	110.5	W401 K405	W401-P403 HydrophobicContact CE3-CB 4.28Å; W401-P403 HydrophobicContact CE3-CG 4.08Å; W401-P403 HydrophobicContact CH2-CB 3.89Å; W401-P403 HydrophobicContact CH2-CG 4.47Å; W401-P403 HydrophobicContact CZ3-CB 3.5Å; W401-P403 VanDerWaalsContact CZ3-CB 3.5Å; W401-P403 HydrophobicContact CZ3-CG 3.59Å; P403-K405 PolarHBondContact O-N 2.92Å
404	P	68.2	Low	58.2	Low	81 Å²	81	126.3 Å²	126.3	53%	0.526	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-57.1	129.9	174.4	21.2	-28.7	0	0	0	108.7	F413	P404-F413 WeakPolarHBondContact O-CE2 3.31Å
405	K	69.8	Low	59.9	Low	148 Å²	148	128.8 Å²	128.8	64%	0.643	63%	0.631	S	S	*	*	S	Bend	trans	-93.3	-5.5	-179	-63.6	173.8	-171.7	159.1	0	112.6	E402 P403 F413	E402-K405 WeakPolarHBondContact OE2-CE 3.43Å; E402-K405 IonicContact OE2-NZ 2.74Å; E402-K405 PolarHBondContact OE2-NZ 2.96Å; P403-K405 PolarHBondContact O-N 2.92Å; K405-F413 VanDerWaalsContact C-CD2 3.46Å; K405-F413 VanDerWaalsContact C-CE2 3.41Å; K405-F413 WeakPolarHBondContact O-CD2 3.27Å
406	R	76.2	Confident	60.7	Low	164 Å²	164	128.1 Å²	128.1	62%	0.619	63%	0.628	S	S	*	*	B	Isolated β-bridge	trans	-146.6	156.6	-177.8	-63.6	-173.2	178.9	-151.2	1.3	111.4	S411 F413	R406-S411 WeakPolarHBondContact CA-O 3.14Å; R406-S411 VanDerWaalsContact CB-O 3.3Å; R406-S411 WeakPolarHBondContact CB-O 3.1Å; R406-F413 VanDerWaalsContact C-CE2 3.42Å
407	H	74.1	Confident	61.9	Low	77 Å²	77	130.9 Å²	130.9	36%	0.356	63%	0.634	S	S	.	*			trans	-67.2	166.1	171	-65.8	-87.5	0	0	0	111.2	D409 G410 S411 F413	H407-D409 WeakPolarHBondContact CB-OD1 3.49Å; H407-D409 PolarHBondContact O-N 3.4Å; H407-D409 VanDerWaalsContact O-N 3.16Å; H407-G410 PolarHBondContact O-N 3.08Å; H407-S411 WeakPolarHBondContact CB-OG 3.36Å; H407-S411 PolarHBondContact CD2-OG 2.96Å; H407-S411 PolarHBondContact N-O 3.05Å; H407-F413 AromaticContact CD2-CD1 3.68Å; H407-F413 AromaticContact CD2-CE1 3.88Å; H407-F413 AromaticContact CE1-CD1 3.35Å; H407-F413 WeakPolarHBondContact CE1-CD1 3.48Å; H407-F413 AromaticContact CE1-CE1 3.38Å; H407-F413 WeakPolarHBondContact CE1-CE1 3.49Å; H407-F413 AromaticContact CG-CE1 3.81Å; H407-F413 AromaticContact ND1-CD1 3.91Å; H407-F413 AromaticContact ND1-CE1 3.5Å; H407-F413 AromaticContact NE2-CD1 3.15Å; H407-F413 WeakPolarHBondContact NE2-CD1 3.43Å; H407-F413 AromaticContact NE2-CE1 3.6Å; H407-F413 AromaticContact NE2-CG 3.96Å
408	R	70.4	Confident	63.5	Low	267 Å²	267	133.5 Å²	133.5	100%	1.008	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-19.3	-179.8	-76.8	-167.7	176.6	-168.9	1.5	114.1
