A0A087X2U9_POEFO Loading...

Golgi associated, gamma adaptin ear containing, ARF binding protein 1

AlphaFold DB , UniProt , Accession A0A087X2U9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 638 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.3	Very low	58.8	Low	248 Å²	248	102.6 Å²	102.6	100%	1.222	61%	0.61	S	S	*	*				0	107.9	0	-164.7	163.5	175.6	0	0	105.6
2	A	37	Very low	61.6	Low	98 Å²	98	97.7 Å²	97.7	81%	0.81	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-76	142	-179.1	0	0	0	0	0	109.2
3	A	36.3	Very low	64	Low	91 Å²	91	92.5 Å²	92.5	75%	0.752	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-62	148	171.8	0	0	0	0	0	110.1
4	P	44.2	Very low	66.2	Low	110 Å²	110	85.9 Å²	85.9	71%	0.714	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-60.9	149.1	168.8	29	-34.2	0	0	0	109.6
5	P	45.9	Very low	68.2	Low	100 Å²	100	85.7 Å²	85.7	65%	0.649	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-63.5	147.8	-178.8	27	-34.7	0	0	0	111.7	T7	P5-T7 HydrophobicContact CG-CG2 4.27Å; P5-T7 PolarHBondContact O-N 3.25Å
6	D	52.9	Low	69.7	Low	133 Å²	133	89.7 Å²	89.7	71%	0.711	51%	0.51	S	S	*	.			trans	-68.4	69.2	-177.1	-52.5	-74.7	0	0	0	113	E8 S12	D6-E8 VanDerWaalsContact C-N 3.3Å; D6-E8 PolarHBondContact O-N 3.2Å; D6-S12 VanDerWaalsContact O-CB 3.24Å; D6-S12 WeakPolarHBondContact O-CB 3.2Å; D6-S12 PolarHBondContact O-OG 2.9Å; D6-S12 VanDerWaalsContact O-OG 3.12Å
7	T	55.4	Low	71.2	Confident	96 Å²	96	84.4 Å²	84.4	59%	0.589	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-9.7	-176	48.8	0	0	0	0	114.5	P5	P5-T7 HydrophobicContact CG-CG2 4.27Å; P5-T7 PolarHBondContact O-N 3.25Å
8	E	68.6	Low	72.5	Confident	147 Å²	147	79.7 Å²	79.7	69%	0.687	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.9	19.5	-172	-59.9	-176.6	164.8	0	0	113.4	D6 Q36	D6-E8 VanDerWaalsContact C-N 3.3Å; D6-E8 PolarHBondContact O-N 3.2Å; E8-Q36 PolarHBondContact O-NE2 3.47Å
9	S	87.9	Confident	73.6	Confident	31 Å²	31	78.4 Å²	78.4	22%	0.217	45%	0.445	C	S	.	.	S	Bend	trans	-84.6	154.7	175.3	66.7	0	0	0	0	112.6	E11 S12 H13	S9-E11 PolarHBondContact O-N 2.64Å; S9-S12 WeakPolarHBondContact O-CB 3.39Å; S9-S12 PolarHBondContact O-N 3.05Å; S9-S12 WeakPolarHBondContact OG-CB 3.49Å; S9-S12 PolarHBondContact OG-N 2.94Å; S9-S12 VanDerWaalsContact OG-N 3.14Å; S9-H13 PolarHBondContact O-CD2 3.42Å; S9-H13 PolarHBondContact O-N 2.84Å
10	L	90.1	Very high	74.5	Confident	6 Å²	6	77 Å²	77	3%	0.031	44%	0.438	C	S	.	.	H	α-helix	trans	-58.2	-35.3	174.7	-79.6	169	0	0	0	111.5	I14 F33 Q36 L37 L46 L50	L10-I14 WeakPolarHBondContact O-CB 3.27Å; L10-I14 VanDerWaalsContact O-CG2 3.28Å; L10-I14 WeakPolarHBondContact O-CG2 3.32Å; L10-I14 PolarHBondContact O-N 3.24Å; L10-F33 HydrophobicContact CB-CD2 4.38Å; L10-F33 HydrophobicContact CB-CE2 4.06Å; L10-F33 HydrophobicContact CD2-CD2 3.52Å; L10-F33 HydrophobicContact CD2-CE2 3.58Å; L10-F33 HydrophobicContact CD2-CG 4.15Å; L10-F33 HydrophobicContact CD2-CZ 4.26Å; L10-F33 HydrophobicContact CG-CE2 4.41Å; L10-F33 WeakPolarHBondContact O-CD2 3.46Å; L10-Q36 HydrophobicContact CD2-CB 3.97Å; L10-Q36 HydrophobicContact CD2-CG 4.08Å; L10-Q36 HydrophobicContact CG-CB 4.45Å; L10-Q36 HydrophobicContact CG-CG 4Å; L10-L37 HydrophobicContact CD2-CB 4.1Å; L10-L46 HydrophobicContact CB-CD2 4.37Å; L10-L46 HydrophobicContact CD1-CB 4.35Å; L10-L46 HydrophobicContact CD1-CD2 4.04Å; L10-L46 HydrophobicContact CD1-CG 4.23Å; L10-L50 HydrophobicContact CB-CD1 4.02Å
11	E	93.1	Very high	75.4	Confident	69 Å²	69	80.3 Å²	80.3	32%	0.322	45%	0.454	S	S	.	.	H	α-helix	trans	-60.4	-44.4	171.7	-68.5	75.4	-171.8	0	0	112.2	S9 I14 N15 L46 L50	S9-E11 PolarHBondContact O-N 2.64Å; E11-I14 WeakPolarHBondContact O-CG2 3.45Å; E11-N15 WeakPolarHBondContact O-CB 3.45Å; E11-N15 VanDerWaalsContact O-CG 3.23Å; E11-N15 PolarHBondContact O-N 2.88Å; E11-N15 PolarHBondContact O-ND2 3.21Å; E11-L46 WeakPolarHBondContact OE1-CD1 3.46Å; E11-L50 HydrophobicContact CG-CD1 4.05Å; E11-L50 HydrophobicContact CG-CD2 4.01Å
12	S	92.6	Very high	78	Confident	43 Å²	43	70.4 Å²	70.4	30%	0.301	41%	0.406	S	S	.	.	H	α-helix	trans	-66	-49.3	179.7	-161.8	0	0	0	0	110.7	D6 S9 N15 R16	D6-S12 VanDerWaalsContact O-CB 3.24Å; D6-S12 WeakPolarHBondContact O-CB 3.2Å; D6-S12 PolarHBondContact O-OG 2.9Å; D6-S12 VanDerWaalsContact O-OG 3.12Å; S9-S12 WeakPolarHBondContact O-CB 3.39Å; S9-S12 PolarHBondContact O-N 3.05Å; S9-S12 WeakPolarHBondContact OG-CB 3.49Å; S9-S12 PolarHBondContact OG-N 2.94Å; S9-S12 VanDerWaalsContact OG-N 3.14Å; S12-N15 PolarHBondContact O-N 2.85Å; S12-R16 WeakPolarHBondContact O-CB 3.44Å; S12-R16 PolarHBondContact O-N 3.13Å
13	H	93.1	Very high	80.3	Confident	30 Å²	30	76.5 Å²	76.5	14%	0.139	41%	0.408	C	S	.	.	H	α-helix	trans	-62.9	-45.6	178.8	-66.9	-61.7	0	0	0	112.8	S9 R16 A17 F33	S9-H13 PolarHBondContact O-CD2 3.42Å; S9-H13 PolarHBondContact O-N 2.84Å; H13-R16 PolarHBondContact O-N 3.25Å; H13-A17 WeakPolarHBondContact O-CB 3.5Å; H13-A17 PolarHBondContact O-N 2.82Å; H13-F33 HydrophobicContact CB-CB 3.96Å; H13-F33 HydrophobicContact CB-CD2 4.22Å
14	I	95.2	Very high	82.7	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.005	40%	0.404	C	S	.	.	H	α-helix	trans	-68.2	-38.6	178.7	-160	177.8	0	0	0	112	L10 E11 R16 A17 T18 F33 L50 L51 K54	L10-I14 WeakPolarHBondContact O-CB 3.27Å; L10-I14 VanDerWaalsContact O-CG2 3.28Å; L10-I14 WeakPolarHBondContact O-CG2 3.32Å; L10-I14 PolarHBondContact O-N 3.24Å; E11-I14 WeakPolarHBondContact O-CG2 3.45Å; I14-R16 VanDerWaalsContact C-N 3.3Å; I14-R16 PolarHBondContact O-N 3.1Å; I14-A17 PolarHBondContact O-N 3.19Å; I14-T18 HydrophobicContact CG1-CG2 4Å; I14-T18 WeakPolarHBondContact O-CB 3.43Å; I14-T18 WeakPolarHBondContact O-CG2 3.49Å; I14-T18 PolarHBondContact O-N 3.22Å; I14-T18 PolarHBondContact O-OG1 2.87Å; I14-F33 HydrophobicContact CB-CD2 3.85Å; I14-F33 HydrophobicContact CB-CE2 3.67Å; I14-F33 HydrophobicContact CB-CZ 4.42Å; I14-F33 HydrophobicContact CD1-CE2 4.17Å; I14-F33 HydrophobicContact CD1-CZ 4.11Å; I14-F33 HydrophobicContact CG1-CE2 4.2Å; I14-F33 HydrophobicContact CG1-CZ 4.49Å; I14-F33 HydrophobicContact CG2-CE2 4.42Å; I14-L50 HydrophobicContact CD1-CB 3.78Å; I14-L50 HydrophobicContact CG2-CB 4.22Å; I14-L50 HydrophobicContact CG2-CD1 4.25Å; I14-L51 HydrophobicContact CD1-CD2 3.82Å; I14-L51 HydrophobicContact CD1-CG 3.98Å; I14-K54 HydrophobicContact CD1-CG 4.01Å; I14-K54 HydrophobicContact CG1-CG 4.36Å
15	N	95.1	Very high	84.9	Confident	82 Å²	82	74.8 Å²	74.8	44%	0.439	38%	0.382	S	S	.	.	H	α-helix	trans	-64.4	-37.7	177.3	-80.8	-43.4	0	0	0	111.6	E11 S12 N19 K54	E11-N15 WeakPolarHBondContact O-CB 3.45Å; E11-N15 VanDerWaalsContact O-CG 3.23Å; E11-N15 PolarHBondContact O-N 2.88Å; E11-N15 PolarHBondContact O-ND2 3.21Å; S12-N15 PolarHBondContact O-N 2.85Å; N15-N19 WeakPolarHBondContact O-CB 3.24Å; N15-N19 PolarHBondContact O-N 2.88Å; N15-K54 WeakPolarHBondContact OD1-CE 3.4Å; N15-K54 PolarHBondContact OD1-NZ 2.96Å
16	R	93.3	Very high	87	Confident	150 Å²	150	71.4 Å²	71.4	57%	0.566	36%	0.358	S	S	*	.	H	α-helix	trans	-70.8	-45	175.2	-173.5	176.1	159.3	173.9	-5.3	112.4	S12 H13 I14 T18 N22 D26 S29	S12-R16 WeakPolarHBondContact O-CB 3.44Å; S12-R16 PolarHBondContact O-N 3.13Å; H13-R16 PolarHBondContact O-N 3.25Å; I14-R16 VanDerWaalsContact C-N 3.3Å; I14-R16 PolarHBondContact O-N 3.1Å; R16-T18 VanDerWaalsContact C-N 3.34Å; R16-T18 PolarHBondContact O-N 3.37Å; R16-N22 PolarHBondContact O-ND2 3.34Å; R16-D26 IonicContact CZ-OD2 2.79Å; R16-D26 IonicContact NE-OD2 3.17Å; R16-D26 PolarHBondContact NE-OD2 3.37Å; R16-D26 IonicContact NH2-OD2 3.57Å; R16-D26 PolarHBondContact NH2-OD2 2.71Å; R16-S29 WeakPolarHBondContact CD-OG 3.3Å; R16-S29 VanDerWaalsContact CG-OG 3.29Å; R16-S29 WeakPolarHBondContact CG-OG 3.42Å; R16-S29 PolarHBondContact NE-OG 3.25Å; R16-S29 VanDerWaalsContact NE-OG 3.08Å
17	A	94.4	Very high	88.9	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-38.9	177.8	0	0	0	0	0	112.8	H13 I14 N22 I30 V69	H13-A17 WeakPolarHBondContact O-CB 3.5Å; H13-A17 PolarHBondContact O-N 2.82Å; I14-A17 PolarHBondContact O-N 3.19Å; A17-N22 PolarHBondContact O-ND2 2.99Å; A17-I30 HydrophobicContact CB-CG1 4Å; A17-V69 HydrophobicContact CB-CG2 4.05Å
18	T	94.9	Very high	90.6	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	6.8	-175.4	62.6	0	0	0	0	114.6	I14 R16 P20 K54 Q65 A66 V69	I14-T18 HydrophobicContact CG1-CG2 4Å; I14-T18 WeakPolarHBondContact O-CB 3.43Å; I14-T18 WeakPolarHBondContact O-CG2 3.49Å; I14-T18 PolarHBondContact O-N 3.22Å; I14-T18 PolarHBondContact O-OG1 2.87Å; R16-T18 VanDerWaalsContact C-N 3.34Å; R16-T18 PolarHBondContact O-N 3.37Å; T18-P20 WeakPolarHBondContact O-CD 3.5Å; T18-K54 HydrophobicContact CG2-CB 4.49Å; T18-K54 HydrophobicContact CG2-CG 4.49Å; T18-K54 WeakPolarHBondContact OG1-CD 3.43Å; T18-K54 VanDerWaalsContact OG1-CE 3.31Å; T18-K54 WeakPolarHBondContact OG1-CE 3.31Å; T18-K54 PolarHBondContact OG1-NZ 3.09Å; T18-K54 VanDerWaalsContact OG1-NZ 3.08Å; T18-Q65 HydrophobicContact CG2-CB 4.47Å; T18-A66 HydrophobicContact CG2-CB 3.85Å; T18-V69 HydrophobicContact CG2-CG2 4.43Å
19	N	93.9	Very high	91.8	Very high	55 Å²	55	64 Å²	64	29%	0.294	32%	0.317	S	S	.	.			trans	-59.8	124	-172.5	-173.2	-15.8	0	0	0	112.1	N15 L21 N22	N15-N19 WeakPolarHBondContact O-CB 3.24Å; N15-N19 PolarHBondContact O-N 2.88Å; N19-L21 PolarHBondContact O-N 2.98Å; N19-L21 WeakPolarHBondContact OD1-CB 3.35Å; N19-L21 PolarHBondContact OD1-N 3.48Å; N19-N22 WeakPolarHBondContact O-CB 3.48Å; N19-N22 PolarHBondContact O-N 3.05Å
20	P	91.7	Very high	92	Very high	49 Å²	49	62.5 Å²	62.5	32%	0.318	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-24.2	173.8	-29	35.5	0	0	0	115.7	T18 E62	T18-P20 WeakPolarHBondContact O-CD 3.5Å; P20-E62 HydrophobicContact CG-CB 4.32Å
21	L	92.1	Very high	92.1	Very high	148 Å²	148	65.4 Å²	65.4	78%	0.775	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-6.1	-178.5	-57.1	177.2	0	0	0	113.7	N19 R23	N19-L21 PolarHBondContact O-N 2.98Å; N19-L21 WeakPolarHBondContact OD1-CB 3.35Å; N19-L21 PolarHBondContact OD1-N 3.48Å; L21-R23 PolarHBondContact O-N 2.74Å
22	N	90.4	Very high	92.1	Very high	39 Å²	39	63.5 Å²	63.5	21%	0.209	32%	0.319	C	S	.	.			trans	-68.8	126.6	177.3	-70.6	-9.8	0	0	0	110.1	R16 A17 N19 W61	R16-N22 PolarHBondContact O-ND2 3.34Å; A17-N22 PolarHBondContact O-ND2 2.99Å; N19-N22 WeakPolarHBondContact O-CB 3.48Å; N19-N22 PolarHBondContact O-N 3.05Å; N22-W61 WeakPolarHBondContact O-CZ2 3.38Å; N22-W61 PolarHBondContact O-NE1 2.94Å
23	R	84.2	Confident	92.2	Very high	226 Å²	226	61.5 Å²	61.5	85%	0.853	31%	0.305	S	S	*	.	S	Bend	trans	-77.2	-28.7	176.4	-65.1	179.6	63	151.5	1.4	112.9	L21	L21-R23 PolarHBondContact O-N 2.74Å
24	D	87.2	Confident	92.2	Very high	126 Å²	126	60.1 Å²	60.1	67%	0.674	30%	0.298	S	S	*	.	S	Bend	trans	-139.9	164.2	-175.2	-58.9	-79.6	0	0	0	108.9	D26	D24-D26 PolarHBondContact O-N 3.05Å
25	T	90.8	Very high	92	Very high	39 Å²	39	64.5 Å²	64.5	24%	0.239	32%	0.322	C	S	.	.			trans	-69.3	119.5	178.7	-71.1	0	0	0	0	111.8	W27 I30 Q65 L68	T25-W27 VanDerWaalsContact C-N 3.33Å; T25-W27 HydrophobicContact CG2-CD2 3.95Å; T25-W27 HydrophobicContact CG2-CG 4.1Å; T25-W27 HydrophobicContact CG2-CZ2 4.18Å; T25-W27 PolarHBondContact O-N 2.81Å; T25-I30 HydrophobicContact CG2-CD1 3.44Å; T25-I30 VanDerWaalsContact CG2-CD1 3.44Å; T25-Q65 PolarHBondContact OG1-NE2 3.43Å; T25-Q65 VanDerWaalsContact OG1-NE2 3.15Å; T25-Q65 PolarHBondContact OG1-OE1 2.93Å; T25-L68 HydrophobicContact CG2-CD2 3.65Å
26	D	90.8	Very high	91.8	Very high	29 Å²	29	64 Å²	64	16%	0.155	32%	0.317	C	S	.	.			trans	-79	78	174.3	-173.9	-6	0	0	0	111.1	R16 D24 S28 S29 I30	R16-D26 IonicContact CZ-OD2 2.79Å; R16-D26 IonicContact NE-OD2 3.17Å; R16-D26 PolarHBondContact NE-OD2 3.37Å; R16-D26 IonicContact NH2-OD2 3.57Å; R16-D26 PolarHBondContact NH2-OD2 2.71Å; D24-D26 PolarHBondContact O-N 3.05Å; D26-S28 PolarHBondContact O-N 2.81Å; D26-S28 WeakPolarHBondContact OD1-CB 3.5Å; D26-S28 PolarHBondContact OD1-N 2.96Å; D26-S29 PolarHBondContact O-N 2.83Å; D26-S29 VanDerWaalsContact O-N 3.12Å; D26-S29 PolarHBondContact OD1-N 2.82Å; D26-S29 WeakPolarHBondContact OD2-CB 3.42Å; D26-S29 PolarHBondContact OD2-OG 2.98Å; D26-I30 WeakPolarHBondContact O-CG1 3.38Å; D26-I30 PolarHBondContact O-N 2.81Å
27	W	91.8	Very high	91.7	Very high	128 Å²	128	56.9 Å²	56.9	49%	0.485	29%	0.29	S	S	.	.	H	α-helix	trans	-55.4	-29.7	176.3	-72.2	104	0	0	0	113.8	T25 I30 N31 L68	T25-W27 VanDerWaalsContact C-N 3.33Å; T25-W27 HydrophobicContact CG2-CD2 3.95Å; T25-W27 HydrophobicContact CG2-CG 4.1Å; T25-W27 HydrophobicContact CG2-CZ2 4.18Å; T25-W27 PolarHBondContact O-N 2.81Å; W27-I30 HydrophobicContact CE3-CD1 4.25Å; W27-I30 PolarHBondContact O-N 3.1Å; W27-N31 WeakPolarHBondContact O-CB 3.43Å; W27-N31 VanDerWaalsContact O-CG 3.25Å; W27-N31 PolarHBondContact O-N 2.78Å; W27-N31 PolarHBondContact O-ND2 2.99Å; W27-L68 HydrophobicContact CH2-CD1 4.19Å; W27-L68 HydrophobicContact CH2-CD2 4.36Å; W27-L68 HydrophobicContact CZ2-CD2 4.45Å
28	S	91.9	Very high	91.4	Very high	89 Å²	89	60 Å²	60	62%	0.622	31%	0.307	S	S	*	.	H	α-helix	trans	-65.7	-44.2	177.2	-54.6	0	0	0	0	110.9	D26 A32	D26-S28 PolarHBondContact O-N 2.81Å; D26-S28 WeakPolarHBondContact OD1-CB 3.5Å; D26-S28 PolarHBondContact OD1-N 2.96Å; S28-A32 VanDerWaalsContact O-CB 3.32Å; S28-A32 WeakPolarHBondContact O-CB 3.24Å; S28-A32 PolarHBondContact O-N 2.77Å
29	S	92.9	Very high	91	Very high	3 Å²	3	66.1 Å²	66.1	2%	0.021	34%	0.34	C	S	.	.	H	α-helix	trans	-70.6	-33	175.5	-64.2	0	0	0	0	113.1	R16 D26 F33	R16-S29 WeakPolarHBondContact CD-OG 3.3Å; R16-S29 VanDerWaalsContact CG-OG 3.29Å; R16-S29 WeakPolarHBondContact CG-OG 3.42Å; R16-S29 PolarHBondContact NE-OG 3.25Å; R16-S29 VanDerWaalsContact NE-OG 3.08Å; D26-S29 PolarHBondContact O-N 2.83Å; D26-S29 VanDerWaalsContact O-N 3.12Å; D26-S29 PolarHBondContact OD1-N 2.82Å; D26-S29 WeakPolarHBondContact OD2-CB 3.42Å; D26-S29 PolarHBondContact OD2-OG 2.98Å; S29-F33 WeakPolarHBondContact O-CB 3.32Å; S29-F33 PolarHBondContact O-N 2.97Å
30	I	93.6	Very high	90.7	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-64.2	-50.2	174.2	-63.6	175.6	0	0	0	110.4	A17 T25 D26 W27 F33 C34 L68 V69 T72	A17-I30 HydrophobicContact CB-CG1 4Å; T25-I30 HydrophobicContact CG2-CD1 3.44Å; T25-I30 VanDerWaalsContact CG2-CD1 3.44Å; D26-I30 WeakPolarHBondContact O-CG1 3.38Å; D26-I30 PolarHBondContact O-N 2.81Å; W27-I30 HydrophobicContact CE3-CD1 4.25Å; W27-I30 PolarHBondContact O-N 3.1Å; I30-F33 WeakPolarHBondContact O-CB 3.39Å; I30-F33 PolarHBondContact O-N 3.36Å; I30-C34 PolarHBondContact O-N 3.12Å; I30-C34 PolarHBondContact O-SG 2.76Å; I30-L68 HydrophobicContact CD1-CD2 4.19Å; I30-L68 HydrophobicContact CD1-CG 4.34Å; I30-V69 HydrophobicContact CD1-CG2 4.42Å; I30-V69 HydrophobicContact CG1-CG2 3.9Å; I30-T72 HydrophobicContact CG2-CG2 3.82Å
31	N	92	Very high	90.3	Very high	67 Å²	67	70.6 Å²	70.6	36%	0.358	36%	0.36	S	S	.	.	H	α-helix	trans	-64.4	-44.7	-179.6	-68.3	-17.6	0	0	0	111.3	W27 F33 C34 D35	W27-N31 WeakPolarHBondContact O-CB 3.43Å; W27-N31 VanDerWaalsContact O-CG 3.25Å; W27-N31 PolarHBondContact O-N 2.78Å; W27-N31 PolarHBondContact O-ND2 2.99Å; N31-F33 VanDerWaalsContact C-N 3.27Å; N31-F33 PolarHBondContact O-N 2.74Å; N31-C34 WeakPolarHBondContact O-CA 3.34Å; N31-C34 WeakPolarHBondContact O-CB 3.41Å; N31-C34 PolarHBondContact O-N 2.86Å; N31-D35 VanDerWaalsContact O-CG 3.31Å; N31-D35 PolarHBondContact O-N 2.8Å
32	A	91.9	Very high	90.2	Very high	30 Å²	30	69.8 Å²	69.8	25%	0.248	35%	0.352	C	S	.	.	H	α-helix	trans	-59.3	-36.4	175.6	0	0	0	0	0	112.8	S28 D35 Q36	S28-A32 VanDerWaalsContact O-CB 3.32Å; S28-A32 WeakPolarHBondContact O-CB 3.24Å; S28-A32 PolarHBondContact O-N 2.77Å; A32-D35 PolarHBondContact O-N 3.13Å; A32-Q36 VanDerWaalsContact O-CB 3.29Å; A32-Q36 WeakPolarHBondContact O-CB 3.48Å; A32-Q36 PolarHBondContact O-N 3.25Å
33	F	95.2	Very high	90.2	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-65	-41.3	172.1	-177.4	-94.6	0	0	0	112.2	L10 H13 I14 S29 I30 N31 L37 A47 L51 V69	L10-F33 HydrophobicContact CB-CD2 4.38Å; L10-F33 HydrophobicContact CB-CE2 4.06Å; L10-F33 HydrophobicContact CD2-CD2 3.52Å; L10-F33 HydrophobicContact CD2-CE2 3.58Å; L10-F33 HydrophobicContact CD2-CG 4.15Å; L10-F33 HydrophobicContact CD2-CZ 4.26Å; L10-F33 HydrophobicContact CG-CE2 4.41Å; L10-F33 WeakPolarHBondContact O-CD2 3.46Å; H13-F33 HydrophobicContact CB-CB 3.96Å; H13-F33 HydrophobicContact CB-CD2 4.22Å; I14-F33 HydrophobicContact CB-CD2 3.85Å; I14-F33 HydrophobicContact CB-CE2 3.67Å; I14-F33 HydrophobicContact CB-CZ 4.42Å; I14-F33 HydrophobicContact CD1-CE2 4.17Å; I14-F33 HydrophobicContact CD1-CZ 4.11Å; I14-F33 HydrophobicContact CG1-CE2 4.2Å; I14-F33 HydrophobicContact CG1-CZ 4.49Å; I14-F33 HydrophobicContact CG2-CE2 4.42Å; S29-F33 WeakPolarHBondContact O-CB 3.32Å; S29-F33 PolarHBondContact O-N 2.97Å; I30-F33 WeakPolarHBondContact O-CB 3.39Å; I30-F33 PolarHBondContact O-N 3.36Å; N31-F33 VanDerWaalsContact C-N 3.27Å; N31-F33 PolarHBondContact O-N 2.74Å; F33-L37 HydrophobicContact CD1-CD1 4.48Å; F33-L37 HydrophobicContact CE1-CD1 4.01Å; F33-L37 WeakPolarHBondContact O-CB 3.15Å; F33-L37 PolarHBondContact O-N 3.35Å; F33-A47 HydrophobicContact CE1-CB 4.01Å; F33-A47 HydrophobicContact CE2-CB 4.43Å; F33-A47 HydrophobicContact CZ-CB 3.56Å; F33-L51 HydrophobicContact CE1-CD1 4.08Å; F33-L51 HydrophobicContact CE1-CD2 4.49Å; F33-L51 HydrophobicContact CE1-CG 4.29Å; F33-L51 HydrophobicContact CZ-CD1 4.37Å; F33-L51 HydrophobicContact CZ-CG 4.24Å; F33-V69 HydrophobicContact CD1-CG1 3.45Å; F33-V69 VanDerWaalsContact CD1-CG1 3.45Å; F33-V69 HydrophobicContact CE1-CG1 3.71Å; F33-V69 HydrophobicContact CG-CG1 4.24Å
34	C	92.6	Very high	90.6	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.007	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-44.7	174.6	-61.3	0	0	0	0	112.1	I30 N31 L37 N38 C73	I30-C34 PolarHBondContact O-N 3.12Å; I30-C34 PolarHBondContact O-SG 2.76Å; N31-C34 WeakPolarHBondContact O-CA 3.34Å; N31-C34 WeakPolarHBondContact O-CB 3.41Å; N31-C34 PolarHBondContact O-N 2.86Å; C34-L37 PolarHBondContact O-N 3.28Å; C34-N38 PolarHBondContact O-N 2.93Å; C34-N38 PolarHBondContact O-ND2 3.28Å; C34-C73 PolarHBondContact SG-SG 2.95Å
35	D	90.3	Very high	91	Very high	94 Å²	94	55.9 Å²	55.9	50%	0.503	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-49.1	-178.4	-64	-27.5	0	0	0	110.6	N31 A32 L37 N38 N39	N31-D35 VanDerWaalsContact O-CG 3.31Å; N31-D35 PolarHBondContact O-N 2.8Å; A32-D35 PolarHBondContact O-N 3.13Å; D35-L37 VanDerWaalsContact C-N 3.3Å; D35-L37 PolarHBondContact O-N 3.42Å; D35-N38 PolarHBondContact O-N 3.02Å; D35-N38 VanDerWaalsContact O-N 3.15Å; D35-N39 VanDerWaalsContact O-CG 3.28Å; D35-N39 PolarHBondContact O-N 3.23Å; D35-N39 PolarHBondContact O-ND2 3.45Å
36	Q	91	Very high	91.1	Very high	71 Å²	71	55.6 Å²	55.6	33%	0.332	29%	0.289	S	S	.	.	H	α-helix	trans	-62.6	-36.1	178.9	-169.1	65.4	-5.3	0	0	112.6	E8 L10 A32 N38 N39 D40	E8-Q36 PolarHBondContact O-NE2 3.47Å; L10-Q36 HydrophobicContact CD2-CB 3.97Å; L10-Q36 HydrophobicContact CD2-CG 4.08Å; L10-Q36 HydrophobicContact CG-CB 4.45Å; L10-Q36 HydrophobicContact CG-CG 4Å; A32-Q36 VanDerWaalsContact O-CB 3.29Å; A32-Q36 WeakPolarHBondContact O-CB 3.48Å; A32-Q36 PolarHBondContact O-N 3.25Å; Q36-N38 VanDerWaalsContact C-N 3.33Å; Q36-N38 PolarHBondContact O-N 3.34Å; Q36-N39 PolarHBondContact O-N 3.22Å; Q36-D40 PolarHBondContact O-N 2.86Å
37	L	92.5	Very high	91.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-62.9	-37.9	175.9	178	171.4	0	0	0	112.3	L10 F33 C34 D35 P44 A47 C73 C77 F81	L10-L37 HydrophobicContact CD2-CB 4.1Å; F33-L37 HydrophobicContact CD1-CD1 4.48Å; F33-L37 HydrophobicContact CE1-CD1 4.01Å; F33-L37 WeakPolarHBondContact O-CB 3.15Å; F33-L37 PolarHBondContact O-N 3.35Å; C34-L37 PolarHBondContact O-N 3.28Å; D35-L37 VanDerWaalsContact C-N 3.3Å; D35-L37 PolarHBondContact O-N 3.42Å; L37-P44 HydrophobicContact CD2-CG 4.2Å; L37-A47 HydrophobicContact CB-CB 4.49Å; L37-A47 HydrophobicContact CD1-CB 3.41Å; L37-A47 VanDerWaalsContact CD1-CB 3.41Å; L37-A47 HydrophobicContact CG-CB 3.77Å; L37-C73 HydrophobicContact CD1-CB 4.34Å; L37-C77 HydrophobicContact CD2-CB 4.13Å; L37-F81 HydrophobicContact CD1-CD2 3.75Å; L37-F81 HydrophobicContact CD1-CE2 3.72Å; L37-F81 HydrophobicContact CD1-CG 4.34Å; L37-F81 HydrophobicContact CD1-CZ 4.31Å; L37-F81 HydrophobicContact CD2-CB 4.03Å; L37-F81 HydrophobicContact CD2-CD2 3.88Å; L37-F81 HydrophobicContact CD2-CG 4.08Å; L37-F81 HydrophobicContact CG-CD2 4.25Å
38	N	88.3	Confident	91.6	Very high	65 Å²	65	48.7 Å²	48.7	35%	0.348	26%	0.262	S	S	.	.	H	α-helix	trans	-78.3	-31.3	179	-72	-55.8	0	0	0	112.8	C34 D35 Q36 C77	C34-N38 PolarHBondContact O-N 2.93Å; C34-N38 PolarHBondContact O-ND2 3.28Å; D35-N38 PolarHBondContact O-N 3.02Å; D35-N38 VanDerWaalsContact O-N 3.15Å; Q36-N38 VanDerWaalsContact C-N 3.33Å; Q36-N38 PolarHBondContact O-N 3.34Å; N38-C77 PolarHBondContact ND2-SG 3.16Å; N38-C77 WeakPolarHBondContact OD1-CB 3.46Å
39	N	86.6	Confident	91.8	Very high	130 Å²	130	50.6 Å²	50.6	70%	0.695	26%	0.256	S	S	*	.	H	α-helix	trans	-74.8	-32.3	-179.3	-69.7	-28.6	0	0	0	113.2	D35 Q36	D35-N39 VanDerWaalsContact O-CG 3.28Å; D35-N39 PolarHBondContact O-N 3.23Å; D35-N39 PolarHBondContact O-ND2 3.45Å; Q36-N39 PolarHBondContact O-N 3.22Å
40	D	87.4	Confident	92	Very high	61 Å²	61	52 Å²	52	33%	0.326	26%	0.263	S	S	.	.	S	Bend	trans	-84.2	143.9	179.9	-177.4	17.4	0	0	0	112.9	Q36 E42 G43 R80	Q36-D40 PolarHBondContact O-N 2.86Å; D40-E42 PolarHBondContact OD1-N 3.15Å; D40-E42 VanDerWaalsContact OD1-N 3.15Å; D40-G43 VanDerWaalsContact CG-N 3.33Å; D40-G43 WeakPolarHBondContact OD2-CA 3.46Å; D40-G43 PolarHBondContact OD2-N 2.91Å; D40-R80 PolarHBondContact O-NH1 2.91Å
41	L	83.4	Confident	92.2	Very high	137 Å²	137	52 Å²	52	72%	0.717	26%	0.263	S	S	*	.	S	Bend	trans	-75	-32.8	177.3	-157.5	134.2	0	0	0	111.6	R80	L41-R80 PolarHBondContact O-NH2 2.73Å
42	E	89	Confident	92.5	Very high	130 Å²	130	49.2 Å²	49.2	61%	0.607	25%	0.249	S	C	*	.	S	Bend	trans	-95.9	-9.6	172.4	-62.3	-153.6	147.5	0	0	113.9	D40 P44 Q45 L46	D40-E42 PolarHBondContact OD1-N 3.15Å; D40-E42 VanDerWaalsContact OD1-N 3.15Å; E42-P44 VanDerWaalsContact O-N 3.13Å; E42-Q45 PolarHBondContact O-N 3.48Å; E42-L46 PolarHBondContact O-N 3.48Å
43	G	90.8	Very high	92.7	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-41	-50.5	-177.1	0	0	0	0	0	115.4	D40 Q45 L46 A47	D40-G43 VanDerWaalsContact CG-N 3.33Å; D40-G43 WeakPolarHBondContact OD2-CA 3.46Å; D40-G43 PolarHBondContact OD2-N 2.91Å; G43-Q45 VanDerWaalsContact C-N 3.34Å; G43-Q45 PolarHBondContact O-N 2.86Å; G43-L46 PolarHBondContact O-N 2.75Å; G43-A47 WeakPolarHBondContact O-CB 3.44Å; G43-A47 PolarHBondContact O-N 2.85Å
44	P	93.8	Very high	92.8	Very high	5 Å²	5	55.4 Å²	55.4	3%	0.032	27%	0.272	C	S	.	.	H	α-helix	trans	-58.6	-37.5	178.1	-28.4	37.1	0	0	0	115	L37 E42 T48 R80 F81 E84	L37-P44 HydrophobicContact CD2-CG 4.2Å; E42-P44 VanDerWaalsContact O-N 3.13Å; P44-T48 WeakPolarHBondContact O-CG2 3.39Å; P44-T48 PolarHBondContact O-N 2.83Å; P44-T48 VanDerWaalsContact O-N 3.16Å; P44-T48 PolarHBondContact O-OG1 3.43Å; P44-R80 HydrophobicContact CG-CB 4.24Å; P44-F81 HydrophobicContact CB-CD2 4.34Å; P44-E84 HydrophobicContact CB-CB 4.48Å; P44-E84 HydrophobicContact CB-CG 3.74Å
45	Q	93.7	Very high	93	Very high	94 Å²	94	55.4 Å²	55.4	44%	0.439	27%	0.272	S	S	.	.	H	α-helix	trans	-77.8	-31.2	-179.6	-65	-175.1	36.8	0	0	112.3	E42 G43 T48 R49 E84	E42-Q45 PolarHBondContact O-N 3.48Å; G43-Q45 VanDerWaalsContact C-N 3.34Å; G43-Q45 PolarHBondContact O-N 2.86Å; Q45-T48 PolarHBondContact O-OG1 3.41Å; Q45-R49 PolarHBondContact O-NH2 2.98Å; Q45-E84 HydrophobicContact CG-CG 4.13Å
46	L	94.4	Very high	93.3	Very high	33 Å²	33	53.4 Å²	53.4	17%	0.173	26%	0.26	C	S	.	.	H	α-helix	trans	-74.3	-48.4	173.7	178.9	54.1	0	0	0	110.7	L10 E11 E42 G43 T48 R49 L50	L10-L46 HydrophobicContact CB-CD2 4.37Å; L10-L46 HydrophobicContact CD1-CB 4.35Å; L10-L46 HydrophobicContact CD1-CD2 4.04Å; L10-L46 HydrophobicContact CD1-CG 4.23Å; E11-L46 WeakPolarHBondContact OE1-CD1 3.46Å; E42-L46 PolarHBondContact O-N 3.48Å; G43-L46 PolarHBondContact O-N 2.75Å; L46-T48 PolarHBondContact O-N 2.8Å; L46-R49 WeakPolarHBondContact O-CB 3.38Å; L46-R49 PolarHBondContact O-N 3.21Å; L46-R49 VanDerWaalsContact O-N 3.12Å; L46-L50 HydrophobicContact CD1-CD1 3.98Å; L46-L50 HydrophobicContact CD1-CG 4.06Å; L46-L50 HydrophobicContact CG-CD1 3.94Å; L46-L50 HydrophobicContact CG-CG 4.45Å; L46-L50 WeakPolarHBondContact O-CG 3.29Å; L46-L50 PolarHBondContact O-N 2.83Å
47	A	95.9	Very high	93.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.9	-47.3	179.5	0	0	0	0	0	112.9	F33 L37 G43 R49 L50 L51 F81	F33-A47 HydrophobicContact CE1-CB 4.01Å; F33-A47 HydrophobicContact CE2-CB 4.43Å; F33-A47 HydrophobicContact CZ-CB 3.56Å; L37-A47 HydrophobicContact CB-CB 4.49Å; L37-A47 HydrophobicContact CD1-CB 3.41Å; L37-A47 VanDerWaalsContact CD1-CB 3.41Å; L37-A47 HydrophobicContact CG-CB 3.77Å; G43-A47 WeakPolarHBondContact O-CB 3.44Å; G43-A47 PolarHBondContact O-N 2.85Å; A47-R49 VanDerWaalsContact C-N 3.28Å; A47-R49 PolarHBondContact O-N 3.18Å; A47-L50 PolarHBondContact O-N 3.21Å; A47-L51 VanDerWaalsContact O-CB 3.32Å; A47-L51 WeakPolarHBondContact O-CB 3.29Å; A47-L51 VanDerWaalsContact O-CG 3.26Å; A47-L51 WeakPolarHBondContact O-CG 3.43Å; A47-L51 PolarHBondContact O-N 2.71Å; A47-F81 HydrophobicContact CB-CE2 4.32Å
48	T	96.5	Very high	93.5	Very high	12 Å²	12	56 Å²	56	7%	0.074	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-36.4	176.5	45	0	0	0	0	112.5	P44 Q45 L46 A52 F81 E84 V85 F90	P44-T48 WeakPolarHBondContact O-CG2 3.39Å; P44-T48 PolarHBondContact O-N 2.83Å; P44-T48 VanDerWaalsContact O-N 3.16Å; P44-T48 PolarHBondContact O-OG1 3.43Å; Q45-T48 PolarHBondContact O-OG1 3.41Å; L46-T48 PolarHBondContact O-N 2.8Å; T48-A52 VanDerWaalsContact O-CB 3.23Å; T48-A52 WeakPolarHBondContact O-CB 3.11Å; T48-A52 PolarHBondContact O-N 2.84Å; T48-F81 HydrophobicContact CG2-CD2 4.33Å; T48-F81 HydrophobicContact CG2-CE2 3.69Å; T48-F81 HydrophobicContact CG2-CZ 4.35Å; T48-E84 HydrophobicContact CG2-CB 3.88Å; T48-V85 HydrophobicContact CG2-CG2 3.85Å; T48-F90 HydrophobicContact CG2-CD2 4.08Å; T48-F90 HydrophobicContact CG2-CE2 4.42Å; T48-F90 HydrophobicContact CG2-CG 4.26Å; T48-F90 WeakPolarHBondContact O-CD2 3.32Å; T48-F90 VanDerWaalsContact O-CE2 3.25Å; T48-F90 WeakPolarHBondContact O-CE2 3.4Å
49	R	96.3	Very high	93.8	Very high	129 Å²	129	57.6 Å²	57.6	49%	0.487	29%	0.288	S	S	.	.	H	α-helix	trans	-67.5	-45.5	176.4	-167.8	-170.2	-46.2	131.8	10.6	112.2	Q45 L46 A47 A52 H53	Q45-R49 PolarHBondContact O-NH2 2.98Å; L46-R49 WeakPolarHBondContact O-CB 3.38Å; L46-R49 PolarHBondContact O-N 3.21Å; L46-R49 VanDerWaalsContact O-N 3.12Å; A47-R49 VanDerWaalsContact C-N 3.28Å; A47-R49 PolarHBondContact O-N 3.18Å; R49-A52 PolarHBondContact O-N 3.33Å; R49-H53 PolarHBondContact O-N 3.44Å
50	L	97	Very high	94.2	Very high	34 Å²	34	56.3 Å²	56.3	18%	0.178	28%	0.278	C	S	.	.	H	α-helix	trans	-66	-43.8	177.9	-65.3	172.1	0	0	0	111.4	L10 E11 I14 L46 A47 H53 K54	L10-L50 HydrophobicContact CB-CD1 4.02Å; E11-L50 HydrophobicContact CG-CD1 4.05Å; E11-L50 HydrophobicContact CG-CD2 4.01Å; I14-L50 HydrophobicContact CD1-CB 3.78Å; I14-L50 HydrophobicContact CG2-CB 4.22Å; I14-L50 HydrophobicContact CG2-CD1 4.25Å; L46-L50 HydrophobicContact CD1-CD1 3.98Å; L46-L50 HydrophobicContact CD1-CG 4.06Å; L46-L50 HydrophobicContact CG-CD1 3.94Å; L46-L50 HydrophobicContact CG-CG 4.45Å; L46-L50 WeakPolarHBondContact O-CG 3.29Å; L46-L50 PolarHBondContact O-N 2.83Å; A47-L50 PolarHBondContact O-N 3.21Å; L50-H53 PolarHBondContact O-N 2.73Å; L50-K54 WeakPolarHBondContact O-CG 3.48Å; L50-K54 PolarHBondContact O-N 2.88Å; L50-K54 VanDerWaalsContact O-N 3.08Å
51	L	97.8	Very high	94.5	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-47.3	174.4	-74.4	166.3	0	0	0	111.5	I14 F33 A47 H53 K54 I55 A66 V69 L70 F81 F90	I14-L51 HydrophobicContact CD1-CD2 3.82Å; I14-L51 HydrophobicContact CD1-CG 3.98Å; F33-L51 HydrophobicContact CE1-CD1 4.08Å; F33-L51 HydrophobicContact CE1-CD2 4.49Å; F33-L51 HydrophobicContact CE1-CG 4.29Å; F33-L51 HydrophobicContact CZ-CD1 4.37Å; F33-L51 HydrophobicContact CZ-CG 4.24Å; A47-L51 VanDerWaalsContact O-CB 3.32Å; A47-L51 WeakPolarHBondContact O-CB 3.29Å; A47-L51 VanDerWaalsContact O-CG 3.26Å; A47-L51 WeakPolarHBondContact O-CG 3.43Å; A47-L51 PolarHBondContact O-N 2.71Å; L51-H53 VanDerWaalsContact C-N 3.27Å; L51-H53 PolarHBondContact O-N 3.22Å; L51-K54 PolarHBondContact O-N 3.48Å; L51-K54 VanDerWaalsContact O-N 3.13Å; L51-I55 HydrophobicContact CB-CD1 4.23Å; L51-I55 WeakPolarHBondContact O-CB 3.36Å; L51-I55 WeakPolarHBondContact O-CD1 3.18Å; L51-I55 WeakPolarHBondContact O-CG1 3.45Å; L51-I55 PolarHBondContact O-N 3.44Å; L51-A66 WeakPolarHBondContact CD2-O 3.24Å; L51-V69 HydrophobicContact CD2-CB 3.89Å; L51-V69 HydrophobicContact CD2-CG1 3.75Å; L51-L70 HydrophobicContact CD1-CB 4.36Å; L51-L70 HydrophobicContact CD1-CD1 4.11Å; L51-L70 HydrophobicContact CD2-CB 4.32Å; L51-F81 HydrophobicContact CD1-CE2 4.44Å; L51-F81 HydrophobicContact CD1-CZ 3.99Å; L51-F90 HydrophobicContact CB-CE2 4.32Å
52	A	97.2	Very high	95.1	Very high	7 Å²	7	52.6 Å²	52.6	6%	0.058	25%	0.251	C	S	.	.	H	α-helix	trans	-57.5	-39	178.7	0	0	0	0	0	113	T48 R49 Q56 F90 E93	T48-A52 VanDerWaalsContact O-CB 3.23Å; T48-A52 WeakPolarHBondContact O-CB 3.11Å; T48-A52 PolarHBondContact O-N 2.84Å; R49-A52 PolarHBondContact O-N 3.33Å; A52-Q56 WeakPolarHBondContact O-CG 3.38Å; A52-Q56 PolarHBondContact O-N 3.44Å; A52-Q56 PolarHBondContact O-NE2 3.28Å; A52-F90 HydrophobicContact CB-CD2 4.12Å; A52-F90 HydrophobicContact CB-CE2 4.01Å; A52-E93 HydrophobicContact CB-CB 3.75Å; A52-E93 HydrophobicContact CB-CG 3.87Å
53	H	97.3	Very high	95.5	Very high	141 Å²	141	46.4 Å²	46.4	65%	0.653	22%	0.222	S	C	*	.	H	α-helix	trans	-66.9	-45.9	175	179.7	-92.5	0	0	0	111.9	R49 L50 L51 Q56	R49-H53 PolarHBondContact O-N 3.44Å; L50-H53 PolarHBondContact O-N 2.73Å; L51-H53 VanDerWaalsContact C-N 3.27Å; L51-H53 PolarHBondContact O-N 3.22Å; H53-Q56 PolarHBondContact O-N 2.86Å
54	K	96.6	Very high	95.7	Very high	19 Å²	19	49.3 Å²	49.3	8%	0.083	24%	0.236	C	C	.	.	H	α-helix	trans	-68.5	-37.6	-178.8	-70.9	-71.8	-172.9	159.2	0	113.5	I14 N15 T18 L50 L51 Q56 S57 E62 A66	I14-K54 HydrophobicContact CD1-CG 4.01Å; I14-K54 HydrophobicContact CG1-CG 4.36Å; N15-K54 WeakPolarHBondContact OD1-CE 3.4Å; N15-K54 PolarHBondContact OD1-NZ 2.96Å; T18-K54 HydrophobicContact CG2-CB 4.49Å; T18-K54 HydrophobicContact CG2-CG 4.49Å; T18-K54 WeakPolarHBondContact OG1-CD 3.43Å; T18-K54 VanDerWaalsContact OG1-CE 3.31Å; T18-K54 WeakPolarHBondContact OG1-CE 3.31Å; T18-K54 PolarHBondContact OG1-NZ 3.09Å; T18-K54 VanDerWaalsContact OG1-NZ 3.08Å; L50-K54 WeakPolarHBondContact O-CG 3.48Å; L50-K54 PolarHBondContact O-N 2.88Å; L50-K54 VanDerWaalsContact O-N 3.08Å; L51-K54 PolarHBondContact O-N 3.48Å; L51-K54 VanDerWaalsContact O-N 3.13Å; K54-Q56 PolarHBondContact O-N 2.89Å; K54-S57 WeakPolarHBondContact O-CB 3.35Å; K54-S57 PolarHBondContact O-N 2.91Å; K54-S57 VanDerWaalsContact O-N 3.1Å; K54-E62 HydrophobicContact CD-CG 4.02Å; K54-E62 WeakPolarHBondContact CD-OE1 3.28Å; K54-E62 WeakPolarHBondContact CE-OE1 3.36Å; K54-E62 IonicContact NZ-OE1 3.7Å; K54-E62 PolarHBondContact NZ-OE1 2.67Å; K54-A66 HydrophobicContact CB-CB 3.58Å
55	I	97.4	Very high	95.9	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-66.8	-28	176.5	-65.6	164.4	0	0	0	111.6	L51 S57 A66 L67 L70 F90 L94 V97 V115	L51-I55 HydrophobicContact CB-CD1 4.23Å; L51-I55 WeakPolarHBondContact O-CB 3.36Å; L51-I55 WeakPolarHBondContact O-CD1 3.18Å; L51-I55 WeakPolarHBondContact O-CG1 3.45Å; L51-I55 PolarHBondContact O-N 3.44Å; I55-S57 PolarHBondContact O-N 3.42Å; I55-A66 HydrophobicContact CG1-CB 3.68Å; I55-L67 HydrophobicContact CD1-CD2 3.94Å; I55-L67 HydrophobicContact CG1-CD2 3.98Å; I55-L67 HydrophobicContact CG1-CG 4.1Å; I55-L67 HydrophobicContact CG2-CD2 3.72Å; I55-L67 HydrophobicContact CG2-CG 4.08Å; I55-L70 HydrophobicContact CD1-CB 4.42Å; I55-L70 HydrophobicContact CD1-CD2 3.66Å; I55-F90 HydrophobicContact CD1-CZ 4.48Å; I55-L94 HydrophobicContact CD1-CD2 4.07Å; I55-L94 HydrophobicContact CG2-CD2 4.03Å; I55-V97 HydrophobicContact CG2-CG2 4.33Å; I55-V115 HydrophobicContact CG2-CG2 4.29Å