409	D	77.4	Confident	65.2	Low	129 Å²	129	131.7 Å²	131.7	69%	0.69	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-1.1	176.4	63.6	0.6	0	0	0	113.5	H407 S411	H407-D409 WeakPolarHBondContact CB-OD1 3.49Å; H407-D409 PolarHBondContact O-N 3.4Å; H407-D409 VanDerWaalsContact O-N 3.16Å; D409-S411 WeakPolarHBondContact OD1-CB 3.39Å; D409-S411 PolarHBondContact OD1-N 2.9Å; D409-S411 PolarHBondContact OD1-OG 3.46Å; D409-S411 PolarHBondContact OD2-OG 2.87Å
410	G	74.8	Confident	66.6	Low	41 Å²	41	126 Å²	126	42%	0.423	61%	0.612	S	S	.	*	S	Bend	trans	87.6	-1.1	-179.2	0	0	0	0	0	115.1	H407	H407-G410 PolarHBondContact O-N 3.08Å
411	S	73.1	Confident	67.9	Low	48 Å²	48	123.5 Å²	123.5	34%	0.336	60%	0.599	S	S	.	*			trans	-70	147.6	174.8	65.7	0	0	0	0	111.7	R406 H407 D409	R406-S411 WeakPolarHBondContact CA-O 3.14Å; R406-S411 VanDerWaalsContact CB-O 3.3Å; R406-S411 WeakPolarHBondContact CB-O 3.1Å; H407-S411 WeakPolarHBondContact CB-OG 3.36Å; H407-S411 PolarHBondContact CD2-OG 2.96Å; H407-S411 PolarHBondContact N-O 3.05Å; D409-S411 WeakPolarHBondContact OD1-CB 3.39Å; D409-S411 PolarHBondContact OD1-N 2.9Å; D409-S411 PolarHBondContact OD1-OG 3.46Å; D409-S411 PolarHBondContact OD2-OG 2.87Å
412	A	76.9	Confident	69.7	Low	48 Å²	48	120.2 Å²	120.2	40%	0.397	60%	0.601	S	S	.	*	B	Isolated β-bridge	trans	-73.6	147.4	174.3	0	0	0	0	0	109.7	Q414	A412-Q414 HydrophobicContact CB-CG 4.23Å; A412-Q414 PolarHBondContact O-N 3.1Å
413	F	68.3	Low	70.8	Confident	79 Å²	79	117.3 Å²	117.3	35%	0.346	59%	0.594	S	S	.	*			trans	-67.6	82.7	167.6	-65.4	-72.8	0	0	0	109.1	P404 K405 R406 H407 Y415	P404-F413 WeakPolarHBondContact O-CE2 3.31Å; K405-F413 VanDerWaalsContact C-CD2 3.46Å; K405-F413 VanDerWaalsContact C-CE2 3.41Å; K405-F413 WeakPolarHBondContact O-CD2 3.27Å; R406-F413 VanDerWaalsContact C-CE2 3.42Å; H407-F413 AromaticContact CD2-CD1 3.68Å; H407-F413 AromaticContact CD2-CE1 3.88Å; H407-F413 AromaticContact CE1-CD1 3.35Å; H407-F413 WeakPolarHBondContact CE1-CD1 3.48Å; H407-F413 AromaticContact CE1-CE1 3.38Å; H407-F413 WeakPolarHBondContact CE1-CE1 3.49Å; H407-F413 AromaticContact CG-CE1 3.81Å; H407-F413 AromaticContact ND1-CD1 3.91Å; H407-F413 AromaticContact ND1-CE1 3.5Å; H407-F413 AromaticContact NE2-CD1 3.15Å; H407-F413 WeakPolarHBondContact NE2-CD1 3.43Å; H407-F413 AromaticContact NE2-CE1 3.6Å; H407-F413 AromaticContact NE2-CG 3.96Å; F413-Y415 HydrophobicContact CB-CE2 3.98Å; F413-Y415 HydrophobicContact CD1-CE2 4.41Å
414	Q	67.8	Low	71.4	Confident	173 Å²	173	117.8 Å²	117.8	81%	0.808	59%	0.592	S	S	*	*			trans	-99.6	101	170.5	-74.3	-178.4	-4.7	0	0	107.1	A412	A412-Q414 HydrophobicContact CB-CG 4.23Å; A412-Q414 PolarHBondContact O-N 3.1Å
415	Y	65.3	Low	71.7	Confident	151 Å²	151	115.2 Å²	115.2	59%	0.592	58%	0.576	S	S	*	*			trans	-87.9	106.2	166.1	-61.2	-79.2	0	0	0	106.7	F413 Y417	F413-Y415 HydrophobicContact CB-CE2 3.98Å; F413-Y415 HydrophobicContact CD1-CE2 4.41Å; Y415-Y417 WeakPolarHBondContact O-CD2 3.41Å; Y415-Y417 PolarHBondContact O-N 3.02Å
416	E	57.1	Low	71.9	Confident	189 Å²	189	110.7 Å²	110.7	88%	0.883	57%	0.566	S	S	*	*			trans	-80.1	103.4	169.3	-158.2	163.7	-154.7	0	0	106.6
417	Y	59.5	Low	71.7	Confident	190 Å²	190	111.5 Å²	111.5	75%	0.745	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-84.3	124.3	174.9	-67.6	-81.1	0	0	0	108.2	Y415	Y415-Y417 WeakPolarHBondContact O-CD2 3.41Å; Y415-Y417 PolarHBondContact O-N 3.02Å
418	E	71.9	Confident	71.6	Confident	164 Å²	164	111.1 Å²	111.1	77%	0.766	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-56.7	140.6	166.1	-73	-64.5	153.1	0	0	109.6
419	P	72.8	Confident	71.5	Confident	91 Å²	91	103.5 Å²	103.5	59%	0.591	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-51.7	137.2	175.2	-24.4	32.7	0	0	0	110.5	C421	P419-C421 PolarHBondContact O-N 3.32Å
420	P	72.6	Confident	71.1	Confident	77 Å²	77	101.6 Å²	101.6	50%	0.5	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-57.8	133.9	-179.5	23.2	-32.4	0	0	0	110	L424	P420-L424 HydrophobicContact CB-CD2 3.78Å
421	C	77.6	Confident	70.6	Confident	72 Å²	72	103.8 Å²	103.8	49%	0.486	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-63.4	149.7	-178.5	62.9	0	0	0	0	111	P419 S423 L424 C425	P419-C421 PolarHBondContact O-N 3.32Å; C421-S423 PolarHBondContact O-N 2.85Å; C421-S423 VanDerWaalsContact O-N 3.1Å; C421-S423 PolarHBondContact SG-OG 2.7Å; C421-L424 WeakPolarHBondContact O-CB 3.34Å; C421-L424 PolarHBondContact O-N 3.14Å; C421-L424 VanDerWaalsContact SG-CB 3.57Å; C421-C425 PolarHBondContact O-N 2.94Å
422	T	76	Confident	70.3	Confident	126 Å²	126	107.1 Å²	107.1	77%	0.773	57%	0.57	S	S	*	*	H	α-helix	trans	-56	-32	-177	51.2	0	0	0	0	113	A426	T422-A426 WeakPolarHBondContact O-CB 3.32Å; T422-A426 PolarHBondContact O-N 3.43Å