56	Q	96.5	Very high	96.1	Very high	51 Å²	51	45.1 Å²	45.1	24%	0.238	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	1.2	174	-74.6	177.2	79.7	0	0	113.8	A52 H53 K54 E93 V97 L103	A52-Q56 WeakPolarHBondContact O-CG 3.38Å; A52-Q56 PolarHBondContact O-N 3.44Å; A52-Q56 PolarHBondContact O-NE2 3.28Å; H53-Q56 PolarHBondContact O-N 2.86Å; K54-Q56 PolarHBondContact O-N 2.89Å; Q56-E93 PolarHBondContact NE2-OE2 2.99Å; Q56-V97 HydrophobicContact CB-CG2 4.45Å; Q56-V97 HydrophobicContact CG-CG2 3.56Å; Q56-L103 HydrophobicContact CB-CD1 4.01Å; Q56-L103 HydrophobicContact CG-CD1 3.76Å
57	S	95.4	Very high	96.2	Very high	12 Å²	12	43.6 Å²	43.6	8%	0.084	21%	0.209	C	C	.	.			trans	-60.2	137.5	178.6	-175.3	0	0	0	0	111.8	K54 I55 Q59 E62	K54-S57 WeakPolarHBondContact O-CB 3.35Å; K54-S57 PolarHBondContact O-N 2.91Å; K54-S57 VanDerWaalsContact O-N 3.1Å; I55-S57 PolarHBondContact O-N 3.42Å; S57-Q59 PolarHBondContact O-N 3.27Å; S57-Q59 PolarHBondContact OG-N 3.01Å; S57-E62 VanDerWaalsContact CB-OE2 3.3Å; S57-E62 WeakPolarHBondContact CB-OE2 3.32Å; S57-E62 PolarHBondContact OG-OE2 3.17Å
58	P	92.9	Very high	96.1	Very high	114 Å²	114	45.2 Å²	45.2	74%	0.74	22%	0.217	S	C	*	.	S	Bend	trans	-69.6	-12.8	170.7	31.1	-36.1	0	0	0	112.6
59	Q	94.2	Very high	96.1	Very high	98 Å²	98	44.7 Å²	44.7	46%	0.458	21%	0.214	S	C	.	.	S	Bend	trans	-83.7	113.5	176.7	-62	-177.9	89	0	0	109.8	S57 W61 E62 A63	S57-Q59 PolarHBondContact O-N 3.27Å; S57-Q59 PolarHBondContact OG-N 3.01Å; Q59-W61 VanDerWaalsContact C-N 3.29Å; Q59-W61 PolarHBondContact O-N 2.89Å; Q59-E62 HydrophobicContact CB-CB 4.04Å; Q59-E62 PolarHBondContact NE2-OE2 3.25Å; Q59-E62 VanDerWaalsContact NE2-OE2 3.14Å; Q59-E62 PolarHBondContact O-N 3.04Å; Q59-A63 PolarHBondContact O-N 3.01Å
60	E	94.6	Very high	96.2	Very high	103 Å²	103	38.5 Å²	38.5	48%	0.481	19%	0.19	S	C	.	.	H	α-helix	trans	-54.7	-42.2	-176.7	-174.4	171.6	162.1	0	0	113.1	M64 P108 A110	E60-M64 HydrophobicContact CG-CG 4.23Å; E60-M64 VanDerWaalsContact O-CB 3.25Å; E60-M64 WeakPolarHBondContact O-CB 3.35Å; E60-M64 WeakPolarHBondContact O-CG 3.43Å; E60-M64 PolarHBondContact O-N 3.46Å; E60-P108 HydrophobicContact CB-CB 3.84Å; E60-P108 HydrophobicContact CB-CG 3.77Å; E60-P108 HydrophobicContact CG-CB 3.72Å; E60-P108 HydrophobicContact CG-CG 4.22Å; E60-A110 HydrophobicContact CG-CB 4.46Å; E60-A110 VanDerWaalsContact OE1-CB 3.22Å; E60-A110 WeakPolarHBondContact OE1-CB 3.39Å
61	W	93.9	Very high	96	Very high	98 Å²	98	37.8 Å²	37.8	37%	0.371	19%	0.186	S	C	.	.	H	α-helix	trans	-64.1	-47.2	178.1	-177.5	-101.7	0	0	0	113	N22 Q59 A63 M64 Q65	N22-W61 WeakPolarHBondContact O-CZ2 3.38Å; N22-W61 PolarHBondContact O-NE1 2.94Å; Q59-W61 VanDerWaalsContact C-N 3.29Å; Q59-W61 PolarHBondContact O-N 2.89Å; W61-A63 PolarHBondContact O-N 2.89Å; W61-M64 PolarHBondContact O-N 3.38Å; W61-Q65 HydrophobicContact CD2-CG 4.14Å; W61-Q65 HydrophobicContact CG-CG 4.43Å; W61-Q65 HydrophobicContact CZ2-CG 4.17Å; W61-Q65 WeakPolarHBondContact O-CG 3.49Å; W61-Q65 PolarHBondContact O-N 3.03Å
62	E	96.4	Very high	95.8	Very high	23 Å²	23	38 Å²	38	11%	0.107	19%	0.188	C	C	.	.	H	α-helix	trans	-61.2	-45.2	178.7	-179.5	171.8	-149	0	0	111.1	P20 K54 S57 Q59 A66	P20-E62 HydrophobicContact CG-CB 4.32Å; K54-E62 HydrophobicContact CD-CG 4.02Å; K54-E62 WeakPolarHBondContact CD-OE1 3.28Å; K54-E62 WeakPolarHBondContact CE-OE1 3.36Å; K54-E62 IonicContact NZ-OE1 3.7Å; K54-E62 PolarHBondContact NZ-OE1 2.67Å; S57-E62 VanDerWaalsContact CB-OE2 3.3Å; S57-E62 WeakPolarHBondContact CB-OE2 3.32Å; S57-E62 PolarHBondContact OG-OE2 3.17Å; Q59-E62 HydrophobicContact CB-CB 4.04Å; Q59-E62 PolarHBondContact NE2-OE2 3.25Å; Q59-E62 VanDerWaalsContact NE2-OE2 3.14Å; Q59-E62 PolarHBondContact O-N 3.04Å; E62-A66 VanDerWaalsContact O-CB 3.3Å; E62-A66 WeakPolarHBondContact O-CB 3.43Å; E62-A66 PolarHBondContact O-N 2.99Å
63	A	96.4	Very high	95.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-42.2	176.8	0	0	0	0	0	112.2	Q59 W61 A66 L67 A111	Q59-A63 PolarHBondContact O-N 3.01Å; W61-A63 PolarHBondContact O-N 2.89Å; A63-A66 PolarHBondContact O-N 3.48Å; A63-L67 VanDerWaalsContact O-CG 3.27Å; A63-L67 WeakPolarHBondContact O-CG 3.48Å; A63-L67 PolarHBondContact O-N 3.38Å; A63-A111 HydrophobicContact CB-CB 4.19Å
64	M	96.4	Very high	95.3	Very high	60 Å²	60	31.1 Å²	31.1	30%	0.296	15%	0.154	S	C	.	.	H	α-helix	trans	-68.5	-40.6	178.7	-74.6	-65	-68.3	0	0	112.7	E60 W61 A66 L67 L68 A110 A111 K114	E60-M64 HydrophobicContact CG-CG 4.23Å; E60-M64 VanDerWaalsContact O-CB 3.25Å; E60-M64 WeakPolarHBondContact O-CB 3.35Å; E60-M64 WeakPolarHBondContact O-CG 3.43Å; E60-M64 PolarHBondContact O-N 3.46Å; W61-M64 PolarHBondContact O-N 3.38Å; M64-A66 VanDerWaalsContact C-N 3.34Å; M64-L67 PolarHBondContact O-N 3.36Å; M64-L67 HydrophobicContact SD-CD1 4.32Å; M64-L68 PolarHBondContact O-N 3.41Å; M64-A110 HydrophobicContact SD-CB 4.09Å; M64-A111 HydrophobicContact SD-CB 4.48Å; M64-K114 HydrophobicContact CE-CB 4.45Å; M64-K114 HydrophobicContact CE-CG 4.43Å; M64-K114 HydrophobicContact SD-CB 4.12Å; M64-K114 HydrophobicContact SD-CG 4.4Å
65	Q	96.6	Very high	95	Very high	11 Å²	11	35.4 Å²	35.4	5%	0.051	17%	0.17	C	C	.	.	H	α-helix	trans	-66	-37.7	172.9	-65.1	-60.4	-33.3	0	0	111	T18 T25 W61 L67 L68 V69	T18-Q65 HydrophobicContact CG2-CB 4.47Å; T25-Q65 PolarHBondContact OG1-NE2 3.43Å; T25-Q65 VanDerWaalsContact OG1-NE2 3.15Å; T25-Q65 PolarHBondContact OG1-OE1 2.93Å; W61-Q65 HydrophobicContact CD2-CG 4.14Å; W61-Q65 HydrophobicContact CG-CG 4.43Å; W61-Q65 HydrophobicContact CZ2-CG 4.17Å; W61-Q65 WeakPolarHBondContact O-CG 3.49Å; W61-Q65 PolarHBondContact O-N 3.03Å; Q65-L67 PolarHBondContact O-N 2.89Å; Q65-L68 WeakPolarHBondContact O-CB 3.35Å; Q65-L68 PolarHBondContact O-N 3.41Å; Q65-V69 VanDerWaalsContact O-CG2 3.29Å; Q65-V69 WeakPolarHBondContact O-CG2 3.43Å; Q65-V69 PolarHBondContact O-N 3.38Å
66	A	97.6	Very high	94.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65	-37.3	174.9	0	0	0	0	0	112.9	T18 L51 K54 I55 E62 A63 M64 L68 V69 L70	T18-A66 HydrophobicContact CG2-CB 3.85Å; L51-A66 WeakPolarHBondContact CD2-O 3.24Å; K54-A66 HydrophobicContact CB-CB 3.58Å; I55-A66 HydrophobicContact CG1-CB 3.68Å; E62-A66 VanDerWaalsContact O-CB 3.3Å; E62-A66 WeakPolarHBondContact O-CB 3.43Å; E62-A66 PolarHBondContact O-N 2.99Å; A63-A66 PolarHBondContact O-N 3.48Å; M64-A66 VanDerWaalsContact C-N 3.34Å; A66-L68 VanDerWaalsContact C-N 3.35Å; A66-V69 PolarHBondContact O-N 3.46Å; A66-L70 WeakPolarHBondContact O-CB 3.38Å; A66-L70 PolarHBondContact O-N 3.35Å
67	L	96.9	Very high	93.9	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-67.3	-33.8	172.4	-70.8	166.4	0	0	0	112.3	I55 A63 M64 Q65 L70 E71 A111 K114 V115 L118	I55-L67 HydrophobicContact CD1-CD2 3.94Å; I55-L67 HydrophobicContact CG1-CD2 3.98Å; I55-L67 HydrophobicContact CG1-CG 4.1Å; I55-L67 HydrophobicContact CG2-CD2 3.72Å; I55-L67 HydrophobicContact CG2-CG 4.08Å; A63-L67 VanDerWaalsContact O-CG 3.27Å; A63-L67 WeakPolarHBondContact O-CG 3.48Å; A63-L67 PolarHBondContact O-N 3.38Å; M64-L67 PolarHBondContact O-N 3.36Å; M64-L67 HydrophobicContact SD-CD1 4.32Å; Q65-L67 PolarHBondContact O-N 2.89Å; L67-L70 HydrophobicContact CD2-CD2 4.47Å; L67-L70 PolarHBondContact O-N 2.77Å; L67-E71 WeakPolarHBondContact O-CB 3.4Å; L67-E71 PolarHBondContact O-N 3.44Å; L67-A111 HydrophobicContact CD1-CB 4.1Å; L67-K114 HydrophobicContact CB-CG 4.08Å; L67-K114 HydrophobicContact CD1-CB 3.99Å; L67-K114 HydrophobicContact CD1-CG 3.95Å; L67-V115 HydrophobicContact CD1-CG2 4.08Å; L67-V115 HydrophobicContact CD2-CG2 3.6Å; L67-V115 HydrophobicContact CG-CG2 4.5Å; L67-L118 HydrophobicContact CB-CD1 4.41Å; L67-L118 HydrophobicContact CD2-CD1 3.95Å
68	L	95.1	Very high	93.4	Very high	34 Å²	34	39 Å²	39	18%	0.178	20%	0.199	C	C	.	.	H	α-helix	trans	-69.2	-40.2	173.2	-179.3	61.5	0	0	0	112.3	T25 W27 I30 M64 Q65 A66 E71 T72	T25-L68 HydrophobicContact CG2-CD2 3.65Å; W27-L68 HydrophobicContact CH2-CD1 4.19Å; W27-L68 HydrophobicContact CH2-CD2 4.36Å; W27-L68 HydrophobicContact CZ2-CD2 4.45Å; I30-L68 HydrophobicContact CD1-CD2 4.19Å; I30-L68 HydrophobicContact CD1-CG 4.34Å; M64-L68 PolarHBondContact O-N 3.41Å; Q65-L68 WeakPolarHBondContact O-CB 3.35Å; Q65-L68 PolarHBondContact O-N 3.41Å; A66-L68 VanDerWaalsContact C-N 3.35Å; L68-E71 PolarHBondContact O-N 2.92Å; L68-T72 WeakPolarHBondContact O-CB 3.38Å; L68-T72 PolarHBondContact O-N 2.81Å; L68-T72 PolarHBondContact O-OG1 3.26Å
69	V	96.5	Very high	93.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.3	-49.9	171.2	178.8	0	0	0	0	109.5	A17 T18 I30 F33 L51 Q65 A66 E71 T72 C73	A17-V69 HydrophobicContact CB-CG2 4.05Å; T18-V69 HydrophobicContact CG2-CG2 4.43Å; I30-V69 HydrophobicContact CD1-CG2 4.42Å; I30-V69 HydrophobicContact CG1-CG2 3.9Å; F33-V69 HydrophobicContact CD1-CG1 3.45Å; F33-V69 VanDerWaalsContact CD1-CG1 3.45Å; F33-V69 HydrophobicContact CE1-CG1 3.71Å; F33-V69 HydrophobicContact CG-CG1 4.24Å; L51-V69 HydrophobicContact CD2-CB 3.89Å; L51-V69 HydrophobicContact CD2-CG1 3.75Å; Q65-V69 VanDerWaalsContact O-CG2 3.29Å; Q65-V69 WeakPolarHBondContact O-CG2 3.43Å; Q65-V69 PolarHBondContact O-N 3.38Å; A66-V69 PolarHBondContact O-N 3.46Å; V69-E71 PolarHBondContact O-N 3.15Å; V69-T72 PolarHBondContact O-N 3.16Å; V69-T72 VanDerWaalsContact O-N 3.15Å; V69-C73 PolarHBondContact O-N 3.03Å; V69-C73 PolarHBondContact O-SG 3.21Å
70	L	96.8	Very high	93	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.6	-45.9	177.9	175.9	60.1	0	0	0	112.5	L51 I55 A66 L67 T72 C73 M74 F81 V85 F90 L118 W122	L51-L70 HydrophobicContact CD1-CB 4.36Å; L51-L70 HydrophobicContact CD1-CD1 4.11Å; L51-L70 HydrophobicContact CD2-CB 4.32Å; I55-L70 HydrophobicContact CD1-CB 4.42Å; I55-L70 HydrophobicContact CD1-CD2 3.66Å; A66-L70 WeakPolarHBondContact O-CB 3.38Å; A66-L70 PolarHBondContact O-N 3.35Å; L67-L70 HydrophobicContact CD2-CD2 4.47Å; L67-L70 PolarHBondContact O-N 2.77Å; L70-T72 VanDerWaalsContact C-N 3.3Å; L70-T72 PolarHBondContact O-N 2.82Å; L70-C73 PolarHBondContact O-N 2.79Å; L70-M74 HydrophobicContact CD1-CG 4.2Å; L70-M74 WeakPolarHBondContact O-CB 3.49Å; L70-M74 VanDerWaalsContact O-CG 3.26Å; L70-M74 WeakPolarHBondContact O-CG 3.41Å; L70-M74 PolarHBondContact O-N 2.9Å; L70-F81 HydrophobicContact CD1-CE1 4.18Å; L70-F81 HydrophobicContact CD1-CZ 3.94Å; L70-V85 HydrophobicContact CD1-CG2 4.13Å; L70-F90 HydrophobicContact CD1-CE1 4.03Å; L70-F90 HydrophobicContact CD1-CZ 3.82Å; L70-F90 HydrophobicContact CD2-CE1 4.01Å; L70-F90 HydrophobicContact CD2-CZ 3.71Å; L70-F90 HydrophobicContact CG-CZ 4.44Å; L70-L118 HydrophobicContact CD2-CD1 4.46Å; L70-W122 HydrophobicContact CD1-CH2 4.41Å; L70-W122 HydrophobicContact CD2-CH2 3.75Å; L70-W122 HydrophobicContact CD2-CZ2 4.3Å; L70-W122 HydrophobicContact CG-CH2 4.04Å; L70-W122 HydrophobicContact CG-CZ2 4.14Å
71	E	93.6	Very high	93	Very high	19 Å²	19	38.4 Å²	38.4	9%	0.089	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-39	176.9	-169.4	-174.2	141.7	0	0	112.1	L67 L68 V69 M74 R75 K114 L118	L67-E71 WeakPolarHBondContact O-CB 3.4Å; L67-E71 PolarHBondContact O-N 3.44Å; L68-E71 PolarHBondContact O-N 2.92Å; V69-E71 PolarHBondContact O-N 3.15Å; E71-M74 PolarHBondContact O-N 3.08Å; E71-R75 PolarHBondContact O-N 2.83Å; E71-R75 VanDerWaalsContact O-N 3.13Å; E71-R75 IonicContact OE1-CZ 2.69Å; E71-R75 IonicContact OE1-NH1 3.57Å; E71-R75 PolarHBondContact OE1-NH1 2.82Å; E71-R75 IonicContact OE1-NH2 3.61Å; E71-R75 PolarHBondContact OE1-NH2 2.85Å; E71-K114 WeakPolarHBondContact OE2-CE 3.3Å; E71-K114 IonicContact OE2-NZ 3.43Å; E71-K114 PolarHBondContact OE2-NZ 2.77Å; E71-L118 HydrophobicContact CB-CD2 3.88Å; E71-L118 HydrophobicContact CG-CD2 3.68Å
72	T	92.5	Very high	93	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.031	16%	0.164	C	C	.	.	H	α-helix	trans	-71.5	-42.3	178.9	-53	0	0	0	0	111.3	I30 L68 V69 L70 M74 R75 N76	I30-T72 HydrophobicContact CG2-CG2 3.82Å; L68-T72 WeakPolarHBondContact O-CB 3.38Å; L68-T72 PolarHBondContact O-N 2.81Å; L68-T72 PolarHBondContact O-OG1 3.26Å; V69-T72 PolarHBondContact O-N 3.16Å; V69-T72 VanDerWaalsContact O-N 3.15Å; L70-T72 VanDerWaalsContact C-N 3.3Å; L70-T72 PolarHBondContact O-N 2.82Å; T72-M74 VanDerWaalsContact C-N 3.33Å; T72-M74 PolarHBondContact O-N 3.32Å; T72-R75 PolarHBondContact O-N 2.92Å; T72-N76 WeakPolarHBondContact O-CB 3.44Å; T72-N76 PolarHBondContact O-N 2.87Å
73	C	93.3	Very high	92.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-39.2	170.9	-65.4	0	0	0	0	112.1	C34 L37 V69 L70 R75 N76 C77 F81	C34-C73 PolarHBondContact SG-SG 2.95Å; L37-C73 HydrophobicContact CD1-CB 4.34Å; V69-C73 PolarHBondContact O-N 3.03Å; V69-C73 PolarHBondContact O-SG 3.21Å; L70-C73 PolarHBondContact O-N 2.79Å; C73-R75 VanDerWaalsContact C-N 3.28Å; C73-R75 PolarHBondContact O-N 2.93Å; C73-N76 PolarHBondContact O-N 2.87Å; C73-C77 WeakPolarHBondContact O-CA 3.41Å; C73-C77 WeakPolarHBondContact O-CB 3.21Å; C73-C77 PolarHBondContact O-N 2.87Å; C73-C77 PolarHBondContact O-SG 3.35Å; C73-C77 VanDerWaalsContact O-SG 3.39Å; C73-F81 HydrophobicContact CB-CD1 3.89Å; C73-F81 HydrophobicContact CB-CE1 3.3Å; C73-F81 HydrophobicContact CB-CZ 3.72Å
74	M	92.1	Very high	92.7	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-67.2	-27.4	177.2	-72.8	-64.4	-77.4	0	0	113.1	L70 E71 T72 F81 H82 V85 W122 L126	L70-M74 HydrophobicContact CD1-CG 4.2Å; L70-M74 WeakPolarHBondContact O-CB 3.49Å; L70-M74 VanDerWaalsContact O-CG 3.26Å; L70-M74 WeakPolarHBondContact O-CG 3.41Å; L70-M74 PolarHBondContact O-N 2.9Å; E71-M74 PolarHBondContact O-N 3.08Å; T72-M74 VanDerWaalsContact C-N 3.33Å; T72-M74 PolarHBondContact O-N 3.32Å; M74-F81 HydrophobicContact CG-CE1 4Å; M74-F81 HydrophobicContact SD-CD1 3.85Å; M74-F81 HydrophobicContact SD-CE1 3.72Å; M74-H82 PolarHBondContact O-NE2 3.49Å; M74-V85 HydrophobicContact CE-CB 4.31Å; M74-V85 HydrophobicContact CE-CG1 3.84Å; M74-V85 HydrophobicContact SD-CB 3.88Å; M74-V85 HydrophobicContact SD-CG1 3.82Å; M74-V85 HydrophobicContact SD-CG2 3.76Å; M74-W122 HydrophobicContact CE-CD2 3.89Å; M74-W122 HydrophobicContact CE-CG 4Å; M74-W122 HydrophobicContact CE-CZ2 4.35Å; M74-W122 HydrophobicContact CG-CZ2 3.77Å; M74-L126 HydrophobicContact CE-CD1 3.39Å
75	R	89	Confident	92.7	Very high	109 Å²	109	34.2 Å²	34.2	41%	0.411	17%	0.168	S	C	.	.	H	α-helix	trans	-79.3	-44.7	171.8	-79	-171.7	-76.3	-110.2	-5.4	113.4	E71 T72 C73 L157	E71-R75 PolarHBondContact O-N 2.83Å; E71-R75 VanDerWaalsContact O-N 3.13Å; E71-R75 IonicContact OE1-CZ 2.69Å; E71-R75 IonicContact OE1-NH1 3.57Å; E71-R75 PolarHBondContact OE1-NH1 2.82Å; E71-R75 IonicContact OE1-NH2 3.61Å; E71-R75 PolarHBondContact OE1-NH2 2.85Å; T72-R75 PolarHBondContact O-N 2.92Å; C73-R75 VanDerWaalsContact C-N 3.28Å; C73-R75 PolarHBondContact O-N 2.93Å; R75-L157 HydrophobicContact CG-CD2 3.49Å; R75-L157 VanDerWaalsContact CG-CD2 3.49Å
76	N	86	Confident	92.5	Very high	97 Å²	97	33.7 Å²	33.7	52%	0.519	17%	0.165	S	C	.	.	H	α-helix	trans	-96.9	-26.5	-165.9	-63.3	0.8	0	0	0	113.5	T72 C73	T72-N76 WeakPolarHBondContact O-CB 3.44Å; T72-N76 PolarHBondContact O-N 2.87Å; C73-N76 PolarHBondContact O-N 2.87Å
77	C	85.1	Confident	92.4	Very high	4 Å²	4	37.4 Å²	37.4	3%	0.027	18%	0.181	C	C	.	.	S	Bend	trans	-90.1	150.5	-179	-52	0	0	0	0	111.7	L37 N38 C73 F81 H82	L37-C77 HydrophobicContact CD2-CB 4.13Å; N38-C77 PolarHBondContact ND2-SG 3.16Å; N38-C77 WeakPolarHBondContact OD1-CB 3.46Å; C73-C77 WeakPolarHBondContact O-CA 3.41Å; C73-C77 WeakPolarHBondContact O-CB 3.21Å; C73-C77 PolarHBondContact O-N 2.87Å; C73-C77 PolarHBondContact O-SG 3.35Å; C73-C77 VanDerWaalsContact O-SG 3.39Å; C77-F81 HydrophobicContact CB-CB 3.8Å; C77-F81 HydrophobicContact CB-CD1 4.13Å; C77-F81 HydrophobicContact CB-CG 4.17Å; C77-H82 PolarHBondContact O-CE1 3.35Å; C77-H82 PolarHBondContact O-NE2 2.99Å; C77-H82 VanDerWaalsContact O-NE2 3.14Å
78	G	85.1	Confident	92.4	Very high	39 Å²	39	41.2 Å²	41.2	40%	0.402	20%	0.198	S	C	.	.			trans	-80.5	-175.7	-176.9	0	0	0	0	0	115	R80 F81 H82	G78-R80 PolarHBondContact O-N 2.83Å; G78-F81 PolarHBondContact O-N 3.12Å; G78-H82 PolarHBondContact O-N 2.94Å
79	K	87.3	Confident	92.4	Very high	168 Å²	168	49 Å²	49	73%	0.73	23%	0.225	S	C	*	.	H	α-helix	trans	-46.6	-34.7	-177	-65.9	-173.4	177.6	-173.7	0	114.9	F81 H82 S83	K79-F81 PolarHBondContact O-N 3.46Å; K79-H82 PolarHBondContact O-N 3.17Å; K79-S83 PolarHBondContact O-N 2.97Å; K79-S83 PolarHBondContact O-OG 3.02Å
80	R	91.6	Very high	92.4	Very high	134 Å²	134	49.3 Å²	49.3	51%	0.506	23%	0.226	S	C	.	.	H	α-helix	trans	-56.7	-37.7	178.7	-61.7	-175.2	74.3	-136.3	-4.4	112.2	D40 L41 P44 G78	D40-R80 PolarHBondContact O-NH1 2.91Å; L41-R80 PolarHBondContact O-NH2 2.73Å; P44-R80 HydrophobicContact CG-CB 4.24Å; G78-R80 PolarHBondContact O-N 2.83Å
81	F	94.3	Very high	92.4	Very high	1 Å²	1	49.3 Å²	49.3	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-78.8	-43.1	176.5	-175	-113.9	0	0	0	112	L37 P44 A47 T48 L51 L70 C73 M74 C77 G78 K79 S83 E84 V85	L37-F81 HydrophobicContact CD1-CD2 3.75Å; L37-F81 HydrophobicContact CD1-CE2 3.72Å; L37-F81 HydrophobicContact CD1-CG 4.34Å; L37-F81 HydrophobicContact CD1-CZ 4.31Å; L37-F81 HydrophobicContact CD2-CB 4.03Å; L37-F81 HydrophobicContact CD2-CD2 3.88Å; L37-F81 HydrophobicContact CD2-CG 4.08Å; L37-F81 HydrophobicContact CG-CD2 4.25Å; P44-F81 HydrophobicContact CB-CD2 4.34Å; A47-F81 HydrophobicContact CB-CE2 4.32Å; T48-F81 HydrophobicContact CG2-CD2 4.33Å; T48-F81 HydrophobicContact CG2-CE2 3.69Å; T48-F81 HydrophobicContact CG2-CZ 4.35Å; L51-F81 HydrophobicContact CD1-CE2 4.44Å; L51-F81 HydrophobicContact CD1-CZ 3.99Å; L70-F81 HydrophobicContact CD1-CE1 4.18Å; L70-F81 HydrophobicContact CD1-CZ 3.94Å; C73-F81 HydrophobicContact CB-CD1 3.89Å; C73-F81 HydrophobicContact CB-CE1 3.3Å; C73-F81 HydrophobicContact CB-CZ 3.72Å; M74-F81 HydrophobicContact CG-CE1 4Å; M74-F81 HydrophobicContact SD-CD1 3.85Å; M74-F81 HydrophobicContact SD-CE1 3.72Å; C77-F81 HydrophobicContact CB-CB 3.8Å; C77-F81 HydrophobicContact CB-CD1 4.13Å; C77-F81 HydrophobicContact CB-CG 4.17Å; G78-F81 PolarHBondContact O-N 3.12Å; K79-F81 PolarHBondContact O-N 3.46Å; F81-S83 VanDerWaalsContact C-N 3.28Å; F81-S83 PolarHBondContact O-N 2.69Å; F81-E84 PolarHBondContact O-N 3.07Å; F81-V85 HydrophobicContact CD1-CG2 4.24Å; F81-V85 HydrophobicContact CE1-CG2 3.75Å; F81-V85 HydrophobicContact CE2-CG2 4.08Å; F81-V85 HydrophobicContact CZ-CG2 3.67Å; F81-V85 PolarHBondContact O-N 3.38Å
82	H	93.9	Very high	92.5	Very high	15 Å²	15	51.9 Å²	51.9	7%	0.069	24%	0.241	C	C	.	.	H	α-helix	trans	-54.7	-43.9	177.1	-58.2	159.2	0	0	0	111.8	M74 C77 G78 K79 E84 V85 G86 L126	M74-H82 PolarHBondContact O-NE2 3.49Å; C77-H82 PolarHBondContact O-CE1 3.35Å; C77-H82 PolarHBondContact O-NE2 2.99Å; C77-H82 VanDerWaalsContact O-NE2 3.14Å; G78-H82 PolarHBondContact O-N 2.94Å; K79-H82 PolarHBondContact O-N 3.17Å; H82-E84 PolarHBondContact O-N 3.17Å; H82-V85 PolarHBondContact O-N 3.48Å; H82-G86 PolarHBondContact O-N 3.03Å; H82-L126 HydrophobicContact CB-CD1 4.3Å
83	S	92.6	Very high	92.7	Very high	49 Å²	49	53.8 Å²	53.8	34%	0.343	25%	0.249	S	C	.	.	H	α-helix	trans	-76.6	-13.1	178.9	-59.8	0	0	0	0	115	K79 F81 K87 E129	K79-S83 PolarHBondContact O-N 2.97Å; K79-S83 PolarHBondContact O-OG 3.02Å; F81-S83 VanDerWaalsContact C-N 3.28Å; F81-S83 PolarHBondContact O-N 2.69Å; S83-K87 VanDerWaalsContact O-CE 3.27Å; S83-K87 WeakPolarHBondContact O-CE 3.35Å; S83-K87 WeakPolarHBondContact O-CG 3.28Å; S83-E129 VanDerWaalsContact CA-OE1 3.26Å; S83-E129 WeakPolarHBondContact CA-OE1 3.33Å; S83-E129 VanDerWaalsContact CB-OE1 3.31Å; S83-E129 WeakPolarHBondContact CB-OE1 3.06Å; S83-E129 PolarHBondContact OG-OE1 3.03Å
84	E	94.7	Very high	92.9	Very high	30 Å²	30	53.9 Å²	53.9	14%	0.14	25%	0.25	C	C	.	.	H	α-helix	trans	-80.5	-42.3	164	-69.3	-54.5	148.1	0	0	111	P44 Q45 T48 F81 H82 G86 K87	P44-E84 HydrophobicContact CB-CB 4.48Å; P44-E84 HydrophobicContact CB-CG 3.74Å; Q45-E84 HydrophobicContact CG-CG 4.13Å; T48-E84 HydrophobicContact CG2-CB 3.88Å; F81-E84 PolarHBondContact O-N 3.07Å; H82-E84 PolarHBondContact O-N 3.17Å; E84-G86 VanDerWaalsContact C-N 3.3Å; E84-G86 PolarHBondContact O-N 3.28Å; E84-K87 WeakPolarHBondContact O-CB 3.38Å; E84-K87 PolarHBondContact O-N 3.4Å; E84-K87 IonicContact OE1-NZ 2.74Å; E84-K87 PolarHBondContact OE1-NZ 3.19Å; E84-K87 WeakPolarHBondContact OE2-CD 3.45Å; E84-K87 WeakPolarHBondContact OE2-CE 3.21Å; E84-K87 IonicContact OE2-NZ 3.07Å; E84-K87 PolarHBondContact OE2-NZ 3Å
85	V	95.6	Very high	93	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-36.3	175.6	169.7	0	0	0	0	111.6	T48 L70 M74 F81 H82 K87 F90 L91 W122	T48-V85 HydrophobicContact CG2-CG2 3.85Å; L70-V85 HydrophobicContact CD1-CG2 4.13Å; M74-V85 HydrophobicContact CE-CB 4.31Å; M74-V85 HydrophobicContact CE-CG1 3.84Å; M74-V85 HydrophobicContact SD-CB 3.88Å; M74-V85 HydrophobicContact SD-CG1 3.82Å; M74-V85 HydrophobicContact SD-CG2 3.76Å; F81-V85 HydrophobicContact CD1-CG2 4.24Å; F81-V85 HydrophobicContact CE1-CG2 3.75Å; F81-V85 HydrophobicContact CE2-CG2 4.08Å; F81-V85 HydrophobicContact CZ-CG2 3.67Å; F81-V85 PolarHBondContact O-N 3.38Å; H82-V85 PolarHBondContact O-N 3.48Å; V85-K87 PolarHBondContact O-N 2.82Å; V85-F90 HydrophobicContact CB-CD1 4.1Å; V85-F90 HydrophobicContact CB-CE1 4.35Å; V85-F90 HydrophobicContact CG1-CD1 3.86Å; V85-F90 HydrophobicContact CG1-CE1 3.89Å; V85-F90 HydrophobicContact CG2-CD1 4.09Å; V85-F90 HydrophobicContact CG2-CE1 4.03Å; V85-L91 WeakPolarHBondContact O-CD2 2.96Å; V85-L91 WeakPolarHBondContact O-CG 3.3Å; V85-W122 HydrophobicContact CG1-CE3 4.16Å; V85-W122 HydrophobicContact CG1-CH2 4.21Å; V85-W122 HydrophobicContact CG1-CZ3 3.89Å
86	G	94.1	Very high	93.4	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-9.6	175.6	0	0	0	0	0	115.2	H82 E84 K131	H82-G86 PolarHBondContact O-N 3.03Å; E84-G86 VanDerWaalsContact C-N 3.3Å; E84-G86 PolarHBondContact O-N 3.28Å; G86-K131 VanDerWaalsContact O-CB 3.23Å; G86-K131 WeakPolarHBondContact O-CB 3.21Å; G86-K131 WeakPolarHBondContact O-CD 3.45Å
87	K	95.3	Very high	93.8	Very high	77 Å²	77	47.6 Å²	47.6	34%	0.335	22%	0.221	S	C	.	.	S	Bend	trans	-79.9	140.9	176.5	-69.4	169.3	-165.7	175.3	0	111.1	S83 E84 V85 R89 F90 L91	S83-K87 VanDerWaalsContact O-CE 3.27Å; S83-K87 WeakPolarHBondContact O-CE 3.35Å; S83-K87 WeakPolarHBondContact O-CG 3.28Å; E84-K87 WeakPolarHBondContact O-CB 3.38Å; E84-K87 PolarHBondContact O-N 3.4Å; E84-K87 IonicContact OE1-NZ 2.74Å; E84-K87 PolarHBondContact OE1-NZ 3.19Å; E84-K87 WeakPolarHBondContact OE2-CD 3.45Å; E84-K87 WeakPolarHBondContact OE2-CE 3.21Å; E84-K87 IonicContact OE2-NZ 3.07Å; E84-K87 PolarHBondContact OE2-NZ 3Å; V85-K87 PolarHBondContact O-N 2.82Å; K87-R89 HydrophobicContact CB-CB 4.38Å; K87-R89 PolarHBondContact O-N 3.33Å; K87-F90 PolarHBondContact O-N 2.89Å; K87-L91 PolarHBondContact O-N 3.33Å
88	F	95.4	Very high	94.3	Very high	83 Å²	83	47.8 Å²	47.8	36%	0.364	22%	0.222	S	C	.	.	H	α-helix	trans	-52.8	-25.8	169.8	-68.6	-56.3	0	0	0	113.5	F90 L91 N92 K131 D134	F88-F90 VanDerWaalsContact C-N 3.25Å; F88-F90 PolarHBondContact O-N 3.28Å; F88-L91 HydrophobicContact CD1-CD1 4.27Å; F88-N92 WeakPolarHBondContact O-CB 3.39Å; F88-N92 PolarHBondContact O-N 2.95Å; F88-N92 PolarHBondContact O-ND2 3.4Å; F88-K131 HydrophobicContact CD1-CB 4.47Å; F88-K131 HydrophobicContact CD2-CD 3.99Å; F88-K131 HydrophobicContact CD2-CG 4.19Å; F88-K131 HydrophobicContact CE1-CB 3.97Å; F88-K131 HydrophobicContact CE1-CG 4.43Å; F88-K131 HydrophobicContact CE2-CB 4.07Å; F88-K131 HydrophobicContact CE2-CD 3.9Å; F88-K131 HydrophobicContact CE2-CG 3.62Å; F88-K131 HydrophobicContact CZ-CB 3.74Å; F88-K131 HydrophobicContact CZ-CD 4.44Å; F88-K131 HydrophobicContact CZ-CG 3.75Å; F88-D134 HydrophobicContact CZ-CB 4.25Å
89	R	94.8	Very high	94.6	Very high	197 Å²	197	46 Å²	46	74%	0.743	20%	0.204	S	C	*	.	H	α-helix	trans	-54.4	-39.4	172.1	-173.3	-179	-179.7	106.7	4.7	112.8	K87	K87-R89 HydrophobicContact CB-CB 4.38Å; K87-R89 PolarHBondContact O-N 3.33Å
90	F	97.4	Very high	94.7	Very high	6 Å²	6	42 Å²	42	3%	0.026	19%	0.194	C	C	.	.	H	α-helix	trans	-92.5	-44.1	177	-178.2	-105.2	0	0	0	111.8	T48 L51 A52 I55 L70 V85 K87 F88 N92 E93 L94	T48-F90 HydrophobicContact CG2-CD2 4.08Å; T48-F90 HydrophobicContact CG2-CE2 4.42Å; T48-F90 HydrophobicContact CG2-CG 4.26Å; T48-F90 WeakPolarHBondContact O-CD2 3.32Å; T48-F90 VanDerWaalsContact O-CE2 3.25Å; T48-F90 WeakPolarHBondContact O-CE2 3.4Å; L51-F90 HydrophobicContact CB-CE2 4.32Å; A52-F90 HydrophobicContact CB-CD2 4.12Å; A52-F90 HydrophobicContact CB-CE2 4.01Å; I55-F90 HydrophobicContact CD1-CZ 4.48Å; L70-F90 HydrophobicContact CD1-CE1 4.03Å; L70-F90 HydrophobicContact CD1-CZ 3.82Å; L70-F90 HydrophobicContact CD2-CE1 4.01Å; L70-F90 HydrophobicContact CD2-CZ 3.71Å; L70-F90 HydrophobicContact CG-CZ 4.44Å; V85-F90 HydrophobicContact CB-CD1 4.1Å; V85-F90 HydrophobicContact CB-CE1 4.35Å; V85-F90 HydrophobicContact CG1-CD1 3.86Å; V85-F90 HydrophobicContact CG1-CE1 3.89Å; V85-F90 HydrophobicContact CG2-CD1 4.09Å; V85-F90 HydrophobicContact CG2-CE1 4.03Å; K87-F90 PolarHBondContact O-N 2.89Å; F88-F90 VanDerWaalsContact C-N 3.25Å; F88-F90 PolarHBondContact O-N 3.28Å; F90-N92 PolarHBondContact O-N 3.22Å; F90-E93 WeakPolarHBondContact O-CB 3.42Å; F90-E93 PolarHBondContact O-N 2.94Å; F90-L94 HydrophobicContact CD1-CD1 4.33Å; F90-L94 HydrophobicContact CE1-CD1 3.78Å; F90-L94 HydrophobicContact CE1-CD2 4.41Å; F90-L94 HydrophobicContact CE1-CG 4.1Å; F90-L94 HydrophobicContact CZ-CD1 4.42Å; F90-L94 HydrophobicContact CZ-CD2 4.25Å; F90-L94 HydrophobicContact CZ-CG 4.39Å; F90-L94 PolarHBondContact O-N 3.46Å
91	L	96.8	Very high	94.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.1	-35.7	179.6	-60.2	172.2	0	0	0	112.5	V85 K87 F88 E93 L94 I95 K131 I132 A135	V85-L91 WeakPolarHBondContact O-CD2 2.96Å; V85-L91 WeakPolarHBondContact O-CG 3.3Å; K87-L91 PolarHBondContact O-N 3.33Å; F88-L91 HydrophobicContact CD1-CD1 4.27Å; L91-E93 VanDerWaalsContact C-N 3.26Å; L91-E93 PolarHBondContact O-N 2.9Å; L91-L94 PolarHBondContact O-N 3.27Å; L91-I95 WeakPolarHBondContact O-CD1 3.26Å; L91-I95 VanDerWaalsContact O-CG1 3.26Å; L91-I95 WeakPolarHBondContact O-CG1 3.5Å; L91-I95 PolarHBondContact O-N 2.97Å; L91-K131 HydrophobicContact CD1-CB 4.12Å; L91-K131 WeakPolarHBondContact CD1-O 3.4Å; L91-I132 HydrophobicContact CD1-CG1 4.15Å; L91-I132 HydrophobicContact CD2-CG1 4.3Å; L91-A135 HydrophobicContact CB-CB 4.5Å; L91-A135 HydrophobicContact CD1-CB 4.19Å
92	N	95.4	Very high	94.5	Very high	73 Å²	73	50.7 Å²	50.7	39%	0.39	23%	0.233	S	C	.	.	H	α-helix	trans	-62.9	-31.6	176.5	-72.5	-13.8	0	0	0	112.6	F88 F90 I95 K96	F88-N92 WeakPolarHBondContact O-CB 3.39Å; F88-N92 PolarHBondContact O-N 2.95Å; F88-N92 PolarHBondContact O-ND2 3.4Å; F90-N92 PolarHBondContact O-N 3.22Å; N92-I95 PolarHBondContact O-N 2.96Å; N92-K96 WeakPolarHBondContact O-CG 3.49Å; N92-K96 PolarHBondContact O-N 2.66Å
93	E	97.4	Very high	94.4	Very high	46 Å²	46	52.7 Å²	52.7	22%	0.215	24%	0.244	C	C	.	.	H	α-helix	trans	-70.4	-37.6	176.1	-55.6	-53.1	130.6	0	0	111.2	A52 Q56 F90 L91 K96 V97	A52-E93 HydrophobicContact CB-CB 3.75Å; A52-E93 HydrophobicContact CB-CG 3.87Å; Q56-E93 PolarHBondContact NE2-OE2 2.99Å; F90-E93 WeakPolarHBondContact O-CB 3.42Å; F90-E93 PolarHBondContact O-N 2.94Å; L91-E93 VanDerWaalsContact C-N 3.26Å; L91-E93 PolarHBondContact O-N 2.9Å; E93-K96 PolarHBondContact O-N 3.11Å; E93-K96 WeakPolarHBondContact OE1-CE 3.38Å; E93-K96 IonicContact OE1-NZ 2.65Å; E93-K96 PolarHBondContact OE1-NZ 3.26Å; E93-K96 IonicContact OE2-NZ 2.75Å; E93-K96 PolarHBondContact OE2-NZ 2.91Å; E93-V97 PolarHBondContact O-N 3.44Å
94	L	96.9	Very high	94.1	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-67.4	-40.8	170.6	-59.2	-174.6	0	0	0	112	I55 F90 L91 K96 V97 V98 V115 I119 W122	I55-L94 HydrophobicContact CD1-CD2 4.07Å; I55-L94 HydrophobicContact CG2-CD2 4.03Å; F90-L94 HydrophobicContact CD1-CD1 4.33Å; F90-L94 HydrophobicContact CE1-CD1 3.78Å; F90-L94 HydrophobicContact CE1-CD2 4.41Å; F90-L94 HydrophobicContact CE1-CG 4.1Å; F90-L94 HydrophobicContact CZ-CD1 4.42Å; F90-L94 HydrophobicContact CZ-CD2 4.25Å; F90-L94 HydrophobicContact CZ-CG 4.39Å; F90-L94 PolarHBondContact O-N 3.46Å; L91-L94 PolarHBondContact O-N 3.27Å; L94-K96 VanDerWaalsContact C-N 3.3Å; L94-K96 PolarHBondContact O-N 3.31Å; L94-V97 WeakPolarHBondContact O-CB 3.23Å; L94-V97 PolarHBondContact O-N 2.96Å; L94-V97 VanDerWaalsContact O-N 3.12Å; L94-V98 PolarHBondContact O-N 2.82Å; L94-V115 HydrophobicContact CB-CG1 3.9Å; L94-V115 HydrophobicContact CD2-CG2 4.41Å; L94-I119 HydrophobicContact CB-CD1 4.2Å; L94-I119 HydrophobicContact CD1-CD1 4.32Å; L94-I119 HydrophobicContact CD1-CG1 4.22Å; L94-W122 HydrophobicContact CD1-CH2 4.18Å; L94-W122 HydrophobicContact CD1-CZ3 3.85Å
95	I	95.3	Very high	93.8	Very high	12 Å²	12	53.6 Å²	53.6	6%	0.062	26%	0.255	C	S	.	.	H	α-helix	trans	-59.8	-39.6	176.1	-71.1	157.1	0	0	0	111	L91 N92 V97 V98 S99 A135 M138 L139	L91-I95 WeakPolarHBondContact O-CD1 3.26Å; L91-I95 VanDerWaalsContact O-CG1 3.26Å; L91-I95 WeakPolarHBondContact O-CG1 3.5Å; L91-I95 PolarHBondContact O-N 2.97Å; N92-I95 PolarHBondContact O-N 2.96Å; I95-V97 VanDerWaalsContact C-N 3.28Å; I95-V97 PolarHBondContact O-N 3.27Å; I95-V98 PolarHBondContact O-N 2.92Å; I95-S99 WeakPolarHBondContact O-CB 3.37Å; I95-S99 PolarHBondContact O-N 3.48Å; I95-A135 HydrophobicContact CD1-CB 4.1Å; I95-M138 HydrophobicContact CD1-CE 3.66Å; I95-M138 HydrophobicContact CG1-CE 4.21Å; I95-M138 HydrophobicContact CG2-CE 4.13Å; I95-L139 HydrophobicContact CG1-CD1 4.35Å; I95-L139 HydrophobicContact CG1-CD2 4.34Å; I95-L139 HydrophobicContact CG1-CG 4.49Å; I95-L139 HydrophobicContact CG2-CD2 4.25Å
96	K	95.8	Very high	93.5	Very high	63 Å²	63	64.2 Å²	64.2	27%	0.274	30%	0.295	S	S	.	.	H	α-helix	trans	-59.1	-38.5	175.1	-72.9	169.8	-163.6	172.3	0	112.5	N92 E93 L94 Y102 L103 G104	N92-K96 WeakPolarHBondContact O-CG 3.49Å; N92-K96 PolarHBondContact O-N 2.66Å; E93-K96 PolarHBondContact O-N 3.11Å; E93-K96 WeakPolarHBondContact OE1-CE 3.38Å; E93-K96 IonicContact OE1-NZ 2.65Å; E93-K96 PolarHBondContact OE1-NZ 3.26Å; E93-K96 IonicContact OE2-NZ 2.75Å; E93-K96 PolarHBondContact OE2-NZ 2.91Å; L94-K96 VanDerWaalsContact C-N 3.3Å; L94-K96 PolarHBondContact O-N 3.31Å; K96-Y102 HydrophobicContact CB-CG 4.39Å; K96-Y102 HydrophobicContact CG-CD1 4.24Å; K96-Y102 HydrophobicContact CG-CD2 4.4Å; K96-Y102 HydrophobicContact CG-CG 4.02Å; K96-Y102 WeakPolarHBondContact O-CB 3.49Å; K96-L103 WeakPolarHBondContact O-CA 3.32Å; K96-L103 WeakPolarHBondContact O-CB 3.25Å; K96-L103 PolarHBondContact O-N 2.93Å; K96-G104 PolarHBondContact O-N 3.08Å
97	V	95.5	Very high	93.4	Very high	1 Å²	1	64.8 Å²	64.8	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-67.7	-38.5	-179.6	174.5	0	0	0	0	112	I55 Q56 E93 L94 I95 G104 S107 K112 V115	I55-V97 HydrophobicContact CG2-CG2 4.33Å; Q56-V97 HydrophobicContact CB-CG2 4.45Å; Q56-V97 HydrophobicContact CG-CG2 3.56Å; E93-V97 PolarHBondContact O-N 3.44Å; L94-V97 WeakPolarHBondContact O-CB 3.23Å; L94-V97 PolarHBondContact O-N 2.96Å; L94-V97 VanDerWaalsContact O-N 3.12Å; I95-V97 VanDerWaalsContact C-N 3.28Å; I95-V97 PolarHBondContact O-N 3.27Å; V97-G104 WeakPolarHBondContact O-CA 3.16Å; V97-G104 PolarHBondContact O-N 2.95Å; V97-S107 WeakPolarHBondContact O-CB 3.49Å; V97-S107 PolarHBondContact O-OG 2.67Å; V97-K112 HydrophobicContact CG1-CG 4.42Å; V97-K112 WeakPolarHBondContact O-CG 3.5Å; V97-V115 HydrophobicContact CG1-CG2 4.31Å
98	V	94.3	Very high	93.3	Very high	7 Å²	7	62.1 Å²	62.1	4%	0.042	29%	0.289	C	S	.	.	H	α-helix	trans	-90.4	-25.2	-179.2	-62.8	0	0	0	0	113.9	L94 I95 P100 K112 V115 L116 L139 I144	L94-V98 PolarHBondContact O-N 2.82Å; I95-V98 PolarHBondContact O-N 2.92Å; V98-P100 WeakPolarHBondContact O-CD 3.28Å; V98-K112 HydrophobicContact CG1-CB 4.27Å; V98-K112 HydrophobicContact CG1-CG 4.49Å; V98-V115 HydrophobicContact CG1-CB 3.81Å; V98-V115 HydrophobicContact CG1-CG1 3.6Å; V98-L116 HydrophobicContact CB-CD2 4.22Å; V98-L116 HydrophobicContact CG1-CD2 3.93Å; V98-L116 HydrophobicContact CG1-CG 4.02Å; V98-L116 HydrophobicContact CG2-CD2 4.24Å; V98-L139 HydrophobicContact CG2-CD1 4.01Å; V98-L139 HydrophobicContact CG2-CD2 3.72Å; V98-I144 HydrophobicContact CB-CG2 4.31Å; V98-I144 HydrophobicContact CG2-CG2 4.43Å
99	S	92.9	Very high	93.1	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.014	30%	0.301	C	S	.	.			trans	-80.6	124.7	-174.2	-176.6	0	0	0	0	112.3	I95 K101 Y102 G104	I95-S99 WeakPolarHBondContact O-CB 3.37Å; I95-S99 PolarHBondContact O-N 3.48Å; S99-K101 PolarHBondContact O-N 2.78Å; S99-K101 VanDerWaalsContact O-N 3.07Å; S99-Y102 PolarHBondContact O-N 3.13Å; S99-G104 WeakPolarHBondContact O-CA 3.39Å; S99-G104 PolarHBondContact O-N 2.97Å
100	P	89.4	Confident	92.9	Very high	83 Å²	83	56.8 Å²	56.8	54%	0.539	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-18.4	176.7	-25.1	35	0	0	0	114.7	V98 Y102 S105	V98-P100 WeakPolarHBondContact O-CD 3.28Å; P100-Y102 PolarHBondContact O-N 2.87Å; P100-S105 PolarHBondContact O-OG 2.92Å
101	K	89.4	Confident	92.8	Very high	169 Å²	169	56.5 Å²	56.5	74%	0.735	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-14.8	176.1	-65.9	-176.5	177.8	179.8	0	113.7	S99	S99-K101 PolarHBondContact O-N 2.78Å; S99-K101 VanDerWaalsContact O-N 3.07Å
102	Y	91.8	Very high	92.6	Very high	150 Å²	150	58 Å²	58	59%	0.588	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.5	-104.8	-176.8	-60.2	-81	0	0	0	110.2	K96 S99 P100	K96-Y102 HydrophobicContact CB-CG 4.39Å; K96-Y102 HydrophobicContact CG-CD1 4.24Å; K96-Y102 HydrophobicContact CG-CD2 4.4Å; K96-Y102 HydrophobicContact CG-CG 4.02Å; K96-Y102 WeakPolarHBondContact O-CB 3.49Å; S99-Y102 PolarHBondContact O-N 3.13Å; P100-Y102 PolarHBondContact O-N 2.87Å
103	L	90.6	Very high	92.5	Very high	56 Å²	56	60.7 Å²	60.7	29%	0.293	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-14.6	-176.5	-58	175.1	0	0	0	113	Q56 K96 S105 R106 S107	Q56-L103 HydrophobicContact CB-CD1 4.01Å; Q56-L103 HydrophobicContact CG-CD1 3.76Å; K96-L103 WeakPolarHBondContact O-CA 3.32Å; K96-L103 WeakPolarHBondContact O-CB 3.25Å; K96-L103 PolarHBondContact O-N 2.93Å; L103-S105 PolarHBondContact O-N 2.86Å; L103-R106 CarbonylContact O-C 3.54Å; L103-R106 WeakPolarHBondContact O-CA 3.41Å; L103-R106 PolarHBondContact O-N 3.21Å; L103-S107 WeakPolarHBondContact CB-OG 3.49Å; L103-S107 PolarHBondContact O-N 2.86Å; L103-S107 PolarHBondContact O-OG 2.98Å
104	G	86.8	Confident	92.3	Very high	5 Å²	5	60 Å²	60	5%	0.052	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-18.5	-171.8	0	0	0	0	0	117	K96 V97 S99 K112	K96-G104 PolarHBondContact O-N 3.08Å; V97-G104 WeakPolarHBondContact O-CA 3.16Å; V97-G104 PolarHBondContact O-N 2.95Å; S99-G104 WeakPolarHBondContact O-CA 3.39Å; S99-G104 PolarHBondContact O-N 2.97Å; G104-K112 WeakPolarHBondContact O-CD 3.49Å; G104-K112 PolarHBondContact O-NZ 3.21Å
105	S	88.1	Confident	92.3	Very high	94 Å²	94	59.9 Å²	59.9	66%	0.657	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-14	172.6	-56.5	0	0	0	0	114	P100 L103	P100-S105 PolarHBondContact O-OG 2.92Å; L103-S105 PolarHBondContact O-N 2.86Å
106	R	89.9	Confident	92.2	Very high	223 Å²	223	60.5 Å²	60.5	84%	0.842	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	-22.9	-179.3	-64.3	-179.8	-177.8	-100.4	1.5	113.1	L103	L103-R106 CarbonylContact O-C 3.54Å; L103-R106 WeakPolarHBondContact O-CA 3.41Å; L103-R106 PolarHBondContact O-N 3.21Å
107	S	92.2	Very high	92	Very high	12 Å²	12	58.8 Å²	58.8	8%	0.084	29%	0.285	C	S	.	.	S	Bend	trans	-68.5	137.4	177.3	-66.7	0	0	0	0	111.6	V97 L103 K112	V97-S107 WeakPolarHBondContact O-CB 3.49Å; V97-S107 PolarHBondContact O-OG 2.67Å; L103-S107 WeakPolarHBondContact CB-OG 3.49Å; L103-S107 PolarHBondContact O-N 2.86Å; L103-S107 PolarHBondContact O-OG 2.98Å; S107-K112 VanDerWaalsContact O-CE 3.31Å; S107-K112 WeakPolarHBondContact O-CE 3.19Å
108	P	92.8	Very high	91.9	Very high	20 Å²	20	59 Å²	59	13%	0.13	29%	0.286	C	S	.	.			trans	-54.6	142.5	178	-28.1	36.2	0	0	0	113.5	E60 A110 A111 K112	E60-P108 HydrophobicContact CB-CB 3.84Å; E60-P108 HydrophobicContact CB-CG 3.77Å; E60-P108 HydrophobicContact CG-CB 3.72Å; E60-P108 HydrophobicContact CG-CG 4.22Å; P108-A110 VanDerWaalsContact C-N 3.35Å; P108-A110 PolarHBondContact O-N 2.92Å; P108-A111 HydrophobicContact CB-CB 4.27Å; P108-A111 PolarHBondContact O-N 2.65Å; P108-K112 PolarHBondContact O-N 3.01Å
109	E	91.3	Very high	91.9	Very high	132 Å²	132	58.7 Å²	58.7	62%	0.617	29%	0.285	S	S	*	.	H	α-helix	trans	-64.9	-38.2	-175.5	-161.8	60	-131.9	0	0	112.3	A111 K112 K113	E109-A111 PolarHBondContact O-N 3.2Å; E109-K112 PolarHBondContact O-N 3.14Å; E109-K112 IonicContact OE1-NZ 2.7Å; E109-K112 WeakPolarHBondContact OE2-CE 3.39Å; E109-K112 IonicContact OE2-NZ 2.63Å; E109-K112 PolarHBondContact OE2-NZ 2.61Å; E109-K113 WeakPolarHBondContact O-CB 3.34Å; E109-K113 PolarHBondContact O-N 3.43Å
110	A	91.8	Very high	91.8	Very high	36 Å²	36	61.1 Å²	61.1	30%	0.298	29%	0.294	S	S	.	.	H	α-helix	trans	-59.9	-45	174.5	0	0	0	0	0	112.1	E60 M64 P108 K113 K114	E60-A110 HydrophobicContact CG-CB 4.46Å; E60-A110 VanDerWaalsContact OE1-CB 3.22Å; E60-A110 WeakPolarHBondContact OE1-CB 3.39Å; M64-A110 HydrophobicContact SD-CB 4.09Å; P108-A110 VanDerWaalsContact C-N 3.35Å; P108-A110 PolarHBondContact O-N 2.92Å; A110-K113 PolarHBondContact O-N 3.48Å; A110-K114 WeakPolarHBondContact O-CB 3.5Å; A110-K114 PolarHBondContact O-N 2.6Å
111	A	93.9	Very high	91.9	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.008	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-44.1	177.9	0	0	0	0	0	111.5	A63 M64 L67 P108 E109 K114 V115	A63-A111 HydrophobicContact CB-CB 4.19Å; M64-A111 HydrophobicContact SD-CB 4.48Å; L67-A111 HydrophobicContact CD1-CB 4.1Å; P108-A111 HydrophobicContact CB-CB 4.27Å; P108-A111 PolarHBondContact O-N 2.65Å; E109-A111 PolarHBondContact O-N 3.2Å; A111-K114 PolarHBondContact O-N 3.17Å; A111-V115 WeakPolarHBondContact O-CG2 3.34Å; A111-V115 PolarHBondContact O-N 2.92Å
112	K	93.9	Very high	92	Very high	31 Å²	31	49.4 Å²	49.4	14%	0.135	24%	0.235	C	C	.	.	H	α-helix	trans	-61.2	-49.5	175.9	-69.2	-178.8	-58	-174.3	0	112	V97 V98 G104 S107 P108 E109 K114 V115 L116	V97-K112 HydrophobicContact CG1-CG 4.42Å; V97-K112 WeakPolarHBondContact O-CG 3.5Å; V98-K112 HydrophobicContact CG1-CB 4.27Å; V98-K112 HydrophobicContact CG1-CG 4.49Å; G104-K112 WeakPolarHBondContact O-CD 3.49Å; G104-K112 PolarHBondContact O-NZ 3.21Å; S107-K112 VanDerWaalsContact O-CE 3.31Å; S107-K112 WeakPolarHBondContact O-CE 3.19Å; P108-K112 PolarHBondContact O-N 3.01Å; E109-K112 PolarHBondContact O-N 3.14Å; E109-K112 IonicContact OE1-NZ 2.7Å; E109-K112 WeakPolarHBondContact OE2-CE 3.39Å; E109-K112 IonicContact OE2-NZ 2.63Å; E109-K112 PolarHBondContact OE2-NZ 2.61Å; K112-K114 VanDerWaalsContact C-N 3.29Å; K112-K114 PolarHBondContact O-N 2.89Å; K112-V115 PolarHBondContact O-N 3.13Å; K112-L116 WeakPolarHBondContact O-CG 3.45Å; K112-L116 PolarHBondContact O-N 3.31Å; K112-L116 VanDerWaalsContact O-N 3.09Å
113	K	92.6	Very high	91.9	Very high	130 Å²	130	43.7 Å²	43.7	57%	0.565	22%	0.216	S	C	*	.	H	α-helix	trans	-56.4	-45.3	175.8	-177.8	-179.6	176.2	-176.4	0	110.9	E109 A110 L116 E117	E109-K113 WeakPolarHBondContact O-CB 3.34Å; E109-K113 PolarHBondContact O-N 3.43Å; A110-K113 PolarHBondContact O-N 3.48Å; K113-L116 PolarHBondContact O-N 3.07Å; K113-E117 VanDerWaalsContact CE-OE1 3.29Å; K113-E117 WeakPolarHBondContact CE-OE1 3.22Å; K113-E117 PolarHBondContact O-N 2.74Å
114	K	93.9	Very high	91.8	Very high	30 Å²	30	45.5 Å²	45.5	13%	0.13	23%	0.225	C	C	.	.	H	α-helix	trans	-66.8	-37.4	-179	-175.8	60.5	177.5	177.6	0	113	M64 L67 E71 A110 A111 K112 L116 E117 L118	M64-K114 HydrophobicContact CE-CB 4.45Å; M64-K114 HydrophobicContact CE-CG 4.43Å; M64-K114 HydrophobicContact SD-CB 4.12Å; M64-K114 HydrophobicContact SD-CG 4.4Å; L67-K114 HydrophobicContact CB-CG 4.08Å; L67-K114 HydrophobicContact CD1-CB 3.99Å; L67-K114 HydrophobicContact CD1-CG 3.95Å; E71-K114 WeakPolarHBondContact OE2-CE 3.3Å; E71-K114 IonicContact OE2-NZ 3.43Å; E71-K114 PolarHBondContact OE2-NZ 2.77Å; A110-K114 WeakPolarHBondContact O-CB 3.5Å; A110-K114 PolarHBondContact O-N 2.6Å; A111-K114 PolarHBondContact O-N 3.17Å; K112-K114 VanDerWaalsContact C-N 3.29Å; K112-K114 PolarHBondContact O-N 2.89Å; K114-L116 VanDerWaalsContact C-N 3.34Å; K114-E117 PolarHBondContact O-N 3Å; K114-L118 WeakPolarHBondContact O-CG 3.48Å; K114-L118 PolarHBondContact O-N 3.37Å
115	V	95.5	Very high	91.6	Very high	1 Å²	1	46 Å²	46	1%	0.006	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-43.8	171	168.8	0	0	0	0	111.1	I55 L67 L94 V97 V98 A111 K112 L118 I119	I55-V115 HydrophobicContact CG2-CG2 4.29Å; L67-V115 HydrophobicContact CD1-CG2 4.08Å; L67-V115 HydrophobicContact CD2-CG2 3.6Å; L67-V115 HydrophobicContact CG-CG2 4.5Å; L94-V115 HydrophobicContact CB-CG1 3.9Å; L94-V115 HydrophobicContact CD2-CG2 4.41Å; V97-V115 HydrophobicContact CG1-CG2 4.31Å; V98-V115 HydrophobicContact CG1-CB 3.81Å; V98-V115 HydrophobicContact CG1-CG1 3.6Å; A111-V115 WeakPolarHBondContact O-CG2 3.34Å; A111-V115 PolarHBondContact O-N 2.92Å; K112-V115 PolarHBondContact O-N 3.13Å; V115-L118 PolarHBondContact O-N 3.41Å; V115-I119 HydrophobicContact CG1-CD1 3.75Å; V115-I119 HydrophobicContact CG1-CG1 4.39Å; V115-I119 WeakPolarHBondContact O-CG1 3.27Å; V115-I119 PolarHBondContact O-N 2.93Å
116	L	93.7	Very high	91.4	Very high	25 Å²	25	42.1 Å²	42.1	13%	0.131	20%	0.201	C	C	.	.	H	α-helix	trans	-66.5	-41.6	177.7	-63.4	179.4	0	0	0	112.4	V98 K112 K113 K114 L118 Y120 L139 I145	V98-L116 HydrophobicContact CB-CD2 4.22Å; V98-L116 HydrophobicContact CG1-CD2 3.93Å; V98-L116 HydrophobicContact CG1-CG 4.02Å; V98-L116 HydrophobicContact CG2-CD2 4.24Å; K112-L116 WeakPolarHBondContact O-CG 3.45Å; K112-L116 PolarHBondContact O-N 3.31Å; K112-L116 VanDerWaalsContact O-N 3.09Å; K113-L116 PolarHBondContact O-N 3.07Å; K114-L116 VanDerWaalsContact C-N 3.34Å; L116-L118 VanDerWaalsContact C-N 3.32Å; L116-L118 PolarHBondContact O-N 3.26Å; L116-Y120 VanDerWaalsContact O-CB 3.32Å; L116-Y120 WeakPolarHBondContact O-CB 3.38Å; L116-Y120 PolarHBondContact O-N 3.38Å; L116-L139 HydrophobicContact CD2-CD1 4.15Å; L116-I145 HydrophobicContact CD1-CG1 4.29Å; L116-I145 HydrophobicContact CD2-CD1 3.86Å; L116-I145 HydrophobicContact CD2-CG1 3.82Å
117	E	92.3	Very high	91	Very high	26 Å²	26	35 Å²	35	12%	0.121	18%	0.184	C	C	.	.	H	α-helix	trans	-55.9	-45	171.8	-78.8	-179.5	-151.7	0	0	111.7	K113 K114 S121 P149 L151 K155	K113-E117 VanDerWaalsContact CE-OE1 3.29Å; K113-E117 WeakPolarHBondContact CE-OE1 3.22Å; K113-E117 PolarHBondContact O-N 2.74Å; K114-E117 PolarHBondContact O-N 3Å; E117-S121 WeakPolarHBondContact O-CB 3.46Å; E117-S121 PolarHBondContact O-N 2.95Å; E117-P149 HydrophobicContact CG-CB 4.06Å; E117-L151 HydrophobicContact CB-CD2 4.48Å; E117-K155 IonicContact OE2-NZ 2.92Å; E117-K155 PolarHBondContact OE2-NZ 3.31Å
118	L	93.1	Very high	90.4	Very high	5 Å²	5	38.7 Å²	38.7	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-68.7	-48.5	-178.9	-73.2	177	0	0	0	112.5	L67 L70 E71 K114 V115 L116 Y120 S121 W122	L67-L118 HydrophobicContact CB-CD1 4.41Å; L67-L118 HydrophobicContact CD2-CD1 3.95Å; L70-L118 HydrophobicContact CD2-CD1 4.46Å; E71-L118 HydrophobicContact CB-CD2 3.88Å; E71-L118 HydrophobicContact CG-CD2 3.68Å; K114-L118 WeakPolarHBondContact O-CG 3.48Å; K114-L118 PolarHBondContact O-N 3.37Å; V115-L118 PolarHBondContact O-N 3.41Å; L116-L118 VanDerWaalsContact C-N 3.32Å; L116-L118 PolarHBondContact O-N 3.26Å; L118-Y120 VanDerWaalsContact C-N 3.26Å; L118-Y120 PolarHBondContact O-N 3.13Å; L118-S121 PolarHBondContact O-N 3.38Å; L118-S121 PolarHBondContact O-OG 3.43Å; L118-W122 HydrophobicContact CB-CH2 3.88Å; L118-W122 HydrophobicContact CB-CZ2 3.71Å; L118-W122 HydrophobicContact CB-CZ3 4.45Å; L118-W122 HydrophobicContact CD1-CH2 4.43Å; L118-W122 HydrophobicContact CD1-CZ2 4.23Å; L118-W122 HydrophobicContact CD2-CZ2 4.18Å; L118-W122 HydrophobicContact CG-CZ2 4.25Å; L118-W122 PolarHBondContact O-N 2.92Å
119	I	93.3	Very high	90.2	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-41.3	178.2	-63.6	170.2	0	0	0	109.9	L94 V115 W122 T123 I132 Y136 L139	L94-I119 HydrophobicContact CB-CD1 4.2Å; L94-I119 HydrophobicContact CD1-CD1 4.32Å; L94-I119 HydrophobicContact CD1-CG1 4.22Å; V115-I119 HydrophobicContact CG1-CD1 3.75Å; V115-I119 HydrophobicContact CG1-CG1 4.39Å; V115-I119 WeakPolarHBondContact O-CG1 3.27Å; V115-I119 PolarHBondContact O-N 2.93Å; I119-W122 HydrophobicContact CG1-CE3 4.44Å; I119-W122 HydrophobicContact CG1-CZ3 4.24Å; I119-W122 PolarHBondContact O-N 2.79Å; I119-T123 WeakPolarHBondContact O-CG2 3.34Å; I119-T123 PolarHBondContact O-N 3.18Å; I119-T123 VanDerWaalsContact O-N 3.14Å; I119-I132 HydrophobicContact CG2-CG2 4.19Å; I119-Y136 HydrophobicContact CB-CD2 4.49Å; I119-Y136 HydrophobicContact CG2-CD2 3.89Å; I119-Y136 HydrophobicContact CG2-CG 4.42Å; I119-L139 HydrophobicContact CD1-CD1 4.24Å
120	Y	91.8	Very high	90.1	Very high	53 Å²	53	36.9 Å²	36.9	21%	0.208	20%	0.199	C	C	.	.	H	α-helix	trans	-65	-43.4	176.6	-175.3	-125.9	0	0	0	112.9	L116 L118 W122 T123 L124 Y136 D148 P149 L151	L116-Y120 VanDerWaalsContact O-CB 3.32Å; L116-Y120 WeakPolarHBondContact O-CB 3.38Å; L116-Y120 PolarHBondContact O-N 3.38Å; L118-Y120 VanDerWaalsContact C-N 3.26Å; L118-Y120 PolarHBondContact O-N 3.13Å; Y120-W122 PolarHBondContact O-N 3.36Å; Y120-T123 PolarHBondContact O-N 3.4Å; Y120-T123 PolarHBondContact O-OG1 2.91Å; Y120-L124 HydrophobicContact CE1-CD1 4.24Å; Y120-Y136 AromaticContact CD2-CE1 3.84Å; Y120-Y136 HydrophobicContact CD2-CE1 3.84Å; Y120-Y136 AromaticContact CD2-CE2 3.81Å; Y120-Y136 HydrophobicContact CD2-CE2 3.81Å; Y120-Y136 AromaticContact CD2-CZ 3.42Å; Y120-Y136 VanDerWaalsContact CD2-CZ 3.42Å; Y120-Y136 WeakPolarHBondContact CD2-OH 3.32Å; Y120-Y136 HydrophobicContact CE2-CE1 4.34Å; Y120-Y136 HydrophobicContact CG-CE2 4.05Å; Y120-D148 HydrophobicContact CE1-CB 4.43Å; Y120-D148 HydrophobicContact CE2-CB 4.23Å; Y120-P149 HydrophobicContact CD1-CB 4.26Å; Y120-P149 HydrophobicContact CD1-CG 4.31Å; Y120-P149 WeakPolarHBondContact CD1-O 3.39Å; Y120-P149 WeakPolarHBondContact CE1-O 3.47Å; Y120-L151 HydrophobicContact CD1-CD1 3.44Å; Y120-L151 VanDerWaalsContact CD1-CD1 3.44Å; Y120-L151 HydrophobicContact CD1-CG 3.77Å; Y120-L151 HydrophobicContact CE1-CD1 3.74Å; Y120-L151 HydrophobicContact CE1-CG 4.06Å; Y120-L151 HydrophobicContact CG-CD1 4.35Å
121	S	90.8	Very high	90.2	Very high	6 Å²	6	39.2 Å²	39.2	4%	0.042	20%	0.203	C	C	.	.	H	α-helix	trans	-63.9	-30.5	177.8	74.5	0	0	0	0	112.2	E117 L118 A125	E117-S121 WeakPolarHBondContact O-CB 3.46Å; E117-S121 PolarHBondContact O-N 2.95Å; L118-S121 PolarHBondContact O-N 3.38Å; L118-S121 PolarHBondContact O-OG 3.43Å; S121-A125 VanDerWaalsContact O-CB 3.3Å; S121-A125 WeakPolarHBondContact O-CB 3.41Å; S121-A125 PolarHBondContact O-N 2.69Å
122	W	92.6	Very high	90.3	Very high	1 Å²	1	39.2 Å²	39.2	0%	0.004	20%	0.202	C	C	.	.	H	α-helix	trans	-76.1	-29.4	175.9	-57.3	-22	0	0	0	114.1	L70 M74 V85 L94 L118 I119 Y120 L124 A125 L126 I132	L70-W122 HydrophobicContact CD1-CH2 4.41Å; L70-W122 HydrophobicContact CD2-CH2 3.75Å; L70-W122 HydrophobicContact CD2-CZ2 4.3Å; L70-W122 HydrophobicContact CG-CH2 4.04Å; L70-W122 HydrophobicContact CG-CZ2 4.14Å; M74-W122 HydrophobicContact CE-CD2 3.89Å; M74-W122 HydrophobicContact CE-CG 4Å; M74-W122 HydrophobicContact CE-CZ2 4.35Å; M74-W122 HydrophobicContact CG-CZ2 3.77Å; V85-W122 HydrophobicContact CG1-CE3 4.16Å; V85-W122 HydrophobicContact CG1-CH2 4.21Å; V85-W122 HydrophobicContact CG1-CZ3 3.89Å; L94-W122 HydrophobicContact CD1-CH2 4.18Å; L94-W122 HydrophobicContact CD1-CZ3 3.85Å; L118-W122 HydrophobicContact CB-CH2 3.88Å; L118-W122 HydrophobicContact CB-CZ2 3.71Å; L118-W122 HydrophobicContact CB-CZ3 4.45Å; L118-W122 HydrophobicContact CD1-CH2 4.43Å; L118-W122 HydrophobicContact CD1-CZ2 4.23Å; L118-W122 HydrophobicContact CD2-CZ2 4.18Å; L118-W122 HydrophobicContact CG-CZ2 4.25Å; L118-W122 PolarHBondContact O-N 2.92Å; I119-W122 HydrophobicContact CG1-CE3 4.44Å; I119-W122 HydrophobicContact CG1-CZ3 4.24Å; I119-W122 PolarHBondContact O-N 2.79Å; Y120-W122 PolarHBondContact O-N 3.36Å; W122-L124 PolarHBondContact O-N 3.2Å; W122-A125 PolarHBondContact O-N 3.37Å; W122-L126 HydrophobicContact CB-CD1 4.45Å; W122-L126 WeakPolarHBondContact O-CA 3.23Å; W122-L126 WeakPolarHBondContact O-CB 3.29Å; W122-L126 PolarHBondContact O-N 2.86Å; W122-I132 HydrophobicContact CB-CD1 4.2Å; W122-I132 HydrophobicContact CB-CG2 3.84Å; W122-I132 HydrophobicContact CE3-CG2 4.49Å
123	T	89.7	Confident	90.1	Very high	30 Å²	30	39.6 Å²	39.6	18%	0.184	21%	0.209	C	C	.	.	H	α-helix	trans	-64.9	-30.8	173	64.7	0	0	0	0	112	I119 Y120 I132 Y136	I119-T123 WeakPolarHBondContact O-CG2 3.34Å; I119-T123 PolarHBondContact O-N 3.18Å; I119-T123 VanDerWaalsContact O-N 3.14Å; Y120-T123 PolarHBondContact O-N 3.4Å; Y120-T123 PolarHBondContact O-OG1 2.91Å; T123-I132 HydrophobicContact CG2-CG2 4.1Å; T123-Y136 HydrophobicContact CG2-CG 4.06Å
124	L	87.2	Confident	90.2	Very high	93 Å²	93	37.3 Å²	37.3	49%	0.487	20%	0.203	S	C	.	.	H	α-helix	trans	-79.3	-43.8	175.2	-58.3	178.4	0	0	0	112.1	Y120 W122 L151 L156	Y120-L124 HydrophobicContact CE1-CD1 4.24Å; W122-L124 PolarHBondContact O-N 3.2Å; L124-L151 HydrophobicContact CD1-CD1 4.06Å; L124-L156 HydrophobicContact CB-CD2 4.43Å; L124-L156 HydrophobicContact CD1-CD2 3.84Å
125	A	82.5	Confident	90.2	Very high	16 Å²	16	36 Å²	36	13%	0.132	20%	0.197	C	C	.	.	H	α-helix	trans	-83.2	-30.1	-174.3	0	0	0	0	0	115	S121 W122 P127 L157 L159	S121-A125 VanDerWaalsContact O-CB 3.3Å; S121-A125 WeakPolarHBondContact O-CB 3.41Å; S121-A125 PolarHBondContact O-N 2.69Å; W122-A125 PolarHBondContact O-N 3.37Å; A125-P127 VanDerWaalsContact O-CD 3.25Å; A125-P127 WeakPolarHBondContact O-CD 3.43Å; A125-L157 HydrophobicContact CB-CB 3.72Å; A125-L157 HydrophobicContact CB-CD1 3.85Å; A125-L157 HydrophobicContact CB-CG 3.96Å; A125-L159 VanDerWaalsContact O-CD1 3.29Å; A125-L159 WeakPolarHBondContact O-CD1 3.36Å
126	L	85.4	Confident	90.2	Very high	12 Å²	12	36.5 Å²	36.5	6%	0.063	20%	0.199	C	C	.	.			trans	-121.2	63.4	-173.6	-62.6	173.5	0	0	0	111.4	M74 H82 W122 D128 E129 I132 L157 L159	M74-L126 HydrophobicContact CE-CD1 3.39Å; H82-L126 HydrophobicContact CB-CD1 4.3Å; W122-L126 HydrophobicContact CB-CD1 4.45Å; W122-L126 WeakPolarHBondContact O-CA 3.23Å; W122-L126 WeakPolarHBondContact O-CB 3.29Å; W122-L126 PolarHBondContact O-N 2.86Å; L126-D128 PolarHBondContact O-N 3.07Å; L126-D128 VanDerWaalsContact O-N 3.09Å; L126-E129 PolarHBondContact O-N 3.28Å; L126-E129 VanDerWaalsContact O-N 3.1Å; L126-I132 HydrophobicContact CD1-CD1 4.36Å; L126-L157 HydrophobicContact CD1-CD1 4.49Å; L126-L159 HydrophobicContact CD2-CD1 4.06Å
127	P	80.7	Confident	90.1	Very high	75 Å²	75	40.8 Å²	40.8	49%	0.487	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-13.1	-178.6	29.6	-37.5	0	0	0	113.9	A125 E129	A125-P127 VanDerWaalsContact O-CD 3.25Å; A125-P127 WeakPolarHBondContact O-CD 3.43Å; P127-E129 VanDerWaalsContact C-N 3.31Å
128	D	80.4	Confident	90.2	Very high	89 Å²	89	42.9 Å²	42.9	48%	0.476	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-8.8	176.5	-58.9	-8.8	0	0	0	113	L126 P130 R162	L126-D128 PolarHBondContact O-N 3.07Å; L126-D128 VanDerWaalsContact O-N 3.09Å; D128-P130 VanDerWaalsContact C-CD 3.46Å; D128-P130 WeakPolarHBondContact O-CD 3.49Å; D128-R162 IonicContact OD1-CZ 2.86Å; D128-R162 IonicContact OD1-NH1 3Å; D128-R162 PolarHBondContact OD1-NH1 2.83Å; D128-R162 IonicContact OD1-NH2 2.69Å; D128-R162 IonicContact OD2-CZ 3.19Å; D128-R162 IonicContact OD2-NH1 2.62Å; D128-R162 PolarHBondContact OD2-NH1 2.7Å; D128-R162 IonicContact OD2-NH2 3.18Å; D128-R162 PolarHBondContact OD2-NH2 2.81Å
129	E	88.8	Confident	90.2	Very high	35 Å²	35	42.7 Å²	42.7	16%	0.164	23%	0.228	C	C	.	.			trans	-108.1	75.1	-180	-69.4	-69.8	171.1	0	0	110.1	S83 L126 P127 K131 I132	S83-E129 VanDerWaalsContact CA-OE1 3.26Å; S83-E129 WeakPolarHBondContact CA-OE1 3.33Å; S83-E129 VanDerWaalsContact CB-OE1 3.31Å; S83-E129 WeakPolarHBondContact CB-OE1 3.06Å; S83-E129 PolarHBondContact OG-OE1 3.03Å; L126-E129 PolarHBondContact O-N 3.28Å; L126-E129 VanDerWaalsContact O-N 3.1Å; P127-E129 VanDerWaalsContact C-N 3.31Å; E129-K131 PolarHBondContact O-N 3.28Å; E129-I132 HydrophobicContact CB-CD1 3.71Å; E129-I132 HydrophobicContact CB-CG1 3.99Å; E129-I132 HydrophobicContact CG-CD1 4.43Å; E129-I132 WeakPolarHBondContact O-CB 3.26Å; E129-I132 PolarHBondContact O-N 3.13Å
130	P	88.8	Confident	90.1	Very high	78 Å²	78	46.8 Å²	46.8	51%	0.506	25%	0.246	S	C	.	.	H	α-helix	trans	-58.8	-30.9	-167.8	22.9	-35.2	0	0	0	113.4	D128 I132 S133 D134	D128-P130 VanDerWaalsContact C-CD 3.46Å; D128-P130 WeakPolarHBondContact O-CD 3.49Å; P130-I132 PolarHBondContact O-N 3.37Å; P130-I132 VanDerWaalsContact O-N 3.16Å; P130-S133 CarbonylContact O-C 3.58Å; P130-S133 WeakPolarHBondContact O-CA 3.13Å; P130-S133 VanDerWaalsContact O-CB 3.27Å; P130-S133 WeakPolarHBondContact O-CB 3.25Å; P130-S133 PolarHBondContact O-N 3.5Å; P130-D134 PolarHBondContact O-N 3.21Å
131	K	94.6	Very high	90.1	Very high	86 Å²	86	53.8 Å²	53.8	37%	0.374	28%	0.278	S	S	.	.	H	α-helix	trans	-58.4	-28.3	178.6	-63.9	173.7	-176.9	158.9	0	113.4	G86 F88 L91 E129 A135	G86-K131 VanDerWaalsContact O-CB 3.23Å; G86-K131 WeakPolarHBondContact O-CB 3.21Å; G86-K131 WeakPolarHBondContact O-CD 3.45Å; F88-K131 HydrophobicContact CD1-CB 4.47Å; F88-K131 HydrophobicContact CD2-CD 3.99Å; F88-K131 HydrophobicContact CD2-CG 4.19Å; F88-K131 HydrophobicContact CE1-CB 3.97Å; F88-K131 HydrophobicContact CE1-CG 4.43Å; F88-K131 HydrophobicContact CE2-CB 4.07Å; F88-K131 HydrophobicContact CE2-CD 3.9Å; F88-K131 HydrophobicContact CE2-CG 3.62Å; F88-K131 HydrophobicContact CZ-CB 3.74Å; F88-K131 HydrophobicContact CZ-CD 4.44Å; F88-K131 HydrophobicContact CZ-CG 3.75Å; L91-K131 HydrophobicContact CD1-CB 4.12Å; L91-K131 WeakPolarHBondContact CD1-O 3.4Å; E129-K131 PolarHBondContact O-N 3.28Å; K131-A135 VanDerWaalsContact O-CB 3.29Å; K131-A135 WeakPolarHBondContact O-CB 3.5Å; K131-A135 PolarHBondContact O-N 3.23Å
132	I	94.1	Very high	90	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-69.6	-42.5	174.3	-54.5	-179	0	0	0	109.8	L91 I119 W122 T123 L126 E129 P130 Y136	L91-I132 HydrophobicContact CD1-CG1 4.15Å; L91-I132 HydrophobicContact CD2-CG1 4.3Å; I119-I132 HydrophobicContact CG2-CG2 4.19Å; W122-I132 HydrophobicContact CB-CD1 4.2Å; W122-I132 HydrophobicContact CB-CG2 3.84Å; W122-I132 HydrophobicContact CE3-CG2 4.49Å; T123-I132 HydrophobicContact CG2-CG2 4.1Å; L126-I132 HydrophobicContact CD1-CD1 4.36Å; E129-I132 HydrophobicContact CB-CD1 3.71Å; E129-I132 HydrophobicContact CB-CG1 3.99Å; E129-I132 HydrophobicContact CG-CD1 4.43Å; E129-I132 WeakPolarHBondContact O-CB 3.26Å; E129-I132 PolarHBondContact O-N 3.13Å; P130-I132 PolarHBondContact O-N 3.37Å; P130-I132 VanDerWaalsContact O-N 3.16Å; I132-Y136 WeakPolarHBondContact O-CB 3.26Å; I132-Y136 PolarHBondContact O-N 2.75Å
133	S	91.6	Very high	89.7	Confident	40 Å²	40	59.8 Å²	59.8	28%	0.28	32%	0.317	S	S	.	.	H	α-helix	trans	-64.2	-45.5	173.4	-166	0	0	0	0	111.4	P130 A135 Y136 Q137	P130-S133 CarbonylContact O-C 3.58Å; P130-S133 WeakPolarHBondContact O-CA 3.13Å; P130-S133 VanDerWaalsContact O-CB 3.27Å; P130-S133 WeakPolarHBondContact O-CB 3.25Å; P130-S133 PolarHBondContact O-N 3.5Å; S133-A135 VanDerWaalsContact C-N 3.35Å; S133-A135 PolarHBondContact O-N 3.23Å; S133-Y136 PolarHBondContact O-N 2.8Å; S133-Q137 WeakPolarHBondContact O-CB 3.32Å; S133-Q137 VanDerWaalsContact O-CG 3.31Å; S133-Q137 WeakPolarHBondContact O-CG 3.41Å; S133-Q137 PolarHBondContact O-N 3.44Å; S133-Q137 PolarHBondContact OG-NE2 3.24Å; S133-Q137 VanDerWaalsContact OG-NE2 3.1Å
134	D	93.9	Very high	89.6	Confident	81 Å²	81	60.1 Å²	60.1	43%	0.433	32%	0.317	S	S	.	.	H	α-helix	trans	-58.6	-45.6	177	-60.8	-29.7	0	0	0	111.7	F88 P130 Q137 M138	F88-D134 HydrophobicContact CZ-CB 4.25Å; P130-D134 PolarHBondContact O-N 3.21Å; D134-Q137 PolarHBondContact O-N 3.5Å; D134-M138 VanDerWaalsContact O-CB 3.26Å; D134-M138 WeakPolarHBondContact O-CB 3.2Å; D134-M138 PolarHBondContact O-N 2.85Å
135	A	94.3	Very high	89.6	Confident	2 Å²	2	56 Å²	56	2%	0.017	30%	0.296	C	S	.	.	H	α-helix	trans	-61.4	-44.5	176.1	0	0	0	0	0	111.9	L91 I95 K131 S133 M138 L139	L91-A135 HydrophobicContact CB-CB 4.5Å; L91-A135 HydrophobicContact CD1-CB 4.19Å; I95-A135 HydrophobicContact CD1-CB 4.1Å; K131-A135 VanDerWaalsContact O-CB 3.29Å; K131-A135 WeakPolarHBondContact O-CB 3.5Å; K131-A135 PolarHBondContact O-N 3.23Å; S133-A135 VanDerWaalsContact C-N 3.35Å; S133-A135 PolarHBondContact O-N 3.23Å; A135-M138 PolarHBondContact O-N 3.23Å; A135-L139 VanDerWaalsContact O-CG 3.3Å; A135-L139 WeakPolarHBondContact O-CG 3.43Å; A135-L139 PolarHBondContact O-N 2.97Å
136	Y	93.9	Very high	89.3	Confident	12 Å²	12	64.7 Å²	64.7	5%	0.047	33%	0.33	C	S	.	.	H	α-helix	trans	-62.9	-48.7	177	-171.9	-98.6	0	0	0	112.2	I119 Y120 T123 I132 S133 M138 L139 K140 I145 D148 P149	I119-Y136 HydrophobicContact CB-CD2 4.49Å; I119-Y136 HydrophobicContact CG2-CD2 3.89Å; I119-Y136 HydrophobicContact CG2-CG 4.42Å; Y120-Y136 AromaticContact CD2-CE1 3.84Å; Y120-Y136 HydrophobicContact CD2-CE1 3.84Å; Y120-Y136 AromaticContact CD2-CE2 3.81Å; Y120-Y136 HydrophobicContact CD2-CE2 3.81Å; Y120-Y136 AromaticContact CD2-CZ 3.42Å; Y120-Y136 VanDerWaalsContact CD2-CZ 3.42Å; Y120-Y136 WeakPolarHBondContact CD2-OH 3.32Å; Y120-Y136 HydrophobicContact CE2-CE1 4.34Å; Y120-Y136 HydrophobicContact CG-CE2 4.05Å; T123-Y136 HydrophobicContact CG2-CG 4.06Å; I132-Y136 WeakPolarHBondContact O-CB 3.26Å; I132-Y136 PolarHBondContact O-N 2.75Å; S133-Y136 PolarHBondContact O-N 2.8Å; Y136-M138 VanDerWaalsContact C-N 3.32Å; Y136-M138 PolarHBondContact O-N 3.38Å; Y136-L139 PolarHBondContact O-N 3.48Å; Y136-K140 HydrophobicContact CE1-CD 4.45Å; Y136-K140 PolarHBondContact O-N 3.33Å; Y136-I145 HydrophobicContact CD2-CD1 3.62Å; Y136-I145 HydrophobicContact CE1-CD1 4.5Å; Y136-I145 HydrophobicContact CE2-CD1 3.34Å; Y136-I145 HydrophobicContact CG-CD1 4.32Å; Y136-D148 WeakPolarHBondContact CE1-OD1 3.37Å; Y136-D148 PolarHBondContact OH-OD1 2.97Å; Y136-P149 WeakPolarHBondContact OH-CD 3.29Å
137	Q	92.6	Very high	88.9	Confident	115 Å²	115	71.3 Å²	71.3	54%	0.537	36%	0.361	S	S	.	.	H	α-helix	trans	-62.8	-38	177.8	-69.9	-178.2	41.5	0	0	111.9	S133 D134 K140 K141	S133-Q137 WeakPolarHBondContact O-CB 3.32Å; S133-Q137 VanDerWaalsContact O-CG 3.31Å; S133-Q137 WeakPolarHBondContact O-CG 3.41Å; S133-Q137 PolarHBondContact O-N 3.44Å; S133-Q137 PolarHBondContact OG-NE2 3.24Å; S133-Q137 VanDerWaalsContact OG-NE2 3.1Å; D134-Q137 PolarHBondContact O-N 3.5Å; Q137-K140 PolarHBondContact O-N 2.94Å; Q137-K141 WeakPolarHBondContact O-CB 3.44Å; Q137-K141 PolarHBondContact O-N 3.5Å
138	M	94	Very high	88.8	Confident	71 Å²	71	70.4 Å²	70.4	35%	0.35	35%	0.352	S	S	.	.	H	α-helix	trans	-61.6	-46.7	173.4	-177.5	-168.7	64.9	0	0	111.6	I95 D134 A135 Y136 K140 K141 Q142	I95-M138 HydrophobicContact CD1-CE 3.66Å; I95-M138 HydrophobicContact CG1-CE 4.21Å; I95-M138 HydrophobicContact CG2-CE 4.13Å; D134-M138 VanDerWaalsContact O-CB 3.26Å; D134-M138 WeakPolarHBondContact O-CB 3.2Å; D134-M138 PolarHBondContact O-N 2.85Å; A135-M138 PolarHBondContact O-N 3.23Å; Y136-M138 VanDerWaalsContact C-N 3.32Å; Y136-M138 PolarHBondContact O-N 3.38Å; M138-K140 VanDerWaalsContact C-N 3.31Å; M138-K140 PolarHBondContact O-N 2.86Å; M138-K141 PolarHBondContact O-N 2.96Å; M138-Q142 WeakPolarHBondContact O-CB 3.27Å; M138-Q142 WeakPolarHBondContact O-CG 3.28Å; M138-Q142 PolarHBondContact O-N 3.44Å
139	L	93.3	Very high	88.7	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.4	-37.9	177.6	-70.2	170.8	0	0	0	111.8	I95 V98 L116 I119 A135 Y136 Q142 G143 I144 I145	I95-L139 HydrophobicContact CG1-CD1 4.35Å; I95-L139 HydrophobicContact CG1-CD2 4.34Å; I95-L139 HydrophobicContact CG1-CG 4.49Å; I95-L139 HydrophobicContact CG2-CD2 4.25Å; V98-L139 HydrophobicContact CG2-CD1 4.01Å; V98-L139 HydrophobicContact CG2-CD2 3.72Å; L116-L139 HydrophobicContact CD2-CD1 4.15Å; I119-L139 HydrophobicContact CD1-CD1 4.24Å; A135-L139 VanDerWaalsContact O-CG 3.3Å; A135-L139 WeakPolarHBondContact O-CG 3.43Å; A135-L139 PolarHBondContact O-N 2.97Å; Y136-L139 PolarHBondContact O-N 3.48Å; L139-Q142 PolarHBondContact O-N 3.14Å; L139-G143 PolarHBondContact O-N 3.3Å; L139-I144 HydrophobicContact CD2-CB 4.44Å; L139-I144 HydrophobicContact CD2-CD1 3.6Å; L139-I144 HydrophobicContact CD2-CG2 4.37Å; L139-I144 WeakPolarHBondContact O-CB 3.39Å; L139-I144 PolarHBondContact O-N 3.49Å; L139-I145 HydrophobicContact CB-CD1 3.66Å; L139-I145 HydrophobicContact CB-CG1 3.89Å; L139-I145 HydrophobicContact CD1-CD1 4.41Å; L139-I145 PolarHBondContact O-N 3.33Å
140	K	91.1	Very high	87.6	Confident	88 Å²	88	74 Å²	74	38%	0.383	37%	0.368	S	S	.	.	H	α-helix	trans	-65.4	-46.8	173.3	-164.3	168.1	-173.5	166.8	0	112	Y136 Q137 M138 Q142 G143 I145 D148	Y136-K140 HydrophobicContact CE1-CD 4.45Å; Y136-K140 PolarHBondContact O-N 3.33Å; Q137-K140 PolarHBondContact O-N 2.94Å; M138-K140 VanDerWaalsContact C-N 3.31Å; M138-K140 PolarHBondContact O-N 2.86Å; K140-Q142 VanDerWaalsContact C-N 3.27Å; K140-Q142 PolarHBondContact O-N 3.41Å; K140-G143 PolarHBondContact O-N 2.95Å; K140-I145 HydrophobicContact CB-CB 4.26Å; K140-I145 HydrophobicContact CG-CB 4.48Å; K140-D148 IonicContact NZ-OD1 2.81Å; K140-D148 PolarHBondContact NZ-OD1 3.13Å; K140-D148 IonicContact NZ-OD2 3.86Å; K140-D148 PolarHBondContact NZ-OD2 3.03Å
141	K	91.4	Very high	86.4	Confident	199 Å²	199	72 Å²	72	87%	0.865	35%	0.353	S	S	*	.	H	α-helix	trans	-62.5	-30	175.8	-173.4	174.1	-178.5	175.9	0	113.2	Q137 M138 G143	Q137-K141 WeakPolarHBondContact O-CB 3.44Å; Q137-K141 PolarHBondContact O-N 3.5Å; M138-K141 PolarHBondContact O-N 2.96Å; K141-G143 VanDerWaalsContact C-N 3.26Å; K141-G143 PolarHBondContact O-N 3.32Å
142	Q	89.9	Confident	84.7	Confident	90 Å²	90	70.8 Å²	70.8	42%	0.421	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	0.1	174	-70.4	-177.9	16.9	0	0	113.7	M138 L139 K140 I144	M138-Q142 WeakPolarHBondContact O-CB 3.27Å; M138-Q142 WeakPolarHBondContact O-CG 3.28Å; M138-Q142 PolarHBondContact O-N 3.44Å; L139-Q142 PolarHBondContact O-N 3.14Å; K140-Q142 VanDerWaalsContact C-N 3.27Å; K140-Q142 PolarHBondContact O-N 3.41Å; Q142-I144 HydrophobicContact CB-CD1 4.02Å; Q142-I144 HydrophobicContact CB-CG1 4.22Å; Q142-I144 PolarHBondContact O-N 3.02Å
143	G	86.1	Confident	82.6	Confident	43 Å²	43	75.8 Å²	75.8	44%	0.443	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	11.5	-179.4	0	0	0	0	0	114.7	L139 K140 K141	L139-G143 PolarHBondContact O-N 3.3Å; K140-G143 PolarHBondContact O-N 2.95Å; K141-G143 VanDerWaalsContact C-N 3.26Å; K141-G143 PolarHBondContact O-N 3.32Å
144	I	87.9	Confident	80.8	Confident	38 Å²	38	80.5 Å²	80.5	20%	0.195	41%	0.408	C	S	.	.	S	Bend	trans	-72.5	-38	174.4	-62.1	164.8	0	0	0	109.2	V98 L139 Q142	V98-I144 HydrophobicContact CB-CG2 4.31Å; V98-I144 HydrophobicContact CG2-CG2 4.43Å; L139-I144 HydrophobicContact CD2-CB 4.44Å; L139-I144 HydrophobicContact CD2-CD1 3.6Å; L139-I144 HydrophobicContact CD2-CG2 4.37Å; L139-I144 WeakPolarHBondContact O-CB 3.39Å; L139-I144 PolarHBondContact O-N 3.49Å; Q142-I144 HydrophobicContact CB-CD1 4.02Å; Q142-I144 HydrophobicContact CB-CG1 4.22Å; Q142-I144 PolarHBondContact O-N 3.02Å
145	I	86.7	Confident	78.8	Confident	7 Å²	7	80.1 Å²	80.1	4%	0.036	40%	0.403	C	S	.	.			trans	-101.9	109.6	173.2	-50.3	179.6	0	0	0	108.3	L116 Y136 L139 K140 Q147	L116-I145 HydrophobicContact CD1-CG1 4.29Å; L116-I145 HydrophobicContact CD2-CD1 3.86Å; L116-I145 HydrophobicContact CD2-CG1 3.82Å; Y136-I145 HydrophobicContact CD2-CD1 3.62Å; Y136-I145 HydrophobicContact CE1-CD1 4.5Å; Y136-I145 HydrophobicContact CE2-CD1 3.34Å; Y136-I145 HydrophobicContact CG-CD1 4.32Å; L139-I145 HydrophobicContact CB-CD1 3.66Å; L139-I145 HydrophobicContact CB-CG1 3.89Å; L139-I145 HydrophobicContact CD1-CD1 4.41Å; L139-I145 PolarHBondContact O-N 3.33Å; K140-I145 HydrophobicContact CB-CB 4.26Å; K140-I145 HydrophobicContact CG-CB 4.48Å; I145-Q147 WeakPolarHBondContact CG2-O 3.2Å
146	K	76.9	Confident	76.7	Confident	198 Å²	198	83.4 Å²	83.4	86%	0.861	42%	0.42	S	S	*	.	S	Bend	trans	-91.6	-31.7	179.8	-63.7	-179	-178.9	177.3	0	113.1
147	Q	75.1	Confident	74.7	Confident	151 Å²	151	83.7 Å²	83.7	71%	0.706	42%	0.422	S	S	*	.	S	Bend	trans	-141.3	141.6	177.5	-173.7	176.1	4	0	0	107	I145	I145-Q147 WeakPolarHBondContact CG2-O 3.2Å