423	S	76	Confident	69.8	Low	68 Å²	68	110 Å²	110	48%	0.476	58%	0.578	S	S	.	*	H	α-helix	trans	-70.5	-36.3	176.6	63.1	0	0	0	0	113.2	C421 R427	C421-S423 PolarHBondContact O-N 2.85Å; C421-S423 VanDerWaalsContact O-N 3.1Å; C421-S423 PolarHBondContact SG-OG 2.7Å; S423-R427 WeakPolarHBondContact O-CB 3.38Å; S423-R427 PolarHBondContact O-N 3.1Å
424	L	72.9	Confident	70	Confident	90 Å²	90	109.3 Å²	109.3	47%	0.471	58%	0.581	S	S	.	*	H	α-helix	trans	-68.5	-46.2	174	-171.4	101.3	0	0	0	110	P420 C421 A426 R427 V428	P420-L424 HydrophobicContact CB-CD2 3.78Å; C421-L424 WeakPolarHBondContact O-CB 3.34Å; C421-L424 PolarHBondContact O-N 3.14Å; C421-L424 VanDerWaalsContact SG-CB 3.57Å; L424-A426 VanDerWaalsContact C-N 3.34Å; L424-A426 PolarHBondContact O-N 3.05Å; L424-R427 PolarHBondContact O-N 3.31Å; L424-V428 VanDerWaalsContact O-CG2 3.31Å; L424-V428 WeakPolarHBondContact O-CG2 3.35Å; L424-V428 PolarHBondContact O-N 2.65Å
425	C	75.6	Confident	70.1	Confident	28 Å²	28	104.7 Å²	104.7	19%	0.189	57%	0.566	C	S	.	*	H	α-helix	trans	-57.8	-46.2	176.1	-66.4	0	0	0	0	111.7	C421 R427 V428 Q429	C421-C425 PolarHBondContact O-N 2.94Å; C425-R427 PolarHBondContact O-N 3.23Å; C425-V428 PolarHBondContact O-N 2.74Å; C425-Q429 WeakPolarHBondContact O-CB 3.31Å; C425-Q429 VanDerWaalsContact O-CG 3.31Å; C425-Q429 WeakPolarHBondContact O-CG 3.45Å; C425-Q429 PolarHBondContact O-N 3.3Å
426	A	73	Confident	70.5	Confident	53 Å²	53	104.1 Å²	104.1	44%	0.438	57%	0.569	S	S	.	*	H	α-helix	trans	-63.3	-40.7	177.1	0	0	0	0	0	112.4	T422 L424 Q429 A430	T422-A426 WeakPolarHBondContact O-CB 3.32Å; T422-A426 PolarHBondContact O-N 3.43Å; L424-A426 VanDerWaalsContact C-N 3.34Å; L424-A426 PolarHBondContact O-N 3.05Å; A426-Q429 PolarHBondContact O-N 3.39Å; A426-A430 VanDerWaalsContact O-CB 3.27Å; A426-A430 WeakPolarHBondContact O-CB 3.48Å; A426-A430 PolarHBondContact O-N 2.66Å
427	R	72.6	Confident	71.3	Confident	181 Å²	181	99.1 Å²	99.1	68%	0.683	55%	0.548	S	S	*	.	H	α-helix	trans	-67.4	-39.4	178.6	-165	-176.8	-56.4	-179.9	2.4	112.2	S423 L424 C425 A430 A431	S423-R427 WeakPolarHBondContact O-CB 3.38Å; S423-R427 PolarHBondContact O-N 3.1Å; L424-R427 PolarHBondContact O-N 3.31Å; C425-R427 PolarHBondContact O-N 3.23Å; R427-A430 PolarHBondContact O-N 3.2Å; R427-A431 WeakPolarHBondContact O-CB 3.15Å; R427-A431 PolarHBondContact O-N 3.16Å
428	V	72.6	Confident	72	Confident	69 Å²	69	92 Å²	92	42%	0.418	52%	0.522	S	S	.	.	H	α-helix	trans	-67.2	-40	175.8	172.5	0	0	0	0	110.9	L424 C425 R432	L424-V428 VanDerWaalsContact O-CG2 3.31Å; L424-V428 WeakPolarHBondContact O-CG2 3.35Å; L424-V428 PolarHBondContact O-N 2.65Å; C425-V428 PolarHBondContact O-N 2.74Å; V428-R432 WeakPolarHBondContact O-CG 3.2Å
429	Q	67.4	Low	72.1	Confident	107 Å²	107	87 Å²	87	50%	0.5	51%	0.508	S	S	.	.	H	α-helix	trans	-67.3	-38.5	174.7	-73.2	176.1	-6.4	0	0	112.1	C425 A426 R432	C425-Q429 WeakPolarHBondContact O-CB 3.31Å; C425-Q429 VanDerWaalsContact O-CG 3.31Å; C425-Q429 WeakPolarHBondContact O-CG 3.45Å; C425-Q429 PolarHBondContact O-N 3.3Å; A426-Q429 PolarHBondContact O-N 3.39Å; Q429-R432 PolarHBondContact O-N 2.79Å
430	A	68.8	Low	72.3	Confident	88 Å²	88	90.1 Å²	90.1	73%	0.727	51%	0.508	S	S	*	.	H	α-helix	trans	-70.2	-29.1	177.9	0	0	0	0	0	113.5	A426 R427 R432	A426-A430 VanDerWaalsContact O-CB 3.27Å; A426-A430 WeakPolarHBondContact O-CB 3.48Å; A426-A430 PolarHBondContact O-N 2.66Å; R427-A430 PolarHBondContact O-N 3.2Å; A430-R432 VanDerWaalsContact C-N 3.29Å; A430-R432 PolarHBondContact O-N 2.94Å
431	A	65.6	Low	72.3	Confident	88 Å²	88	87.9 Å²	87.9	73%	0.727	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-4.9	177.7	0	0	0	0	0	113.7	R427	R427-A431 WeakPolarHBondContact O-CB 3.15Å; R427-A431 PolarHBondContact O-N 3.16Å
432	R	65.1	Low	72.1	Confident	117 Å²	117	89 Å²	89	44%	0.442	50%	0.498	S	S	.	.	S	Bend	trans	-109.6	140.8	-177.7	-70.8	-174.2	-177.9	-142.5	4.4	111.5	V428 Q429 A430	V428-R432 WeakPolarHBondContact O-CG 3.2Å; Q429-R432 PolarHBondContact O-N 2.79Å; A430-R432 VanDerWaalsContact C-N 3.29Å; A430-R432 PolarHBondContact O-N 2.94Å
433	L	67.9	Low	71.9	Confident	110 Å²	110	88.6 Å²	88.6	58%	0.576	49%	0.487	S	S	*	.			trans	-70.4	130.5	179.4	-71.9	164.9	0	0	0	110.1	M438	L433-M438 HydrophobicContact CB-CE 4.17Å; L433-M438 HydrophobicContact CD1-CE 3.94Å
434	P	72.8	Confident	71.6	Confident	63 Å²	63	92.3 Å²	92.3	41%	0.409	49%	0.494	S	S	.	.			trans	-57.3	142.2	173.7	-24.3	32.8	0	0	0	111.3	Q436 L437 M438	P434-Q436 PolarHBondContact O-N 3.02Å; P434-Q436 VanDerWaalsContact O-N 3.08Å; P434-L437 HydrophobicContact CB-CB 4.29Å; P434-L437 HydrophobicContact CG-CB 4.47Å; P434-L437 HydrophobicContact CG-CD1 4.31Å; P434-L437 WeakPolarHBondContact O-CA 3.42Å; P434-L437 WeakPolarHBondContact O-CB 3.5Å; P434-L437 PolarHBondContact O-N 2.87Å; P434-M438 PolarHBondContact O-N 2.94Å
435	P	68.6	Low	71.3	Confident	76 Å²	76	94.9 Å²	94.9	49%	0.494	51%	0.508	S	S	.	.	H	α-helix	trans	-53.8	-32.4	178.6	-27	34	0	0	0	113.6	M438 A439	P435-M438 PolarHBondContact O-N 3.39Å; P435-A439 WeakPolarHBondContact O-CB 3.33Å; P435-A439 PolarHBondContact O-N 3.41Å