148	D	80.3	Confident	72.3	Confident	55 Å²	55	85.7 Å²	85.7	29%	0.294	43%	0.431	S	S	.	.			trans	-68.3	136.6	176.2	-58.3	-56.4	0	0	0	109.4	Y120 Y136 K140 E150	Y120-D148 HydrophobicContact CE1-CB 4.43Å; Y120-D148 HydrophobicContact CE2-CB 4.23Å; Y136-D148 WeakPolarHBondContact CE1-OD1 3.37Å; Y136-D148 PolarHBondContact OH-OD1 2.97Å; K140-D148 IonicContact NZ-OD1 2.81Å; K140-D148 PolarHBondContact NZ-OD1 3.13Å; K140-D148 IonicContact NZ-OD2 3.86Å; K140-D148 PolarHBondContact NZ-OD2 3.03Å; D148-E150 PolarHBondContact O-N 3.01Å
149	P	78.3	Confident	69.7	Low	25 Å²	25	85.5 Å²	85.5	16%	0.162	43%	0.431	C	S	.	.			trans	-63.1	132.4	-177.7	-22.9	32.8	0	0	0	112.9	E117 Y120 Y136 L151	E117-P149 HydrophobicContact CG-CB 4.06Å; Y120-P149 HydrophobicContact CD1-CB 4.26Å; Y120-P149 HydrophobicContact CD1-CG 4.31Å; Y120-P149 WeakPolarHBondContact CD1-O 3.39Å; Y120-P149 WeakPolarHBondContact CE1-O 3.47Å; Y136-P149 WeakPolarHBondContact OH-CD 3.29Å; P149-L151 PolarHBondContact O-N 2.96Å; P149-L151 VanDerWaalsContact O-N 3.07Å
150	E	64.9	Low	67	Low	174 Å²	174	90.4 Å²	90.4	81%	0.813	46%	0.463	S	S	*	.			trans	-66.7	107.1	169.2	-71.6	-179.9	173.5	0	0	110	D148	D148-E150 PolarHBondContact O-N 3.01Å
151	L	63.7	Low	64.1	Low	36 Å²	36	92.2 Å²	92.2	19%	0.188	48%	0.484	C	S	.	.			trans	-90.4	121.6	174.7	-67.9	174.5	0	0	0	109.9	E117 Y120 L124 P149 L156	E117-L151 HydrophobicContact CB-CD2 4.48Å; Y120-L151 HydrophobicContact CD1-CD1 3.44Å; Y120-L151 VanDerWaalsContact CD1-CD1 3.44Å; Y120-L151 HydrophobicContact CD1-CG 3.77Å; Y120-L151 HydrophobicContact CE1-CD1 3.74Å; Y120-L151 HydrophobicContact CE1-CG 4.06Å; Y120-L151 HydrophobicContact CG-CD1 4.35Å; L124-L151 HydrophobicContact CD1-CD1 4.06Å; P149-L151 PolarHBondContact O-N 2.96Å; P149-L151 VanDerWaalsContact O-N 3.07Å; L151-L156 HydrophobicContact CD1-CD2 3.99Å
152	P	58.3	Low	61.7	Low	61 Å²	61	88.5 Å²	88.5	40%	0.396	46%	0.464	S	S	.	.			trans	-57.2	144.8	164.6	-22.8	33.5	0	0	0	110.8	D154 K155	P152-D154 VanDerWaalsContact C-N 3.26Å; P152-D154 PolarHBondContact O-N 3.39Å; P152-K155 HydrophobicContact CG-CD 4.39Å; P152-K155 HydrophobicContact CG-CG 4.48Å; P152-K155 PolarHBondContact O-N 2.77Å
153	P	51.2	Low	59.3	Low	105 Å²	105	95.1 Å²	95.1	68%	0.682	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-50.8	-42.6	-179.6	-29.3	35.9	0	0	0	113.8	K155 L156	P153-K155 PolarHBondContact O-N 3.48Å; P153-K155 VanDerWaalsContact O-N 3.12Å; P153-L156 PolarHBondContact O-N 2.97Å
154	D	52.6	Low	57.2	Low	139 Å²	139	98.2 Å²	98.2	74%	0.743	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-64.4	-11.7	179.1	-67	-8.5	0	0	0	115.2	P152	P152-D154 VanDerWaalsContact C-N 3.26Å; P152-D154 PolarHBondContact O-N 3.39Å
155	K	52	Low	55.1	Low	73 Å²	73	104.6 Å²	104.6	32%	0.317	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-96.1	-8.2	179.7	-74.9	-163.2	-171.3	164.8	0	114.1	E117 P152 P153	E117-K155 IonicContact OE2-NZ 2.92Å; E117-K155 PolarHBondContact OE2-NZ 3.31Å; P152-K155 HydrophobicContact CG-CD 4.39Å; P152-K155 HydrophobicContact CG-CG 4.48Å; P152-K155 PolarHBondContact O-N 2.77Å; P153-K155 PolarHBondContact O-N 3.48Å; P153-K155 VanDerWaalsContact O-N 3.12Å
156	L	50.3	Low	52.9	Low	72 Å²	72	107.9 Å²	107.9	38%	0.377	54%	0.542	S	S	.	.	S	Bend	trans	-65.6	137.1	169	-62.5	175.8	0	0	0	108	L124 L151 P153 H158	L124-L156 HydrophobicContact CB-CD2 4.43Å; L124-L156 HydrophobicContact CD1-CD2 3.84Å; L151-L156 HydrophobicContact CD1-CD2 3.99Å; P153-L156 PolarHBondContact O-N 2.97Å; L156-H158 PolarHBondContact O-CD2 3.11Å; L156-H158 VanDerWaalsContact O-CD2 3.28Å; L156-H158 PolarHBondContact O-N 3.5Å
157	L	51.8	Low	51.4	Low	18 Å²	18	104.4 Å²	104.4	9%	0.094	54%	0.537	C	S	.	.			trans	-62.8	113	174.6	-58.9	175.7	0	0	0	107.4	R75 A125 L126 L159	R75-L157 HydrophobicContact CG-CD2 3.49Å; R75-L157 VanDerWaalsContact CG-CD2 3.49Å; A125-L157 HydrophobicContact CB-CB 3.72Å; A125-L157 HydrophobicContact CB-CD1 3.85Å; A125-L157 HydrophobicContact CB-CG 3.96Å; L126-L157 HydrophobicContact CD1-CD1 4.49Å; L157-L159 PolarHBondContact O-N 3.3Å
158	H	42.5	Very low	49.9	Very low	156 Å²	156	99.9 Å²	99.9	72%	0.722	52%	0.518	S	S	*	.			trans	-70	67	172.4	-76.7	-114.1	0	0	0	109.9	L156	L156-H158 PolarHBondContact O-CD2 3.11Å; L156-H158 VanDerWaalsContact O-CD2 3.28Å; L156-H158 PolarHBondContact O-N 3.5Å
159	L	40.1	Very low	48.3	Very low	67 Å²	67	104 Å²	104	35%	0.351	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-60.7	139.3	153.5	-68.6	179.9	0	0	0	107.2	A125 L126 L157	A125-L159 VanDerWaalsContact O-CD1 3.29Å; A125-L159 WeakPolarHBondContact O-CD1 3.36Å; L126-L159 HydrophobicContact CD2-CD1 4.06Å; L157-L159 PolarHBondContact O-N 3.3Å
160	P	34.9	Very low	47	Very low	104 Å²	104	110.9 Å²	110.9	68%	0.675	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-53.8	137.4	173.3	23.8	-33.5	0	0	0	108.3	R162	P160-R162 PolarHBondContact O-N 3.04Å
161	P	30.8	Very low	46.8	Very low	126 Å²	126	105.1 Å²	105.1	82%	0.818	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-52.8	118	-174.4	20.5	-32.5	0	0	0	108.3	R163	P161-R163 PolarHBondContact O-N 2.89Å
162	R	41	Very low	47.1	Very low	120 Å²	120	108.8 Å²	108.8	45%	0.453	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-56.9	123.3	174.7	-70.5	-172.4	178.7	-154.8	-1.4	105.9	D128 P160	D128-R162 IonicContact OD1-CZ 2.86Å; D128-R162 IonicContact OD1-NH1 3Å; D128-R162 PolarHBondContact OD1-NH1 2.83Å; D128-R162 IonicContact OD1-NH2 2.69Å; D128-R162 IonicContact OD2-CZ 3.19Å; D128-R162 IonicContact OD2-NH1 2.62Å; D128-R162 PolarHBondContact OD2-NH1 2.7Å; D128-R162 IonicContact OD2-NH2 3.18Å; D128-R162 PolarHBondContact OD2-NH2 2.81Å; P160-R162 PolarHBondContact O-N 3.04Å
163	R	39.7	Very low	48	Very low	229 Å²	229	113.2 Å²	113.2	86%	0.864	57%	0.569	S	S	*	*			trans	-43.4	132.9	170.1	-77.4	-174.7	-91	171.6	-7.9	107.2	P161 K165	P161-R163 PolarHBondContact O-N 2.89Å; R163-K165 PolarHBondContact O-N 2.99Å
164	P	42.3	Very low	49.5	Very low	109 Å²	109	112.9 Å²	112.9	71%	0.708	56%	0.557	S	S	*	*			trans	-47	133.7	-173.1	17.7	-31.4	0	0	0	108.9	N166	P164-N166 PolarHBondContact O-N 3.01Å
165	K	43.3	Very low	50.8	Low	172 Å²	172	107.8 Å²	107.8	75%	0.748	53%	0.533	S	S	*	.			trans	-64.2	90.4	178.1	-78.3	-177.6	174.4	-178.5	0	107.4	R163 T167	R163-K165 PolarHBondContact O-N 2.99Å; K165-T167 PolarHBondContact O-N 3.16Å
166	N	41	Very low	52.5	Low	75 Å²	75	108.7 Å²	108.7	40%	0.401	54%	0.536	S	S	.	.			trans	-53.6	124.1	162.4	-77.6	19.9	0	0	0	105.8	P164 I168 D204	P164-N166 PolarHBondContact O-N 3.01Å; N166-I168 HydrophobicContact CB-CB 4.06Å; N166-I168 HydrophobicContact CB-CD1 3.86Å; N166-I168 HydrophobicContact CB-CG1 4Å; N166-I168 PolarHBondContact O-N 2.85Å; N166-D204 PolarHBondContact ND2-OD1 3.25Å
167	T	45.3	Very low	54.2	Low	126 Å²	126	110 Å²	110	77%	0.773	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	23.2	174.3	42	0	0	0	0	112.6	K165	K165-T167 PolarHBondContact O-N 3.16Å
168	I	42.9	Very low	56	Low	56 Å²	56	110.4 Å²	110.4	29%	0.287	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-2.9	-166.2	-62.7	172.6	0	0	0	111.4	N166 E170 D204 R207	N166-I168 HydrophobicContact CB-CB 4.06Å; N166-I168 HydrophobicContact CB-CD1 3.86Å; N166-I168 HydrophobicContact CB-CG1 4Å; N166-I168 PolarHBondContact O-N 2.85Å; I168-E170 PolarHBondContact O-N 3.41Å; I168-D204 WeakPolarHBondContact CD1-OD1 3.36Å; I168-R207 VanDerWaalsContact CD1-CD 3.47Å; I168-R207 HydrophobicContact CD1-CG 4.49Å
169	F	47.2	Very low	58.2	Low	140 Å²	140	105.8 Å²	105.8	61%	0.614	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	27.5	166.1	-76.3	-69.1	0	0	0	113.4	D171 S175	F169-D171 PolarHBondContact O-N 3.32Å; F169-S175 VanDerWaalsContact CE1-OG 3.29Å; F169-S175 WeakPolarHBondContact CE1-OG 3.33Å
170	E	51	Low	60.6	Low	171 Å²	171	111.3 Å²	111.3	80%	0.799	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-34.5	165.2	-70.1	-178.7	142.7	0	0	110.9	I168 E172	I168-E170 PolarHBondContact O-N 3.41Å; E170-E172 VanDerWaalsContact C-N 3.28Å; E170-E172 PolarHBondContact O-N 2.84Å; E170-E172 VanDerWaalsContact O-N 3.13Å
171	D	61.3	Low	63.3	Low	53 Å²	53	107.7 Å²	107.7	28%	0.283	52%	0.52	S	S	.	.			trans	-89.9	68	171.9	-150.1	-39.9	0	0	0	111.2	F169 E173 K174 S175	F169-D171 PolarHBondContact O-N 3.32Å; D171-E173 PolarHBondContact O-N 3.45Å; D171-E173 WeakPolarHBondContact OD1-CB 3.22Å; D171-E173 PolarHBondContact OD1-N 2.95Å; D171-K174 HydrophobicContact CB-CB 4Å; D171-K174 HydrophobicContact CB-CD 4.03Å; D171-K174 HydrophobicContact CB-CG 4.17Å; D171-K174 VanDerWaalsContact CG-CG 3.4Å; D171-K174 PolarHBondContact O-N 3.4Å; D171-K174 WeakPolarHBondContact OD1-CB 3.35Å; D171-K174 WeakPolarHBondContact OD1-CG 3.32Å; D171-K174 PolarHBondContact OD1-N 3.04Å; D171-K174 WeakPolarHBondContact OD2-CD 3.34Å; D171-K174 WeakPolarHBondContact OD2-CE 3.48Å; D171-K174 WeakPolarHBondContact OD2-CG 3.5Å; D171-K174 IonicContact OD2-NZ 3.31Å; D171-K174 PolarHBondContact OD2-NZ 3.28Å; D171-S175 PolarHBondContact O-N 3.21Å; D171-S175 VanDerWaalsContact O-N 3.1Å
172	E	70.7	Confident	66.1	Low	113 Å²	113	105.7 Å²	105.7	53%	0.528	50%	0.502	S	S	.	.	H	α-helix	trans	-56.3	-27.1	172.4	-151.4	-158.3	168.5	0	0	110.9	E170 K176	E170-E172 VanDerWaalsContact C-N 3.28Å; E170-E172 PolarHBondContact O-N 2.84Å; E170-E172 VanDerWaalsContact O-N 3.13Å; E172-K176 HydrophobicContact CG-CD 4.43Å; E172-K176 WeakPolarHBondContact O-CB 3.43Å; E172-K176 WeakPolarHBondContact O-CD 3.39Å; E172-K176 WeakPolarHBondContact O-CG 3.45Å; E172-K176 PolarHBondContact O-N 2.66Å; E172-K176 WeakPolarHBondContact OE1-CE 3.39Å; E172-K176 IonicContact OE1-NZ 3.88Å; E172-K176 PolarHBondContact OE1-NZ 3.46Å; E172-K176 IonicContact OE2-NZ 2.73Å; E172-K176 PolarHBondContact OE2-NZ 3.3Å
173	E	77.3	Confident	68.5	Low	154 Å²	154	106.5 Å²	106.5	72%	0.72	52%	0.516	S	S	*	.	H	α-helix	trans	-69.6	-48.6	175.4	-51.7	-161.3	141.6	0	0	112.3	D171 S175 K176 M177	D171-E173 PolarHBondContact O-N 3.45Å; D171-E173 WeakPolarHBondContact OD1-CB 3.22Å; D171-E173 PolarHBondContact OD1-N 2.95Å; E173-S175 VanDerWaalsContact C-N 3.28Å; E173-S175 PolarHBondContact O-N 2.94Å; E173-K176 PolarHBondContact O-N 3.33Å; E173-M177 WeakPolarHBondContact O-CB 3.34Å; E173-M177 PolarHBondContact O-N 2.87Å
174	K	81.6	Confident	70.9	Confident	98 Å²	98	96.9 Å²	96.9	43%	0.426	48%	0.483	S	S	.	.	H	α-helix	trans	-59.4	-38.4	172.6	-78.7	178.8	-174.1	117.7	0	111.6	D171 M177 L178	D171-K174 HydrophobicContact CB-CB 4Å; D171-K174 HydrophobicContact CB-CD 4.03Å; D171-K174 HydrophobicContact CB-CG 4.17Å; D171-K174 VanDerWaalsContact CG-CG 3.4Å; D171-K174 PolarHBondContact O-N 3.4Å; D171-K174 WeakPolarHBondContact OD1-CB 3.35Å; D171-K174 WeakPolarHBondContact OD1-CG 3.32Å; D171-K174 PolarHBondContact OD1-N 3.04Å; D171-K174 WeakPolarHBondContact OD2-CD 3.34Å; D171-K174 WeakPolarHBondContact OD2-CE 3.48Å; D171-K174 WeakPolarHBondContact OD2-CG 3.5Å; D171-K174 IonicContact OD2-NZ 3.31Å; D171-K174 PolarHBondContact OD2-NZ 3.28Å; K174-M177 PolarHBondContact O-N 3.18Å; K174-L178 VanDerWaalsContact O-CB 3.27Å; K174-L178 WeakPolarHBondContact O-CB 3.46Å; K174-L178 PolarHBondContact O-N 3.11Å
175	S	79.5	Confident	73.2	Confident	32 Å²	32	97.3 Å²	97.3	22%	0.224	49%	0.489	C	S	.	.	H	α-helix	trans	-64.6	-47.3	175.2	-178	0	0	0	0	112.5	F169 D171 E173 S179	F169-S175 VanDerWaalsContact CE1-OG 3.29Å; F169-S175 WeakPolarHBondContact CE1-OG 3.33Å; D171-S175 PolarHBondContact O-N 3.21Å; D171-S175 VanDerWaalsContact O-N 3.1Å; E173-S175 VanDerWaalsContact C-N 3.28Å; E173-S175 PolarHBondContact O-N 2.94Å; S175-S179 WeakPolarHBondContact O-CB 3.44Å; S175-S179 PolarHBondContact O-N 3.12Å; S175-S179 PolarHBondContact O-OG 2.7Å
176	K	87.4	Confident	75.4	Confident	91 Å²	91	95.1 Å²	95.1	40%	0.396	48%	0.481	S	S	.	.	H	α-helix	trans	-63.4	-40.2	174.5	-74.6	164.7	-178	166.2	0	111.5	E172 E173 S179 R180	E172-K176 HydrophobicContact CG-CD 4.43Å; E172-K176 WeakPolarHBondContact O-CB 3.43Å; E172-K176 WeakPolarHBondContact O-CD 3.39Å; E172-K176 WeakPolarHBondContact O-CG 3.45Å; E172-K176 PolarHBondContact O-N 2.66Å; E172-K176 WeakPolarHBondContact OE1-CE 3.39Å; E172-K176 IonicContact OE1-NZ 3.88Å; E172-K176 PolarHBondContact OE1-NZ 3.46Å; E172-K176 IonicContact OE2-NZ 2.73Å; E172-K176 PolarHBondContact OE2-NZ 3.3Å; E173-K176 PolarHBondContact O-N 3.33Å; K176-S179 PolarHBondContact O-N 2.95Å; K176-R180 VanDerWaalsContact O-CG 3.3Å; K176-R180 WeakPolarHBondContact O-CG 3.34Å; K176-R180 PolarHBondContact O-N 2.82Å
177	M	86.4	Confident	77.8	Confident	100 Å²	100	96.1 Å²	96.1	49%	0.493	49%	0.492	S	S	.	.	H	α-helix	trans	-65.3	-49.9	177.6	-176.2	179.4	-68.1	0	0	111.1	E173 K174 S179 R180 L181 L196	E173-M177 WeakPolarHBondContact O-CB 3.34Å; E173-M177 PolarHBondContact O-N 2.87Å; K174-M177 PolarHBondContact O-N 3.18Å; M177-S179 VanDerWaalsContact C-N 3.28Å; M177-S179 PolarHBondContact O-N 3.17Å; M177-R180 WeakPolarHBondContact O-CB 3.37Å; M177-R180 PolarHBondContact O-N 2.83Å; M177-R180 VanDerWaalsContact O-N 3.11Å; M177-L181 HydrophobicContact CG-CD1 3.96Å; M177-L181 HydrophobicContact CG-CG 4.36Å; M177-L181 VanDerWaalsContact O-CG 3.31Å; M177-L181 WeakPolarHBondContact O-CG 3.4Å; M177-L181 PolarHBondContact O-N 3.39Å; M177-L196 HydrophobicContact CG-CD2 4.5Å
178	L	89.9	Confident	80	Confident	26 Å²	26	95.8 Å²	95.8	14%	0.136	48%	0.481	C	S	.	.	H	α-helix	trans	-57.7	-43.1	176	179.5	57.6	0	0	0	111.3	K174 R180 L181 L182 A193 L196 I197 M200	K174-L178 VanDerWaalsContact O-CB 3.27Å; K174-L178 WeakPolarHBondContact O-CB 3.46Å; K174-L178 PolarHBondContact O-N 3.11Å; L178-R180 PolarHBondContact O-N 3.39Å; L178-L181 PolarHBondContact O-N 2.87Å; L178-L182 HydrophobicContact CD1-CD1 3.89Å; L178-L182 HydrophobicContact CD1-CG 3.95Å; L178-L182 HydrophobicContact CG-CD1 3.89Å; L178-L182 HydrophobicContact CG-CG 4.37Å; L178-L182 WeakPolarHBondContact O-CB 3.47Å; L178-L182 WeakPolarHBondContact O-CG 3.48Å; L178-L182 PolarHBondContact O-N 3.07Å; L178-A193 HydrophobicContact CD1-CB 3.85Å; L178-L196 HydrophobicContact CB-CD2 3.83Å; L178-L196 HydrophobicContact CD1-CD2 4.3Å; L178-I197 HydrophobicContact CD1-CD1 4.01Å; L178-I197 HydrophobicContact CD1-CG1 3.67Å; L178-I197 HydrophobicContact CD2-CG1 3.9Å; L178-I197 HydrophobicContact CG-CG1 4.43Å; L178-M200 HydrophobicContact CD2-SD 3.98Å
179	S	89.4	Confident	82.4	Confident	59 Å²	59	95.7 Å²	95.7	41%	0.413	48%	0.481	S	S	.	.	H	α-helix	trans	-62.7	-38.8	176.6	-57.7	0	0	0	0	112.6	S175 K176 M177 N183	S175-S179 WeakPolarHBondContact O-CB 3.44Å; S175-S179 PolarHBondContact O-N 3.12Å; S175-S179 PolarHBondContact O-OG 2.7Å; K176-S179 PolarHBondContact O-N 2.95Å; M177-S179 VanDerWaalsContact C-N 3.28Å; M177-S179 PolarHBondContact O-N 3.17Å; S179-N183 WeakPolarHBondContact O-CB 3.49Å; S179-N183 PolarHBondContact O-N 3.07Å; S179-N183 VanDerWaalsContact O-N 3.17Å; S179-N183 PolarHBondContact O-ND2 3.28Å; S179-N183 VanDerWaalsContact O-ND2 3.11Å
180	R	90.8	Very high	84.5	Confident	183 Å²	183	92.2 Å²	92.2	69%	0.691	47%	0.469	S	S	*	.	H	α-helix	trans	-66.3	-45.3	173.7	-72.5	169.4	-173.8	160.4	1.7	111.7	K176 M177 L178 N183 S184	K176-R180 VanDerWaalsContact O-CG 3.3Å; K176-R180 WeakPolarHBondContact O-CG 3.34Å; K176-R180 PolarHBondContact O-N 2.82Å; M177-R180 WeakPolarHBondContact O-CB 3.37Å; M177-R180 PolarHBondContact O-N 2.83Å; M177-R180 VanDerWaalsContact O-N 3.11Å; L178-R180 PolarHBondContact O-N 3.39Å; R180-N183 PolarHBondContact O-N 3.3Å; R180-S184 PolarHBondContact O-N 3.37Å; R180-S184 VanDerWaalsContact O-N 3.13Å
181	L	91.7	Very high	86.5	Confident	29 Å²	29	89.9 Å²	89.9	15%	0.152	46%	0.456	C	S	.	.	H	α-helix	trans	-65.8	-38.7	-179.1	-67.1	171.2	0	0	0	112.2	M177 L178 S184 D189 A192 A193 L196	M177-L181 HydrophobicContact CG-CD1 3.96Å; M177-L181 HydrophobicContact CG-CG 4.36Å; M177-L181 VanDerWaalsContact O-CG 3.31Å; M177-L181 WeakPolarHBondContact O-CG 3.4Å; M177-L181 PolarHBondContact O-N 3.39Å; L178-L181 PolarHBondContact O-N 2.87Å; L181-S184 WeakPolarHBondContact O-CB 3.48Å; L181-S184 PolarHBondContact O-N 3.03Å; L181-D189 HydrophobicContact CD2-CB 3.85Å; L181-A192 HydrophobicContact CD1-CB 4.09Å; L181-A192 HydrophobicContact CD2-CB 4.23Å; L181-A193 HydrophobicContact CB-CB 3.8Å; L181-L196 HydrophobicContact CD1-CD2 4.32Å
182	L	89.4	Confident	87.9	Confident	83 Å²	83	89.3 Å²	89.3	44%	0.435	46%	0.459	S	S	.	.	H	α-helix	trans	-71.1	-28.7	175.3	-71.9	173.5	0	0	0	113.7	L178 S184 A193 I197	L178-L182 HydrophobicContact CD1-CD1 3.89Å; L178-L182 HydrophobicContact CD1-CG 3.95Å; L178-L182 HydrophobicContact CG-CD1 3.89Å; L178-L182 HydrophobicContact CG-CG 4.37Å; L178-L182 WeakPolarHBondContact O-CB 3.47Å; L178-L182 WeakPolarHBondContact O-CG 3.48Å; L178-L182 PolarHBondContact O-N 3.07Å; L182-S184 VanDerWaalsContact C-N 3.33Å; L182-A193 HydrophobicContact CD2-CB 3.7Å; L182-A193 HydrophobicContact CG-CB 3.98Å; L182-I197 HydrophobicContact CD2-CD1 4.3Å
183	N	90.3	Very high	89	Confident	138 Å²	138	83.9 Å²	83.9	74%	0.738	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-4.7	175.5	-70.7	-22.5	0	0	0	113	S179 R180	S179-N183 WeakPolarHBondContact O-CB 3.49Å; S179-N183 PolarHBondContact O-N 3.07Å; S179-N183 VanDerWaalsContact O-N 3.17Å; S179-N183 PolarHBondContact O-ND2 3.28Å; S179-N183 VanDerWaalsContact O-ND2 3.11Å; R180-N183 PolarHBondContact O-N 3.3Å
184	S	91.2	Very high	89.6	Confident	26 Å²	26	81.7 Å²	81.7	18%	0.182	43%	0.427	C	S	.	.			trans	-77.1	144.1	176.4	-174.3	0	0	0	0	111.4	R180 L181 L182 H186 D189	R180-S184 PolarHBondContact O-N 3.37Å; R180-S184 VanDerWaalsContact O-N 3.13Å; L181-S184 WeakPolarHBondContact O-CB 3.48Å; L181-S184 PolarHBondContact O-N 3.03Å; L182-S184 VanDerWaalsContact C-N 3.33Å; S184-H186 VanDerWaalsContact C-N 3.32Å; S184-H186 PolarHBondContact OG-N 3.45Å; S184-D189 WeakPolarHBondContact CB-OD2 3.41Å; S184-D189 PolarHBondContact OG-OD2 3.38Å
185	S	89.3	Confident	90.2	Very high	119 Å²	119	83.3 Å²	83.3	83%	0.832	43%	0.434	S	S	*	.			trans	-88	0.5	172.6	-57.8	0	0	0	0	113.1
186	H	91	Very high	90.7	Very high	125 Å²	125	82.8 Å²	82.8	58%	0.579	43%	0.428	S	S	*	.			trans	-88.6	135.8	-179.5	-63.9	-63.1	0	0	0	112.1	S184 E188 D189 L190	S184-H186 VanDerWaalsContact C-N 3.32Å; S184-H186 PolarHBondContact OG-N 3.45Å; H186-E188 VanDerWaalsContact C-N 3.34Å; H186-E188 PolarHBondContact O-N 2.93Å; H186-D189 HydrophobicContact CB-CB 4.45Å; H186-D189 IonicContact CD2-OD2 2.76Å; H186-D189 PolarHBondContact O-N 3.19Å; H186-L190 PolarHBondContact O-N 2.97Å
187	P	90.3	Very high	90.8	Very high	97 Å²	97	81.3 Å²	81.3	63%	0.63	42%	0.424	S	S	*	.	H	α-helix	trans	-67.4	-30.9	-175	26.1	-34.7	0	0	0	113.6	K191	P187-K191 WeakPolarHBondContact O-CB 3.26Å; P187-K191 PolarHBondContact O-N 2.99Å; P187-K191 VanDerWaalsContact O-N 3.08Å
188	E	92.7	Very high	91	Very high	118 Å²	118	82.8 Å²	82.8	55%	0.551	43%	0.428	S	S	*	.	H	α-helix	trans	-71.1	-32.3	176.5	-67.6	-60	128	0	0	112.2	H186 K191 A192	H186-E188 VanDerWaalsContact C-N 3.34Å; H186-E188 PolarHBondContact O-N 2.93Å; E188-K191 WeakPolarHBondContact O-CB 3.46Å; E188-K191 PolarHBondContact O-N 3.22Å; E188-K191 IonicContact OE1-NZ 2.7Å; E188-K191 PolarHBondContact OE1-NZ 2.98Å; E188-K191 VanDerWaalsContact OE1-NZ 3.08Å; E188-K191 WeakPolarHBondContact OE2-CD 3.5Å; E188-K191 IonicContact OE2-NZ 2.88Å; E188-K191 PolarHBondContact OE2-NZ 3.25Å; E188-A192 WeakPolarHBondContact O-CB 3.37Å; E188-A192 PolarHBondContact O-N 2.99Å
189	D	92.7	Very high	91	Very high	54 Å²	54	86.1 Å²	86.1	29%	0.289	44%	0.443	S	S	.	.	H	α-helix	trans	-69.2	-41.8	175.5	-67.8	-22.4	0	0	0	111.2	L181 S184 H186 K191 A192 A193	L181-D189 HydrophobicContact CD2-CB 3.85Å; S184-D189 WeakPolarHBondContact CB-OD2 3.41Å; S184-D189 PolarHBondContact OG-OD2 3.38Å; H186-D189 HydrophobicContact CB-CB 4.45Å; H186-D189 IonicContact CD2-OD2 2.76Å; H186-D189 PolarHBondContact O-N 3.19Å; D189-K191 VanDerWaalsContact C-N 3.28Å; D189-K191 PolarHBondContact O-N 3.2Å; D189-A192 CarbonylContact O-C 3.59Å; D189-A192 WeakPolarHBondContact O-CB 3.45Å; D189-A192 PolarHBondContact O-N 3.48Å; D189-A193 PolarHBondContact O-N 2.81Å
190	L	90.4	Very high	90.8	Very high	68 Å²	68	86.5 Å²	86.5	36%	0.356	44%	0.439	S	S	.	.	H	α-helix	trans	-63.5	-34.8	173.7	-66.9	174.3	0	0	0	112.1	H186 A193 N194	H186-L190 PolarHBondContact O-N 2.97Å; L190-A193 PolarHBondContact O-N 3.35Å; L190-N194 WeakPolarHBondContact O-CB 3.36Å; L190-N194 PolarHBondContact O-N 3.1Å; L190-N194 PolarHBondContact O-ND2 3.41Å
191	K	92.7	Very high	90.7	Very high	121 Å²	121	82.2 Å²	82.2	53%	0.526	43%	0.432	S	S	.	.	H	α-helix	trans	-69.9	-38.5	173.9	-178	-177.7	171	-162.4	0	111.8	P187 E188 D189 N194 K195	P187-K191 WeakPolarHBondContact O-CB 3.26Å; P187-K191 PolarHBondContact O-N 2.99Å; P187-K191 VanDerWaalsContact O-N 3.08Å; E188-K191 WeakPolarHBondContact O-CB 3.46Å; E188-K191 PolarHBondContact O-N 3.22Å; E188-K191 IonicContact OE1-NZ 2.7Å; E188-K191 PolarHBondContact OE1-NZ 2.98Å; E188-K191 VanDerWaalsContact OE1-NZ 3.08Å; E188-K191 WeakPolarHBondContact OE2-CD 3.5Å; E188-K191 IonicContact OE2-NZ 2.88Å; E188-K191 PolarHBondContact OE2-NZ 3.25Å; D189-K191 VanDerWaalsContact C-N 3.28Å; D189-K191 PolarHBondContact O-N 3.2Å; K191-N194 PolarHBondContact O-N 3.39Å; K191-K195 PolarHBondContact O-N 2.99Å
192	A	92.3	Very high	90.6	Very high	41 Å²	41	86.5 Å²	86.5	34%	0.339	45%	0.452	S	S	.	.	H	α-helix	trans	-64.7	-41.6	170.9	0	0	0	0	0	111.8	L181 E188 D189 K195 L196	L181-A192 HydrophobicContact CD1-CB 4.09Å; L181-A192 HydrophobicContact CD2-CB 4.23Å; E188-A192 WeakPolarHBondContact O-CB 3.37Å; E188-A192 PolarHBondContact O-N 2.99Å; D189-A192 CarbonylContact O-C 3.59Å; D189-A192 WeakPolarHBondContact O-CB 3.45Å; D189-A192 PolarHBondContact O-N 3.48Å; A192-K195 PolarHBondContact O-N 3Å; A192-L196 WeakPolarHBondContact O-CB 3.32Å; A192-L196 PolarHBondContact O-N 3.07Å
193	A	92.3	Very high	90.4	Very high	0 Å²	0	85.8 Å²	85.8	0%	0	45%	0.446	C	S	.	.	H	α-helix	trans	-58.4	-48.6	173.2	0	0	0	0	0	111.6	L178 L181 L182 D189 L190 K195 L196 I197	L178-A193 HydrophobicContact CD1-CB 3.85Å; L181-A193 HydrophobicContact CB-CB 3.8Å; L182-A193 HydrophobicContact CD2-CB 3.7Å; L182-A193 HydrophobicContact CG-CB 3.98Å; D189-A193 PolarHBondContact O-N 2.81Å; L190-A193 PolarHBondContact O-N 3.35Å; A193-K195 VanDerWaalsContact C-N 3.31Å; A193-K195 PolarHBondContact O-N 2.75Å; A193-L196 PolarHBondContact O-N 3.25Å; A193-I197 WeakPolarHBondContact O-CB 3.35Å; A193-I197 VanDerWaalsContact O-CG1 3.26Å; A193-I197 WeakPolarHBondContact O-CG1 3.04Å; A193-I197 PolarHBondContact O-N 2.74Å
194	N	90.6	Very high	90.1	Very high	107 Å²	107	82 Å²	82	57%	0.572	43%	0.426	S	S	*	.	H	α-helix	trans	-62.1	-36.7	178.3	-77.3	-50.1	0	0	0	112.7	L190 K191 K198	L190-N194 WeakPolarHBondContact O-CB 3.36Å; L190-N194 PolarHBondContact O-N 3.1Å; L190-N194 PolarHBondContact O-ND2 3.41Å; K191-N194 PolarHBondContact O-N 3.39Å; N194-K198 PolarHBondContact O-N 3.35Å; N194-K198 VanDerWaalsContact O-N 3.17Å
195	K	93.5	Very high	90	Very high	133 Å²	133	85.9 Å²	85.9	58%	0.578	44%	0.441	S	S	*	.	H	α-helix	trans	-64.7	-48.3	172.2	-176.2	-173.6	165.3	-169.6	0	111.2	K191 A192 A193 I197 K198 E199	K191-K195 PolarHBondContact O-N 2.99Å; A192-K195 PolarHBondContact O-N 3Å; A193-K195 VanDerWaalsContact C-N 3.31Å; A193-K195 PolarHBondContact O-N 2.75Å; K195-I197 PolarHBondContact O-N 2.67Å; K195-K198 WeakPolarHBondContact O-CB 3.31Å; K195-K198 PolarHBondContact O-N 3.42Å; K195-K198 VanDerWaalsContact O-N 3.16Å; K195-E199 WeakPolarHBondContact CE-OE1 3.4Å; K195-E199 IonicContact NZ-OE1 2.64Å; K195-E199 PolarHBondContact O-N 2.96Å
196	L	89.9	Confident	90	Very high	20 Å²	20	84.8 Å²	84.8	11%	0.105	42%	0.419	C	S	.	.	H	α-helix	trans	-62.7	-41.1	-179.7	-176.8	60	0	0	0	111.9	M177 L178 L181 A192 A193 K198 E199 M200	M177-L196 HydrophobicContact CG-CD2 4.5Å; L178-L196 HydrophobicContact CB-CD2 3.83Å; L178-L196 HydrophobicContact CD1-CD2 4.3Å; L181-L196 HydrophobicContact CD1-CD2 4.32Å; A192-L196 WeakPolarHBondContact O-CB 3.32Å; A192-L196 PolarHBondContact O-N 3.07Å; A193-L196 PolarHBondContact O-N 3.25Å; L196-K198 VanDerWaalsContact C-N 3.33Å; L196-K198 PolarHBondContact O-N 2.93Å; L196-E199 PolarHBondContact O-N 3.15Å; L196-M200 HydrophobicContact CD1-CG 4.38Å; L196-M200 HydrophobicContact CD1-SD 4.44Å; L196-M200 HydrophobicContact CG-SD 4.13Å; L196-M200 WeakPolarHBondContact O-CB 3.35Å; L196-M200 VanDerWaalsContact O-CG 3.27Å; L196-M200 WeakPolarHBondContact O-CG 3.46Å; L196-M200 PolarHBondContact O-N 2.86Å
197	I	89.7	Confident	89.7	Confident	60 Å²	60	82 Å²	82	31%	0.308	40%	0.403	S	S	.	.	H	α-helix	trans	-57.9	-46.1	172.6	-70.7	163.3	0	0	0	110.6	L178 L182 A193 K195 E199 M200 V201	L178-I197 HydrophobicContact CD1-CD1 4.01Å; L178-I197 HydrophobicContact CD1-CG1 3.67Å; L178-I197 HydrophobicContact CD2-CG1 3.9Å; L178-I197 HydrophobicContact CG-CG1 4.43Å; L182-I197 HydrophobicContact CD2-CD1 4.3Å; A193-I197 WeakPolarHBondContact O-CB 3.35Å; A193-I197 VanDerWaalsContact O-CG1 3.26Å; A193-I197 WeakPolarHBondContact O-CG1 3.04Å; A193-I197 PolarHBondContact O-N 2.74Å; K195-I197 PolarHBondContact O-N 2.67Å; I197-E199 PolarHBondContact O-N 2.84Å; I197-M200 PolarHBondContact O-N 3.19Å; I197-V201 HydrophobicContact CG2-CG2 4.3Å; I197-V201 WeakPolarHBondContact O-CB 3.48Å; I197-V201 VanDerWaalsContact O-CG2 3.29Å; I197-V201 WeakPolarHBondContact O-CG2 3.06Å; I197-V201 PolarHBondContact O-N 2.69Å
198	K	90.8	Very high	89.5	Confident	132 Å²	132	79.7 Å²	79.7	57%	0.574	39%	0.393	S	S	*	.	H	α-helix	trans	-62.3	-44.3	-179.9	-175.4	179.5	178.9	-178.9	0	112	N194 K195 L196 Q202	N194-K198 PolarHBondContact O-N 3.35Å; N194-K198 VanDerWaalsContact O-N 3.17Å; K195-K198 WeakPolarHBondContact O-CB 3.31Å; K195-K198 PolarHBondContact O-N 3.42Å; K195-K198 VanDerWaalsContact O-N 3.16Å; L196-K198 VanDerWaalsContact C-N 3.33Å; L196-K198 PolarHBondContact O-N 2.93Å; K198-Q202 WeakPolarHBondContact O-CG 3.48Å; K198-Q202 PolarHBondContact O-N 3.33Å; K198-Q202 VanDerWaalsContact O-N 3.1Å
199	E	90.9	Very high	89.4	Confident	96 Å²	96	78.1 Å²	78.1	45%	0.449	39%	0.385	S	S	.	.	H	α-helix	trans	-64.6	-45.5	176.7	-71.7	173.9	179.7	0	0	111.1	K195 L196 I197 V201 Q202 E203	K195-E199 WeakPolarHBondContact CE-OE1 3.4Å; K195-E199 IonicContact NZ-OE1 2.64Å; K195-E199 PolarHBondContact O-N 2.96Å; L196-E199 PolarHBondContact O-N 3.15Å; I197-E199 PolarHBondContact O-N 2.84Å; E199-V201 PolarHBondContact O-N 2.96Å; E199-Q202 PolarHBondContact O-N 2.62Å; E199-E203 VanDerWaalsContact O-CB 3.26Å; E199-E203 WeakPolarHBondContact O-CB 3.35Å; E199-E203 PolarHBondContact O-N 3.32Å
200	M	85.3	Confident	89.3	Confident	66 Å²	66	78.9 Å²	78.9	33%	0.325	39%	0.386	S	S	.	.	H	α-helix	trans	-60.5	-42.6	176.3	-73.4	179.1	70.9	0	0	112.8	L178 L196 I197 E203 D204	L178-M200 HydrophobicContact CD2-SD 3.98Å; L196-M200 HydrophobicContact CD1-CG 4.38Å; L196-M200 HydrophobicContact CD1-SD 4.44Å; L196-M200 HydrophobicContact CG-SD 4.13Å; L196-M200 WeakPolarHBondContact O-CB 3.35Å; L196-M200 VanDerWaalsContact O-CG 3.27Å; L196-M200 WeakPolarHBondContact O-CG 3.46Å; L196-M200 PolarHBondContact O-N 2.86Å; I197-M200 PolarHBondContact O-N 3.19Å; M200-E203 PolarHBondContact O-N 3.47Å; M200-D204 VanDerWaalsContact O-CB 3.31Å; M200-D204 WeakPolarHBondContact O-CB 3.41Å; M200-D204 PolarHBondContact O-N 3.04Å
201	V	87.3	Confident	89.3	Confident	93 Å²	93	78.5 Å²	78.5	56%	0.564	39%	0.387	S	S	*	.	H	α-helix	trans	-67.8	-39.5	179	169.2	0	0	0	0	111.7	I197 E199 E203 Q205	I197-V201 HydrophobicContact CG2-CG2 4.3Å; I197-V201 WeakPolarHBondContact O-CB 3.48Å; I197-V201 VanDerWaalsContact O-CG2 3.29Å; I197-V201 WeakPolarHBondContact O-CG2 3.06Å; I197-V201 PolarHBondContact O-N 2.69Å; E199-V201 PolarHBondContact O-N 2.96Å; V201-E203 VanDerWaalsContact C-N 3.35Å; V201-Q205 WeakPolarHBondContact O-CB 3.41Å; V201-Q205 PolarHBondContact O-N 3.08Å
202	Q	89.3	Confident	89.3	Confident	120 Å²	120	75.7 Å²	75.7	56%	0.561	38%	0.382	S	S	*	.	H	α-helix	trans	-66.2	-39.1	175.8	-73	-179.6	-19.3	0	0	111.8	K198 E199 R206	K198-Q202 WeakPolarHBondContact O-CG 3.48Å; K198-Q202 PolarHBondContact O-N 3.33Å; K198-Q202 VanDerWaalsContact O-N 3.1Å; E199-Q202 PolarHBondContact O-N 2.62Å; Q202-R206 WeakPolarHBondContact O-CB 3.27Å; Q202-R206 PolarHBondContact O-N 3.06Å
203	E	86.7	Confident	89.4	Confident	67 Å²	67	79.7 Å²	79.7	31%	0.313	39%	0.392	S	S	.	.	H	α-helix	trans	-70.7	-37.8	177.2	173.6	53.6	-159.4	0	0	112.8	E199 M200 V201 R206 R207	E199-E203 VanDerWaalsContact O-CB 3.26Å; E199-E203 WeakPolarHBondContact O-CB 3.35Å; E199-E203 PolarHBondContact O-N 3.32Å; M200-E203 PolarHBondContact O-N 3.47Å; V201-E203 VanDerWaalsContact C-N 3.35Å; E203-R206 VanDerWaalsContact CD-NH2 3.29Å; E203-R206 IonicContact OE1-CZ 2.82Å; E203-R206 IonicContact OE1-NE 2.67Å; E203-R206 IonicContact OE1-NH2 2.78Å; E203-R206 PolarHBondContact OE1-NH2 3.19Å; E203-R206 IonicContact OE2-CZ 2.7Å; E203-R206 VanDerWaalsContact OE2-CZ 3.31Å; E203-R206 IonicContact OE2-NE 3.8Å; E203-R206 PolarHBondContact OE2-NE 3.21Å; E203-R206 IonicContact OE2-NH2 2.84Å; E203-R206 PolarHBondContact OE2-NH2 3Å; E203-R207 WeakPolarHBondContact O-CB 3.44Å; E203-R207 PolarHBondContact O-N 3.32Å; E203-R207 PolarHBondContact O-NH1 3.41Å; E203-R207 IonicContact OE1-CZ 2.6Å; E203-R207 IonicContact OE1-NH1 3.08Å; E203-R207 PolarHBondContact OE1-NH1 2.83Å; E203-R207 IonicContact OE1-NH2 3.68Å; E203-R207 PolarHBondContact OE1-NH2 3.46Å
204	D	83.9	Confident	89.4	Confident	58 Å²	58	81.4 Å²	81.4	31%	0.31	40%	0.398	S	S	.	.	H	α-helix	trans	-65.2	-45.8	173.2	-166.4	56.7	0	0	0	110.8	N166 I168 M200 R206 R207 A208	N166-D204 PolarHBondContact ND2-OD1 3.25Å; I168-D204 WeakPolarHBondContact CD1-OD1 3.36Å; M200-D204 VanDerWaalsContact O-CB 3.31Å; M200-D204 WeakPolarHBondContact O-CB 3.41Å; M200-D204 PolarHBondContact O-N 3.04Å; D204-R206 PolarHBondContact O-N 3.34Å; D204-R207 PolarHBondContact O-N 3.07Å; D204-A208 WeakPolarHBondContact O-CB 3.48Å; D204-A208 PolarHBondContact O-N 3.45Å
205	Q	88.6	Confident	89.6	Confident	108 Å²	108	79.7 Å²	79.7	51%	0.505	39%	0.392	S	S	.	.	H	α-helix	trans	-59.2	-46.9	174.2	178.9	61.9	32.5	0	0	111.9	V201 R207 A208 E209	V201-Q205 WeakPolarHBondContact O-CB 3.41Å; V201-Q205 PolarHBondContact O-N 3.08Å; Q205-R207 VanDerWaalsContact C-N 3.32Å; Q205-R207 PolarHBondContact O-N 2.95Å; Q205-A208 PolarHBondContact O-N 3.45Å; Q205-E209 PolarHBondContact NE2-OE1 3.35Å; Q205-E209 WeakPolarHBondContact O-CG 3.42Å; Q205-E209 PolarHBondContact O-N 2.91Å
206	R	88.7	Confident	89.8	Confident	97 Å²	97	78.2 Å²	78.2	37%	0.366	39%	0.39	S	S	.	.	H	α-helix	trans	-58.5	-42.8	176.5	-174.4	-164.3	68	78.1	-1.2	111.7	Q202 E203 D204 K210	Q202-R206 WeakPolarHBondContact O-CB 3.27Å; Q202-R206 PolarHBondContact O-N 3.06Å; E203-R206 VanDerWaalsContact CD-NH2 3.29Å; E203-R206 IonicContact OE1-CZ 2.82Å; E203-R206 IonicContact OE1-NE 2.67Å; E203-R206 IonicContact OE1-NH2 2.78Å; E203-R206 PolarHBondContact OE1-NH2 3.19Å; E203-R206 IonicContact OE2-CZ 2.7Å; E203-R206 VanDerWaalsContact OE2-CZ 3.31Å; E203-R206 IonicContact OE2-NE 3.8Å; E203-R206 PolarHBondContact OE2-NE 3.21Å; E203-R206 IonicContact OE2-NH2 2.84Å; E203-R206 PolarHBondContact OE2-NH2 3Å; D204-R206 PolarHBondContact O-N 3.34Å; R206-K210 PolarHBondContact O-N 3.05Å
207	R	85.3	Confident	90	Very high	65 Å²	65	77.9 Å²	77.9	25%	0.245	39%	0.39	C	S	.	.	H	α-helix	trans	-70.8	-41.5	178.3	-173.8	-174.5	-80.2	80.4	7.1	111.7	I168 E203 D204 Q205 E209 K210 V211	I168-R207 VanDerWaalsContact CD1-CD 3.47Å; I168-R207 HydrophobicContact CD1-CG 4.49Å; E203-R207 WeakPolarHBondContact O-CB 3.44Å; E203-R207 PolarHBondContact O-N 3.32Å; E203-R207 PolarHBondContact O-NH1 3.41Å; E203-R207 IonicContact OE1-CZ 2.6Å; E203-R207 IonicContact OE1-NH1 3.08Å; E203-R207 PolarHBondContact OE1-NH1 2.83Å; E203-R207 IonicContact OE1-NH2 3.68Å; E203-R207 PolarHBondContact OE1-NH2 3.46Å; D204-R207 PolarHBondContact O-N 3.07Å; Q205-R207 VanDerWaalsContact C-N 3.32Å; Q205-R207 PolarHBondContact O-N 2.95Å; R207-E209 VanDerWaalsContact C-N 3.29Å; R207-E209 PolarHBondContact O-N 3.47Å; R207-K210 WeakPolarHBondContact O-CB 3.29Å; R207-K210 PolarHBondContact O-N 3.38Å; R207-V211 HydrophobicContact CG-CG2 4.49Å; R207-V211 WeakPolarHBondContact O-CG2 3.22Å; R207-V211 PolarHBondContact O-N 3.16Å