436	Q	74.8	Confident	70.8	Confident	139 Å²	139	100.4 Å²	100.4	65%	0.65	53%	0.533	S	S	*	.	H	α-helix	trans	-69	-36.4	177.1	-59.1	81.8	-2.4	0	0	112.1	P434 A439 W440	P434-Q436 PolarHBondContact O-N 3.02Å; P434-Q436 VanDerWaalsContact O-N 3.08Å; Q436-A439 PolarHBondContact O-N 2.67Å; Q436-W440 WeakPolarHBondContact O-CB 3.15Å; Q436-W440 PolarHBondContact O-N 3.5Å
437	L	73.3	Confident	70.1	Confident	85 Å²	85	102.7 Å²	102.7	45%	0.445	54%	0.537	S	S	.	.	H	α-helix	trans	-72.3	-36.7	177.4	-129.1	164.3	0	0	0	110.5	P434 W440 A441	P434-L437 HydrophobicContact CB-CB 4.29Å; P434-L437 HydrophobicContact CG-CB 4.47Å; P434-L437 HydrophobicContact CG-CD1 4.31Å; P434-L437 WeakPolarHBondContact O-CA 3.42Å; P434-L437 WeakPolarHBondContact O-CB 3.5Å; P434-L437 PolarHBondContact O-N 2.87Å; L437-W440 HydrophobicContact CD2-CE3 4.21Å; L437-A441 WeakPolarHBondContact O-CB 3.3Å; L437-A441 PolarHBondContact O-N 3.05Å
438	M	73.8	Confident	69.1	Low	41 Å²	41	99.3 Å²	99.3	20%	0.202	54%	0.539	C	S	.	.	H	α-helix	trans	-66	-44.3	171.3	-166.1	68.9	70.2	0	0	111.6	L227 L433 P434 P435 W440 A441 L442	L227-M438 HydrophobicContact CB-CE 4.35Å; L227-M438 HydrophobicContact CD1-CE 3.99Å; L433-M438 HydrophobicContact CB-CE 4.17Å; L433-M438 HydrophobicContact CD1-CE 3.94Å; P434-M438 PolarHBondContact O-N 2.94Å; P435-M438 PolarHBondContact O-N 3.39Å; M438-W440 VanDerWaalsContact C-N 3.35Å; M438-A441 PolarHBondContact O-N 3.26Å; M438-L442 HydrophobicContact CG-CD1 4.36Å; M438-L442 WeakPolarHBondContact O-CB 3.43Å; M438-L442 VanDerWaalsContact O-CG 3.3Å; M438-L442 WeakPolarHBondContact O-CG 3.39Å; M438-L442 PolarHBondContact O-N 2.93Å
439	A	74.2	Confident	68.1	Low	58 Å²	58	104.6 Å²	104.6	48%	0.479	56%	0.559	S	S	.	*	H	α-helix	trans	-63.7	-39.7	176.4	0	0	0	0	0	112.1	P435 Q436 L442 H443	P435-A439 WeakPolarHBondContact O-CB 3.33Å; P435-A439 PolarHBondContact O-N 3.41Å; Q436-A439 PolarHBondContact O-N 2.67Å; A439-L442 PolarHBondContact O-N 2.98Å; A439-H443 WeakPolarHBondContact O-CB 3.38Å; A439-H443 PolarHBondContact O-N 2.87Å
440	W	77.6	Confident	67.3	Low	156 Å²	156	105 Å²	105	59%	0.591	57%	0.573	S	S	*	*	H	α-helix	trans	-62.7	-46.4	172.3	173.5	83.5	0	0	0	112	Q436 L437 M438 L442 H443 F444	Q436-W440 WeakPolarHBondContact O-CB 3.15Å; Q436-W440 PolarHBondContact O-N 3.5Å; L437-W440 HydrophobicContact CD2-CE3 4.21Å; M438-W440 VanDerWaalsContact C-N 3.35Å; W440-L442 VanDerWaalsContact C-N 3.34Å; W440-L442 PolarHBondContact O-N 3.43Å; W440-H443 PolarHBondContact O-N 2.89Å; W440-H443 VanDerWaalsContact O-N 3.17Å; W440-F444 HydrophobicContact CZ2-CD2 4.28Å; W440-F444 PolarHBondContact O-N 3.22Å