208	A	86.9	Confident	90.3	Very high	50 Å²	50	75.4 Å²	75.4	41%	0.413	38%	0.377	S	S	.	.	H	α-helix	trans	-59.2	-40.6	174.5	0	0	0	0	0	111.6	D204 Q205 V211 S212	D204-A208 WeakPolarHBondContact O-CB 3.48Å; D204-A208 PolarHBondContact O-N 3.45Å; Q205-A208 PolarHBondContact O-N 3.45Å; A208-V211 PolarHBondContact O-N 2.89Å; A208-S212 VanDerWaalsContact O-CB 3.28Å; A208-S212 WeakPolarHBondContact O-CB 3.49Å; A208-S212 PolarHBondContact O-N 3.37Å
209	E	89.3	Confident	90.6	Very high	85 Å²	85	73.3 Å²	73.3	40%	0.397	37%	0.37	S	S	.	.	H	α-helix	trans	-66.2	-41.9	173.1	-74.9	178.8	-148.8	0	0	113.3	Q205 R207 K213	Q205-E209 PolarHBondContact NE2-OE1 3.35Å; Q205-E209 WeakPolarHBondContact O-CG 3.42Å; Q205-E209 PolarHBondContact O-N 2.91Å; R207-E209 VanDerWaalsContact C-N 3.29Å; R207-E209 PolarHBondContact O-N 3.47Å; E209-K213 WeakPolarHBondContact O-CB 3.29Å; E209-K213 WeakPolarHBondContact O-CD 3.26Å; E209-K213 WeakPolarHBondContact O-CG 3.39Å; E209-K213 PolarHBondContact O-N 2.96Å; E209-K213 IonicContact OE2-NZ 3.03Å
210	K	90.3	Very high	90.8	Very high	70 Å²	70	72.1 Å²	72.1	30%	0.304	36%	0.364	S	S	.	.	H	α-helix	trans	-57.1	-50.6	171.9	-89.3	-161	171.7	-161.1	0	110.8	R206 R207 K213 R214 D268 D271	R206-K210 PolarHBondContact O-N 3.05Å; R207-K210 WeakPolarHBondContact O-CB 3.29Å; R207-K210 PolarHBondContact O-N 3.38Å; K210-K213 PolarHBondContact O-N 3.41Å; K210-R214 WeakPolarHBondContact O-CB 3.37Å; K210-R214 PolarHBondContact O-N 3.35Å; K210-D268 PolarHBondContact NZ-O 2.83Å; K210-D271 VanDerWaalsContact NZ-CG 3.3Å; K210-D271 IonicContact NZ-OD1 2.61Å; K210-D271 PolarHBondContact NZ-OD1 3.17Å; K210-D271 IonicContact NZ-OD2 3.48Å; K210-D271 PolarHBondContact NZ-OD2 3.45Å
211	V	90.8	Very high	91.4	Very high	60 Å²	60	69 Å²	69	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-63.2	-45.2	-179.1	173	0	0	0	0	111.1	R207 A208 K213 R214 V215	R207-V211 HydrophobicContact CG-CG2 4.49Å; R207-V211 WeakPolarHBondContact O-CG2 3.22Å; R207-V211 PolarHBondContact O-N 3.16Å; A208-V211 PolarHBondContact O-N 2.89Å; V211-K213 PolarHBondContact O-N 2.88Å; V211-R214 PolarHBondContact O-N 3.45Å; V211-V215 HydrophobicContact CG1-CG2 4.14Å; V211-V215 WeakPolarHBondContact O-CB 3.42Å; V211-V215 WeakPolarHBondContact O-CG2 3.32Å; V211-V215 PolarHBondContact O-N 3.48Å
212	S	93.5	Very high	91.7	Very high	61 Å²	61	70.1 Å²	70.1	43%	0.427	35%	0.346	S	S	.	.	H	α-helix	trans	-61.3	-44.9	177.2	-179.9	0	0	0	0	112.1	A208 R214 V215 N216	A208-S212 VanDerWaalsContact O-CB 3.28Å; A208-S212 WeakPolarHBondContact O-CB 3.49Å; A208-S212 PolarHBondContact O-N 3.37Å; S212-R214 VanDerWaalsContact C-N 3.33Å; S212-R214 PolarHBondContact O-N 3.49Å; S212-V215 PolarHBondContact O-N 3.08Å; S212-N216 VanDerWaalsContact O-CB 3.29Å; S212-N216 WeakPolarHBondContact O-CB 3.45Å; S212-N216 PolarHBondContact O-N 3.12Å; S212-N216 PolarHBondContact O-ND2 3Å
213	K	93.4	Very high	92	Very high	126 Å²	126	69.5 Å²	69.5	55%	0.548	34%	0.343	S	S	.	.	H	α-helix	trans	-59.7	-42.9	174.2	-71.8	164.2	-170.4	161.9	0	111.5	E209 K210 V211 A217	E209-K213 WeakPolarHBondContact O-CB 3.29Å; E209-K213 WeakPolarHBondContact O-CD 3.26Å; E209-K213 WeakPolarHBondContact O-CG 3.39Å; E209-K213 PolarHBondContact O-N 2.96Å; E209-K213 IonicContact OE2-NZ 3.03Å; K210-K213 PolarHBondContact O-N 3.41Å; V211-K213 PolarHBondContact O-N 2.88Å; K213-A217 WeakPolarHBondContact O-CB 3.36Å; K213-A217 PolarHBondContact O-N 3.29Å; K213-A217 VanDerWaalsContact O-N 3.14Å
214	R	93.8	Very high	92.4	Very high	35 Å²	35	66.5 Å²	66.5	13%	0.132	33%	0.329	C	S	.	.	H	α-helix	trans	-62.4	-55.2	177.5	-173.3	-178.7	90.2	-131.3	11.9	111.9	K210 V211 S212 N216 A217 I218 L265 E278 I279	K210-R214 WeakPolarHBondContact O-CB 3.37Å; K210-R214 PolarHBondContact O-N 3.35Å; V211-R214 PolarHBondContact O-N 3.45Å; S212-R214 VanDerWaalsContact C-N 3.33Å; S212-R214 PolarHBondContact O-N 3.49Å; R214-N216 PolarHBondContact O-N 3.02Å; R214-A217 PolarHBondContact O-N 2.85Å; R214-I218 HydrophobicContact CG-CD1 3.76Å; R214-I218 HydrophobicContact CG-CG1 4.49Å; R214-I218 WeakPolarHBondContact O-CG1 3.13Å; R214-I218 PolarHBondContact O-N 3.07Å; R214-L265 HydrophobicContact CB-CD1 4.37Å; R214-L265 HydrophobicContact CB-CD2 4.47Å; R214-L265 HydrophobicContact CG-CD2 4.22Å; R214-E278 IonicContact CZ-OE2 2.66Å; R214-E278 IonicContact NE-OE2 2.69Å; R214-E278 PolarHBondContact NE-OE2 2.89Å; R214-E278 IonicContact NH2-OE1 3.66Å; R214-E278 IonicContact NH2-OE2 3.63Å; R214-E278 PolarHBondContact NH2-OE2 3.42Å; R214-I279 HydrophobicContact CG-CD1 4Å; R214-I279 HydrophobicContact CG-CG1 3.87Å
215	V	94.8	Very high	93	Very high	72 Å²	72	64.7 Å²	64.7	44%	0.436	32%	0.321	S	S	.	.	H	α-helix	trans	-60.8	-45	-177	171.6	0	0	0	0	110.9	V211 S212 A217 I218 Q219	V211-V215 HydrophobicContact CG1-CG2 4.14Å; V211-V215 WeakPolarHBondContact O-CB 3.42Å; V211-V215 WeakPolarHBondContact O-CG2 3.32Å; V211-V215 PolarHBondContact O-N 3.48Å; S212-V215 PolarHBondContact O-N 3.08Å; V215-A217 PolarHBondContact O-N 2.73Å; V215-I218 PolarHBondContact O-N 2.88Å; V215-Q219 VanDerWaalsContact O-CB 3.23Å; V215-Q219 WeakPolarHBondContact O-CB 3.29Å; V215-Q219 PolarHBondContact O-N 3.05Å
216	N	95.7	Very high	93.3	Very high	101 Å²	101	62.4 Å²	62.4	54%	0.54	32%	0.32	S	S	.	.	H	α-helix	trans	-62.5	-44.2	178.5	-68.8	-11.8	0	0	0	112.1	S212 R214 Q219 E220	S212-N216 VanDerWaalsContact O-CB 3.29Å; S212-N216 WeakPolarHBondContact O-CB 3.45Å; S212-N216 PolarHBondContact O-N 3.12Å; S212-N216 PolarHBondContact O-ND2 3Å; R214-N216 PolarHBondContact O-N 3.02Å; N216-Q219 PolarHBondContact O-N 2.88Å; N216-E220 WeakPolarHBondContact O-CB 3.42Å; N216-E220 PolarHBondContact O-N 3.06Å
217	A	95.2	Very high	93.6	Very high	13 Å²	13	61.5 Å²	61.5	11%	0.107	32%	0.322	C	S	.	.	H	α-helix	trans	-65	-43.8	178.1	0	0	0	0	0	112.2	K213 R214 V215 Q219 V221 L265	K213-A217 WeakPolarHBondContact O-CB 3.36Å; K213-A217 PolarHBondContact O-N 3.29Å; K213-A217 VanDerWaalsContact O-N 3.14Å; R214-A217 PolarHBondContact O-N 2.85Å; V215-A217 PolarHBondContact O-N 2.73Å; A217-Q219 VanDerWaalsContact C-N 3.33Å; A217-Q219 PolarHBondContact O-N 2.74Å; A217-V221 WeakPolarHBondContact O-CG2 3.46Å; A217-V221 PolarHBondContact O-N 3.4Å; A217-V221 VanDerWaalsContact O-N 3.07Å; A217-L265 HydrophobicContact CB-CD2 3.92Å
218	I	96.2	Very high	93.9	Very high	9 Å²	9	58.4 Å²	58.4	5%	0.046	31%	0.31	C	S	.	.	H	α-helix	trans	-64.4	-39	176.3	-69.1	176	0	0	0	111	R214 V215 V221 K222 E278 I279 A282	R214-I218 HydrophobicContact CG-CD1 3.76Å; R214-I218 HydrophobicContact CG-CG1 4.49Å; R214-I218 WeakPolarHBondContact O-CG1 3.13Å; R214-I218 PolarHBondContact O-N 3.07Å; V215-I218 PolarHBondContact O-N 2.88Å; I218-V221 PolarHBondContact O-N 2.83Å; I218-K222 HydrophobicContact CG2-CD 4.03Å; I218-K222 HydrophobicContact CG2-CG 4.46Å; I218-K222 WeakPolarHBondContact O-CG 3.29Å; I218-K222 PolarHBondContact O-N 3.42Å; I218-E278 HydrophobicContact CD1-CB 3.78Å; I218-I279 HydrophobicContact CD1-CG1 3.98Å; I218-A282 HydrophobicContact CG1-CB 4.2Å; I218-A282 HydrophobicContact CG2-CB 4.24Å
219	Q	96.3	Very high	94.2	Very high	88 Å²	88	57.9 Å²	57.9	41%	0.411	30%	0.302	S	S	.	.	H	α-helix	trans	-66.6	-46.5	178.5	-176.9	59.2	24.5	0	0	111.6	V215 N216 A217 V221 K222 E223	V215-Q219 VanDerWaalsContact O-CB 3.23Å; V215-Q219 WeakPolarHBondContact O-CB 3.29Å; V215-Q219 PolarHBondContact O-N 3.05Å; N216-Q219 PolarHBondContact O-N 2.88Å; A217-Q219 VanDerWaalsContact C-N 3.33Å; A217-Q219 PolarHBondContact O-N 2.74Å; Q219-V221 PolarHBondContact O-N 2.76Å; Q219-K222 PolarHBondContact O-N 2.84Å; Q219-K222 VanDerWaalsContact O-N 3.13Å; Q219-E223 WeakPolarHBondContact CG-OE1 3.4Å; Q219-E223 PolarHBondContact NE2-OE1 3.2Å; Q219-E223 WeakPolarHBondContact O-CG 3.44Å; Q219-E223 PolarHBondContact O-N 2.64Å
220	E	95.6	Very high	94.3	Very high	71 Å²	71	59.3 Å²	59.3	33%	0.332	31%	0.308	S	S	.	.	H	α-helix	trans	-60.4	-35.6	175.5	-173.6	-172.5	-177.7	0	0	111.7	N216 S224 R254 M258	N216-E220 WeakPolarHBondContact O-CB 3.42Å; N216-E220 PolarHBondContact O-N 3.06Å; E220-S224 VanDerWaalsContact O-CB 3.29Å; E220-S224 WeakPolarHBondContact O-CB 3.46Å; E220-S224 PolarHBondContact O-N 2.93Å; E220-S224 PolarHBondContact O-OG 3.3Å; E220-R254 IonicContact OE1-CZ 2.78Å; E220-R254 VanDerWaalsContact OE1-CZ 3.26Å; E220-R254 IonicContact OE1-NE 3.6Å; E220-R254 PolarHBondContact OE1-NE 3.47Å; E220-R254 IonicContact OE1-NH2 2.74Å; E220-R254 PolarHBondContact OE1-NH2 3.41Å; E220-M258 HydrophobicContact CB-CE 3.61Å; E220-M258 VanDerWaalsContact CD-CE 3.4Å; E220-M258 HydrophobicContact CG-CE 3.43Å; E220-M258 VanDerWaalsContact CG-CE 3.43Å; E220-M258 HydrophobicContact CG-SD 4.11Å; E220-M258 WeakPolarHBondContact OE2-CE 3.38Å
221	V	97.1	Very high	94.2	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.006	30%	0.302	C	S	.	.	H	α-helix	trans	-65.6	-49.6	172.6	168.1	0	0	0	0	110.8	A217 I218 Q219 E223 S224 V225 M258 L262 A282 L286	A217-V221 WeakPolarHBondContact O-CG2 3.46Å; A217-V221 PolarHBondContact O-N 3.4Å; A217-V221 VanDerWaalsContact O-N 3.07Å; I218-V221 PolarHBondContact O-N 2.83Å; Q219-V221 PolarHBondContact O-N 2.76Å; V221-E223 VanDerWaalsContact C-N 3.32Å; V221-E223 PolarHBondContact O-N 2.86Å; V221-S224 PolarHBondContact O-N 3.44Å; V221-V225 HydrophobicContact CG1-CG2 3.96Å; V221-V225 VanDerWaalsContact O-CB 3.26Å; V221-V225 WeakPolarHBondContact O-CB 3.39Å; V221-V225 WeakPolarHBondContact O-CG2 3.44Å; V221-V225 PolarHBondContact O-N 2.83Å; V221-M258 HydrophobicContact CB-CE 4.36Å; V221-M258 HydrophobicContact CG2-CB 4.22Å; V221-M258 HydrophobicContact CG2-CE 3.4Å; V221-M258 VanDerWaalsContact CG2-CE 3.4Å; V221-M258 HydrophobicContact CG2-SD 3.93Å; V221-L262 HydrophobicContact CG1-CD1 4.46Å; V221-L262 HydrophobicContact CG2-CD1 4Å; V221-L262 HydrophobicContact CG2-CD2 4.11Å; V221-L262 HydrophobicContact CG2-CG 4.16Å; V221-A282 HydrophobicContact CG1-CB 4.18Å; V221-L286 HydrophobicContact CG1-CB 3.96Å; V221-L286 HydrophobicContact CG1-CD1 4.3Å; V221-L286 HydrophobicContact CG1-CD2 4.46Å; V221-L286 HydrophobicContact CG1-CG 4.48Å; V221-L286 HydrophobicContact CG2-CD2 4.3Å
222	K	94.8	Very high	94	Very high	116 Å²	116	54.6 Å²	54.6	50%	0.504	28%	0.284	S	S	.	.	H	α-helix	trans	-58.1	-43.5	179.3	-76	172.4	178.6	175.6	0	111.9	I218 Q219 A226	I218-K222 HydrophobicContact CG2-CD 4.03Å; I218-K222 HydrophobicContact CG2-CG 4.46Å; I218-K222 WeakPolarHBondContact O-CG 3.29Å; I218-K222 PolarHBondContact O-N 3.42Å; Q219-K222 PolarHBondContact O-N 2.84Å; Q219-K222 VanDerWaalsContact O-N 3.13Å; K222-A226 VanDerWaalsContact O-CB 3.26Å; K222-A226 WeakPolarHBondContact O-CB 3.37Å; K222-A226 PolarHBondContact O-N 3.46Å
223	E	96.3	Very high	93.6	Very high	107 Å²	107	58.6 Å²	58.6	50%	0.5	30%	0.296	S	S	.	.	H	α-helix	trans	-64.3	-47.9	176.5	-72	170.8	-168.5	0	0	112.1	Q219 V221 V225 A226 L227	Q219-E223 WeakPolarHBondContact CG-OE1 3.4Å; Q219-E223 PolarHBondContact NE2-OE1 3.2Å; Q219-E223 WeakPolarHBondContact O-CG 3.44Å; Q219-E223 PolarHBondContact O-N 2.64Å; V221-E223 VanDerWaalsContact C-N 3.32Å; V221-E223 PolarHBondContact O-N 2.86Å; E223-V225 PolarHBondContact O-N 3.47Å; E223-A226 PolarHBondContact O-N 2.88Å; E223-L227 WeakPolarHBondContact O-CB 3.47Å; E223-L227 PolarHBondContact O-N 3.46Å
224	S	94.8	Very high	92.8	Very high	3 Å²	3	58.3 Å²	58.3	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-65.5	-38.8	179.7	-56.2	0	0	0	0	112	E220 V221 L228	E220-S224 VanDerWaalsContact O-CB 3.29Å; E220-S224 WeakPolarHBondContact O-CB 3.46Å; E220-S224 PolarHBondContact O-N 2.93Å; E220-S224 PolarHBondContact O-OG 3.3Å; V221-S224 PolarHBondContact O-N 3.44Å; S224-L228 WeakPolarHBondContact O-CB 3.46Å; S224-L228 PolarHBondContact O-N 2.82Å
225	V	96.1	Very high	92	Very high	21 Å²	21	59 Å²	59	13%	0.127	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-47.4	175.3	169.4	0	0	0	0	111.2	V221 E223 T229 L286 V289	V221-V225 HydrophobicContact CG1-CG2 3.96Å; V221-V225 VanDerWaalsContact O-CB 3.26Å; V221-V225 WeakPolarHBondContact O-CB 3.39Å; V221-V225 WeakPolarHBondContact O-CG2 3.44Å; V221-V225 PolarHBondContact O-N 2.83Å; E223-V225 PolarHBondContact O-N 3.47Å; V225-T229 VanDerWaalsContact O-CB 3.26Å; V225-T229 WeakPolarHBondContact O-CB 3.29Å; V225-T229 PolarHBondContact O-N 2.9Å; V225-T229 PolarHBondContact O-OG1 3.03Å; V225-L286 HydrophobicContact CG2-CB 4.29Å; V225-L286 HydrophobicContact CG2-CD1 3.99Å; V225-V289 HydrophobicContact CB-CG1 4.24Å; V225-V289 HydrophobicContact CG1-CB 4.23Å; V225-V289 HydrophobicContact CG1-CG1 4.12Å; V225-V289 HydrophobicContact CG2-CG1 3.81Å
226	A	95.1	Very high	90.7	Very high	59 Å²	59	61 Å²	61	49%	0.488	31%	0.312	S	S	.	.	H	α-helix	trans	-62.4	-48.2	-179.9	0	0	0	0	0	111.6	K222 E223 T229 Q230	K222-A226 VanDerWaalsContact O-CB 3.26Å; K222-A226 WeakPolarHBondContact O-CB 3.37Å; K222-A226 PolarHBondContact O-N 3.46Å; E223-A226 PolarHBondContact O-N 2.88Å; A226-T229 PolarHBondContact O-N 2.76Å; A226-Q230 PolarHBondContact O-N 3.04Å
227	L	93.9	Very high	89.2	Confident	79 Å²	79	59 Å²	59	41%	0.414	32%	0.315	S	S	.	.	H	α-helix	trans	-65.7	-43.7	-179.3	-176.5	60.4	0	0	0	112.1	E223 T229 Q230 L231 L251	E223-L227 WeakPolarHBondContact O-CB 3.47Å; E223-L227 PolarHBondContact O-N 3.46Å; L227-T229 VanDerWaalsContact C-N 3.35Å; L227-Q230 PolarHBondContact O-N 3.48Å; L227-L231 HydrophobicContact CD1-CD1 4.26Å; L227-L231 HydrophobicContact CD1-CG 4.4Å; L227-L231 HydrophobicContact CG-CD1 4.21Å; L227-L231 WeakPolarHBondContact O-CG 3.3Å; L227-L231 PolarHBondContact O-N 3.19Å; L227-L251 HydrophobicContact CD2-CD1 3.73Å; L227-L251 HydrophobicContact CD2-CD2 3.95Å; L227-L251 HydrophobicContact CD2-CG 4.5Å; L227-L251 HydrophobicContact CG-CD1 3.75Å
228	L	93.1	Very high	87.3	Confident	0 Å²	0	65 Å²	65	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-65.7	-38.5	176.3	-177.3	59.5	0	0	0	111.6	S224 L232 I248 L251 C255 V289 Y293	S224-L228 WeakPolarHBondContact O-CB 3.46Å; S224-L228 PolarHBondContact O-N 2.82Å; L228-L232 HydrophobicContact CD1-CD1 4.15Å; L228-L232 HydrophobicContact CD1-CG 4.28Å; L228-L232 HydrophobicContact CG-CD1 3.95Å; L228-L232 WeakPolarHBondContact O-CB 3.5Å; L228-L232 WeakPolarHBondContact O-CD1 3.25Å; L228-L232 WeakPolarHBondContact O-CG 3.17Å; L228-L232 PolarHBondContact O-N 3.43Å; L228-I248 HydrophobicContact CD1-CG2 3.64Å; L228-L251 HydrophobicContact CB-CB 4.41Å; L228-L251 HydrophobicContact CD1-CB 4.11Å; L228-C255 HydrophobicContact CD2-CB 4.46Å; L228-V289 HydrophobicContact CB-CG2 3.98Å; L228-V289 HydrophobicContact CD2-CG1 4.18Å; L228-V289 HydrophobicContact CD2-CG2 3.87Å; L228-V289 HydrophobicContact CG-CG2 3.77Å; L228-Y293 HydrophobicContact CD1-CD2 4.4Å
229	T	92.4	Very high	85.3	Confident	38 Å²	38	68.5 Å²	68.5	23%	0.233	38%	0.381	C	S	.	.	H	α-helix	trans	-63	-43.5	175.6	-56.8	0	0	0	0	111.4	V225 A226 L227 L232 Q233 V289	V225-T229 VanDerWaalsContact O-CB 3.26Å; V225-T229 WeakPolarHBondContact O-CB 3.29Å; V225-T229 PolarHBondContact O-N 2.9Å; V225-T229 PolarHBondContact O-OG1 3.03Å; A226-T229 PolarHBondContact O-N 2.76Å; L227-T229 VanDerWaalsContact C-N 3.35Å; T229-L232 PolarHBondContact O-N 3.41Å; T229-Q233 WeakPolarHBondContact O-CG 3.35Å; T229-Q233 PolarHBondContact O-N 2.93Å; T229-V289 VanDerWaalsContact OG1-CG2 3.3Å; T229-V289 WeakPolarHBondContact OG1-CG2 3.38Å
230	Q	91.4	Very high	83.6	Confident	115 Å²	115	66.4 Å²	66.4	54%	0.537	37%	0.374	S	S	.	.	H	α-helix	trans	-64.1	-48.9	178.5	-175.2	178	-27.4	0	0	111.5	A226 L227 L232 Q233 D234	A226-Q230 PolarHBondContact O-N 3.04Å; L227-Q230 PolarHBondContact O-N 3.48Å; Q230-L232 PolarHBondContact O-N 2.96Å; Q230-Q233 WeakPolarHBondContact O-CB 3.33Å; Q230-Q233 PolarHBondContact O-N 3.43Å; Q230-D234 PolarHBondContact O-N 3.15Å; Q230-D234 VanDerWaalsContact O-N 3.17Å
231	L	87.8	Confident	82.1	Confident	31 Å²	31	68.9 Å²	68.9	16%	0.162	39%	0.39	C	S	.	.	H	α-helix	trans	-65.5	-24.9	178.8	-65.6	170.7	0	0	0	113.1	L227 Y235 L247 I248 L251	L227-L231 HydrophobicContact CD1-CD1 4.26Å; L227-L231 HydrophobicContact CD1-CG 4.4Å; L227-L231 HydrophobicContact CG-CD1 4.21Å; L227-L231 WeakPolarHBondContact O-CG 3.3Å; L227-L231 PolarHBondContact O-N 3.19Å; L231-Y235 PolarHBondContact O-N 3.43Å; L231-L247 HydrophobicContact CD1-CD2 3.86Å; L231-L247 HydrophobicContact CD1-CG 4.03Å; L231-I248 HydrophobicContact CB-CD1 4.05Å; L231-I248 HydrophobicContact CB-CG1 3.69Å; L231-I248 HydrophobicContact CD1-CG1 4.1Å; L231-I248 HydrophobicContact CG-CG1 4.46Å; L231-L251 HydrophobicContact CD1-CD1 3.54Å
232	L	87.3	Confident	80.8	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-76.8	-31.9	170.9	-73.8	168.9	0	0	0	112.9	L228 T229 Q230 D234 Y235 I248 V289 L292 Y293 Q296 V297	L228-L232 HydrophobicContact CD1-CD1 4.15Å; L228-L232 HydrophobicContact CD1-CG 4.28Å; L228-L232 HydrophobicContact CG-CD1 3.95Å; L228-L232 WeakPolarHBondContact O-CB 3.5Å; L228-L232 WeakPolarHBondContact O-CD1 3.25Å; L228-L232 WeakPolarHBondContact O-CG 3.17Å; L228-L232 PolarHBondContact O-N 3.43Å; T229-L232 PolarHBondContact O-N 3.41Å; Q230-L232 PolarHBondContact O-N 2.96Å; L232-D234 VanDerWaalsContact C-N 3.32Å; L232-Y235 WeakPolarHBondContact O-CB 3.25Å; L232-Y235 PolarHBondContact O-N 3.41Å; L232-I248 HydrophobicContact CD2-CG2 4.17Å; L232-V289 HydrophobicContact CD1-CG2 4.15Å; L232-L292 HydrophobicContact CB-CD2 4.31Å; L232-L292 HydrophobicContact CD1-CB 4.3Å; L232-L292 HydrophobicContact CD1-CD2 4.01Å; L232-L292 HydrophobicContact CD1-CG 4.08Å; L232-Y293 HydrophobicContact CD2-CD2 4.16Å; L232-Q296 PolarHBondContact O-NE2 3.47Å; L232-Q296 PolarHBondContact O-OE1 3.19Å; L232-V297 HydrophobicContact CD2-CG2 3.51Å
233	Q	84.9	Confident	79.8	Confident	145 Å²	145	72.1 Å²	72.1	68%	0.678	42%	0.42	S	S	*	.	H	α-helix	trans	-65.1	-37.9	173.2	-74.6	174	3.2	0	0	111.7	T229 Q230 Y235	T229-Q233 WeakPolarHBondContact O-CG 3.35Å; T229-Q233 PolarHBondContact O-N 2.93Å; Q230-Q233 WeakPolarHBondContact O-CB 3.33Å; Q230-Q233 PolarHBondContact O-N 3.43Å; Q233-Y235 VanDerWaalsContact C-N 3.29Å; Q233-Y235 PolarHBondContact O-N 2.89Å
234	D	76.9	Confident	79	Confident	120 Å²	120	70.7 Å²	70.7	64%	0.642	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	4.7	178.7	-61.3	-32.3	0	0	0	113.4	Q230 L232 D236	Q230-D234 PolarHBondContact O-N 3.15Å; Q230-D234 VanDerWaalsContact O-N 3.17Å; L232-D234 VanDerWaalsContact C-N 3.32Å; D234-D236 PolarHBondContact O-N 3.13Å
235	Y	76.4	Confident	78.4	Confident	49 Å²	49	72 Å²	72	19%	0.192	43%	0.427	C	S	.	.			trans	-83.8	95.8	-174.6	-175.8	-98.7	0	0	0	113.1	L231 L232 Q233 T240 I248 Q296 V297	L231-Y235 PolarHBondContact O-N 3.43Å; L232-Y235 WeakPolarHBondContact O-CB 3.25Å; L232-Y235 PolarHBondContact O-N 3.41Å; Q233-Y235 VanDerWaalsContact C-N 3.29Å; Q233-Y235 PolarHBondContact O-N 2.89Å; Y235-T240 HydrophobicContact CD2-CG2 4.09Å; Y235-T240 WeakPolarHBondContact CD2-OG1 3.22Å; Y235-T240 HydrophobicContact CE2-CG2 4.03Å; Y235-I248 HydrophobicContact CD2-CD1 3.82Å; Y235-I248 HydrophobicContact CE2-CD1 4.49Å; Y235-Q296 HydrophobicContact CD1-CG 4.22Å; Y235-V297 HydrophobicContact CD1-CG2 4.2Å; Y235-V297 HydrophobicContact CE1-CG2 4Å; Y235-V297 HydrophobicContact CE2-CG2 4.38Å; Y235-V297 HydrophobicContact CG-CG2 4.48Å
236	D	67.3	Low	77.9	Confident	116 Å²	116	74.7 Å²	74.7	62%	0.62	44%	0.441	S	S	*	.			trans	-88	104.4	166.8	-111.5	-32	0	0	0	110.7	D234 T238 A239 T240	D234-D236 PolarHBondContact O-N 3.13Å; D236-T238 PolarHBondContact O-N 3.17Å; D236-A239 PolarHBondContact O-N 3.28Å; D236-T240 PolarHBondContact O-N 3.46Å; D236-T240 PolarHBondContact O-OG1 3.29Å; D236-T240 VanDerWaalsContact O-OG1 3.05Å
237	G	64	Low	77.6	Confident	58 Å²	58	75.5 Å²	75.5	60%	0.598	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	11.4	-175.2	0	0	0	0	0	116.9
238	T	56	Low	77.4	Confident	140 Å²	140	72 Å²	72	86%	0.859	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.4	-7.5	175.3	60.2	0	0	0	0	114	D236	D236-T238 PolarHBondContact O-N 3.17Å
239	A	54.3	Low	77.2	Confident	81 Å²	81	76.7 Å²	76.7	67%	0.669	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145	13	-171.7	0	0	0	0	0	115.5	D236 D241	D236-A239 PolarHBondContact O-N 3.28Å; A239-D241 PolarHBondContact O-N 2.88Å
240	T	59.5	Low	77.2	Confident	44 Å²	44	79.7 Å²	79.7	27%	0.27	46%	0.455	S	S	.	.			trans	-71.3	125.2	178.5	-59.1	0	0	0	0	112.4	Y235 D236 N244 A245	Y235-T240 HydrophobicContact CD2-CG2 4.09Å; Y235-T240 WeakPolarHBondContact CD2-OG1 3.22Å; Y235-T240 HydrophobicContact CE2-CG2 4.03Å; D236-T240 PolarHBondContact O-N 3.46Å; D236-T240 PolarHBondContact O-OG1 3.29Å; D236-T240 VanDerWaalsContact O-OG1 3.05Å; T240-N244 HydrophobicContact CG2-CB 3.76Å; T240-A245 HydrophobicContact CG2-CB 4.34Å
241	D	64.1	Low	77.3	Confident	124 Å²	124	74.9 Å²	74.9	66%	0.663	43%	0.432	S	S	*	.			trans	-56.8	137.3	169.3	-87.6	-38.9	0	0	0	111.3	A239 G243 N244 A245	A239-D241 PolarHBondContact O-N 2.88Å; D241-G243 PolarHBondContact O-N 2.98Å; D241-G243 VanDerWaalsContact O-N 3.09Å; D241-N244 WeakPolarHBondContact O-CB 3.22Å; D241-N244 PolarHBondContact O-N 3.05Å; D241-A245 PolarHBondContact O-N 3.28Å
242	Q	70.7	Confident	77.6	Confident	134 Å²	134	74.7 Å²	74.7	63%	0.626	43%	0.43	S	S	*	.	H	α-helix	trans	-52.4	-38.7	-176.3	-176	64.6	53.3	0	0	113	N244 A245 D246	Q242-N244 VanDerWaalsContact C-N 3.3Å; Q242-N244 PolarHBondContact O-N 3.35Å; Q242-A245 WeakPolarHBondContact O-CB 3.32Å; Q242-A245 PolarHBondContact O-N 3.03Å; Q242-D246 PolarHBondContact NE2-OD1 3.34Å; Q242-D246 VanDerWaalsContact O-CG 3.27Å; Q242-D246 PolarHBondContact O-N 3.36Å
243	G	72.8	Confident	78	Confident	51 Å²	51	78 Å²	78	53%	0.526	45%	0.445	S	S	.	.	H	α-helix	trans	-65.2	-29.2	178	0	0	0	0	0	114.1	D241 L247	D241-G243 PolarHBondContact O-N 2.98Å; D241-G243 VanDerWaalsContact O-N 3.09Å; G243-L247 WeakPolarHBondContact O-CB 3.45Å; G243-L247 PolarHBondContact O-N 2.83Å; G243-L247 VanDerWaalsContact O-N 3.12Å
244	N	80.1	Confident	78.5	Confident	77 Å²	77	76.5 Å²	76.5	41%	0.412	43%	0.433	S	S	.	.	H	α-helix	trans	-75.1	-39.2	173.1	-72	-8	0	0	0	110.7	T240 D241 Q242 L247 I248	T240-N244 HydrophobicContact CG2-CB 3.76Å; D241-N244 WeakPolarHBondContact O-CB 3.22Å; D241-N244 PolarHBondContact O-N 3.05Å; Q242-N244 VanDerWaalsContact C-N 3.3Å; Q242-N244 PolarHBondContact O-N 3.35Å; N244-L247 PolarHBondContact O-N 3.44Å; N244-I248 WeakPolarHBondContact O-CD1 3.43Å; N244-I248 WeakPolarHBondContact O-CG1 3.38Å; N244-I248 PolarHBondContact O-N 3.23Å
245	A	81.6	Confident	79.3	Confident	30 Å²	30	70.8 Å²	70.8	25%	0.248	40%	0.403	C	S	.	.	H	α-helix	trans	-60.9	-45.5	175.3	0	0	0	0	0	111.8	T240 D241 Q242 I248 Q249	T240-A245 HydrophobicContact CG2-CB 4.34Å; D241-A245 PolarHBondContact O-N 3.28Å; Q242-A245 WeakPolarHBondContact O-CB 3.32Å; Q242-A245 PolarHBondContact O-N 3.03Å; A245-I248 PolarHBondContact O-N 3.16Å; A245-Q249 WeakPolarHBondContact O-CB 3.25Å; A245-Q249 PolarHBondContact O-N 3.24Å
246	D	85.7	Confident	80.2	Confident	78 Å²	78	71 Å²	71	42%	0.417	41%	0.405	S	S	.	.	H	α-helix	trans	-62.2	-44.2	176.7	-62.9	-14.4	0	0	0	111.2	Q242 Q249 D250	Q242-D246 PolarHBondContact NE2-OD1 3.34Å; Q242-D246 VanDerWaalsContact O-CG 3.27Å; Q242-D246 PolarHBondContact O-N 3.36Å; D246-Q249 PolarHBondContact O-N 3Å; D246-D250 PolarHBondContact O-N 3.24Å
247	L	89.1	Confident	81.5	Confident	76 Å²	76	72.5 Å²	72.5	40%	0.398	41%	0.406	S	S	.	.	H	α-helix	trans	-61.9	-44	177.3	177.6	62.5	0	0	0	113	L231 G243 N244 Q249 D250 L251	L231-L247 HydrophobicContact CD1-CD2 3.86Å; L231-L247 HydrophobicContact CD1-CG 4.03Å; G243-L247 WeakPolarHBondContact O-CB 3.45Å; G243-L247 PolarHBondContact O-N 2.83Å; G243-L247 VanDerWaalsContact O-N 3.12Å; N244-L247 PolarHBondContact O-N 3.44Å; L247-Q249 VanDerWaalsContact C-N 3.33Å; L247-D250 PolarHBondContact O-N 3.37Å; L247-L251 HydrophobicContact CD1-CD1 4.14Å; L247-L251 HydrophobicContact CD1-CG 4.39Å; L247-L251 HydrophobicContact CG-CD1 4.11Å; L247-L251 WeakPolarHBondContact O-CB 3.46Å; L247-L251 WeakPolarHBondContact O-CG 3.44Å; L247-L251 PolarHBondContact O-N 3.14Å
248	I	89.4	Confident	83	Confident	4 Å²	4	70.3 Å²	70.3	2%	0.021	38%	0.381	C	S	.	.	H	α-helix	trans	-64.6	-41.3	177.3	-62.9	165.7	0	0	0	109.6	L228 L231 L232 Y235 N244 A245 L251 Y252 Y293 V297	L228-I248 HydrophobicContact CD1-CG2 3.64Å; L231-I248 HydrophobicContact CB-CD1 4.05Å; L231-I248 HydrophobicContact CB-CG1 3.69Å; L231-I248 HydrophobicContact CD1-CG1 4.1Å; L231-I248 HydrophobicContact CG-CG1 4.46Å; L232-I248 HydrophobicContact CD2-CG2 4.17Å; Y235-I248 HydrophobicContact CD2-CD1 3.82Å; Y235-I248 HydrophobicContact CE2-CD1 4.49Å; N244-I248 WeakPolarHBondContact O-CD1 3.43Å; N244-I248 WeakPolarHBondContact O-CG1 3.38Å; N244-I248 PolarHBondContact O-N 3.23Å; A245-I248 PolarHBondContact O-N 3.16Å; I248-L251 PolarHBondContact O-N 3.29Å; I248-Y252 WeakPolarHBondContact O-CB 3.04Å; I248-Y252 PolarHBondContact O-N 3.01Å; I248-Y293 HydrophobicContact CG2-CD2 3.59Å; I248-Y293 HydrophobicContact CG2-CE2 3.54Å; I248-V297 HydrophobicContact CG2-CG2 4.48Å
249	Q	90.3	Very high	84.8	Confident	100 Å²	100	66.5 Å²	66.5	47%	0.467	35%	0.351	S	S	.	.	H	α-helix	trans	-63.6	-39.5	176.3	174.1	170.6	-34.7	0	0	112.5	A245 D246 L247 Q253	A245-Q249 WeakPolarHBondContact O-CB 3.25Å; A245-Q249 PolarHBondContact O-N 3.24Å; D246-Q249 PolarHBondContact O-N 3Å; L247-Q249 VanDerWaalsContact C-N 3.33Å; Q249-Q253 WeakPolarHBondContact O-CG 3.33Å; Q249-Q253 PolarHBondContact O-N 3.34Å; Q249-Q253 PolarHBondContact O-NE2 2.92Å
250	D	92.5	Very high	86.8	Confident	101 Å²	101	66.8 Å²	66.8	54%	0.54	35%	0.346	S	S	.	.	H	α-helix	trans	-69.7	-40.4	176.8	-84.3	-9.7	0	0	0	112.4	D246 L247 Q253 R254	D246-D250 PolarHBondContact O-N 3.24Å; L247-D250 PolarHBondContact O-N 3.37Å; D250-Q253 PolarHBondContact O-N 2.95Å; D250-Q253 PolarHBondContact OD1-NE2 2.89Å; D250-R254 PolarHBondContact O-N 2.88Å
251	L	92.7	Very high	88.5	Confident	13 Å²	13	67.4 Å²	67.4	7%	0.068	35%	0.35	C	S	.	.	H	α-helix	trans	-64.3	-41.7	173.4	-75.1	167.1	0	0	0	112	L227 L228 L231 L247 I248 Q253 R254 C255	L227-L251 HydrophobicContact CD2-CD1 3.73Å; L227-L251 HydrophobicContact CD2-CD2 3.95Å; L227-L251 HydrophobicContact CD2-CG 4.5Å; L227-L251 HydrophobicContact CG-CD1 3.75Å; L228-L251 HydrophobicContact CB-CB 4.41Å; L228-L251 HydrophobicContact CD1-CB 4.11Å; L231-L251 HydrophobicContact CD1-CD1 3.54Å; L247-L251 HydrophobicContact CD1-CD1 4.14Å; L247-L251 HydrophobicContact CD1-CG 4.39Å; L247-L251 HydrophobicContact CG-CD1 4.11Å; L247-L251 WeakPolarHBondContact O-CB 3.46Å; L247-L251 WeakPolarHBondContact O-CG 3.44Å; L247-L251 PolarHBondContact O-N 3.14Å; I248-L251 PolarHBondContact O-N 3.29Å; L251-Q253 VanDerWaalsContact C-N 3.34Å; L251-Q253 PolarHBondContact O-N 3.42Å; L251-R254 WeakPolarHBondContact O-CB 3.42Å; L251-R254 PolarHBondContact O-N 3.45Å; L251-C255 WeakPolarHBondContact O-CB 3.5Å; L251-C255 PolarHBondContact O-N 2.89Å; L251-C255 PolarHBondContact O-SG 3.46Å; L251-C255 VanDerWaalsContact O-SG 3.33Å
252	Y	94.3	Very high	90	Very high	27 Å²	27	61.6 Å²	61.6	11%	0.106	32%	0.318	C	S	.	.	H	α-helix	trans	-57.9	-45.4	171.7	165.6	-91.5	0	0	0	112	I248 R254 C255 E256 I290 Y293 K294	I248-Y252 WeakPolarHBondContact O-CB 3.04Å; I248-Y252 PolarHBondContact O-N 3.01Å; Y252-R254 VanDerWaalsContact C-N 3.33Å; Y252-R254 PolarHBondContact O-N 3.02Å; Y252-C255 PolarHBondContact O-N 3.37Å; Y252-E256 HydrophobicContact CE1-CG 3.96Å; Y252-E256 HydrophobicContact CE2-CG 4.11Å; Y252-E256 PolarHBondContact O-N 2.91Å; Y252-E256 PolarHBondContact OH-OE1 3.35Å; Y252-I290 HydrophobicContact CE2-CG2 3.87Å; Y252-Y293 HydrophobicContact CD1-CD1 4.18Å; Y252-Y293 AromaticContact CD1-CE1 3.81Å; Y252-Y293 HydrophobicContact CD1-CE1 3.81Å; Y252-Y293 AromaticContact CD2-CD1 3.03Å; Y252-Y293 HydrophobicContact CD2-CD1 3.03Å; Y252-Y293 HydrophobicContact CD2-CD2 4.21Å; Y252-Y293 AromaticContact CD2-CE1 3.57Å; Y252-Y293 HydrophobicContact CD2-CE1 3.57Å; Y252-Y293 AromaticContact CD2-CG 3.41Å; Y252-Y293 HydrophobicContact CD2-CG 3.41Å; Y252-Y293 VanDerWaalsContact CD2-CG 3.41Å; Y252-Y293 HydrophobicContact CE1-CD1 4.46Å; Y252-Y293 HydrophobicContact CE1-CE1 4.15Å; Y252-Y293 AromaticContact CE2-CD1 3.33Å; Y252-Y293 HydrophobicContact CE2-CD1 3.33Å; Y252-Y293 AromaticContact CE2-CE1 3.84Å; Y252-Y293 HydrophobicContact CE2-CE1 3.84Å; Y252-Y293 HydrophobicContact CE2-CG 4.09Å; Y252-Y293 AromaticContact CG-CD1 3.49Å; Y252-Y293 HydrophobicContact CG-CD1 3.49Å; Y252-Y293 VanDerWaalsContact CG-CD1 3.49Å; Y252-Y293 HydrophobicContact CG-CD2 4.25Å; Y252-Y293 AromaticContact CG-CE1 3.52Å; Y252-Y293 HydrophobicContact CG-CE1 3.52Å; Y252-Y293 HydrophobicContact CG-CE2 4.28Å; Y252-Y293 AromaticContact CG-CG 3.87Å; Y252-Y293 HydrophobicContact CG-CG 3.87Å; Y252-Y293 AromaticContact CG-CZ 3.93Å; Y252-K294 HydrophobicContact CE2-CG 4.13Å; Y252-K294 WeakPolarHBondContact OH-CE 3.45Å
253	Q	95.1	Very high	91.2	Very high	70 Å²	70	62.4 Å²	62.4	33%	0.327	32%	0.32	S	S	.	.	H	α-helix	trans	-64.4	-36	176.7	-76.3	177.5	74.3	0	0	112.5	Q249 D250 L251 K257	Q249-Q253 WeakPolarHBondContact O-CG 3.33Å; Q249-Q253 PolarHBondContact O-N 3.34Å; Q249-Q253 PolarHBondContact O-NE2 2.92Å; D250-Q253 PolarHBondContact O-N 2.95Å; D250-Q253 PolarHBondContact OD1-NE2 2.89Å; L251-Q253 VanDerWaalsContact C-N 3.34Å; L251-Q253 PolarHBondContact O-N 3.42Å; Q253-K257 VanDerWaalsContact O-CG 3.28Å; Q253-K257 WeakPolarHBondContact O-CG 3.27Å; Q253-K257 PolarHBondContact O-N 2.76Å
254	R	94.9	Very high	92.2	Very high	114 Å²	114	67.4 Å²	67.4	43%	0.43	32%	0.323	S	S	.	.	H	α-helix	trans	-61.9	-51.4	172.2	-170.5	-178.4	-172.4	175.1	1	109.9	E220 D250 L251 Y252 E256 K257 M258	E220-R254 IonicContact OE1-CZ 2.78Å; E220-R254 VanDerWaalsContact OE1-CZ 3.26Å; E220-R254 IonicContact OE1-NE 3.6Å; E220-R254 PolarHBondContact OE1-NE 3.47Å; E220-R254 IonicContact OE1-NH2 2.74Å; E220-R254 PolarHBondContact OE1-NH2 3.41Å; D250-R254 PolarHBondContact O-N 2.88Å; L251-R254 WeakPolarHBondContact O-CB 3.42Å; L251-R254 PolarHBondContact O-N 3.45Å; Y252-R254 VanDerWaalsContact C-N 3.33Å; Y252-R254 PolarHBondContact O-N 3.02Å; R254-E256 PolarHBondContact O-N 2.92Å; R254-K257 WeakPolarHBondContact O-CB 2.85Å; R254-K257 PolarHBondContact O-N 2.68Å; R254-K257 VanDerWaalsContact O-N 3.07Å; R254-M258 HydrophobicContact CG-SD 4.45Å; R254-M258 WeakPolarHBondContact O-CG 3.38Å; R254-M258 PolarHBondContact O-N 3.22Å
255	C	95.4	Very high	92.9	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-55.8	-46.6	178.2	-72.5	0	0	0	0	113	L228 L251 Y252 K257 M258 L286 I290	L228-C255 HydrophobicContact CD2-CB 4.46Å; L251-C255 WeakPolarHBondContact O-CB 3.5Å; L251-C255 PolarHBondContact O-N 2.89Å; L251-C255 PolarHBondContact O-SG 3.46Å; L251-C255 VanDerWaalsContact O-SG 3.33Å; Y252-C255 PolarHBondContact O-N 3.37Å; C255-K257 VanDerWaalsContact C-N 3.34Å; C255-K257 PolarHBondContact O-N 2.66Å; C255-M258 PolarHBondContact O-N 2.94Å; C255-M258 VanDerWaalsContact O-N 3.13Å; C255-L286 HydrophobicContact CB-CD1 3.54Å; C255-I290 HydrophobicContact CB-CD1 3.93Å; C255-I290 HydrophobicContact CB-CG1 3.82Å
256	E	94.5	Very high	93.6	Very high	52 Å²	52	64.2 Å²	64.2	24%	0.243	30%	0.304	C	S	.	.	H	α-helix	trans	-58.1	-42.3	174.7	-82.8	-80.4	166.4	0	0	112.1	Y252 R254 M258 R259 I290 K294	Y252-E256 HydrophobicContact CE1-CG 3.96Å; Y252-E256 HydrophobicContact CE2-CG 4.11Å; Y252-E256 PolarHBondContact O-N 2.91Å; Y252-E256 PolarHBondContact OH-OE1 3.35Å; R254-E256 PolarHBondContact O-N 2.92Å; E256-M258 PolarHBondContact O-N 3.49Å; E256-R259 VanDerWaalsContact CD-NH1 3.34Å; E256-R259 VanDerWaalsContact CD-NH2 3.3Å; E256-R259 PolarHBondContact O-N 3.23Å; E256-R259 IonicContact OE1-CZ 2.94Å; E256-R259 IonicContact OE1-NH1 2.69Å; E256-R259 IonicContact OE1-NH2 3.89Å; E256-R259 PolarHBondContact OE1-NH2 3.21Å; E256-R259 IonicContact OE2-CZ 2.67Å; E256-R259 IonicContact OE2-NH1 3.26Å; E256-R259 PolarHBondContact OE2-NH1 3.5Å; E256-R259 IonicContact OE2-NH2 2.76Å; E256-R259 PolarHBondContact OE2-NH2 2.59Å; E256-I290 HydrophobicContact CG-CD1 4.29Å; E256-I290 HydrophobicContact CG-CG2 4.49Å; E256-I290 VanDerWaalsContact OE1-CG2 3.32Å; E256-I290 WeakPolarHBondContact OE1-CG2 3.26Å; E256-K294 IonicContact OE1-NZ 2.68Å; E256-K294 PolarHBondContact OE1-NZ 3.09Å
257	K	94.9	Very high	94	Very high	149 Å²	149	63.9 Å²	63.9	65%	0.648	31%	0.308	S	S	*	.	H	α-helix	trans	-66.6	-18.3	177.5	-72.2	168.2	-174.7	169	0	113.9	Q253 R254 C255	Q253-K257 VanDerWaalsContact O-CG 3.28Å; Q253-K257 WeakPolarHBondContact O-CG 3.27Å; Q253-K257 PolarHBondContact O-N 2.76Å; R254-K257 WeakPolarHBondContact O-CB 2.85Å; R254-K257 PolarHBondContact O-N 2.68Å; R254-K257 VanDerWaalsContact O-N 3.07Å; C255-K257 VanDerWaalsContact C-N 3.34Å; C255-K257 PolarHBondContact O-N 2.66Å
258	M	95	Very high	94.1	Very high	12 Å²	12	64.7 Å²	64.7	6%	0.059	31%	0.313	C	S	.	.	H	α-helix	trans	-85.5	-21.1	-179.7	-65.3	-175.2	86.3	0	0	113.9	E220 V221 R254 C255 E256 T261 L262 L286	E220-M258 HydrophobicContact CB-CE 3.61Å; E220-M258 VanDerWaalsContact CD-CE 3.4Å; E220-M258 HydrophobicContact CG-CE 3.43Å; E220-M258 VanDerWaalsContact CG-CE 3.43Å; E220-M258 HydrophobicContact CG-SD 4.11Å; E220-M258 WeakPolarHBondContact OE2-CE 3.38Å; V221-M258 HydrophobicContact CB-CE 4.36Å; V221-M258 HydrophobicContact CG2-CB 4.22Å; V221-M258 HydrophobicContact CG2-CE 3.4Å; V221-M258 VanDerWaalsContact CG2-CE 3.4Å; V221-M258 HydrophobicContact CG2-SD 3.93Å; R254-M258 HydrophobicContact CG-SD 4.45Å; R254-M258 WeakPolarHBondContact O-CG 3.38Å; R254-M258 PolarHBondContact O-N 3.22Å; C255-M258 PolarHBondContact O-N 2.94Å; C255-M258 VanDerWaalsContact O-N 3.13Å; E256-M258 PolarHBondContact O-N 3.49Å; M258-T261 WeakPolarHBondContact O-CB 3.12Å; M258-T261 PolarHBondContact O-N 3.46Å; M258-T261 VanDerWaalsContact O-N 3.13Å; M258-L262 PolarHBondContact O-N 2.9Å; M258-L286 HydrophobicContact CB-CD2 3.85Å
259	R	94.8	Very high	94.3	Very high	59 Å²	59	65 Å²	65	22%	0.223	32%	0.315	C	S	.	.	H	α-helix	trans	-56.8	-47.5	177.8	-76.9	-152.1	-133.3	82	-2.2	113.7	E256 T261 L262 F263 L286 I290	E256-R259 VanDerWaalsContact CD-NH1 3.34Å; E256-R259 VanDerWaalsContact CD-NH2 3.3Å; E256-R259 PolarHBondContact O-N 3.23Å; E256-R259 IonicContact OE1-CZ 2.94Å; E256-R259 IonicContact OE1-NH1 2.69Å; E256-R259 IonicContact OE1-NH2 3.89Å; E256-R259 PolarHBondContact OE1-NH2 3.21Å; E256-R259 IonicContact OE2-CZ 2.67Å; E256-R259 IonicContact OE2-NH1 3.26Å; E256-R259 PolarHBondContact OE2-NH1 3.5Å; E256-R259 IonicContact OE2-NH2 2.76Å; E256-R259 PolarHBondContact OE2-NH2 2.59Å; R259-T261 PolarHBondContact O-N 3Å; R259-L262 PolarHBondContact O-N 3.06Å; R259-F263 WeakPolarHBondContact O-CB 3.29Å; R259-F263 PolarHBondContact O-N 3.46Å; R259-L286 HydrophobicContact CG-CD2 3.88Å; R259-L286 HydrophobicContact CG-CG 4.38Å; R259-I290 HydrophobicContact CG-CD1 4.48Å; R259-I290 VanDerWaalsContact NH2-CG2 3.25Å
260	P	95.6	Very high	94.3	Very high	88 Å²	88	68.5 Å²	68.5	57%	0.571	33%	0.331	S	S	*	.	H	α-helix	trans	-62.3	-32.7	177.1	-23.2	34.9	0	0	0	112.9	R264	P260-R264 WeakPolarHBondContact O-CB 3.43Å; P260-R264 PolarHBondContact O-N 2.91Å
261	T	94.3	Very high	94	Very high	57 Å²	57	67.8 Å²	67.8	35%	0.35	33%	0.328	S	S	.	.	H	α-helix	trans	-65.9	-48.5	176.4	-57.7	0	0	0	0	111.1	M258 R259 L265	M258-T261 WeakPolarHBondContact O-CB 3.12Å; M258-T261 PolarHBondContact O-N 3.46Å; M258-T261 VanDerWaalsContact O-N 3.13Å; R259-T261 PolarHBondContact O-N 3Å; T261-L265 WeakPolarHBondContact O-CB 3.33Å; T261-L265 PolarHBondContact O-N 2.96Å
262	L	95.6	Very high	93.8	Very high	1 Å²	1	70.5 Å²	70.5	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-63.6	-39.6	175.3	-69.4	-175.5	0	0	0	112.5	V221 M258 R259 L265 A266 I279 A282 N283 L286	V221-L262 HydrophobicContact CG1-CD1 4.46Å; V221-L262 HydrophobicContact CG2-CD1 4Å; V221-L262 HydrophobicContact CG2-CD2 4.11Å; V221-L262 HydrophobicContact CG2-CG 4.16Å; M258-L262 PolarHBondContact O-N 2.9Å; R259-L262 PolarHBondContact O-N 3.06Å; L262-L265 HydrophobicContact CD2-CD2 4.34Å; L262-L265 PolarHBondContact O-N 3.18Å; L262-A266 WeakPolarHBondContact O-CB 3.45Å; L262-A266 PolarHBondContact O-N 3.04Å; L262-I279 HydrophobicContact CB-CG2 4.34Å; L262-I279 HydrophobicContact CD2-CG2 4.27Å; L262-I279 WeakPolarHBondContact O-CG2 3.41Å; L262-A282 HydrophobicContact CD1-CB 4.23Å; L262-A282 HydrophobicContact CD2-CB 4.49Å; L262-N283 VanDerWaalsContact CD1-CA 3.48Å; L262-N283 HydrophobicContact CD1-CB 3.79Å; L262-L286 HydrophobicContact CD1-CD2 3.85Å
263	F	95.9	Very high	93.7	Very high	151 Å²	151	75.5 Å²	75.5	66%	0.662	37%	0.371	S	S	*	.	H	α-helix	trans	-62.9	-46.8	178.7	-176	-91.1	0	0	0	111.9	R259 A266 S267	R259-F263 WeakPolarHBondContact O-CB 3.29Å; R259-F263 PolarHBondContact O-N 3.46Å; F263-A266 PolarHBondContact O-N 3.19Å; F263-S267 PolarHBondContact O-N 3.46Å
264	R	95.4	Very high	93.6	Very high	156 Å²	156	79.4 Å²	79.4	59%	0.589	39%	0.389	S	S	*	.	H	α-helix	trans	-62.2	-43.5	173.5	176.1	173.9	56.3	-176.3	-4.2	111.5	P260 A266 S267 D268	P260-R264 WeakPolarHBondContact O-CB 3.43Å; P260-R264 PolarHBondContact O-N 2.91Å; R264-A266 VanDerWaalsContact C-N 3.31Å; R264-A266 PolarHBondContact O-N 2.97Å; R264-S267 CarbonylContact O-C 3.56Å; R264-S267 WeakPolarHBondContact O-CB 3.34Å; R264-S267 PolarHBondContact O-N 2.82Å; R264-S267 VanDerWaalsContact O-N 3.11Å; R264-D268 WeakPolarHBondContact CG-OD2 3.44Å; R264-D268 WeakPolarHBondContact O-CB 3.41Å; R264-D268 VanDerWaalsContact O-CG 3.27Å; R264-D268 PolarHBondContact O-N 3.48Å
265	L	94.5	Very high	93.5	Very high	24 Å²	24	74 Å²	74	13%	0.126	37%	0.368	C	S	.	.	H	α-helix	trans	-61.3	-38.2	179.1	-174	70.2	0	0	0	112.2	R214 A217 T261 L262 D268 T269 I279	R214-L265 HydrophobicContact CB-CD1 4.37Å; R214-L265 HydrophobicContact CB-CD2 4.47Å; R214-L265 HydrophobicContact CG-CD2 4.22Å; A217-L265 HydrophobicContact CB-CD2 3.92Å; T261-L265 WeakPolarHBondContact O-CB 3.33Å; T261-L265 PolarHBondContact O-N 2.96Å; L262-L265 HydrophobicContact CD2-CD2 4.34Å; L262-L265 PolarHBondContact O-N 3.18Å; L265-D268 PolarHBondContact O-N 2.9Å; L265-T269 WeakPolarHBondContact O-CB 3.11Å; L265-T269 PolarHBondContact O-N 3.38Å; L265-T269 PolarHBondContact O-OG1 3.28Å; L265-I279 HydrophobicContact CB-CG2 4.47Å; L265-I279 HydrophobicContact CD2-CD1 4.15Å; L265-I279 HydrophobicContact CD2-CG1 3.96Å; L265-I279 HydrophobicContact CD2-CG2 4.32Å; L265-I279 HydrophobicContact CG-CD1 3.8Å; L265-I279 HydrophobicContact CG-CG1 4.17Å
266	A	94.6	Very high	93.5	Very high	17 Å²	17	76.3 Å²	76.3	14%	0.14	38%	0.381	C	S	.	.	H	α-helix	trans	-64	-46.9	171.5	0	0	0	0	0	111.3	L262 F263 R264 D268 T269 L276 I279	L262-A266 WeakPolarHBondContact O-CB 3.45Å; L262-A266 PolarHBondContact O-N 3.04Å; F263-A266 PolarHBondContact O-N 3.19Å; R264-A266 VanDerWaalsContact C-N 3.31Å; R264-A266 PolarHBondContact O-N 2.97Å; A266-D268 VanDerWaalsContact C-N 3.27Å; A266-D268 PolarHBondContact O-N 3.34Å; A266-T269 PolarHBondContact O-N 3.06Å; A266-T269 VanDerWaalsContact O-N 3.08Å; A266-L276 HydrophobicContact CB-CD1 3.71Å; A266-I279 HydrophobicContact CB-CG2 3.87Å
267	S	95.1	Very high	93.6	Very high	71 Å²	71	76.6 Å²	76.6	50%	0.497	39%	0.392	S	S	.	.	H	α-helix	trans	-63.3	-28.4	176.5	-167.1	0	0	0	0	114	F263 R264 T269	F263-S267 PolarHBondContact O-N 3.46Å; R264-S267 CarbonylContact O-C 3.56Å; R264-S267 WeakPolarHBondContact O-CB 3.34Å; R264-S267 PolarHBondContact O-N 2.82Å; R264-S267 VanDerWaalsContact O-N 3.11Å; S267-T269 VanDerWaalsContact C-N 3.3Å
268	D	91.6	Very high	93.6	Very high	92 Å²	92	73.1 Å²	73.1	49%	0.492	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-3.2	176.7	-66.7	-24.2	0	0	0	112.7	K210 R264 L265 A266	K210-D268 PolarHBondContact NZ-O 2.83Å; R264-D268 WeakPolarHBondContact CG-OD2 3.44Å; R264-D268 WeakPolarHBondContact O-CB 3.41Å; R264-D268 VanDerWaalsContact O-CG 3.27Å; R264-D268 PolarHBondContact O-N 3.48Å; L265-D268 PolarHBondContact O-N 2.9Å; A266-D268 VanDerWaalsContact C-N 3.27Å; A266-D268 PolarHBondContact O-N 3.34Å
269	T	92.8	Very high	93.7	Very high	12 Å²	12	72.6 Å²	72.6	7%	0.074	38%	0.375	C	S	.	.			trans	-114.2	61.9	-175.3	-52.8	0	0	0	0	110.7	L265 A266 S267 A275 L276 I279	L265-T269 WeakPolarHBondContact O-CB 3.11Å; L265-T269 PolarHBondContact O-N 3.38Å; L265-T269 PolarHBondContact O-OG1 3.28Å; A266-T269 PolarHBondContact O-N 3.06Å; A266-T269 VanDerWaalsContact O-N 3.08Å; S267-T269 VanDerWaalsContact C-N 3.3Å; T269-A275 HydrophobicContact CG2-CB 3.67Å; T269-L276 HydrophobicContact CG2-CB 4.49Å; T269-I279 HydrophobicContact CG2-CD1 4.16Å; T269-I279 WeakPolarHBondContact OG1-CD1 3.31Å
270	E	90.3	Very high	93.8	Very high	173 Å²	173	73.8 Å²	73.8	81%	0.808	39%	0.386	S	S	*	.			trans	-84.9	-16.1	172.7	-57.5	178.8	159.4	0	0	112.4
271	D	85.8	Confident	93.8	Very high	86 Å²	86	75.8 Å²	75.8	46%	0.46	39%	0.387	S	S	.	.	S	Bend	trans	-93.6	6.2	-173.1	53.5	-32	0	0	0	114.5	K210	K210-D271 VanDerWaalsContact NZ-CG 3.3Å; K210-D271 IonicContact NZ-OD1 2.61Å; K210-D271 PolarHBondContact NZ-OD1 3.17Å; K210-D271 IonicContact NZ-OD2 3.48Å; K210-D271 PolarHBondContact NZ-OD2 3.45Å
272	N	89.7	Confident	93.9	Very high	69 Å²	69	73.3 Å²	73.3	37%	0.369	37%	0.373	S	S	.	.			trans	-163.1	108.1	-179.7	-172.1	-51	0	0	0	113.2	E274 A275 L276	N272-E274 PolarHBondContact OD1-N 3.15Å; N272-E274 VanDerWaalsContact OD1-N 3.16Å; N272-A275 HydrophobicContact CB-CB 3.78Å; N272-A275 WeakPolarHBondContact O-CB 3.39Å; N272-A275 PolarHBondContact O-N 3.05Å; N272-A275 VanDerWaalsContact OD1-CB 3.27Å; N272-A275 WeakPolarHBondContact OD1-CB 3.38Å; N272-A275 PolarHBondContact OD1-N 3.25Å; N272-L276 PolarHBondContact O-N 3.14Å
273	D	92.4	Very high	94	Very high	133 Å²	133	74.8 Å²	74.8	71%	0.711	38%	0.381	S	S	*	.	H	α-helix	trans	-67	-35.7	-177.9	-69.4	-19.1	0	0	0	114.2	L276 A277	D273-L276 PolarHBondContact O-N 3.46Å; D273-A277 PolarHBondContact O-N 2.88Å
274	E	92.9	Very high	94	Very high	152 Å²	152	73 Å²	73	71%	0.71	38%	0.378	S	S	*	.	H	α-helix	trans	-65.8	-44.3	178.4	-177.1	177.7	-148.8	0	0	110.5	N272 L276 A277 E278	N272-E274 PolarHBondContact OD1-N 3.15Å; N272-E274 VanDerWaalsContact OD1-N 3.16Å; E274-L276 VanDerWaalsContact C-N 3.33Å; E274-L276 PolarHBondContact O-N 3.22Å; E274-A277 WeakPolarHBondContact O-CB 3.35Å; E274-A277 PolarHBondContact O-N 3.06Å; E274-E278 WeakPolarHBondContact O-CG 3.48Å; E274-E278 PolarHBondContact O-N 3.07Å
275	A	92.9	Very high	94.1	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-61.1	-40.6	173.5	0	0	0	0	0	112.5	T269 N272 E278 I279	T269-A275 HydrophobicContact CG2-CB 3.67Å; N272-A275 HydrophobicContact CB-CB 3.78Å; N272-A275 WeakPolarHBondContact O-CB 3.39Å; N272-A275 PolarHBondContact O-N 3.05Å; N272-A275 VanDerWaalsContact OD1-CB 3.27Å; N272-A275 WeakPolarHBondContact OD1-CB 3.38Å; N272-A275 PolarHBondContact OD1-N 3.25Å; A275-E278 PolarHBondContact O-N 2.98Å; A275-I279 WeakPolarHBondContact O-CD1 3.44Å; A275-I279 VanDerWaalsContact O-CG1 3.26Å; A275-I279 WeakPolarHBondContact O-CG1 3.26Å; A275-I279 PolarHBondContact O-N 3.49Å
276	L	95.6	Very high	94.2	Very high	49 Å²	49	67 Å²	67	26%	0.257	36%	0.362	S	S	.	.	H	α-helix	trans	-63.2	-43.9	175.5	-179.4	59.4	0	0	0	110.9	A266 T269 N272 D273 E274 E278 I279 L280	A266-L276 HydrophobicContact CB-CD1 3.71Å; T269-L276 HydrophobicContact CG2-CB 4.49Å; N272-L276 PolarHBondContact O-N 3.14Å; D273-L276 PolarHBondContact O-N 3.46Å; E274-L276 VanDerWaalsContact C-N 3.33Å; E274-L276 PolarHBondContact O-N 3.22Å; L276-E278 PolarHBondContact O-N 3.28Å; L276-I279 PolarHBondContact O-N 3.38Å; L276-L280 HydrophobicContact CD1-CD1 4.42Å; L276-L280 HydrophobicContact CD1-CG 4.39Å; L276-L280 HydrophobicContact CG-CD1 4.2Å; L276-L280 WeakPolarHBondContact O-CG 3.41Å; L276-L280 PolarHBondContact O-N 3.44Å
277	A	95	Very high	94.2	Very high	58 Å²	58	68.1 Å²	68.1	48%	0.479	37%	0.367	S	S	.	.	H	α-helix	trans	-60.4	-41.3	175.7	0	0	0	0	0	112.7	D273 E274 I279 L280 Q281	D273-A277 PolarHBondContact O-N 2.88Å; E274-A277 WeakPolarHBondContact O-CB 3.35Å; E274-A277 PolarHBondContact O-N 3.06Å; A277-I279 VanDerWaalsContact C-N 3.34Å; A277-I279 PolarHBondContact O-N 3Å; A277-L280 PolarHBondContact O-N 3.3Å; A277-Q281 WeakPolarHBondContact O-CB 3.47Å; A277-Q281 PolarHBondContact O-N 3.39Å
278	E	96	Very high	94.2	Very high	75 Å²	75	71.1 Å²	71.1	35%	0.35	37%	0.373	S	S	.	.	H	α-helix	trans	-59.4	-42.2	173.8	-66.8	179.9	152.9	0	0	112.5	R214 I218 E274 A275 L276 A282	R214-E278 IonicContact CZ-OE2 2.66Å; R214-E278 IonicContact NE-OE2 2.69Å; R214-E278 PolarHBondContact NE-OE2 2.89Å; R214-E278 IonicContact NH2-OE1 3.66Å; R214-E278 IonicContact NH2-OE2 3.63Å; R214-E278 PolarHBondContact NH2-OE2 3.42Å; I218-E278 HydrophobicContact CD1-CB 3.78Å; E274-E278 WeakPolarHBondContact O-CG 3.48Å; E274-E278 PolarHBondContact O-N 3.07Å; A275-E278 PolarHBondContact O-N 2.98Å; L276-E278 PolarHBondContact O-N 3.28Å; E278-A282 WeakPolarHBondContact O-CB 3.3Å; E278-A282 PolarHBondContact O-N 3.39Å
279	I	97	Very high	94.4	Very high	1 Å²	1	66.8 Å²	66.8	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-67.3	-42.5	-179.9	-63.1	158.3	0	0	0	110.5	R214 I218 L262 L265 A266 T269 A275 L276 A277 A282 N283	R214-I279 HydrophobicContact CG-CD1 4Å; R214-I279 HydrophobicContact CG-CG1 3.87Å; I218-I279 HydrophobicContact CD1-CG1 3.98Å; L262-I279 HydrophobicContact CB-CG2 4.34Å; L262-I279 HydrophobicContact CD2-CG2 4.27Å; L262-I279 WeakPolarHBondContact O-CG2 3.41Å; L265-I279 HydrophobicContact CB-CG2 4.47Å; L265-I279 HydrophobicContact CD2-CD1 4.15Å; L265-I279 HydrophobicContact CD2-CG1 3.96Å; L265-I279 HydrophobicContact CD2-CG2 4.32Å; L265-I279 HydrophobicContact CG-CD1 3.8Å; L265-I279 HydrophobicContact CG-CG1 4.17Å; A266-I279 HydrophobicContact CB-CG2 3.87Å; T269-I279 HydrophobicContact CG2-CD1 4.16Å; T269-I279 WeakPolarHBondContact OG1-CD1 3.31Å; A275-I279 WeakPolarHBondContact O-CD1 3.44Å; A275-I279 VanDerWaalsContact O-CG1 3.26Å; A275-I279 WeakPolarHBondContact O-CG1 3.26Å; A275-I279 PolarHBondContact O-N 3.49Å; L276-I279 PolarHBondContact O-N 3.38Å; A277-I279 VanDerWaalsContact C-N 3.34Å; A277-I279 PolarHBondContact O-N 3Å; I279-A282 PolarHBondContact O-N 3.14Å; I279-N283 PolarHBondContact O-N 3.49Å
280	L	96.3	Very high	94.4	Very high	84 Å²	84	66.2 Å²	66.2	44%	0.44	35%	0.346	S	S	.	.	H	α-helix	trans	-65.2	-45.2	177.6	-67.1	175.4	0	0	0	111.2	L276 A277 A282 N283 D284	L276-L280 HydrophobicContact CD1-CD1 4.42Å; L276-L280 HydrophobicContact CD1-CG 4.39Å; L276-L280 HydrophobicContact CG-CD1 4.2Å; L276-L280 WeakPolarHBondContact O-CG 3.41Å; L276-L280 PolarHBondContact O-N 3.44Å; A277-L280 PolarHBondContact O-N 3.3Å; L280-A282 VanDerWaalsContact C-N 3.28Å; L280-A282 PolarHBondContact O-N 2.91Å; L280-N283 WeakPolarHBondContact O-CA 3.27Å; L280-N283 WeakPolarHBondContact O-CB 3.41Å; L280-N283 PolarHBondContact O-N 2.93Å; L280-D284 PolarHBondContact O-N 2.97Å
281	Q	96.8	Very high	94.5	Very high	131 Å²	131	60 Å²	60	61%	0.612	32%	0.319	S	S	*	.	H	α-helix	trans	-59.1	-38.6	175.3	-171.4	-174	26.9	0	0	112.4	A277 N283 S285	A277-Q281 WeakPolarHBondContact O-CB 3.47Å; A277-Q281 PolarHBondContact O-N 3.39Å; Q281-N283 VanDerWaalsContact C-N 3.34Å; Q281-S285 WeakPolarHBondContact O-CB 3.34Å; Q281-S285 PolarHBondContact O-N 2.62Å; Q281-S285 VanDerWaalsContact O-N 3.11Å; Q281-S285 PolarHBondContact O-OG 2.97Å
282	A	96.9	Very high	94.8	Very high	5 Å²	5	58.1 Å²	58.1	4%	0.041	31%	0.308	C	S	.	.	H	α-helix	trans	-65.6	-37.2	173.5	0	0	0	0	0	111.9	I218 V221 L262 E278 I279 L280 L286	I218-A282 HydrophobicContact CG1-CB 4.2Å; I218-A282 HydrophobicContact CG2-CB 4.24Å; V221-A282 HydrophobicContact CG1-CB 4.18Å; L262-A282 HydrophobicContact CD1-CB 4.23Å; L262-A282 HydrophobicContact CD2-CB 4.49Å; E278-A282 WeakPolarHBondContact O-CB 3.3Å; E278-A282 PolarHBondContact O-N 3.39Å; I279-A282 PolarHBondContact O-N 3.14Å; L280-A282 VanDerWaalsContact C-N 3.28Å; L280-A282 PolarHBondContact O-N 2.91Å; A282-L286 VanDerWaalsContact O-CB 3.25Å; A282-L286 WeakPolarHBondContact O-CB 3.36Å; A282-L286 PolarHBondContact O-N 3.4Å
283	N	96.9	Very high	94.8	Very high	32 Å²	32	55.4 Å²	55.4	17%	0.171	29%	0.293	C	S	.	.	H	α-helix	trans	-67.9	-42.8	177.2	-162.3	-46.1	0	0	0	112.4	L262 I279 L280 Q281 S285 L286 T287	L262-N283 VanDerWaalsContact CD1-CA 3.48Å; L262-N283 HydrophobicContact CD1-CB 3.79Å; I279-N283 PolarHBondContact O-N 3.49Å; L280-N283 WeakPolarHBondContact O-CA 3.27Å; L280-N283 WeakPolarHBondContact O-CB 3.41Å; L280-N283 PolarHBondContact O-N 2.93Å; Q281-N283 VanDerWaalsContact C-N 3.34Å; N283-S285 PolarHBondContact O-N 3.08Å; N283-L286 WeakPolarHBondContact O-CB 3.47Å; N283-L286 PolarHBondContact O-N 3.48Å; N283-T287 WeakPolarHBondContact O-CB 3.17Å; N283-T287 PolarHBondContact O-N 2.95Å; N283-T287 PolarHBondContact O-OG1 3.45Å; N283-T287 VanDerWaalsContact O-OG1 3.04Å; N283-T287 PolarHBondContact OD1-OG1 3.06Å
284	D	96.1	Very high	94.6	Very high	113 Å²	113	50.7 Å²	50.7	60%	0.604	27%	0.266	S	S	*	.	H	α-helix	trans	-61.4	-45.6	176.1	-68.1	-27.9	0	0	0	111	L280 L286 T287 H288	L280-D284 PolarHBondContact O-N 2.97Å; D284-L286 PolarHBondContact O-N 2.69Å; D284-T287 PolarHBondContact O-N 3.21Å; D284-H288 WeakPolarHBondContact O-CB 3.49Å; D284-H288 PolarHBondContact O-N 3.09Å
285	S	96.3	Very high	94.3	Very high	53 Å²	53	48.8 Å²	48.8	37%	0.371	26%	0.257	S	S	.	.	H	α-helix	trans	-61.3	-43.5	176.4	-55.3	0	0	0	0	112	Q281 N283 H288 V289	Q281-S285 WeakPolarHBondContact O-CB 3.34Å; Q281-S285 PolarHBondContact O-N 2.62Å; Q281-S285 VanDerWaalsContact O-N 3.11Å; Q281-S285 PolarHBondContact O-OG 2.97Å; N283-S285 PolarHBondContact O-N 3.08Å; S285-H288 PolarHBondContact O-N 3.44Å; S285-V289 PolarHBondContact O-N 2.93Å
286	L	97.1	Very high	93.8	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.5	-43.2	176	-176.7	62.7	0	0	0	112.1	V221 V225 C255 M258 R259 L262 A282 N283 D284 V289 I290	V221-L286 HydrophobicContact CG1-CB 3.96Å; V221-L286 HydrophobicContact CG1-CD1 4.3Å; V221-L286 HydrophobicContact CG1-CD2 4.46Å; V221-L286 HydrophobicContact CG1-CG 4.48Å; V221-L286 HydrophobicContact CG2-CD2 4.3Å; V225-L286 HydrophobicContact CG2-CB 4.29Å; V225-L286 HydrophobicContact CG2-CD1 3.99Å; C255-L286 HydrophobicContact CB-CD1 3.54Å; M258-L286 HydrophobicContact CB-CD2 3.85Å; R259-L286 HydrophobicContact CG-CD2 3.88Å; R259-L286 HydrophobicContact CG-CG 4.38Å; L262-L286 HydrophobicContact CD1-CD2 3.85Å; A282-L286 VanDerWaalsContact O-CB 3.25Å; A282-L286 WeakPolarHBondContact O-CB 3.36Å; A282-L286 PolarHBondContact O-N 3.4Å; N283-L286 WeakPolarHBondContact O-CB 3.47Å; N283-L286 PolarHBondContact O-N 3.48Å; D284-L286 PolarHBondContact O-N 2.69Å; L286-V289 WeakPolarHBondContact O-CG1 3.27Å; L286-I290 HydrophobicContact CD1-CD1 4.2Å; L286-I290 HydrophobicContact CG-CD1 4.02Å; L286-I290 WeakPolarHBondContact O-CB 3.46Å; L286-I290 WeakPolarHBondContact O-CD1 3.31Å; L286-I290 WeakPolarHBondContact O-CG1 3.44Å; L286-I290 PolarHBondContact O-N 3.18Å
287	T	95.3	Very high	93.2	Very high	42 Å²	42	52.1 Å²	52.1	26%	0.258	27%	0.274	S	S	.	.	H	α-helix	trans	-68	-37	178	-66	0	0	0	0	111.4	N283 D284 N291	N283-T287 WeakPolarHBondContact O-CB 3.17Å; N283-T287 PolarHBondContact O-N 2.95Å; N283-T287 PolarHBondContact O-OG1 3.45Å; N283-T287 VanDerWaalsContact O-OG1 3.04Å; N283-T287 PolarHBondContact OD1-OG1 3.06Å; D284-T287 PolarHBondContact O-N 3.21Å; T287-N291 PolarHBondContact O-N 2.84Å; T287-N291 VanDerWaalsContact O-N 3.07Å; T287-N291 PolarHBondContact O-ND2 2.78Å
288	H	95.1	Very high	92.3	Very high	133 Å²	133	54.3 Å²	54.3	62%	0.616	27%	0.273	S	S	*	.	H	α-helix	trans	-60.8	-53.2	175.7	-177.3	71.8	0	0	0	112.5	D284 S285 I290 N291 L292	D284-H288 WeakPolarHBondContact O-CB 3.49Å; D284-H288 PolarHBondContact O-N 3.09Å; S285-H288 PolarHBondContact O-N 3.44Å; H288-I290 VanDerWaalsContact C-N 3.31Å; H288-I290 PolarHBondContact O-N 2.93Å; H288-N291 PolarHBondContact O-N 3.1Å; H288-N291 VanDerWaalsContact O-N 3.13Å; H288-L292 PolarHBondContact O-N 3.18Å
289	V	94.7	Very high	91	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-66.2	-32.9	-179	73.1	0	0	0	0	112.6	V225 L228 T229 L232 S285 L286 N291 L292 Y293	V225-V289 HydrophobicContact CB-CG1 4.24Å; V225-V289 HydrophobicContact CG1-CB 4.23Å; V225-V289 HydrophobicContact CG1-CG1 4.12Å; V225-V289 HydrophobicContact CG2-CG1 3.81Å; L228-V289 HydrophobicContact CB-CG2 3.98Å; L228-V289 HydrophobicContact CD2-CG1 4.18Å; L228-V289 HydrophobicContact CD2-CG2 3.87Å; L228-V289 HydrophobicContact CG-CG2 3.77Å; T229-V289 VanDerWaalsContact OG1-CG2 3.3Å; T229-V289 WeakPolarHBondContact OG1-CG2 3.38Å; L232-V289 HydrophobicContact CD1-CG2 4.15Å; S285-V289 PolarHBondContact O-N 2.93Å; L286-V289 WeakPolarHBondContact O-CG1 3.27Å; V289-N291 VanDerWaalsContact C-N 3.32Å; V289-N291 PolarHBondContact O-N 2.94Å; V289-L292 WeakPolarHBondContact O-CB 3.31Å; V289-L292 PolarHBondContact O-N 3.31Å; V289-Y293 PolarHBondContact O-N 2.92Å
290	I	94.3	Very high	89.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-40.9	173.8	-75	167.9	0	0	0	111.1	Y252 C255 E256 R259 L286 H288 K294	Y252-I290 HydrophobicContact CE2-CG2 3.87Å; C255-I290 HydrophobicContact CB-CD1 3.93Å; C255-I290 HydrophobicContact CB-CG1 3.82Å; E256-I290 HydrophobicContact CG-CD1 4.29Å; E256-I290 HydrophobicContact CG-CG2 4.49Å; E256-I290 VanDerWaalsContact OE1-CG2 3.32Å; E256-I290 WeakPolarHBondContact OE1-CG2 3.26Å; R259-I290 HydrophobicContact CG-CD1 4.48Å; R259-I290 VanDerWaalsContact NH2-CG2 3.25Å; L286-I290 HydrophobicContact CD1-CD1 4.2Å; L286-I290 HydrophobicContact CG-CD1 4.02Å; L286-I290 WeakPolarHBondContact O-CB 3.46Å; L286-I290 WeakPolarHBondContact O-CD1 3.31Å; L286-I290 WeakPolarHBondContact O-CG1 3.44Å; L286-I290 PolarHBondContact O-N 3.18Å; H288-I290 VanDerWaalsContact C-N 3.31Å; H288-I290 PolarHBondContact O-N 2.93Å; I290-K294 HydrophobicContact CG2-CD 4.33Å; I290-K294 WeakPolarHBondContact O-CG 3.42Å; I290-K294 PolarHBondContact O-N 3.35Å; I290-K294 VanDerWaalsContact O-N 3.11Å
291	N	92.4	Very high	88	Confident	44 Å²	44	60.9 Å²	60.9	24%	0.235	32%	0.32	C	S	.	.	H	α-helix	trans	-69.9	-36.6	177.1	-66.7	-18	0	0	0	111.5	T287 H288 V289 K294 Q295 V302	T287-N291 PolarHBondContact O-N 2.84Å; T287-N291 VanDerWaalsContact O-N 3.07Å; T287-N291 PolarHBondContact O-ND2 2.78Å; H288-N291 PolarHBondContact O-N 3.1Å; H288-N291 VanDerWaalsContact O-N 3.13Å; V289-N291 VanDerWaalsContact C-N 3.32Å; V289-N291 PolarHBondContact O-N 2.94Å; N291-K294 PolarHBondContact O-N 3.21Å; N291-Q295 WeakPolarHBondContact O-CB 3.43Å; N291-Q295 PolarHBondContact O-N 3.04Å; N291-V302 HydrophobicContact CB-CG1 4.15Å
292	L	90.4	Very high	86.1	Confident	46 Å²	46	56.6 Å²	56.6	24%	0.241	30%	0.303	C	S	.	.	H	α-helix	trans	-59.6	-47.3	173.1	-173.2	67.4	0	0	0	111.6	L232 H288 V289 K294 Q295 Q296	L232-L292 HydrophobicContact CB-CD2 4.31Å; L232-L292 HydrophobicContact CD1-CB 4.3Å; L232-L292 HydrophobicContact CD1-CD2 4.01Å; L232-L292 HydrophobicContact CD1-CG 4.08Å; H288-L292 PolarHBondContact O-N 3.18Å; V289-L292 WeakPolarHBondContact O-CB 3.31Å; V289-L292 PolarHBondContact O-N 3.31Å; L292-K294 PolarHBondContact O-N 2.98Å; L292-Q295 PolarHBondContact O-N 3.3Å; L292-Q296 WeakPolarHBondContact O-CB 3.36Å; L292-Q296 PolarHBondContact O-N 2.97Å
293	Y	90.1	Very high	84	Confident	11 Å²	11	62.9 Å²	62.9	4%	0.043	34%	0.336	C	S	.	.	H	α-helix	trans	-57.2	-47.1	173.4	174.5	-87.6	0	0	0	112.2	L228 L232 I248 Y252 V289 Q295 Q296 V297 K298	L228-Y293 HydrophobicContact CD1-CD2 4.4Å; L232-Y293 HydrophobicContact CD2-CD2 4.16Å; I248-Y293 HydrophobicContact CG2-CD2 3.59Å; I248-Y293 HydrophobicContact CG2-CE2 3.54Å; Y252-Y293 HydrophobicContact CD1-CD1 4.18Å; Y252-Y293 AromaticContact CD1-CE1 3.81Å; Y252-Y293 HydrophobicContact CD1-CE1 3.81Å; Y252-Y293 AromaticContact CD2-CD1 3.03Å; Y252-Y293 HydrophobicContact CD2-CD1 3.03Å; Y252-Y293 HydrophobicContact CD2-CD2 4.21Å; Y252-Y293 AromaticContact CD2-CE1 3.57Å; Y252-Y293 HydrophobicContact CD2-CE1 3.57Å; Y252-Y293 AromaticContact CD2-CG 3.41Å; Y252-Y293 HydrophobicContact CD2-CG 3.41Å; Y252-Y293 VanDerWaalsContact CD2-CG 3.41Å; Y252-Y293 HydrophobicContact CE1-CD1 4.46Å; Y252-Y293 HydrophobicContact CE1-CE1 4.15Å; Y252-Y293 AromaticContact CE2-CD1 3.33Å; Y252-Y293 HydrophobicContact CE2-CD1 3.33Å; Y252-Y293 AromaticContact CE2-CE1 3.84Å; Y252-Y293 HydrophobicContact CE2-CE1 3.84Å; Y252-Y293 HydrophobicContact CE2-CG 4.09Å; Y252-Y293 AromaticContact CG-CD1 3.49Å; Y252-Y293 HydrophobicContact CG-CD1 3.49Å; Y252-Y293 VanDerWaalsContact CG-CD1 3.49Å; Y252-Y293 HydrophobicContact CG-CD2 4.25Å; Y252-Y293 AromaticContact CG-CE1 3.52Å; Y252-Y293 HydrophobicContact CG-CE1 3.52Å; Y252-Y293 HydrophobicContact CG-CE2 4.28Å; Y252-Y293 AromaticContact CG-CG 3.87Å; Y252-Y293 HydrophobicContact CG-CG 3.87Å; Y252-Y293 AromaticContact CG-CZ 3.93Å; V289-Y293 PolarHBondContact O-N 2.92Å; Y293-Q295 VanDerWaalsContact C-N 3.29Å; Y293-Q295 PolarHBondContact O-N 3.01Å; Y293-Q296 PolarHBondContact O-N 3.1Å; Y293-V297 HydrophobicContact CD2-CB 3.99Å; Y293-V297 HydrophobicContact CD2-CG1 4.48Å; Y293-V297 HydrophobicContact CD2-CG2 3.72Å; Y293-V297 HydrophobicContact CE1-CB 4.49Å; Y293-V297 HydrophobicContact CE2-CB 3.8Å; Y293-V297 HydrophobicContact CE2-CG1 3.79Å; Y293-V297 HydrophobicContact CE2-CG2 3.82Å; Y293-V297 HydrophobicContact CG-CB 4.42Å; Y293-V297 HydrophobicContact CG-CG2 4.4Å; Y293-V297 WeakPolarHBondContact O-CB 3.35Å; Y293-V297 PolarHBondContact O-N 2.94Å; Y293-K298 HydrophobicContact CE1-CD 4.07Å; Y293-K298 HydrophobicContact CE1-CG 3.97Å; Y293-K298 PolarHBondContact O-N 3.04Å
294	K	89.1	Confident	81.7	Confident	34 Å²	34	64.6 Å²	64.6	15%	0.148	36%	0.361	C	S	.	.	H	α-helix	trans	-60.3	-40.2	179.8	-75.9	174.4	-176.9	169.1	0	111.8	Y252 E256 I290 N291 L292 K298 G299 E300 V302	Y252-K294 HydrophobicContact CE2-CG 4.13Å; Y252-K294 WeakPolarHBondContact OH-CE 3.45Å; E256-K294 IonicContact OE1-NZ 2.68Å; E256-K294 PolarHBondContact OE1-NZ 3.09Å; I290-K294 HydrophobicContact CG2-CD 4.33Å; I290-K294 WeakPolarHBondContact O-CG 3.42Å; I290-K294 PolarHBondContact O-N 3.35Å; I290-K294 VanDerWaalsContact O-N 3.11Å; N291-K294 PolarHBondContact O-N 3.21Å; L292-K294 PolarHBondContact O-N 2.98Å; K294-K298 HydrophobicContact CG-CD 4.41Å; K294-K298 CarbonylContact O-C 3.57Å; K294-K298 WeakPolarHBondContact O-CB 3.41Å; K294-K298 PolarHBondContact O-N 3.37Å; K294-G299 PolarHBondContact O-N 3.42Å; K294-G299 VanDerWaalsContact O-N 3.08Å; K294-E300 HydrophobicContact CB-CB 4.24Å; K294-E300 PolarHBondContact O-N 2.84Å; K294-V302 HydrophobicContact CB-CG2 3.66Å; K294-V302 HydrophobicContact CD-CG2 4.06Å; K294-V302 HydrophobicContact CG-CG2 4.49Å
295	Q	86.9	Confident	78.9	Confident	113 Å²	113	65.5 Å²	65.5	53%	0.528	37%	0.366	S	S	.	.	H	α-helix	trans	-70.3	-48.1	178	-171	174.9	26.2	0	0	112.4	N291 L292 Y293 G299	N291-Q295 WeakPolarHBondContact O-CB 3.43Å; N291-Q295 PolarHBondContact O-N 3.04Å; L292-Q295 PolarHBondContact O-N 3.3Å; Y293-Q295 VanDerWaalsContact C-N 3.29Å; Y293-Q295 PolarHBondContact O-N 3.01Å; Q295-G299 WeakPolarHBondContact O-CA 3.47Å; Q295-G299 PolarHBondContact O-N 3.46Å
296	Q	82.1	Confident	76.2	Confident	78 Å²	78	70.1 Å²	70.1	36%	0.364	39%	0.386	S	S	.	.	H	α-helix	trans	-88	-33.7	-168.1	-166.9	177.4	-7	0	0	114.1	L232 Y235 L292 Y293	L232-Q296 PolarHBondContact O-NE2 3.47Å; L232-Q296 PolarHBondContact O-OE1 3.19Å; Y235-Q296 HydrophobicContact CD1-CG 4.22Å; L292-Q296 WeakPolarHBondContact O-CB 3.36Å; L292-Q296 PolarHBondContact O-N 2.97Å; Y293-Q296 PolarHBondContact O-N 3.1Å
297	V	82.4	Confident	73.6	Confident	41 Å²	41	76 Å²	76	25%	0.248	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-43.1	-177	-176.8	0	0	0	0	111.7	L232 Y235 I248 Y293	L232-V297 HydrophobicContact CD2-CG2 3.51Å; Y235-V297 HydrophobicContact CD1-CG2 4.2Å; Y235-V297 HydrophobicContact CE1-CG2 4Å; Y235-V297 HydrophobicContact CE2-CG2 4.38Å; Y235-V297 HydrophobicContact CG-CG2 4.48Å; I248-V297 HydrophobicContact CG2-CG2 4.48Å; Y293-V297 HydrophobicContact CD2-CB 3.99Å; Y293-V297 HydrophobicContact CD2-CG1 4.48Å; Y293-V297 HydrophobicContact CD2-CG2 3.72Å; Y293-V297 HydrophobicContact CE1-CB 4.49Å; Y293-V297 HydrophobicContact CE2-CB 3.8Å; Y293-V297 HydrophobicContact CE2-CG1 3.79Å; Y293-V297 HydrophobicContact CE2-CG2 3.82Å; Y293-V297 HydrophobicContact CG-CB 4.42Å; Y293-V297 HydrophobicContact CG-CG2 4.4Å; Y293-V297 WeakPolarHBondContact O-CB 3.35Å; Y293-V297 PolarHBondContact O-N 2.94Å
298	K	77.3	Confident	70.8	Confident	104 Å²	104	81.5 Å²	81.5	45%	0.452	45%	0.45	S	S	.	.	S	Bend	trans	-91.6	-18	-179.7	-70.4	178.8	151.5	-157.3	0	114.8	Y293 K294 E300	Y293-K298 HydrophobicContact CE1-CD 4.07Å; Y293-K298 HydrophobicContact CE1-CG 3.97Å; Y293-K298 PolarHBondContact O-N 3.04Å; K294-K298 HydrophobicContact CG-CD 4.41Å; K294-K298 CarbonylContact O-C 3.57Å; K294-K298 WeakPolarHBondContact O-CB 3.41Å; K294-K298 PolarHBondContact O-N 3.37Å; K298-E300 HydrophobicContact CB-CG 4.11Å; K298-E300 HydrophobicContact CD-CG 4.45Å; K298-E300 WeakPolarHBondContact CD-OE1 3.5Å; K298-E300 IonicContact NZ-OE1 2.76Å; K298-E300 PolarHBondContact NZ-OE1 3.37Å; K298-E300 PolarHBondContact O-N 3.44Å
299	G	67.3	Low	68	Low	57 Å²	57	81.8 Å²	81.8	59%	0.588	46%	0.455	S	S	*	.			trans	67.7	18.9	-172.7	0	0	0	0	0	114.4	K294 Q295	K294-G299 PolarHBondContact O-N 3.42Å; K294-G299 VanDerWaalsContact O-N 3.08Å; Q295-G299 WeakPolarHBondContact O-CA 3.47Å; Q295-G299 PolarHBondContact O-N 3.46Å
300	E	72.9	Confident	65.1	Low	85 Å²	85	88.3 Å²	88.3	40%	0.397	50%	0.495	S	S	.	.			trans	-73.5	128.2	175.6	-74.8	174	-167.7	0	0	109.7	K294 K298 V302	K294-E300 HydrophobicContact CB-CB 4.24Å; K294-E300 PolarHBondContact O-N 2.84Å; K298-E300 HydrophobicContact CB-CG 4.11Å; K298-E300 HydrophobicContact CD-CG 4.45Å; K298-E300 WeakPolarHBondContact CD-OE1 3.5Å; K298-E300 IonicContact NZ-OE1 2.76Å; K298-E300 PolarHBondContact NZ-OE1 3.37Å; K298-E300 PolarHBondContact O-N 3.44Å; E300-V302 HydrophobicContact CB-CG2 4.29Å; E300-V302 PolarHBondContact O-N 3.07Å
301	I	57.5	Low	62.4	Low	156 Å²	156	96.8 Å²	96.8	80%	0.8	54%	0.535	S	S	*	.			trans	-77.5	84.6	178.2	-45.6	171.1	0	0	0	109.4
302	V	57.3	Low	59.5	Low	41 Å²	41	104.1 Å²	104.1	25%	0.248	57%	0.565	C	S	.	*			trans	-85.6	125.7	177.7	-169.9	0	0	0	0	110.4	N291 K294 E300	N291-V302 HydrophobicContact CB-CG1 4.15Å; K294-V302 HydrophobicContact CB-CG2 3.66Å; K294-V302 HydrophobicContact CD-CG2 4.06Å; K294-V302 HydrophobicContact CG-CG2 4.49Å; E300-V302 HydrophobicContact CB-CG2 4.29Å; E300-V302 PolarHBondContact O-N 3.07Å
303	N	51.9	Low	57	Low	136 Å²	136	107.9 Å²	107.9	73%	0.727	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.3	58.6	177.3	-80.7	13.1	0	0	0	116.4	N305	N303-N305 PolarHBondContact O-N 3.43Å
304	G	49.9	Very low	54.5	Low	68 Å²	68	112.6 Å²	112.6	70%	0.701	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	61.9	-5.4	148.2	0	0	0	0	0	119.8	N306	G304-N306 PolarHBondContact O-N 2.84Å
305	N	36	Very low	51.7	Low	132 Å²	132	114.3 Å²	114.3	71%	0.706	66%	0.661	S	S	*	*			trans	-90.2	95.7	-170.9	-78.8	-7.3	0	0	0	111	N303	N303-N305 PolarHBondContact O-N 3.43Å
306	N	40.7	Very low	49.3	Very low	151 Å²	151	115.7 Å²	115.7	81%	0.807	68%	0.677	S	S	*	*			trans	-96.8	91.7	178.6	-171.8	12.7	0	0	0	111.4	G304	G304-N306 PolarHBondContact O-N 2.84Å
307	T	41.8	Very low	47.2	Very low	124 Å²	124	116.5 Å²	116.5	76%	0.761	70%	0.697	S	S	*	*			trans	-142.6	72.2	175.3	57.7	0	0	0	0	113.4
308	L	36.4	Very low	45	Very low	157 Å²	157	121.6 Å²	121.6	82%	0.822	72%	0.722	S	S	*	*				-173.2	114.9	116.1	-130	71.3	0	0	0	114.1
309	N	36.3	Very low	43.2	Very low	138 Å²	138	123.8 Å²	123.8	74%	0.738	74%	0.738	S	S	*	*			trans	8.7	116.7	140.5	-150.3	15.1	0	0	0	119.3
310	T	33.2	Very low	41.7	Very low	138 Å²	138	127.2 Å²	127.2	85%	0.847	74%	0.743	S	S	*	*			trans	-135.5	121.4	144.8	-54.6	0	0	0	0	109.5
311	Q	38.8	Very low	40	Very low	178 Å²	178	129.5 Å²	129.5	83%	0.832	76%	0.757	S	S	*	*			trans	-67.5	137.2	177	-66	171.4	-57.8	0	0	111.1
312	K	30.6	Very low	38.9	Very low	199 Å²	199	127.3 Å²	127.3	87%	0.865	76%	0.755	S	S	*	*			trans	-137.3	130.7	161.8	-151.9	169.8	-172.2	175.6	0	109.2
313	P	38.2	Very low	37.7	Very low	125 Å²	125	128.7 Å²	128.7	81%	0.812	78%	0.778	S	S	*	*			trans	-77.8	164.6	-169.8	30.7	-35.5	0	0	0	113.8
314	A	38	Very low	36.7	Very low	109 Å²	109	130.5 Å²	130.5	90%	0.901	79%	0.787	S	S	*	*			trans	-45.5	151.6	-170.2	0	0	0	0	0	118.5
315	G	30.6	Very low	35.8	Very low	71 Å²	71	133.7 Å²	133.7	73%	0.732	79%	0.788	S	S	*	*			trans	-164.6	58	176.1	0	0	0	0	0	115.2
316	T	36.4	Very low	35.7	Very low	142 Å²	142	133.6 Å²	133.6	87%	0.871	79%	0.792	S	S	*	*			trans	23.1	111.4	152.2	52.7	0	0	0	0	121.7