441	A	72.7	Confident	66	Low	31 Å²	31	109 Å²	109	26%	0.256	58%	0.577	S	S	.	*	H	α-helix	trans	-63.4	-40.1	178.4	0	0	0	0	0	111.9	L437 M438 F444 L445	L437-A441 WeakPolarHBondContact O-CB 3.3Å; L437-A441 PolarHBondContact O-N 3.05Å; M438-A441 PolarHBondContact O-N 3.26Å; A441-F444 PolarHBondContact O-N 3.23Å; A441-L445 WeakPolarHBondContact O-CB 3.34Å; A441-L445 VanDerWaalsContact O-CG 3.26Å; A441-L445 WeakPolarHBondContact O-CG 3.33Å; A441-L445 PolarHBondContact O-N 2.92Å
442	L	72	Confident	65.1	Low	96 Å²	96	110.3 Å²	110.3	50%	0.503	58%	0.578	S	S	.	*	H	α-helix	trans	-64.3	-40.1	173.4	-73.3	171	0	0	0	111.7	M438 A439 W440 L445 M446	M438-L442 HydrophobicContact CG-CD1 4.36Å; M438-L442 WeakPolarHBondContact O-CB 3.43Å; M438-L442 VanDerWaalsContact O-CG 3.3Å; M438-L442 WeakPolarHBondContact O-CG 3.39Å; M438-L442 PolarHBondContact O-N 2.93Å; A439-L442 PolarHBondContact O-N 2.98Å; W440-L442 VanDerWaalsContact C-N 3.34Å; W440-L442 PolarHBondContact O-N 3.43Å; L442-L445 PolarHBondContact O-N 3.19Å; L442-M446 WeakPolarHBondContact O-CB 3.21Å; L442-M446 WeakPolarHBondContact O-CG 3.42Å; L442-M446 PolarHBondContact O-N 2.94Å
443	H	73.4	Confident	63.9	Low	117 Å²	117	111.2 Å²	111.2	54%	0.542	60%	0.597	S	S	.	*	H	α-helix	trans	-64.5	-42.1	176.3	-171.9	26.8	0	0	0	111.7	A439 W440 M446 D447	A439-H443 WeakPolarHBondContact O-CB 3.38Å; A439-H443 PolarHBondContact O-N 2.87Å; W440-H443 PolarHBondContact O-N 2.89Å; W440-H443 VanDerWaalsContact O-N 3.17Å; H443-M446 PolarHBondContact O-N 3.47Å; H443-D447 IonicContact CE1-OD1 3.31Å; H443-D447 IonicContact CE1-OD2 3.08Å; H443-D447 WeakPolarHBondContact O-CB 3.33Å; H443-D447 PolarHBondContact O-N 3.28Å
444	F	70	Confident	63	Low	146 Å²	146	111.6 Å²	111.6	64%	0.64	61%	0.606	S	S	*	*	H	α-helix	trans	-66.9	-37.1	177.9	-164.4	-89	0	0	0	112.9	W440 A441	W440-F444 HydrophobicContact CZ2-CD2 4.28Å; W440-F444 PolarHBondContact O-N 3.22Å; A441-F444 PolarHBondContact O-N 3.23Å
445	L	65.9	Low	61.3	Low	143 Å²	143	121 Å²	121	75%	0.749	65%	0.648	S	S	*	*	H	α-helix	trans	-77.2	-23.2	177.2	-71.5	168.9	0	0	0	113.3	A441 L442	A441-L445 WeakPolarHBondContact O-CB 3.34Å; A441-L445 VanDerWaalsContact O-CG 3.26Å; A441-L445 WeakPolarHBondContact O-CG 3.33Å; A441-L445 PolarHBondContact O-N 2.92Å; L442-L445 PolarHBondContact O-N 3.19Å