317	A	38.3	Very low	35.3	Very low	94 Å²	94	131.3 Å²	131.3	78%	0.777	79%	0.788	S	S	*	*			trans	-174.3	103.1	134.2	0	0	0	0	0	108.1
318	L	35.6	Very low	35.2	Very low	148 Å²	148	131.5 Å²	131.5	78%	0.775	79%	0.791	S	S	*	*				66.8	110.1	83.6	-72	-178.5	0	0	0	115.8
319	L	39.8	Very low	34.9	Very low	151 Å²	151	133.3 Å²	133.3	79%	0.791	80%	0.796	S	S	*	*			trans	70.5	150	139.8	-60.6	167.9	0	0	0	118.3
320	D	36.5	Very low	35.1	Very low	129 Å²	129	131.7 Å²	131.7	69%	0.69	80%	0.795	S	S	*	*			cis	-172.9	176.9	-17.9	-171.4	15.4	0	0	0	108.7
321	L	35.7	Very low	35.3	Very low	132 Å²	132	130.9 Å²	130.9	69%	0.691	79%	0.792	S	S	*	*			trans	78.2	85.3	159.5	-55.5	-177.9	0	0	0	120
322	S	35.9	Very low	35.4	Very low	110 Å²	110	128.1 Å²	128.1	77%	0.769	79%	0.79	S	S	*	*				13.2	129.9	120.2	60.9	0	0	0	0	120.2
323	G	30.1	Very low	35.3	Very low	70 Å²	70	124.2 Å²	124.2	72%	0.722	79%	0.787	S	S	*	*			trans	137.1	95.3	139.5	0	0	0	0	0	117
324	L	32.1	Very low	35.2	Very low	174 Å²	174	127.7 Å²	127.7	91%	0.911	79%	0.79	S	S	*	*				-164.1	149.5	110	-127.3	75	0	0	0	111.9
325	D	31.8	Very low	35.6	Very low	136 Å²	136	127.6 Å²	127.6	73%	0.727	78%	0.78	S	S	*	*			trans	-88.9	123.7	177.4	172.3	21.2	0	0	0	110.6
326	T	32.3	Very low	35.3	Very low	129 Å²	129	132.8 Å²	132.8	79%	0.791	79%	0.786	S	S	*	*			trans	-145	110.3	156	64.4	0	0	0	0	110.2
327	S	33.6	Very low	34.9	Very low	103 Å²	103	135 Å²	135	72%	0.72	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-66.6	157.1	171.1	-76.4	0	0	0	0	112.7
328	P	38.8	Very low	34.9	Very low	129 Å²	129	136.2 Å²	136.2	84%	0.838	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-77.5	142.7	-164.5	30.6	-36.3	0	0	0	113.8
329	Q	30.7	Very low	34.8	Very low	195 Å²	195	135 Å²	135	91%	0.911	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-99	122.4	174.7	-137.9	173.5	8	0	0	110.7
330	S	39.3	Very low	35	Very low	103 Å²	103	133 Å²	133	72%	0.72	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-79.3	159.1	175	38.8	0	0	0	0	112.4
331	P	38.8	Very low	34.8	Very low	122 Å²	122	132.7 Å²	132.7	79%	0.792	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-76.2	149.9	-179.6	31.4	-35.9	0	0	0	112.8
332	P	39.3	Very low	34.4	Very low	120 Å²	120	134.1 Å²	134.1	78%	0.779	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-90.6	120.2	-176.4	33.3	-33.3	0	0	0	115.2
333	S	30.2	Very low	34	Very low	116 Å²	116	131.7 Å²	131.7	81%	0.811	78%	0.782	S	S	*	*				55.8	132	125.7	-52.8	0	0	0	0	124.3
334	F	34.9	Very low	34	Very low	198 Å²	198	136.4 Å²	136.4	87%	0.868	79%	0.79	S	S	*	*			trans	-68	178.8	158.5	-66.3	-104.2	0	0	0	112.9
335	P	46.7	Very low	33.8	Very low	108 Å²	108	137.1 Å²	137.1	70%	0.701	79%	0.788	S	S	*	*				-138.9	173.9	86.7	41.4	-26.8	0	0	0	113
336	E	24.3	Very low	33.6	Very low	180 Å²	180	135 Å²	135	84%	0.841	79%	0.789	S	S	*	*			cis	-152.1	166.2	12.5	-143.4	153.5	141.3	0	0	114.1
337	F	27.7	Very low	34.1	Very low	188 Å²	188	134.3 Å²	134.3	83%	0.825	79%	0.787	S	S	*	*			trans	-89	-170.1	179.4	-91	-93.4	0	0	0	111.4
338	P	39.1	Very low	33.8	Very low	120 Å²	120	134 Å²	134	78%	0.779	79%	0.785	S	S	*	*			cis	-139.3	163.8	9.5	39.5	-19.3	0	0	0	119.5
339	T	34.1	Very low	33.3	Very low	121 Å²	121	136.1 Å²	136.1	74%	0.742	78%	0.784	S	S	*	*			trans	-96.1	166.3	156.6	-21.8	0	0	0	0	110.5
340	P	43.3	Very low	33.2	Very low	109 Å²	109	134 Å²	134	71%	0.708	77%	0.774	S	S	*	*			trans	-131.8	138	141.1	8.5	14	0	0	0	115.2
341	T	31.4	Very low	32.8	Very low	124 Å²	124	135.7 Å²	135.7	76%	0.761	78%	0.78	S	S	*	*			trans	21.3	143.3	139.3	49.8	0	0	0	0	120.4
342	D	28.3	Very low	32.4	Very low	162 Å²	162	132.8 Å²	132.8	87%	0.866	77%	0.773	S	S	*	*			cis	-150.8	172.8	30.2	-105.3	-40.8	0	0	0	108.4
343	G	27.1	Very low	32.1	Very low	59 Å²	59	135.3 Å²	135.3	61%	0.608	78%	0.778	S	S	*	*			cis	155.9	139.7	7.6	0	0	0	0	0	110.2
344	L	29.4	Very low	32.3	Very low	168 Å²	168	135.3 Å²	135.3	88%	0.88	78%	0.778	S	S	*	*			trans	71	135.7	163.1	-61.9	167.3	0	0	0	123.5
345	Q	29.1	Very low	32.5	Very low	190 Å²	190	132.7 Å²	132.7	89%	0.888	77%	0.772	S	S	*	*			trans	81.4	146.7	148	-97.8	163.6	-41	0	0	122.8
346	A	26.1	Very low	32.1	Very low	90 Å²	90	135.7 Å²	135.7	74%	0.744	78%	0.782	S	S	*	*			trans	-123.2	-171.5	-176.4	0	0	0	0	0	109.7
347	P	43.4	Very low	32.6	Very low	115 Å²	115	134 Å²	134	75%	0.747	78%	0.778	S	S	*	*			cis	-133.4	-168.9	-12.7	36	-15.1	0	0	0	114.2
348	S	27.9	Very low	33.2	Very low	98 Å²	98	131.4 Å²	131.4	69%	0.685	77%	0.773	S	S	*	*			trans	108	128.2	150.3	-47.9	0	0	0	0	119.6
349	Q	28.2	Very low	33.4	Very low	173 Å²	173	134.4 Å²	134.4	81%	0.808	78%	0.777	S	S	*	*			trans	20.9	145.2	139.3	-62.9	173.4	-58.9	0	0	119.6
350	E	28.2	Very low	33.7	Very low	150 Å²	150	136.6 Å²	136.6	70%	0.701	78%	0.783	S	S	*	*			cis	-168.5	166	26.6	-144.9	167.2	-136.6	0	0	112.3
351	T	31.9	Very low	33.5	Very low	138 Å²	138	139.4 Å²	139.4	85%	0.847	79%	0.788	S	S	*	*			trans	66	153.3	173.6	75.6	0	0	0	0	116.5
352	G	29.1	Very low	33.8	Very low	62 Å²	62	138.7 Å²	138.7	64%	0.639	79%	0.788	S	S	*	*			cis	149	112.6	-6.8	0	0	0	0	0	113.3
353	I	33.6	Very low	34.3	Very low	172 Å²	172	139 Å²	139	88%	0.882	79%	0.789	S	S	*	*			trans	65.3	142.2	160.4	17.9	178.8	0	0	0	122.3
354	S	34	Very low	34.7	Very low	117 Å²	117	139.6 Å²	139.6	82%	0.818	80%	0.795	S	S	*	*			trans	83.5	102.9	156	-58.9	0	0	0	0	119.2
355	L	39.6	Very low	35	Very low	142 Å²	142	140 Å²	140	74%	0.743	80%	0.797	S	S	*	*			trans	-137.9	58.9	176.9	-141.1	177.8	0	0	0	109.9
356	L	38.9	Very low	35.1	Very low	172 Å²	172	135.7 Å²	135.7	90%	0.901	79%	0.788	S	S	*	*			trans	-136.8	21	-178.8	-70.9	178.1	0	0	0	113
357	D	33.3	Very low	35.2	Very low	144 Å²	144	139.7 Å²	139.7	77%	0.77	79%	0.792	S	S	*	*	S	Bend	trans	-107.4	-10.9	-178.6	-144.3	39.6	0	0	0	112.8
358	D	41	Very low	34.5	Very low	133 Å²	133	137.3 Å²	137.3	71%	0.711	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-18.3	-173.8	-91.4	-44	0	0	0	114.9
359	E	42.7	Very low	34.5	Very low	184 Å²	184	138.2 Å²	138.2	86%	0.86	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-13.4	-175.8	-94.8	-171.9	125.4	0	0	114.9
360	L	41	Very low	34.7	Very low	166 Å²	166	138.2 Å²	138.2	87%	0.869	79%	0.789	S	S	*	*	G	3₁₀ helix	trans	-86.7	-7.6	-176.5	-136.8	81.2	0	0	0	114.6
361	M	39.4	Very low	34.6	Very low	168 Å²	168	136.9 Å²	136.9	83%	0.828	79%	0.792	S	S	*	*	G	3₁₀ helix	trans	-89.7	6.1	-172	-77	-68.8	-176.8	0	0	115.5
362	S	37.6	Very low	34.4	Very low	109 Å²	109	135.6 Å²	135.6	76%	0.762	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-90.1	4.8	-175.4	-72.3	0	0	0	0	116.3
363	L	39.1	Very low	34.2	Very low	169 Å²	169	139.7 Å²	139.7	89%	0.885	80%	0.796	S	S	*	*	S	Bend	trans	-119.4	70.7	176.8	-68.3	176.9	0	0	0	111.5	L365	L363-L365 PolarHBondContact O-N 3.29Å
364	G	35.5	Very low	34.6	Very low	71 Å²	71	136.3 Å²	136.3	73%	0.732	79%	0.785	S	S	*	*			trans	-67.2	119.3	-178.1	0	0	0	0	0	114
365	L	34.3	Very low	34.3	Very low	176 Å²	176	136 Å²	136	92%	0.921	78%	0.783	S	S	*	*			trans	-128.5	100.3	150.5	-72.5	178	0	0	0	108	L363	L363-L365 PolarHBondContact O-N 3.29Å
366	S	31.5	Very low	33.8	Very low	100 Å²	100	138 Å²	138	70%	0.699	79%	0.788	S	S	*	*			trans	-87.1	-177.9	175	63.2	0	0	0	0	112.4
367	E	27.8	Very low	33.9	Very low	174 Å²	174	134.8 Å²	134.8	81%	0.813	78%	0.777	S	S	*	*			trans	76.8	110.1	-179.2	-97.7	68.2	-161.8	0	0	113.9
368	G	28.7	Very low	33.6	Very low	66 Å²	66	134.9 Å²	134.9	68%	0.68	78%	0.778	S	S	*	*			cis	118.7	142.5	35.4	0	0	0	0	0	108
369	T	29.8	Very low	32.9	Very low	117 Å²	117	135.2 Å²	135.2	72%	0.718	78%	0.78	S	S	*	*			cis	-166	134	6.1	16.9	0	0	0	0	110.2
370	H	31.1	Very low	32.3	Very low	172 Å²	172	130.2 Å²	130.2	80%	0.796	77%	0.765	S	S	*	*			trans	57.5	159.4	151	-46.9	-52.9	0	0	0	119.4
371	T	27	Very low	31.8	Very low	123 Å²	123	128.4 Å²	128.4	76%	0.755	76%	0.761	S	S	*	*			cis	-148.2	160.2	27.6	52.4	0	0	0	0	115.1
372	S	28.1	Very low	31.3	Very low	110 Å²	110	124.6 Å²	124.6	77%	0.769	76%	0.756	S	S	*	*			trans	67.9	98.5	145.9	56.3	0	0	0	0	121.8
373	N	24.3	Very low	30.8	Very low	149 Å²	149	129.9 Å²	129.9	80%	0.797	76%	0.76	S	S	*	*			trans	-61.4	-177.4	140.8	-135.6	12.8	0	0	0	110.7
374	P	41.8	Very low	30.4	Very low	100 Å²	100	128.3 Å²	128.3	65%	0.649	75%	0.752	S	S	*	*			cis	-139.9	179.1	-0.5	36.6	-14.8	0	0	0	117.6
375	S	27.9	Very low	29.9	Very low	111 Å²	111	128.6 Å²	128.6	78%	0.776	74%	0.743	S	S	*	*			trans	121.3	116.7	139	-57	0	0	0	0	118.5
376	Q	28.3	Very low	29.5	Very low	185 Å²	185	128.2 Å²	128.2	86%	0.864	73%	0.734	S	S	*	*			trans	-72.5	178.7	152.5	-94.2	-177.8	-68	0	0	110.9
377	P	41.8	Very low	29.3	Very low	103 Å²	103	131.2 Å²	131.2	67%	0.669	74%	0.737	S	S	*	*			cis	-139.4	-166.1	18.1	42.7	-22.3	0	0	0	116.9
378	D	27.3	Very low	29.2	Very low	147 Å²	147	127.5 Å²	127.5	79%	0.786	73%	0.731	S	S	*	*			trans	76.9	99.1	155	-71.8	-3.4	0	0	0	122.9
379	D	26	Very low	29.3	Very low	140 Å²	140	129.5 Å²	129.5	75%	0.749	73%	0.734	S	S	*	*				85.9	147.9	100	-156.2	42.8	0	0	0	122.7
380	S	29	Very low	29.2	Very low	79 Å²	79	131.5 Å²	131.5	55%	0.552	74%	0.74	S	S	*	*			trans	70.4	106.1	156	-78.9	0	0	0	0	122.4
381	T	31.5	Very low	29.4	Very low	127 Å²	127	127.9 Å²	127.9	78%	0.779	73%	0.734	S	S	*	*				58.3	118.8	129.3	64.9	0	0	0	0	122.4
382	A	29.1	Very low	29.7	Very low	88 Å²	88	129.4 Å²	129.4	73%	0.727	74%	0.736	S	S	*	*				156	111	122.4	0	0	0	0	0	111
383	W	27.7	Very low	29.7	Very low	220 Å²	220	131 Å²	131	83%	0.833	74%	0.736	S	S	*	*				70.9	113.8	82.1	-77.3	103.4	0	0	0	114.3
384	D	29.9	Very low	30	Very low	136 Å²	136	128 Å²	128	73%	0.727	73%	0.732	S	S	*	*			trans	64.8	152.9	153.5	-66.9	-24.4	0	0	0	117.9
385	S	24.5	Very low	29.4	Very low	77 Å²	77	130.6 Å²	130.6	54%	0.538	74%	0.74	S	S	.	*			cis	-171	177.5	15.9	-139.9	0	0	0	0	113.2
386	F	26.8	Very low	29.5	Very low	169 Å²	169	129.7 Å²	129.7	74%	0.741	73%	0.73	S	S	*	*			trans	56.6	110	161	-61	-62.1	0	0	0	118.3
387	Q	26.5	Very low	29.4	Very low	162 Å²	162	129.8 Å²	129.8	76%	0.757	73%	0.73	S	S	*	*				90.4	138.5	64.7	-87.3	-167.4	2.4	0	0	114.6
388	S	26.8	Very low	28.8	Very low	97 Å²	97	129.6 Å²	129.6	68%	0.678	74%	0.737	S	S	*	*			trans	71.4	124.7	160.6	-53.8	0	0	0	0	116
389	S	30.4	Very low	28.9	Very low	107 Å²	107	126.8 Å²	126.8	75%	0.748	74%	0.735	S	S	*	*				58.9	120.7	64.9	-52	0	0	0	0	110.4
390	D	27.3	Very low	29.6	Very low	160 Å²	160	125.6 Å²	125.6	86%	0.856	74%	0.735	S	S	*	*				-159.2	-175.4	65.8	-128.3	-42.8	0	0	0	115.4
391	S	34.8	Very low	29.5	Very low	95 Å²	95	129.9 Å²	129.9	66%	0.664	75%	0.745	S	S	*	*			trans	-101.7	-168.4	-173.6	-52.1	0	0	0	0	114.3
392	I	33.7	Very low	29.3	Very low	156 Å²	156	131.7 Å²	131.7	80%	0.8	75%	0.75	S	S	*	*			trans	75.7	152	169.1	80.9	151.9	0	0	0	116.9
393	D	27.7	Very low	29.3	Very low	144 Å²	144	134.5 Å²	134.5	77%	0.77	75%	0.752	S	S	*	*			cis	-150.1	-176.4	6	-141.7	-40.7	0	0	0	112.5
394	A	31.8	Very low	29.4	Very low	85 Å²	85	131.5 Å²	131.5	70%	0.702	75%	0.751	S	S	*	*			trans	-86.5	178.4	-174.4	0	0	0	0	0	116.3
395	D	28.2	Very low	29.5	Very low	155 Å²	155	130.2 Å²	130.2	83%	0.829	75%	0.753	S	S	*	*				160.4	164.5	115.3	-166.5	22.4	0	0	0	115
396	V	30.3	Very low	30.1	Very low	91 Å²	91	132.5 Å²	132.5	55%	0.552	77%	0.766	S	S	*	*			trans	100.4	100.7	149.9	-168.3	0	0	0	0	122.5
397	Q	27.1	Very low	30.3	Very low	187 Å²	187	131.8 Å²	131.8	87%	0.874	77%	0.77	S	S	*	*			trans	63.7	157.7	137.6	-59.4	170.8	3.4	0	0	121.6
398	A	27.7	Very low	31.1	Very low	99 Å²	99	129.4 Å²	129.4	82%	0.818	77%	0.768	S	S	*	*			cis	-149.2	173.1	8.5	0	0	0	0	0	113
399	A	29.4	Very low	31.9	Very low	89 Å²	89	130.2 Å²	130.2	74%	0.736	77%	0.771	S	S	*	*			trans	-124.9	167.6	170.9	0	0	0	0	0	112
400	P	41	Very low	31.6	Very low	115 Å²	115	129.9 Å²	129.9	75%	0.747	77%	0.769	S	S	*	*				-148.3	144.2	107.1	36.2	-19.7	0	0	0	117.6
401	H	26.6	Very low	31.8	Very low	168 Å²	168	130.7 Å²	130.7	78%	0.778	77%	0.767	S	S	*	*			trans	24.5	137.5	144.1	-57.4	-77.4	0	0	0	121.4
402	L	27.9	Very low	31.6	Very low	166 Å²	166	131.6 Å²	131.6	87%	0.869	77%	0.773	S	S	*	*				-152	166.9	72.4	-85	169.1	0	0	0	115.7
403	L	30	Very low	31.7	Very low	147 Å²	147	131.9 Å²	131.9	77%	0.77	77%	0.771	S	S	*	*			trans	-69.2	169.4	-179.5	-57.1	154.3	0	0	0	112.3
404	L	28.6	Very low	32	Very low	157 Å²	157	131.2 Å²	131.2	82%	0.822	78%	0.775	S	S	*	*			cis	-166	153.9	27.4	-165.9	72.1	0	0	0	110.3
405	S	33.2	Very low	32	Very low	108 Å²	108	133.2 Å²	133.2	76%	0.755	77%	0.773	S	S	*	*			trans	-79.4	164.1	173.3	-29.8	0	0	0	0	112.7
406	P	37.2	Very low	32.9	Very low	126 Å²	126	128.4 Å²	128.4	82%	0.818	75%	0.751	S	S	*	*				-143.8	175.8	55.4	37.2	-15.3	0	0	0	118.1
407	D	29.9	Very low	33.5	Very low	154 Å²	154	129.1 Å²	129.1	82%	0.824	76%	0.76	S	S	*	*			trans	-60.3	175.1	174.7	-81.5	-52.3	0	0	0	116.6
408	P	43.7	Very low	34.7	Very low	112 Å²	112	126.8 Å²	126.8	73%	0.727	75%	0.753	S	S	*	*			cis	-127.1	-155.7	-33.7	38.1	-18.8	0	0	0	109.4
409	P	42.7	Very low	36	Very low	114 Å²	114	127 Å²	127	74%	0.74	74%	0.741	S	S	*	*			cis	-135.8	-165.8	-2.8	44.9	-26	0	0	0	116.1
410	S	25.8	Very low	37.4	Very low	99 Å²	99	130 Å²	130	69%	0.692	74%	0.74	S	S	*	*			trans	89.3	113.9	162.4	73.8	0	0	0	0	119.8
411	H	29.7	Very low	38.4	Very low	178 Å²	178	130.8 Å²	130.8	82%	0.824	74%	0.737	S	S	*	*				-176	150.4	117.4	-103.5	-72.4	0	0	0	114.1
412	S	30.5	Very low	40.1	Very low	113 Å²	113	126.5 Å²	126.5	79%	0.79	72%	0.72	S	S	*	*			trans	64.6	131.3	156.3	46	0	0	0	0	121.9
413	Q	36.1	Very low	42	Very low	162 Å²	162	123.9 Å²	123.9	76%	0.757	71%	0.706	S	S	*	*			trans	-82.7	169.5	174.8	-59.1	166.1	-60.7	0	0	112.4	L415	Q413-L415 HydrophobicContact CB-CD1 4.32Å; Q413-L415 HydrophobicContact CG-CD1 4.46Å
414	P	34.2	Very low	43.7	Very low	131 Å²	131	122.1 Å²	122.1	85%	0.851	70%	0.697	S	S	*	*				-130.3	139.4	116.6	34.8	-27.1	0	0	0	114.2
415	L	33	Very low	45.7	Very low	127 Å²	127	116.6 Å²	116.6	67%	0.665	68%	0.678	S	S	*	*			trans	-79.9	129.6	170.4	-98.8	74.3	0	0	0	109.5	Q413	Q413-L415 HydrophobicContact CB-CD1 4.32Å; Q413-L415 HydrophobicContact CG-CD1 4.46Å
416	S	46.6	Very low	47.3	Very low	53 Å²	53	117.2 Å²	117.2	37%	0.371	67%	0.667	S	S	.	*				83.5	55.4	70.6	85.4	0	0	0	0	115.8	L418 D419	S416-L418 PolarHBondContact O-N 3.31Å; S416-D419 WeakPolarHBondContact CB-OD2 3.38Å
417	S	42.4	Very low	48.7	Very low	106 Å²	106	115 Å²	115	74%	0.741	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-5.4	169.4	54.1	0	0	0	0	114.7
418	L	52	Low	50.2	Low	138 Å²	138	112.8 Å²	112.8	72%	0.723	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-29.6	-174.8	-146.7	148.5	0	0	0	112.2	S416 L421 D422	S416-L418 PolarHBondContact O-N 3.31Å; L418-L421 PolarHBondContact O-N 2.98Å; L418-D422 PolarHBondContact O-N 2.6Å
419	D	56.1	Low	51.1	Low	105 Å²	105	113.6 Å²	113.6	56%	0.561	64%	0.637	S	S	*	*	H	α-helix	trans	-70.9	-32.2	177.1	-68.2	-48.8	0	0	0	112.7	S416 L421 D422 L423	S416-D419 WeakPolarHBondContact CB-OD2 3.38Å; D419-L421 VanDerWaalsContact C-N 3.27Å; D419-L421 PolarHBondContact O-N 3.48Å; D419-D422 PolarHBondContact O-N 3.31Å; D419-L423 WeakPolarHBondContact O-CB 3.47Å; D419-L423 PolarHBondContact O-N 2.72Å
420	E	58.1	Low	51.7	Low	151 Å²	151	115.1 Å²	115.1	71%	0.706	63%	0.634	S	S	*	*	H	α-helix	trans	-64.1	-34.2	173.7	-67.9	-168.4	146.6	0	0	111.8	L424	E420-L424 WeakPolarHBondContact O-CB 3.32Å; E420-L424 PolarHBondContact O-N 3.29Å
421	L	61.5	Low	53	Low	131 Å²	131	118.1 Å²	118.1	69%	0.686	64%	0.637	S	S	*	*	H	α-helix	trans	-73.1	-38.9	179.1	-143	76.2	0	0	0	111.9	L418 D419 L424 G425	L418-L421 PolarHBondContact O-N 2.98Å; D419-L421 VanDerWaalsContact C-N 3.27Å; D419-L421 PolarHBondContact O-N 3.48Å; L421-L424 PolarHBondContact O-N 3.42Å; L421-G425 PolarHBondContact O-N 2.93Å
422	D	63.4	Low	53.8	Low	79 Å²	79	114 Å²	114	42%	0.422	63%	0.628	S	S	.	*	H	α-helix	trans	-68	-37.6	173	-179.6	57.3	0	0	0	111.7	L418 D419 G425 K426	L418-D422 PolarHBondContact O-N 2.6Å; D419-D422 PolarHBondContact O-N 3.31Å; D422-G425 PolarHBondContact O-N 3.41Å; D422-K426 WeakPolarHBondContact O-CB 3.4Å; D422-K426 WeakPolarHBondContact O-CG 3.49Å; D422-K426 PolarHBondContact O-N 3.08Å; D422-K426 IonicContact OD1-NZ 3.48Å; D422-K426 VanDerWaalsContact OD2-CE 3.25Å; D422-K426 WeakPolarHBondContact OD2-CE 3.4Å; D422-K426 IonicContact OD2-NZ 3.6Å; D422-K426 PolarHBondContact OD2-NZ 3.27Å
423	L	66.2	Low	54.7	Low	111 Å²	111	114 Å²	114	58%	0.581	62%	0.618	S	S	*	*	H	α-helix	trans	-65.4	-39.7	173.1	-173	62.8	0	0	0	112	D419 K426 T427	D419-L423 WeakPolarHBondContact O-CB 3.47Å; D419-L423 PolarHBondContact O-N 2.72Å; L423-K426 PolarHBondContact O-N 2.81Å; L423-T427 WeakPolarHBondContact O-CB 3.47Å; L423-T427 PolarHBondContact O-N 2.88Å; L423-T427 PolarHBondContact O-OG1 2.92Å
424	L	67.7	Low	55.1	Low	109 Å²	109	111.3 Å²	111.3	57%	0.571	62%	0.615	S	S	*	*	H	α-helix	trans	-64.8	-44.5	174.9	-153.6	87.9	0	0	0	111.3	E420 L421 T427 L428	E420-L424 WeakPolarHBondContact O-CB 3.32Å; E420-L424 PolarHBondContact O-N 3.29Å; L421-L424 PolarHBondContact O-N 3.42Å; L424-T427 PolarHBondContact O-N 3.2Å; L424-L428 PolarHBondContact O-N 3.08Å
425	G	69.4	Low	55.7	Low	42 Å²	42	111 Å²	111	43%	0.433	61%	0.613	S	S	.	*	H	α-helix	trans	-59.6	-46	175.7	0	0	0	0	0	112.5	L421 D422 T427 L428 L429	L421-G425 PolarHBondContact O-N 2.93Å; D422-G425 PolarHBondContact O-N 3.41Å; G425-T427 PolarHBondContact O-N 3.34Å; G425-L428 PolarHBondContact O-N 3.4Å; G425-L429 PolarHBondContact O-N 3.17Å; G425-L429 VanDerWaalsContact O-N 3.07Å
426	K	67.3	Low	56.1	Low	120 Å²	120	114 Å²	114	52%	0.522	62%	0.624	S	S	.	*	H	α-helix	trans	-61.8	-40.8	173.9	-75.8	166.7	178.4	166	0	112.4	D422 L423 L429 Q430	D422-K426 WeakPolarHBondContact O-CB 3.4Å; D422-K426 WeakPolarHBondContact O-CG 3.49Å; D422-K426 PolarHBondContact O-N 3.08Å; D422-K426 IonicContact OD1-NZ 3.48Å; D422-K426 VanDerWaalsContact OD2-CE 3.25Å; D422-K426 WeakPolarHBondContact OD2-CE 3.4Å; D422-K426 IonicContact OD2-NZ 3.6Å; D422-K426 PolarHBondContact OD2-NZ 3.27Å; L423-K426 PolarHBondContact O-N 2.81Å; K426-L429 PolarHBondContact O-N 3.3Å; K426-Q430 WeakPolarHBondContact O-CB 3.31Å; K426-Q430 PolarHBondContact O-N 3.37Å
427	T	65.9	Low	56	Low	81 Å²	81	114.7 Å²	114.7	50%	0.497	64%	0.639	S	S	.	*	H	α-helix	trans	-66.2	-40.9	-179.8	-57	0	0	0	0	112	L423 L424 G425 Q430 Q431	L423-T427 WeakPolarHBondContact O-CB 3.47Å; L423-T427 PolarHBondContact O-N 2.88Å; L423-T427 PolarHBondContact O-OG1 2.92Å; L424-T427 PolarHBondContact O-N 3.2Å; G425-T427 PolarHBondContact O-N 3.34Å; T427-Q430 PolarHBondContact O-N 2.8Å; T427-Q431 PolarHBondContact O-N 2.76Å
428	L	62	Low	56.1	Low	106 Å²	106	117.9 Å²	117.9	56%	0.555	65%	0.647	S	S	*	*	H	α-helix	trans	-66.1	-38	174	-86.6	161.1	0	0	0	112.7	L424 G425 Q430 Q431 S432	L424-L428 PolarHBondContact O-N 3.08Å; G425-L428 PolarHBondContact O-N 3.4Å; L428-Q430 VanDerWaalsContact C-N 3.33Å; L428-Q431 PolarHBondContact O-N 3.43Å; L428-S432 PolarHBondContact O-N 3.39Å; L428-S432 PolarHBondContact O-OG 3.4Å
429	L	62.6	Low	55.3	Low	130 Å²	130	118.9 Å²	118.9	68%	0.681	65%	0.648	S	S	*	*	H	α-helix	trans	-68	-33.1	175.1	-143.5	76.6	0	0	0	112.3	G425 K426 S432	G425-L429 PolarHBondContact O-N 3.17Å; G425-L429 VanDerWaalsContact O-N 3.07Å; K426-L429 PolarHBondContact O-N 3.3Å; L429-S432 PolarHBondContact O-OG 2.9Å
430	Q	55.2	Low	54.2	Low	146 Å²	146	119.7 Å²	119.7	68%	0.682	66%	0.656	S	S	*	*	H	α-helix	trans	-70.9	-35.5	175.1	-160.1	77.8	45.5	0	0	112.1	K426 T427 L428 S432	K426-Q430 WeakPolarHBondContact O-CB 3.31Å; K426-Q430 PolarHBondContact O-N 3.37Å; T427-Q430 PolarHBondContact O-N 2.8Å; L428-Q430 VanDerWaalsContact C-N 3.33Å; Q430-S432 VanDerWaalsContact C-N 3.31Å; Q430-S432 PolarHBondContact O-N 3.18Å
431	Q	53.7	Low	53	Low	162 Å²	162	121.8 Å²	121.8	76%	0.757	66%	0.663	S	S	*	*	H	α-helix	trans	-75.3	-17.1	-179.3	-167.8	178.2	93.6	0	0	113.6	T427 L428	T427-Q431 PolarHBondContact O-N 2.76Å; L428-Q431 PolarHBondContact O-N 3.43Å
432	S	46.2	Very low	51.5	Low	90 Å²	90	126.8 Å²	126.8	63%	0.629	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	7.3	-179.1	36.7	0	0	0	0	114.2	L428 L429 Q430	L428-S432 PolarHBondContact O-N 3.39Å; L428-S432 PolarHBondContact O-OG 3.4Å; L429-S432 PolarHBondContact O-OG 2.9Å; Q430-S432 VanDerWaalsContact C-N 3.31Å; Q430-S432 PolarHBondContact O-N 3.18Å
433	L	49.5	Very low	49.8	Very low	114 Å²	114	130.8 Å²	130.8	60%	0.597	69%	0.694	S	S	*	*	S	Bend	trans	-99	139	172.1	-73.3	160.9	0	0	0	111.2
434	P	44.1	Very low	48.1	Very low	105 Å²	105	133.4 Å²	133.4	68%	0.682	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-69.4	153.1	175	29.4	-34.6	0	0	0	112
435	P	47	Very low	46.1	Very low	124 Å²	124	137.5 Å²	137.5	81%	0.805	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-64.5	152.1	-172.8	24.7	-34.4	0	0	0	114.2	G437	P435-G437 VanDerWaalsContact C-N 3.34Å; P435-G437 PolarHBondContact O-N 3.11Å
436	E	40.3	Very low	44.3	Very low	191 Å²	191	143.3 Å²	143.3	89%	0.893	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	79.1	-176.2	-68.3	175.9	113.6	0	0	113.5
437	G	46.1	Very low	42.5	Very low	67 Å²	67	143.2 Å²	143.2	69%	0.691	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.8	-20.5	168.9	0	0	0	0	0	114.7	P435	P435-G437 VanDerWaalsContact C-N 3.34Å; P435-G437 PolarHBondContact O-N 3.11Å
438	L	43.1	Very low	41	Very low	173 Å²	173	148.7 Å²	148.7	91%	0.906	76%	0.764	S	S	*	*			trans	-142	66	-173.8	-69	173.1	0	0	0	111.8
439	Q	34.8	Very low	39.9	Very low	160 Å²	160	149.1 Å²	149.1	75%	0.748	77%	0.773	S	S	*	*			trans	-104.6	113.8	165.4	-70.6	-169.1	19.5	0	0	110.7
440	V	34.5	Very low	39.1	Very low	121 Å²	121	148.6 Å²	148.6	73%	0.733	78%	0.775	S	S	*	*			trans	-81.1	121.3	166.7	176.6	0	0	0	0	108	W442	V440-W442 PolarHBondContact O-N 3.34Å
441	K	31.7	Very low	38.2	Very low	196 Å²	196	150.5 Å²	150.5	85%	0.852	79%	0.789	S	S	*	*			trans	-61.1	126.9	176.8	-77.3	-177.2	171.1	-175.6	0	111
442	W	31.1	Very low	37.7	Very low	236 Å²	236	153.6 Å²	153.6	89%	0.894	79%	0.794	S	S	*	*			trans	-114.7	121.3	157.6	-74.3	97.5	0	0	0	108.9	V440	V440-W442 PolarHBondContact O-N 3.34Å
443	D	27.3	Very low	37.4	Very low	163 Å²	163	156.1 Å²	156.1	87%	0.872	80%	0.801	S	S	*	*			trans	-74.7	147.4	-174.9	-130.7	-52.4	0	0	0	111.7
444	K	30.1	Very low	36.8	Very low	166 Å²	166	159.1 Å²	159.1	72%	0.722	82%	0.817	S	S	*	*			trans	-110.4	108.4	-166.8	179.6	-175.9	179.2	179.9	0	110.1
445	Q	26.9	Very low	36.6	Very low	195 Å²	195	163.1 Å²	163.1	91%	0.911	83%	0.826	S	S	*	*			trans	-126.7	111.7	168	-159.4	161	-43.9	0	0	112.2
446	Q	31.1	Very low	35.8	Very low	164 Å²	164	162.6 Å²	162.6	77%	0.766	83%	0.825	S	S	*	*			trans	-81.2	141.2	174.2	-64.3	168.4	-82.2	0	0	110.5
447	S	30.3	Very low	35.2	Very low	117 Å²	117	162.8 Å²	162.8	82%	0.818	82%	0.823	S	S	*	*			trans	-156.4	138.4	141.2	52.6	0	0	0	0	110.7
448	K	34.5	Very low	34.3	Very low	197 Å²	197	165.2 Å²	165.2	86%	0.857	83%	0.83	S	S	*	*			trans	-91.5	131.1	170.2	-68.7	176.4	174.6	179.9	0	108.2
449	P	37.8	Very low	33.4	Very low	115 Å²	115	160.4 Å²	160.4	75%	0.747	82%	0.822	S	S	*	*			trans	-81.4	146.7	160.7	32.3	-29.8	0	0	0	110.2
450	T	45.5	Very low	33.1	Very low	118 Å²	118	160.3 Å²	160.3	72%	0.724	83%	0.825	S	S	*	*			trans	-115	166.4	172.5	48.7	0	0	0	0	110.2	R452	T450-R452 PolarHBondContact O-N 3.46Å
451	L	36.6	Very low	32.6	Very low	186 Å²	186	161.1 Å²	161.1	97%	0.974	83%	0.825	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	58.6	-169.9	-82.4	163.4	0	0	0	115.3
452	R	44	Very low	32.3	Very low	227 Å²	227	157.6 Å²	157.6	86%	0.857	82%	0.82	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137	-9.1	175.1	-107.7	178.3	177	158.6	0.4	117.1	T450	T450-R452 PolarHBondContact O-N 3.46Å
453	D	38.5	Very low	32	Very low	144 Å²	144	152 Å²	152	77%	0.77	82%	0.817	S	S	*	*	S	Bend	trans	-94.8	3.5	-173.2	-71.5	-35.6	0	0	0	116.2
454	L	37.7	Very low	31.9	Very low	177 Å²	177	148.7 Å²	148.7	93%	0.927	81%	0.812	S	S	*	*	S	Bend	trans	-101.4	18.5	-177.5	-90.3	165.9	0	0	0	115.4
455	Q	39.2	Very low	32.1	Very low	189 Å²	189	146.8 Å²	146.8	88%	0.883	82%	0.817	S	S	*	*			trans	-133.9	76.1	174.1	-82.4	-171	-30.7	0	0	113.5
456	S	30.5	Very low	32	Very low	113 Å²	113	141.6 Å²	141.6	79%	0.79	81%	0.807	S	S	*	*			trans	-163.1	132.7	144.7	54.4	0	0	0	0	114.1
457	K	27.3	Very low	31.8	Very low	194 Å²	194	140.8 Å²	140.8	84%	0.843	81%	0.813	S	S	*	*			trans	45.8	116.7	157	-67.1	177.3	175.4	177.8	0	119.2
458	S	26.9	Very low	31.6	Very low	119 Å²	119	141 Å²	141	83%	0.832	81%	0.81	S	S	*	*				72.1	91.2	64.1	-56.6	0	0	0	0	115.8
459	G	25.3	Very low	31.1	Very low	72 Å²	72	135.6 Å²	135.6	74%	0.742	80%	0.801	S	S	*	*			trans	67.2	131	132.8	0	0	0	0	0	121.9
460	I	27.8	Very low	30.5	Very low	158 Å²	158	138.4 Å²	138.4	81%	0.81	81%	0.809	S	S	*	*				175.6	138.6	120	-88.8	156.6	0	0	0	111.3
461	N	25.3	Very low	29.5	Very low	138 Å²	138	137.4 Å²	137.4	74%	0.738	81%	0.813	S	S	*	*			trans	-1.6	163.1	154.9	-45.3	-15.1	0	0	0	120.5
462	T	24.2	Very low	29	Very low	122 Å²	122	133.7 Å²	133.7	75%	0.748	81%	0.809	S	S	*	*			cis	-170.6	163	33.4	-26.5	0	0	0	0	113.4
463	S	24.6	Very low	28.1	Very low	119 Å²	119	130.1 Å²	130.1	83%	0.832	81%	0.807	S	S	*	*			trans	87	140.7	143.8	75.1	0	0	0	0	121.6
464	A	25.9	Very low	28.6	Very low	92 Å²	92	128 Å²	128	76%	0.76	80%	0.801	S	S	*	*			trans	-121.2	175	174.6	0	0	0	0	0	110.2
465	P	33.6	Very low	28	Very low	127 Å²	127	125.4 Å²	125.4	83%	0.825	80%	0.797	S	S	*	*				-140.2	169.3	119.4	36.2	-24.1	0	0	0	112.2
466	A	26.3	Very low	27.6	Very low	86 Å²	86	121 Å²	121	71%	0.711	79%	0.793	S	S	*	*			cis	159.9	118.1	-23.7	0	0	0	0	0	106.7
467	V	26.8	Very low	27.4	Very low	147 Å²	147	121.9 Å²	121.9	89%	0.891	80%	0.799	S	S	*	*			trans	165.9	157.3	157.5	-85.6	0	0	0	0	107.3
468	V	26	Very low	27.5	Very low	122 Å²	122	117.3 Å²	117.3	74%	0.739	79%	0.792	S	S	*	*			cis	-149.9	113.3	-29.9	132	0	0	0	0	102.7
469	A	23.9	Very low	27.6	Very low	83 Å²	83	119.9 Å²	119.9	69%	0.686	80%	0.796	S	S	*	*				70.7	127	79.4	0	0	0	0	0	115
470	L	24.6	Very low	27.6	Very low	173 Å²	173	120.3 Å²	120.3	91%	0.906	80%	0.8	S	S	*	*			trans	124.9	87.6	166.7	-71.8	157.9	0	0	0	111.5
471	A	24.4	Very low	27.6	Very low	97 Å²	97	116 Å²	116	80%	0.802	80%	0.795	S	S	*	*				88.7	106.9	59.9	0	0	0	0	0	114.2
472	A	26.3	Very low	27.7	Very low	108 Å²	108	115.7 Å²	115.7	89%	0.893	80%	0.798	S	S	*	*			trans	-151.5	123.8	147	0	0	0	0	0	107.7
473	D	24.9	Very low	27.9	Very low	153 Å²	153	116.9 Å²	116.9	82%	0.818	80%	0.799	S	S	*	*			trans	-130.5	-168.8	-172.1	-156.8	35.1	0	0	0	106.5
474	P	48.6	Very low	28.4	Very low	99 Å²	99	119 Å²	119	64%	0.643	80%	0.8	S	S	*	*				-115	176.7	-72.9	33.3	-20.6	0	0	0	112.3
475	S	26	Very low	28.5	Very low	122 Å²	122	122.3 Å²	122.3	85%	0.853	81%	0.805	S	S	*	*				-173.9	124.4	126.4	35.2	0	0	0	0	112
476	A	31.4	Very low	28.4	Very low	96 Å²	96	125.5 Å²	125.5	79%	0.793	81%	0.806	S	S	*	*			trans	-85.8	156.9	170.6	0	0	0	0	0	110.9
477	S	26	Very low	28.4	Very low	132 Å²	132	126.7 Å²	126.7	92%	0.923	81%	0.809	S	S	*	*			trans	-152.4	143.9	149.1	-82.5	0	0	0	0	110.1
478	S	28	Very low	28.8	Very low	98 Å²	98	125.2 Å²	125.2	69%	0.685	80%	0.802	S	S	*	*			trans	-113.8	158.9	-163.9	63.4	0	0	0	0	112.6
479	L	30.4	Very low	28.9	Very low	174 Å²	174	124 Å²	124	91%	0.911	81%	0.805	S	S	*	*			trans	68.3	128.9	157	-60.2	160.9	0	0	0	117.3
480	G	24.5	Very low	29.3	Very low	81 Å²	81	129.3 Å²	129.3	84%	0.835	82%	0.815	S	S	*	*			trans	165.7	109.8	167.2	0	0	0	0	0	112.6
481	G	28.1	Very low	29.7	Very low	68 Å²	68	125.7 Å²	125.7	70%	0.701	81%	0.811	S	S	*	*			trans	-81	-176.7	-167.5	0	0	0	0	0	118.1
482	T	27.8	Very low	30.5	Very low	131 Å²	131	124.7 Å²	124.7	80%	0.804	80%	0.802	S	S	*	*			trans	73.1	120.4	154.7	48.9	0	0	0	0	121.4
483	L	29	Very low	31.4	Very low	147 Å²	147	128.5 Å²	128.5	77%	0.77	80%	0.801	S	S	*	*			trans	76.6	120.2	136	-67.2	168.3	0	0	0	120.7
484	L	34.7	Very low	33.2	Very low	162 Å²	162	123.1 Å²	123.1	85%	0.848	77%	0.774	S	S	*	*			trans	60.1	98.6	141.8	-59.3	169.8	0	0	0	118.3
485	D	26.4	Very low	34.2	Very low	163 Å²	163	121.8 Å²	121.8	87%	0.872	77%	0.767	S	S	*	*				-147.9	163.9	123.6	-158.2	10.2	0	0	0	111.7
486	K	33.5	Very low	36.5	Very low	193 Å²	193	116.6 Å²	116.6	84%	0.839	73%	0.73	S	S	*	*			trans	-128.2	99.2	-162.5	-173.7	-176.1	-175.2	-176.7	0	110.1
487	S	26	Very low	38.4	Very low	111 Å²	111	115.2 Å²	115.2	78%	0.776	72%	0.718	S	S	*	*			trans	-155.2	163.3	173.9	-95.3	0	0	0	0	112.1
488	P	35	Very low	40.5	Very low	116 Å²	116	116.5 Å²	116.5	75%	0.753	72%	0.715	S	S	*	*				-99.1	163.8	-125	36	-39.5	0	0	0	116.6
489	A	26.7	Very low	42.9	Very low	96 Å²	96	112.5 Å²	112.5	79%	0.793	69%	0.686	S	S	*	*			trans	47.4	99.2	154.3	0	0	0	0	0	117.3	A491	A489-A491 PolarHBondContact O-N 3Å
490	H	32.5	Very low	45.4	Very low	195 Å²	195	110.6 Å²	110.6	90%	0.903	67%	0.671	S	S	*	*			trans	-54.8	121.3	158.2	-77.4	-82.5	0	0	0	110.3	A492	H490-A492 PolarHBondContact O-N 3.46Å
491	A	33.7	Very low	48.2	Very low	98 Å²	98	107.4 Å²	107.4	81%	0.81	64%	0.635	S	S	*	*			trans	-65.5	115.2	158.8	0	0	0	0	0	107.8	A489 E493	A489-A491 PolarHBondContact O-N 3Å; A491-E493 PolarHBondContact O-N 3.11Å
492	A	41.6	Very low	50.8	Low	75 Å²	75	107.2 Å²	107.2	62%	0.62	62%	0.621	S	S	*	*			trans	-71.2	123.6	176.4	0	0	0	0	0	109.6	H490 V494	H490-A492 PolarHBondContact O-N 3.46Å; A492-V494 WeakPolarHBondContact O-CG2 3.39Å; A492-V494 PolarHBondContact O-N 3.12Å
493	E	45.3	Very low	53.3	Low	188 Å²	188	105 Å²	105	88%	0.879	60%	0.604	S	S	*	*			trans	-65.1	119.5	175	-69.7	-171.8	138.6	0	0	110.3	A491 S495	A491-E493 PolarHBondContact O-N 3.11Å; E493-S495 PolarHBondContact O-N 2.83Å
494	V	62.3	Low	55.8	Low	40 Å²	40	107.3 Å²	107.3	24%	0.242	61%	0.611	C	S	.	*			trans	-83.3	58.6	-172.3	-159.7	0	0	0	0	111.4	A492 A598 P600	A492-V494 WeakPolarHBondContact O-CG2 3.39Å; A492-V494 PolarHBondContact O-N 3.12Å; V494-A598 HydrophobicContact CG1-CB 3.46Å; V494-A598 VanDerWaalsContact CG1-CB 3.46Å; V494-P600 HydrophobicContact CG1-CG 4.26Å; V494-P600 HydrophobicContact CG2-CG 3.8Å
495	S	69.4	Low	58.1	Low	71 Å²	71	102.9 Å²	102.9	50%	0.497	59%	0.594	S	S	.	*			trans	-74.1	131.3	177.6	-173.2	0	0	0	0	111.8	E493 A497	E493-S495 PolarHBondContact O-N 2.83Å; S495-A497 PolarHBondContact OG-N 3.01Å
496	L	74.6	Confident	60.9	Low	14 Å²	14	96.5 Å²	96.5	7%	0.073	56%	0.559	C	S	.	*			trans	-112.2	5.9	171.9	-81.2	174.4	0	0	0	112.6	D498 V499 V539 G568 K570 L596 A598	L496-D498 VanDerWaalsContact C-N 3.3Å; L496-D498 PolarHBondContact O-N 3.28Å; L496-V499 HydrophobicContact CD2-CB 4.14Å; L496-V499 HydrophobicContact CD2-CG2 3.94Å; L496-V499 PolarHBondContact O-N 3.2Å; L496-V539 HydrophobicContact CD2-CG2 3.9Å; L496-G568 WeakPolarHBondContact CD1-O 3.16Å; L496-K570 HydrophobicContact CB-CB 3.91Å; L496-K570 HydrophobicContact CB-CD 3.97Å; L496-K570 HydrophobicContact CD1-CB 3.85Å; L496-K570 WeakPolarHBondContact O-CD 3.27Å; L496-K570 PolarHBondContact O-NZ 3.16Å; L496-L596 HydrophobicContact CD1-CB 4.33Å; L496-A598 HydrophobicContact CD1-CB 3.91Å; L496-A598 HydrophobicContact CD2-CB 3.96Å; L496-A598 HydrophobicContact CG-CB 3.92Å
497	A	70.6	Confident	63.4	Low	67 Å²	67	92.8 Å²	92.8	55%	0.554	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-46	-172.5	0	0	0	0	0	112.6	S495 K570	S495-A497 PolarHBondContact OG-N 3.01Å; A497-K570 PolarHBondContact O-NZ 3Å
498	D	70.6	Confident	66.3	Low	159 Å²	159	92.8 Å²	92.8	85%	0.85	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-3.9	-173.6	-50.1	-53.2	0	0	0	114.4	L496 F500	L496-D498 VanDerWaalsContact C-N 3.3Å; L496-D498 PolarHBondContact O-N 3.28Å; D498-F500 PolarHBondContact O-N 3.46Å
499	V	78.9	Confident	68.9	Low	14 Å²	14	88.3 Å²	88.3	9%	0.085	51%	0.512	C	S	.	.			trans	-87.7	112.8	-178.1	-172.4	0	0	0	0	110.4	L496 V501 P533 R536 K570 L596	L496-V499 HydrophobicContact CD2-CB 4.14Å; L496-V499 HydrophobicContact CD2-CG2 3.94Å; L496-V499 PolarHBondContact O-N 3.2Å; V499-V501 HydrophobicContact CG1-CG2 4.4Å; V499-P533 HydrophobicContact CG1-CB 4.34Å; V499-P533 HydrophobicContact CG1-CG 4.23Å; V499-R536 HydrophobicContact CG2-CG 4.11Å; V499-K570 PolarHBondContact O-NZ 3.22Å; V499-L596 HydrophobicContact CB-CD1 4.27Å; V499-L596 HydrophobicContact CG1-CD1 3.9Å
500	F	81.8	Confident	71.7	Confident	134 Å²	134	88.7 Å²	88.7	59%	0.588	51%	0.509	S	S	*	.			trans	-124.6	135.1	170.2	-176.3	-91.7	0	0	0	109.1	D498 P502 Q572	D498-F500 PolarHBondContact O-N 3.46Å; F500-P502 HydrophobicContact CD1-CG 4.23Å; F500-P502 HydrophobicContact CE1-CB 4.45Å; F500-P502 HydrophobicContact CE1-CG 4.06Å; F500-Q572 HydrophobicContact CD2-CG 4.41Å