446	M	65.8	Low	60.9	Low	145 Å²	145	123.3 Å²	123.3	71%	0.714	66%	0.655	S	S	*	*	H	α-helix	trans	-101.9	-4.6	-178.3	-66.4	-65.9	-54.4	0	0	113.4	L442 H443 P448	L442-M446 WeakPolarHBondContact O-CB 3.21Å; L442-M446 WeakPolarHBondContact O-CG 3.42Å; L442-M446 PolarHBondContact O-N 2.94Å; H443-M446 PolarHBondContact O-N 3.47Å; M446-P448 WeakPolarHBondContact O-CD 3.26Å
447	D	57.7	Low	60.2	Low	100 Å²	100	122.4 Å²	122.4	54%	0.535	66%	0.656	S	S	.	*			trans	-73.1	109.8	170.4	-110.2	-7.6	0	0	0	107.8	H443 E449	H443-D447 IonicContact CE1-OD1 3.31Å; H443-D447 IonicContact CE1-OD2 3.08Å; H443-D447 WeakPolarHBondContact O-CB 3.33Å; H443-D447 PolarHBondContact O-N 3.28Å; D447-E449 PolarHBondContact O-N 3.46Å
448	P	51.8	Low	59.5	Low	110 Å²	110	124.5 Å²	124.5	71%	0.714	67%	0.667	S	S	*	*			trans	-63.9	124.7	167	28.4	-30.6	0	0	0	106.4	M446 S450	M446-P448 WeakPolarHBondContact O-CD 3.26Å; P448-S450 PolarHBondContact O-N 3.4Å
449	E	51	Low	58.6	Low	180 Å²	180	129.4 Å²	129.4	84%	0.841	70%	0.695	S	S	*	*			trans	-44.4	123.3	165.2	-75.2	-159.7	148.9	0	0	107.9	D447 E451	D447-E449 PolarHBondContact O-N 3.46Å; E449-E451 PolarHBondContact O-N 2.75Å
450	S	51	Low	57.7	Low	115 Å²	115	133.9 Å²	133.9	80%	0.804	71%	0.708	S	S	*	*			trans	-57.6	108.6	166.7	23.9	0	0	0	0	106	P448	P448-S450 PolarHBondContact O-N 3.4Å
451	E	40.9	Very low	56.3	Low	173 Å²	173	132.4 Å²	132.4	81%	0.808	72%	0.716	S	S	*	*			trans	-47	130.6	178	-81.2	-165.8	140.2	0	0	109.9	E449 T453	E449-E451 PolarHBondContact O-N 2.75Å; E451-T453 PolarHBondContact O-N 3.41Å
452	P	47.6	Very low	55.2	Low	116 Å²	116	139.6 Å²	139.6	75%	0.753	75%	0.749	S	S	*	*			trans	-66	111	168.2	26.9	-30.3	0	0	0	107.7	P454	P452-P454 WeakPolarHBondContact O-CD 3.31Å
453	T	39.1	Very low	53.9	Low	135 Å²	135	143 Å²	143	83%	0.828	77%	0.768	S	S	*	*			trans	-65	122.6	173.3	-19.6	0	0	0	0	108.1	E451 M455	E451-T453 PolarHBondContact O-N 3.41Å; T453-M455 PolarHBondContact O-N 3.03Å
454	P	49	Very low	52.3	Low	119 Å²	119	145.2 Å²	145.2	77%	0.773	79%	0.787	S	S	*	*			trans	-83.4	112.7	175	31	-28.2	0	0	0	109.2	P452	P452-P454 WeakPolarHBondContact O-CD 3.31Å
455	M	37.5	Very low	50.6	Low	260 Å²	260	145.1 Å²	145.1	100%	1.281	80%	0.8	S	S	*	*			trans	-151.1	0	152.3	-85.9	-66.7	-93.3	0	0	109.4	T453	T453-M455 PolarHBondContact O-N 3.03Å

Retrieved 455 of 455 residues in 1635.8 ms (Link to these results)

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