501	V	83.6	Confident	74.4	Confident	14 Å²	14	82.8 Å²	82.8	9%	0.085	48%	0.483	C	S	.	.			trans	-123.8	109.4	-178.4	-177.7	0	0	0	0	107.7	V499 I506 P533 V541 Q572 I594 L596	V499-V501 HydrophobicContact CG1-CG2 4.4Å; V501-I506 HydrophobicContact CG1-CD1 4.04Å; V501-I506 HydrophobicContact CG1-CG1 3.72Å; V501-P533 HydrophobicContact CG2-CB 4.39Å; V501-P533 HydrophobicContact CG2-CG 3.88Å; V501-V541 HydrophobicContact CG1-CG1 4.33Å; V501-V541 HydrophobicContact CG2-CG2 4.26Å; V501-Q572 PolarHBondContact O-NE2 3.29Å; V501-Q572 PolarHBondContact O-OE1 3.46Å; V501-I594 WeakPolarHBondContact O-CD1 3.34Å; V501-L596 HydrophobicContact CB-CD2 4.47Å; V501-L596 HydrophobicContact CG2-CD2 3.83Å
502	P	83.1	Confident	77	Confident	63 Å²	63	85.2 Å²	85.2	41%	0.409	48%	0.482	S	S	.	.			trans	-64.2	138.7	175	-20.1	31.7	0	0	0	111.4	F500 E504 S505	F500-P502 HydrophobicContact CD1-CG 4.23Å; F500-P502 HydrophobicContact CE1-CB 4.45Å; F500-P502 HydrophobicContact CE1-CG 4.06Å; P502-E504 PolarHBondContact O-N 2.94Å; P502-S505 WeakPolarHBondContact O-CB 3.49Å; P502-S505 PolarHBondContact O-N 2.79Å; P502-S505 PolarHBondContact O-OG 3.39Å
503	L	79.6	Confident	79.5	Confident	84 Å²	84	84.4 Å²	84.4	44%	0.44	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-54.7	-39.6	-178.9	-173.1	64.6	0	0	0	112.6	S505 I506 I543 I594	L503-S505 PolarHBondContact O-N 3.27Å; L503-I506 HydrophobicContact CD1-CD1 4.34Å; L503-I506 PolarHBondContact O-N 3.1Å; L503-I543 HydrophobicContact CD1-CG2 4.44Å; L503-I594 HydrophobicContact CB-CD1 4.2Å; L503-I594 HydrophobicContact CD1-CD1 4.24Å; L503-I594 HydrophobicContact CD1-CG1 4.37Å
504	E	81.7	Confident	81.8	Confident	197 Å²	197	76.7 Å²	76.7	92%	0.921	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-62.1	-23	178.4	-62.3	171.6	-170.5	0	0	114.1	P502	P502-E504 PolarHBondContact O-N 2.94Å
505	S	83.7	Confident	83.3	Confident	69 Å²	69	78.6 Å²	78.6	48%	0.483	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-86.2	-9.6	-179	70.5	0	0	0	0	113.8	P502 L503	P502-S505 WeakPolarHBondContact O-CB 3.49Å; P502-S505 PolarHBondContact O-N 2.79Å; P502-S505 PolarHBondContact O-OG 3.39Å; L503-S505 PolarHBondContact O-N 3.27Å
506	I	85.6	Confident	84.5	Confident	28 Å²	28	76 Å²	76	14%	0.144	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-85.9	117.5	-172	-54.4	176.7	0	0	0	110.3	V501 L503 A529 V541 I543 I594	V501-I506 HydrophobicContact CG1-CD1 4.04Å; V501-I506 HydrophobicContact CG1-CG1 3.72Å; L503-I506 HydrophobicContact CD1-CD1 4.34Å; L503-I506 PolarHBondContact O-N 3.1Å; I506-A529 HydrophobicContact CG2-CB 3.48Å; I506-A529 VanDerWaalsContact CG2-CB 3.48Å; I506-V541 HydrophobicContact CD1-CG1 3.79Å; I506-V541 HydrophobicContact CG1-CG1 4.39Å; I506-I543 HydrophobicContact CB-CD1 4.4Å; I506-I543 HydrophobicContact CD1-CD1 4.34Å; I506-I543 HydrophobicContact CD1-CG1 3.99Å; I506-I543 HydrophobicContact CG2-CD1 3.82Å; I506-I543 HydrophobicContact CG2-CG1 4.36Å; I506-I594 HydrophobicContact CD1-CD1 3.87Å; I506-I594 HydrophobicContact CD1-CG1 4.18Å; I506-I594 HydrophobicContact CD1-CG2 4.49Å
507	K	85.8	Confident	85.5	Confident	115 Å²	115	76.4 Å²	76.4	50%	0.5	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-83.5	136.9	169.2	-55.1	-162.6	-160.3	92.4	0	110.6	A529 R530 D531	K507-A529 WeakPolarHBondContact O-CA 3.43Å; K507-R530 HydrophobicContact CB-CB 4.26Å; K507-R530 PolarHBondContact O-N 3.45Å; K507-D531 WeakPolarHBondContact CD-OD2 3.47Å; K507-D531 WeakPolarHBondContact CG-OD2 3.11Å; K507-D531 IonicContact NZ-OD2 3.63Å; K507-D531 PolarHBondContact NZ-OD2 2.87Å
508	P	85.9	Confident	86.6	Confident	111 Å²	111	78.2 Å²	78.2	72%	0.721	43%	0.43	S	S	*	.	B	Isolated β-bridge	trans	-65.9	140.8	174.9	28.4	-34.5	0	0	0	110.8	R530	P508-R530 WeakPolarHBondContact O-CB 3.16Å
509	S	90.4	Very high	87.6	Confident	23 Å²	23	71.6 Å²	71.6	16%	0.161	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-76.4	171.9	169.9	61.6	0	0	0	0	112.6	L511 F528 L638	S509-L511 PolarHBondContact OG-N 3.21Å; S509-F528 WeakPolarHBondContact CB-O 3.46Å; S509-F528 PolarHBondContact N-O 3.19Å; S509-F528 PolarHBondContact OG-O 3.13Å; S509-L638 VanDerWaalsContact CA-O 3.27Å; S509-L638 WeakPolarHBondContact CA-O 3.24Å; S509-L638 VanDerWaalsContact CB-C 3.41Å; S509-L638 WeakPolarHBondContact CB-O 3.39Å; S509-L638 WeakPolarHBondContact CB-OXT 3.36Å
510	S	85.4	Confident	88.2	Confident	104 Å²	104	75.1 Å²	75.1	73%	0.727	41%	0.414	S	S	*	.	S	Bend	trans	-77.1	-7.9	169.4	68.7	0	0	0	0	113.9	L638	S510-L638 WeakPolarHBondContact CB-OXT 3.09Å; S510-L638 PolarHBondContact N-O 3.43Å; S510-L638 PolarHBondContact N-OXT 3.18Å; S510-L638 PolarHBondContact OG-OXT 3.35Å
511	L	88.5	Confident	88.6	Confident	70 Å²	70	71.8 Å²	71.8	37%	0.366	41%	0.408	S	S	.	.	S	Bend	trans	-80.6	143.2	-173	-59.4	-176.5	0	0	0	112.7	S509 F528 P630 L638	S509-L511 PolarHBondContact OG-N 3.21Å; L511-F528 HydrophobicContact CB-CD2 4.19Å; L511-F528 HydrophobicContact CD1-CB 4.39Å; L511-F528 HydrophobicContact CD1-CD2 4.08Å; L511-F528 HydrophobicContact CD1-CG 4.43Å; L511-P630 HydrophobicContact CD1-CB 3.8Å; L511-P630 HydrophobicContact CD1-CG 3.52Å; L511-L638 HydrophobicContact CD1-CB 4.24Å; L511-L638 HydrophobicContact CD1-CD1 4.24Å; L511-L638 HydrophobicContact CD1-CD2 4.15Å; L511-L638 HydrophobicContact CD1-CG 4.46Å; L511-L638 HydrophobicContact CG-CB 4.49Å
512	L	89.3	Confident	89.1	Confident	150 Å²	150	71.1 Å²	71.1	79%	0.785	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-65.1	138.4	172.5	-65	178	0	0	0	110.6	I514	L512-I514 PolarHBondContact O-N 2.76Å
513	P	92.8	Very high	89.7	Confident	58 Å²	58	73.2 Å²	73.2	38%	0.377	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-63.4	135.9	172.8	-19.2	32.2	0	0	0	110.6	F526 H527	P513-F526 CarbonylContact C-O 3.58Å; P513-F526 WeakPolarHBondContact CA-O 3.2Å; P513-H527 VanDerWaalsContact CG-ND1 3.34Å; P513-H527 WeakPolarHBondContact CG-ND1 3.47Å
514	I	94.5	Very high	90.5	Very high	26 Å²	26	69.2 Å²	69.2	13%	0.133	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	139.1	176.2	62.8	168.7	0	0	0	110.6	L512 V516 L525 F526 F528 V626 Q628	L512-I514 PolarHBondContact O-N 2.76Å; I514-V516 HydrophobicContact CD1-CG2 4.3Å; I514-V516 HydrophobicContact CG1-CG2 4.24Å; I514-V516 PolarHBondContact O-N 2.74Å; I514-L525 CarbonylContact O-C 3.57Å; I514-L525 WeakPolarHBondContact O-CA 3.46Å; I514-F526 HydrophobicContact CD1-CB 4.3Å; I514-F526 HydrophobicContact CD1-CD2 4.25Å; I514-F526 HydrophobicContact CG1-CB 3.74Å; I514-F526 HydrophobicContact CG1-CG 4.48Å; I514-F526 PolarHBondContact N-O 2.65Å; I514-F526 PolarHBondContact O-N 3.38Å; I514-F528 HydrophobicContact CD1-CE2 4.43Å; I514-F528 HydrophobicContact CD1-CZ 3.83Å; I514-F528 HydrophobicContact CG1-CE2 4.19Å; I514-F528 HydrophobicContact CG1-CZ 3.97Å; I514-F528 HydrophobicContact CG2-CE2 4.24Å; I514-V626 HydrophobicContact CD1-CG1 3.55Å; I514-Q628 HydrophobicContact CD1-CB 4.46Å
515	T	94.4	Very high	91.2	Very high	79 Å²	79	60.5 Å²	60.5	49%	0.485	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	114.7	171.7	-55.2	0	0	0	0	109.2	D518 R523	T515-D518 HydrophobicContact CG2-CB 3.84Å; T515-R523 HydrophobicContact CG2-CG 4.08Å
516	V	93.8	Very high	91.8	Very high	17 Å²	17	57.2 Å²	57.2	10%	0.103	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-35.4	-179.3	170.9	0	0	0	0	111.2	I514 V524 F526 Y609 V626	I514-V516 HydrophobicContact CD1-CG2 4.3Å; I514-V516 HydrophobicContact CG1-CG2 4.24Å; I514-V516 PolarHBondContact O-N 2.74Å; V516-V524 HydrophobicContact CB-CG1 4.48Å; V516-V524 PolarHBondContact N-O 2.95Å; V516-F526 HydrophobicContact CB-CD1 4.39Å; V516-F526 HydrophobicContact CB-CE1 4.33Å; V516-F526 HydrophobicContact CG1-CE1 4.27Å; V516-F526 HydrophobicContact CG1-CZ 4.27Å; V516-F526 HydrophobicContact CG2-CB 4.15Å; V516-F526 HydrophobicContact CG2-CD1 3.57Å; V516-F526 HydrophobicContact CG2-CD2 3.65Å; V516-F526 HydrophobicContact CG2-CE1 3.78Å; V516-F526 HydrophobicContact CG2-CE2 3.87Å; V516-F526 HydrophobicContact CG2-CG 3.5Å; V516-F526 HydrophobicContact CG2-CZ 3.94Å; V516-Y609 HydrophobicContact CG1-CD1 3.55Å; V516-Y609 HydrophobicContact CG1-CE1 3.33Å; V516-Y609 HydrophobicContact CG1-CE2 4.41Å; V516-Y609 HydrophobicContact CG1-CG 4.16Å; V516-Y609 PolarHBondContact O-OH 3.33Å; V516-V626 HydrophobicContact CB-CG2 4.3Å; V516-V626 HydrophobicContact CG1-CG2 3.65Å; V516-V626 HydrophobicContact CG2-CG2 3.88Å
517	F	94.9	Very high	92.3	Very high	23 Å²	23	58.8 Å²	58.8	10%	0.101	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	138.7	175.6	178.8	-100.8	0	0	0	109.3	G519 L522 R523 V524 Y609 L611 F613 E622	F517-G519 VanDerWaalsContact CE1-O 3.3Å; F517-G519 WeakPolarHBondContact CE1-O 3.18Å; F517-L522 WeakPolarHBondContact CD1-O 3.29Å; F517-L522 HydrophobicContact CE1-CB 4.46Å; F517-L522 WeakPolarHBondContact CE1-O 3.46Å; F517-R523 CarbonylContact O-C 3.4Å; F517-R523 WeakPolarHBondContact O-CA 3.37Å; F517-V524 HydrophobicContact CB-CB 4.08Å; F517-V524 HydrophobicContact CB-CG2 4.21Å; F517-V524 HydrophobicContact CD1-CG2 4.39Å; F517-V524 PolarHBondContact N-O 3.23Å; F517-V524 PolarHBondContact O-N 3.02Å; F517-Y609 HydrophobicContact CB-CE2 4.41Å; F517-L611 HydrophobicContact CB-CD2 4.27Å; F517-L611 HydrophobicContact CD1-CD2 3.46Å; F517-L611 VanDerWaalsContact CD1-CD2 3.46Å; F517-L611 HydrophobicContact CE1-CD2 3.87Å; F517-L611 HydrophobicContact CG-CD2 3.84Å; F517-F613 HydrophobicContact CE1-CE1 4.35Å; F517-F613 HydrophobicContact CE1-CZ 4.49Å; F517-E622 HydrophobicContact CD2-CB 4.24Å; F517-E622 HydrophobicContact CE2-CB 3.71Å; F517-E622 HydrophobicContact CE2-CG 3.58Å; F517-E622 HydrophobicContact CZ-CB 4.24Å; F517-E622 HydrophobicContact CZ-CG 3.77Å
518	D	94.4	Very high	92.7	Very high	105 Å²	105	53.7 Å²	53.7	56%	0.561	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.6	103.1	169.9	-158.3	-23.4	0	0	0	107.6	T515 R523	T515-D518 HydrophobicContact CG2-CB 3.84Å; D518-R523 HydrophobicContact CB-CG 4.08Å; D518-R523 WeakPolarHBondContact OD2-CD 3.21Å
519	G	92.1	Very high	93	Very high	19 Å²	19	48.6 Å²	48.6	20%	0.196	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.5	151	-171.1	0	0	0	0	0	111.7	F517 S521 L522	F517-G519 VanDerWaalsContact CE1-O 3.3Å; F517-G519 WeakPolarHBondContact CE1-O 3.18Å; G519-S521 PolarHBondContact O-N 2.63Å; G519-S521 VanDerWaalsContact O-N 3.08Å; G519-L522 PolarHBondContact N-O 3.4Å; G519-L522 VanDerWaalsContact N-O 3.12Å; G519-L522 PolarHBondContact O-N 3.44Å
520	H	90.4	Very high	92.9	Very high	88 Å²	88	53.1 Å²	53.1	41%	0.407	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	31.6	-176.2	-52.5	-65.9	0	0	0	113.9	L522 F613 M615 H620 E622	H520-L522 PolarHBondContact O-N 2.86Å; H520-F613 HydrophobicContact CB-CE2 4.14Å; H520-F613 HydrophobicContact CB-CZ 3.97Å; H520-F613 AromaticContact CD2-CZ 3.96Å; H520-M615 WeakPolarHBondContact O-CE 3.36Å; H520-H620 AromaticContact CD2-CE1 3.87Å; H520-H620 AromaticContact CD2-ND1 3.33Å; H520-H620 PolarHBondContact CD2-ND1 3.12Å; H520-H620 VanDerWaalsContact CD2-ND1 3.33Å; H520-H620 AromaticContact CE1-CE1 3.48Å; H520-H620 PolarHBondContact CE1-CE1 3.17Å; H520-H620 VanDerWaalsContact CE1-CE1 3.48Å; H520-H620 AromaticContact CE1-ND1 3.44Å; H520-H620 PolarHBondContact CE1-ND1 2.93Å; H520-H620 AromaticContact CG-CE1 3.67Å; H520-H620 AromaticContact CG-ND1 3.6Å; H520-H620 AromaticContact ND1-CE1 3.41Å; H520-H620 PolarHBondContact ND1-CE1 2.74Å; H520-H620 AromaticContact ND1-ND1 3.66Å; H520-H620 AromaticContact NE2-CE1 3.75Å; H520-H620 AromaticContact NE2-ND1 3.21Å; H520-H620 PolarHBondContact NE2-ND1 3.31Å; H520-E622 IonicContact NE2-OE1 2.76Å
521	S	91.7	Very high	93	Very high	65 Å²	65	50.9 Å²	50.9	46%	0.455	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	12.3	-173.9	-54.4	0	0	0	0	115.7	G519 S548 S549	G519-S521 PolarHBondContact O-N 2.63Å; G519-S521 VanDerWaalsContact O-N 3.08Å; S521-S548 WeakPolarHBondContact O-CA 3.38Å; S521-S549 PolarHBondContact O-N 3.39Å
522	L	93.6	Very high	92.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.8	170.9	-176.9	71.8	0	0	0	109.2	F517 G519 H520 L579 L611 F613	F517-L522 WeakPolarHBondContact CD1-O 3.29Å; F517-L522 HydrophobicContact CE1-CB 4.46Å; F517-L522 WeakPolarHBondContact CE1-O 3.46Å; G519-L522 PolarHBondContact N-O 3.4Å; G519-L522 VanDerWaalsContact N-O 3.12Å; G519-L522 PolarHBondContact O-N 3.44Å; H520-L522 PolarHBondContact O-N 2.86Å; L522-L579 HydrophobicContact CD1-CD1 3.74Å; L522-L611 HydrophobicContact CD2-CD2 4.04Å; L522-F613 HydrophobicContact CB-CZ 4.45Å; L522-F613 HydrophobicContact CD2-CB 4.4Å; L522-F613 HydrophobicContact CD2-CD1 3.62Å; L522-F613 HydrophobicContact CD2-CD2 4.01Å; L522-F613 HydrophobicContact CD2-CE1 3.74Å; L522-F613 HydrophobicContact CD2-CE2 4.12Å; L522-F613 HydrophobicContact CD2-CG 3.75Å; L522-F613 HydrophobicContact CD2-CZ 3.98Å
523	R	95.8	Very high	92.7	Very high	107 Å²	107	41.8 Å²	41.8	40%	0.404	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.2	178.2	-164.5	173.8	82.8	-179.8	8.9	111.2	T515 F517 D518 L525 M546 L547	T515-R523 HydrophobicContact CG2-CG 4.08Å; F517-R523 CarbonylContact O-C 3.4Å; F517-R523 WeakPolarHBondContact O-CA 3.37Å; D518-R523 HydrophobicContact CB-CG 4.08Å; D518-R523 WeakPolarHBondContact OD2-CD 3.21Å; R523-L525 HydrophobicContact CG-CD2 4.41Å; R523-M546 WeakPolarHBondContact O-CA 3.18Å; R523-L547 PolarHBondContact N-O 3.1Å; R523-L547 PolarHBondContact O-N 2.86Å
524	V	96.6	Very high	91.9	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	122.6	176.1	-175.7	0	0	0	0	109.6	V516 F517 I544 S545 M546 F559 L611	V516-V524 HydrophobicContact CB-CG1 4.48Å; V516-V524 PolarHBondContact N-O 2.95Å; F517-V524 HydrophobicContact CB-CB 4.08Å; F517-V524 HydrophobicContact CB-CG2 4.21Å; F517-V524 HydrophobicContact CD1-CG2 4.39Å; F517-V524 PolarHBondContact N-O 3.23Å; F517-V524 PolarHBondContact O-N 3.02Å; V524-I544 HydrophobicContact CG1-CG2 3.5Å; V524-S545 WeakPolarHBondContact CA-O 3.41Å; V524-M546 HydrophobicContact CG1-CG 4.27Å; V524-M546 HydrophobicContact CG2-CB 4.42Å; V524-M546 HydrophobicContact CG2-CG 4.07Å; V524-F559 HydrophobicContact CG1-CE2 4.31Å; V524-L611 HydrophobicContact CG2-CD1 4.48Å; V524-L611 HydrophobicContact CG2-CD2 3.72Å
525	L	96.6	Very high	90.9	Very high	14 Å²	14	49.1 Å²	49.1	7%	0.073	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	141.6	-179.2	-58.9	164.9	0	0	0	109.9	I514 R523 I544 S545 L547	I514-L525 CarbonylContact O-C 3.57Å; I514-L525 WeakPolarHBondContact O-CA 3.46Å; R523-L525 HydrophobicContact CG-CD2 4.41Å; L525-I544 CarbonylContact O-C 3.13Å; L525-I544 WeakPolarHBondContact O-CA 3.19Å; L525-S545 PolarHBondContact N-O 3.28Å; L525-S545 PolarHBondContact O-N 2.95Å; L525-L547 HydrophobicContact CD1-CD1 3.91Å
526	F	96.3	Very high	90.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.4	164.7	-75.2	4.1	0	0	0	109.5	P513 I514 V516 F528 V542 I544 F559 L595 L607 V626	P513-F526 CarbonylContact C-O 3.58Å; P513-F526 WeakPolarHBondContact CA-O 3.2Å; I514-F526 HydrophobicContact CD1-CB 4.3Å; I514-F526 HydrophobicContact CD1-CD2 4.25Å; I514-F526 HydrophobicContact CG1-CB 3.74Å; I514-F526 HydrophobicContact CG1-CG 4.48Å; I514-F526 PolarHBondContact N-O 2.65Å; I514-F526 PolarHBondContact O-N 3.38Å; V516-F526 HydrophobicContact CB-CD1 4.39Å; V516-F526 HydrophobicContact CB-CE1 4.33Å; V516-F526 HydrophobicContact CG1-CE1 4.27Å; V516-F526 HydrophobicContact CG1-CZ 4.27Å; V516-F526 HydrophobicContact CG2-CB 4.15Å; V516-F526 HydrophobicContact CG2-CD1 3.57Å; V516-F526 HydrophobicContact CG2-CD2 3.65Å; V516-F526 HydrophobicContact CG2-CE1 3.78Å; V516-F526 HydrophobicContact CG2-CE2 3.87Å; V516-F526 HydrophobicContact CG2-CG 3.5Å; V516-F526 HydrophobicContact CG2-CZ 3.94Å; F526-F528 HydrophobicContact CB-CZ 4.34Å; F526-V542 HydrophobicContact CB-CG1 3.59Å; F526-V542 HydrophobicContact CD1-CG1 4.11Å; F526-V542 HydrophobicContact CD2-CG1 3.75Å; F526-V542 HydrophobicContact CE2-CG1 4.43Å; F526-V542 HydrophobicContact CG-CG1 3.55Å; F526-I544 HydrophobicContact CD1-CB 4.34Å; F526-I544 HydrophobicContact CD1-CG1 3.86Å; F526-I544 HydrophobicContact CD1-CG2 4.2Å; F526-I544 HydrophobicContact CE1-CB 4.33Å; F526-I544 HydrophobicContact CE1-CD1 3.79Å; F526-I544 HydrophobicContact CE1-CG1 3.62Å; F526-I544 HydrophobicContact CE1-CG2 4.05Å; F526-I544 HydrophobicContact CZ-CD1 4.38Å; F526-I544 HydrophobicContact CZ-CG1 4.49Å; F526-F559 HydrophobicContact CE1-CE1 4.3Å; F526-F559 AromaticContact CE1-CZ 3.8Å; F526-F559 HydrophobicContact CE1-CZ 3.8Å; F526-F559 HydrophobicContact CZ-CE1 4.24Å; F526-F559 AromaticContact CZ-CZ 3.77Å; F526-F559 HydrophobicContact CZ-CZ 3.77Å; F526-L595 HydrophobicContact CE2-CD2 4.02Å; F526-L595 HydrophobicContact CZ-CD2 3.88Å; F526-L607 HydrophobicContact CE2-CD2 3.72Å; F526-L607 HydrophobicContact CZ-CD2 3.9Å; F526-V626 HydrophobicContact CE2-CG1 4.48Å; F526-V626 HydrophobicContact CE2-CG2 4.34Å
527	H	94.9	Very high	89.6	Confident	60 Å²	60	52.4 Å²	52.4	28%	0.278	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.5	168.6	-53	-114.9	0	0	0	108.5	P513 V542 I543 S545	P513-H527 VanDerWaalsContact CG-ND1 3.34Å; P513-H527 WeakPolarHBondContact CG-ND1 3.47Å; H527-V542 CarbonylContact O-C 3.58Å; H527-V542 WeakPolarHBondContact O-CA 3.3Å; H527-I543 HydrophobicContact CB-CB 4.27Å; H527-I543 PolarHBondContact N-O 3.3Å; H527-I543 PolarHBondContact O-N 3.06Å; H527-S545 PolarHBondContact CD2-OG 2.58Å; H527-S545 WeakPolarHBondContact NE2-CB 3.4Å; H527-S545 PolarHBondContact NE2-OG 3.14Å
528	F	94.3	Very high	89.1	Confident	8 Å²	8	52.6 Å²	52.6	4%	0.035	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	138.3	179	-55.7	-70.4	0	0	0	110.4	S509 L511 I514 F526 L540 V542 L629 P630 L638	S509-F528 WeakPolarHBondContact CB-O 3.46Å; S509-F528 PolarHBondContact N-O 3.19Å; S509-F528 PolarHBondContact OG-O 3.13Å; L511-F528 HydrophobicContact CB-CD2 4.19Å; L511-F528 HydrophobicContact CD1-CB 4.39Å; L511-F528 HydrophobicContact CD1-CD2 4.08Å; L511-F528 HydrophobicContact CD1-CG 4.43Å; I514-F528 HydrophobicContact CD1-CE2 4.43Å; I514-F528 HydrophobicContact CD1-CZ 3.83Å; I514-F528 HydrophobicContact CG1-CE2 4.19Å; I514-F528 HydrophobicContact CG1-CZ 3.97Å; I514-F528 HydrophobicContact CG2-CE2 4.24Å; F526-F528 HydrophobicContact CB-CZ 4.34Å; F528-L540 HydrophobicContact CD1-CD1 4.31Å; F528-L540 HydrophobicContact CD1-CD2 4.06Å; F528-L540 HydrophobicContact CD1-CG 4.49Å; F528-L540 HydrophobicContact CE1-CD2 4.28Å; F528-V542 HydrophobicContact CD1-CG1 4.45Å; F528-V542 HydrophobicContact CD1-CG2 3.97Å; F528-V542 HydrophobicContact CE1-CG1 4.31Å; F528-V542 HydrophobicContact CE1-CG2 4.05Å; F528-L629 HydrophobicContact CE1-CD2 3.74Å; F528-L629 HydrophobicContact CZ-CD2 4.07Å; F528-P630 HydrophobicContact CB-CG 4.32Å; F528-P630 HydrophobicContact CD1-CG 3.65Å; F528-P630 HydrophobicContact CD2-CG 3.82Å; F528-P630 VanDerWaalsContact CE1-CD 3.45Å; F528-P630 HydrophobicContact CE1-CG 3.9Å; F528-P630 HydrophobicContact CE2-CG 4.04Å; F528-P630 HydrophobicContact CG-CG 3.62Å; F528-P630 HydrophobicContact CZ-CG 4.08Å; F528-L638 HydrophobicContact CB-CD1 4.12Å
529	A	92.4	Very high	88.9	Confident	4 Å²	4	47.6 Å²	47.6	3%	0.033	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-73.3	147.6	169.1	0	0	0	0	0	110.7	I506 K507 V541	I506-A529 HydrophobicContact CG2-CB 3.48Å; I506-A529 VanDerWaalsContact CG2-CB 3.48Å; K507-A529 WeakPolarHBondContact O-CA 3.43Å; A529-V541 HydrophobicContact CB-CB 3.7Å; A529-V541 HydrophobicContact CB-CG1 4.26Å; A529-V541 WeakPolarHBondContact CB-O 3.08Å; A529-V541 PolarHBondContact N-O 3.46Å
530	R	88.8	Confident	88.9	Confident	119 Å²	119	46.8 Å²	46.8	45%	0.449	25%	0.251	S	S	.	.	S	Bend	trans	-66.7	-50.9	171	174.2	163.2	-175.5	-177.8	4	112.1	K507 P508 G636 N637 L638	K507-R530 HydrophobicContact CB-CB 4.26Å; K507-R530 PolarHBondContact O-N 3.45Å; P508-R530 WeakPolarHBondContact O-CB 3.16Å; R530-G636 CarbonylContact O-C 3.52Å; R530-N637 PolarHBondContact O-N 2.93Å; R530-L638 WeakPolarHBondContact CA-O 3.28Å; R530-L638 WeakPolarHBondContact CB-O 3.31Å; R530-L638 WeakPolarHBondContact CG-O 3.39Å; R530-L638 PolarHBondContact O-N 2.7Å; R530-L638 VanDerWaalsContact O-N 3.17Å
531	D	86.9	Confident	89	Confident	56 Å²	56	42.7 Å²	42.7	30%	0.299	23%	0.232	S	C	.	.	S	Bend	trans	-97.5	143.8	-172.8	-54.5	-47.1	0	0	0	111	K507	K507-D531 WeakPolarHBondContact CD-OD2 3.47Å; K507-D531 WeakPolarHBondContact CG-OD2 3.11Å; K507-D531 IonicContact NZ-OD2 3.63Å; K507-D531 PolarHBondContact NZ-OD2 2.87Å
532	S	86.4	Confident	89.2	Confident	20 Å²	20	39.6 Å²	39.6	14%	0.14	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-85.3	158.8	167.5	-74.4	0	0	0	0	110.4	V539 G636	S532-V539 VanDerWaalsContact CB-O 3.29Å; S532-V539 WeakPolarHBondContact CB-O 3.32Å; S532-V539 PolarHBondContact OG-O 3Å; S532-G636 WeakPolarHBondContact OG-CA 3.45Å; S532-G636 PolarHBondContact OG-N 2.98Å
533	P	85.1	Confident	89.3	Confident	10 Å²	10	41 Å²	41	7%	0.065	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-55.8	134.1	176.5	-23	34.7	0	0	0	110.8	V499 V501 S535 R536 V539 V541	V499-P533 HydrophobicContact CG1-CB 4.34Å; V499-P533 HydrophobicContact CG1-CG 4.23Å; V501-P533 HydrophobicContact CG2-CB 4.39Å; V501-P533 HydrophobicContact CG2-CG 3.88Å; P533-S535 PolarHBondContact O-N 3.36Å; P533-R536 CarbonylContact O-C 3.59Å; P533-R536 PolarHBondContact O-N 3.08Å; P533-V539 WeakPolarHBondContact CD-O 3.26Å; P533-V539 HydrophobicContact CG-CB 4.11Å; P533-V539 HydrophobicContact CG-CG1 3.91Å; P533-V541 HydrophobicContact CG-CG2 3.87Å
534	P	75.1	Confident	89.3	Confident	146 Å²	146	35.9 Å²	35.9	95%	0.948	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-22.4	-173.1	-28.6	35.2	0	0	0	115.4
535	S	74.8	Confident	89.3	Confident	92 Å²	92	36.6 Å²	36.6	64%	0.643	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-14.7	177.6	51.5	0	0	0	0	114.7	P533	P533-S535 PolarHBondContact O-N 3.36Å
536	R	80.3	Confident	89.3	Confident	67 Å²	67	36 Å²	36	25%	0.253	20%	0.201	S	C	.	.			trans	-148.3	86	-169.3	-61	-71.8	-82.1	122.1	14.9	111	V499 P533 D538 V539	V499-R536 HydrophobicContact CG2-CG 4.11Å; P533-R536 CarbonylContact O-C 3.59Å; P533-R536 PolarHBondContact O-N 3.08Å; R536-D538 IonicContact CZ-OD1 3.98Å; R536-D538 IonicContact CZ-OD2 3.93Å; R536-D538 IonicContact NE-OD1 3.8Å; R536-D538 IonicContact NH1-OD1 3.85Å; R536-D538 PolarHBondContact NH1-OD1 3.36Å; R536-D538 IonicContact NH1-OD2 3.2Å; R536-D538 PolarHBondContact NH1-OD2 3.31Å; R536-D538 IonicContact NH2-OD1 3.09Å; R536-D538 IonicContact NH2-OD2 2.84Å; R536-D538 PolarHBondContact NH2-OD2 2.83Å; R536-D538 PolarHBondContact O-N 3.43Å; R536-V539 HydrophobicContact CB-CB 4.21Å; R536-V539 HydrophobicContact CB-CG2 3.63Å; R536-V539 HydrophobicContact CG-CG2 4.42Å; R536-V539 PolarHBondContact O-N 3.43Å
537	P	81.1	Confident	89.2	Confident	97 Å²	97	38.3 Å²	38.3	63%	0.63	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-13.2	179	30.4	-36.1	0	0	0	113.5	V539	P537-V539 PolarHBondContact O-N 3.28Å
538	D	84.2	Confident	89.2	Confident	27 Å²	27	35.9 Å²	35.9	14%	0.144	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	9.4	172.8	62.7	-45.3	0	0	0	113.4	R536 A598 N599 W635	R536-D538 IonicContact CZ-OD1 3.98Å; R536-D538 IonicContact CZ-OD2 3.93Å; R536-D538 IonicContact NE-OD1 3.8Å; R536-D538 IonicContact NH1-OD1 3.85Å; R536-D538 PolarHBondContact NH1-OD1 3.36Å; R536-D538 IonicContact NH1-OD2 3.2Å; R536-D538 PolarHBondContact NH1-OD2 3.31Å; R536-D538 IonicContact NH2-OD1 3.09Å; R536-D538 IonicContact NH2-OD2 2.84Å; R536-D538 PolarHBondContact NH2-OD2 2.83Å; R536-D538 PolarHBondContact O-N 3.43Å; D538-A598 CarbonylContact O-C 3.59Å; D538-A598 WeakPolarHBondContact O-CA 3.22Å; D538-N599 PolarHBondContact O-N 2.56Å; D538-W635 WeakPolarHBondContact O-CZ3 3.42Å
539	V	90.5	Very high	89.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	121.2	179	176.3	0	0	0	0	111.4	L496 S532 P533 R536 P537 L596 L597 A598	L496-V539 HydrophobicContact CD2-CG2 3.9Å; S532-V539 VanDerWaalsContact CB-O 3.29Å; S532-V539 WeakPolarHBondContact CB-O 3.32Å; S532-V539 PolarHBondContact OG-O 3Å; P533-V539 WeakPolarHBondContact CD-O 3.26Å; P533-V539 HydrophobicContact CG-CB 4.11Å; P533-V539 HydrophobicContact CG-CG1 3.91Å; R536-V539 HydrophobicContact CB-CB 4.21Å; R536-V539 HydrophobicContact CB-CG2 3.63Å; R536-V539 HydrophobicContact CG-CG2 4.42Å; R536-V539 PolarHBondContact O-N 3.43Å; P537-V539 PolarHBondContact O-N 3.28Å; V539-L596 HydrophobicContact CG1-CB 4.18Å; V539-L596 HydrophobicContact CG1-CD2 4.28Å; V539-L597 CarbonylContact C-O 3.55Å; V539-L597 VanDerWaalsContact CA-O 3.29Å; V539-L597 WeakPolarHBondContact CA-O 3.26Å; V539-A598 HydrophobicContact CG2-CB 3.88Å
540	L	91	Very high	89.1	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	131.9	164.7	-179	63.8	0	0	0	109.6	F528 V542 L597 W635 L638	F528-L540 HydrophobicContact CD1-CD1 4.31Å; F528-L540 HydrophobicContact CD1-CD2 4.06Å; F528-L540 HydrophobicContact CD1-CG 4.49Å; F528-L540 HydrophobicContact CE1-CD2 4.28Å; L540-V542 HydrophobicContact CD2-CG2 3.9Å; L540-V542 HydrophobicContact CG-CG2 3.87Å; L540-L597 HydrophobicContact CB-CB 4.38Å; L540-L597 HydrophobicContact CD2-CD1 4.48Å; L540-L597 PolarHBondContact N-O 3.36Å; L540-L597 PolarHBondContact O-N 3.44Å; L540-W635 HydrophobicContact CB-CD2 3.65Å; L540-W635 HydrophobicContact CB-CE3 3.65Å; L540-W635 HydrophobicContact CB-CG 4.3Å; L540-W635 HydrophobicContact CB-CH2 3.78Å; L540-W635 HydrophobicContact CB-CZ2 3.83Å; L540-W635 HydrophobicContact CB-CZ3 3.69Å; L540-W635 HydrophobicContact CD1-CG 4.42Å; L540-W635 HydrophobicContact CD2-CH2 4.45Å; L540-W635 HydrophobicContact CD2-CZ2 3.83Å; L540-W635 HydrophobicContact CG-CD2 4.48Å; L540-W635 HydrophobicContact CG-CZ2 4.44Å; L540-L638 HydrophobicContact CD1-CD1 3.54Å
541	V	93.7	Very high	89.2	Confident	3 Å²	3	38.7 Å²	38.7	2%	0.018	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125.5	170.3	-172.7	0	0	0	0	108.6	V501 I506 A529 P533 I594 L596	V501-V541 HydrophobicContact CG1-CG1 4.33Å; V501-V541 HydrophobicContact CG2-CG2 4.26Å; I506-V541 HydrophobicContact CD1-CG1 3.79Å; I506-V541 HydrophobicContact CG1-CG1 4.39Å; A529-V541 HydrophobicContact CB-CB 3.7Å; A529-V541 HydrophobicContact CB-CG1 4.26Å; A529-V541 WeakPolarHBondContact CB-O 3.08Å; A529-V541 PolarHBondContact N-O 3.46Å; P533-V541 HydrophobicContact CG-CG2 3.87Å; V541-I594 HydrophobicContact CG1-CG2 3.82Å; V541-L596 HydrophobicContact CB-CD2 4.22Å; V541-L596 HydrophobicContact CG1-CD2 3.98Å; V541-L596 HydrophobicContact CG2-CD2 3.8Å
542	V	94.6	Very high	89.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.7	179.2	-174.2	0	0	0	0	108.4	F526 H527 F528 L540 L595 L597	F526-V542 HydrophobicContact CB-CG1 3.59Å; F526-V542 HydrophobicContact CD1-CG1 4.11Å; F526-V542 HydrophobicContact CD2-CG1 3.75Å; F526-V542 HydrophobicContact CE2-CG1 4.43Å; F526-V542 HydrophobicContact CG-CG1 3.55Å; H527-V542 CarbonylContact O-C 3.58Å; H527-V542 WeakPolarHBondContact O-CA 3.3Å; F528-V542 HydrophobicContact CD1-CG1 4.45Å; F528-V542 HydrophobicContact CD1-CG2 3.97Å; F528-V542 HydrophobicContact CE1-CG1 4.31Å; F528-V542 HydrophobicContact CE1-CG2 4.05Å; L540-V542 HydrophobicContact CD2-CG2 3.9Å; L540-V542 HydrophobicContact CG-CG2 3.87Å; V542-L595 HydrophobicContact CB-CB 4.11Å; V542-L595 HydrophobicContact CB-CD2 4.26Å; V542-L595 HydrophobicContact CB-CG 4.35Å; V542-L595 HydrophobicContact CG1-CD2 4.48Å; V542-L595 PolarHBondContact N-O 3.33Å; V542-L595 PolarHBondContact O-N 3.42Å; V542-L597 HydrophobicContact CG2-CD1 4.4Å
543	I	95.9	Very high	89.8	Confident	28 Å²	28	41.6 Å²	41.6	14%	0.144	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	117.3	170.7	-54.6	156.8	0	0	0	107.2	L503 I506 H527	L503-I543 HydrophobicContact CD1-CG2 4.44Å; I506-I543 HydrophobicContact CB-CD1 4.4Å; I506-I543 HydrophobicContact CD1-CD1 4.34Å; I506-I543 HydrophobicContact CD1-CG1 3.99Å; I506-I543 HydrophobicContact CG2-CD1 3.82Å; I506-I543 HydrophobicContact CG2-CG1 4.36Å; H527-I543 HydrophobicContact CB-CB 4.27Å; H527-I543 PolarHBondContact N-O 3.3Å; H527-I543 PolarHBondContact O-N 3.06Å
544	I	96.3	Very high	90.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	118.7	172.3	-49.9	-176.7	0	0	0	107.5	V524 L525 F526 M546 F559 L571 T592 Q593 L595	V524-I544 HydrophobicContact CG1-CG2 3.5Å; L525-I544 CarbonylContact O-C 3.13Å; L525-I544 WeakPolarHBondContact O-CA 3.19Å; F526-I544 HydrophobicContact CD1-CB 4.34Å; F526-I544 HydrophobicContact CD1-CG1 3.86Å; F526-I544 HydrophobicContact CD1-CG2 4.2Å; F526-I544 HydrophobicContact CE1-CB 4.33Å; F526-I544 HydrophobicContact CE1-CD1 3.79Å; F526-I544 HydrophobicContact CE1-CG1 3.62Å; F526-I544 HydrophobicContact CE1-CG2 4.05Å; F526-I544 HydrophobicContact CZ-CD1 4.38Å; F526-I544 HydrophobicContact CZ-CG1 4.49Å; I544-M546 HydrophobicContact CG2-CE 3.72Å; I544-M546 HydrophobicContact CG2-CG 4.14Å; I544-F559 HydrophobicContact CD1-CD1 3.49Å; I544-F559 VanDerWaalsContact CD1-CD1 3.49Å; I544-F559 HydrophobicContact CD1-CE1 3.36Å; I544-F559 HydrophobicContact CD1-CG 4.31Å; I544-F559 HydrophobicContact CD1-CZ 4.1Å; I544-L571 HydrophobicContact CD1-CD2 3.8Å; I544-T592 CarbonylContact O-C 3.6Å; I544-T592 VanDerWaalsContact O-CA 3.28Å; I544-T592 WeakPolarHBondContact O-CA 3.34Å; I544-Q593 HydrophobicContact CB-CB 4.3Å; I544-Q593 WeakPolarHBondContact CB-O 3.48Å; I544-Q593 PolarHBondContact N-O 3.43Å; I544-Q593 PolarHBondContact O-N 3.35Å; I544-L595 HydrophobicContact CD1-CB 3.91Å; I544-L595 HydrophobicContact CD1-CD2 4.32Å; I544-L595 HydrophobicContact CG1-CB 4.11Å
545	S	96.4	Very high	91.2	Very high	16 Å²	16	35.8 Å²	35.8	11%	0.112	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	118.8	174.9	-57.8	0	0	0	0	109.3	V524 L525 H527	V524-S545 WeakPolarHBondContact CA-O 3.41Å; L525-S545 PolarHBondContact N-O 3.28Å; L525-S545 PolarHBondContact O-N 2.95Å; H527-S545 PolarHBondContact CD2-OG 2.58Å; H527-S545 WeakPolarHBondContact NE2-CB 3.4Å; H527-S545 PolarHBondContact NE2-OG 3.14Å
546	M	96.4	Very high	92	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124.6	178.6	-45.2	-179.3	-166.1	0	0	109.4	R523 V524 I544 I557 F559 A590 I591	R523-M546 WeakPolarHBondContact O-CA 3.18Å; V524-M546 HydrophobicContact CG1-CG 4.27Å; V524-M546 HydrophobicContact CG2-CB 4.42Å; V524-M546 HydrophobicContact CG2-CG 4.07Å; I544-M546 HydrophobicContact CG2-CE 3.72Å; I544-M546 HydrophobicContact CG2-CG 4.14Å; M546-I557 HydrophobicContact SD-CG2 3.51Å; M546-I557 VanDerWaalsContact SD-CG2 3.51Å; M546-F559 HydrophobicContact CE-CB 3.46Å; M546-F559 VanDerWaalsContact CE-CB 3.46Å; M546-F559 HydrophobicContact CE-CD2 4.37Å; M546-F559 HydrophobicContact CE-CG 4.02Å; M546-A590 CarbonylContact O-C 3.54Å; M546-A590 VanDerWaalsContact O-CA 3.25Å; M546-A590 WeakPolarHBondContact O-CA 3.33Å; M546-I591 HydrophobicContact CB-CB 4.28Å; M546-I591 PolarHBondContact N-O 2.92Å; M546-I591 PolarHBondContact O-N 3.07Å; M546-I591 HydrophobicContact SD-CG2 4.43Å
547	L	95.2	Very high	92.7	Very high	48 Å²	48	32.6 Å²	32.6	25%	0.251	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.8	-178.1	-58	96.7	0	0	0	110.4	R523 L525 P588 A590	R523-L547 PolarHBondContact N-O 3.1Å; R523-L547 PolarHBondContact O-N 2.86Å; L525-L547 HydrophobicContact CD1-CD1 3.91Å; L547-P588 HydrophobicContact CD2-CB 4.5Å; L547-A590 HydrophobicContact CD2-CB 4.28Å; L547-A590 HydrophobicContact CG-CB 4Å
548	S	94.1	Very high	93.4	Very high	8 Å²	8	32.9 Å²	32.9	6%	0.056	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	129.5	176.2	-178.2	0	0	0	0	110.8	S521 A550	S521-S548 WeakPolarHBondContact O-CA 3.38Å; S548-A550 WeakPolarHBondContact OG-CB 3.39Å; S548-A550 PolarHBondContact OG-N 3.13Å
549	S	93.4	Very high	93.9	Very high	79 Å²	79	32.2 Å²	32.2	55%	0.552	19%	0.186	S	C	*	.			trans	-102.1	10.6	169.8	-58.6	0	0	0	0	111.7	S521	S521-S549 PolarHBondContact O-N 3.39Å
550	A	91.4	Very high	94.1	Very high	1 Å²	1	37 Å²	37	1%	0.008	21%	0.208	C	C	.	.			trans	-77	144.1	-177.1	0	0	0	0	0	112.4	S548 I552 F582 M615	S548-A550 WeakPolarHBondContact OG-CB 3.39Å; S548-A550 PolarHBondContact OG-N 3.13Å; A550-I552 HydrophobicContact CB-CG1 4.34Å; A550-I552 PolarHBondContact O-N 3.33Å; A550-I552 VanDerWaalsContact O-N 3.13Å; A550-F582 VanDerWaalsContact O-CB 3.27Å; A550-F582 WeakPolarHBondContact O-CB 3.44Å; A550-F582 PolarHBondContact O-N 2.82Å; A550-M615 HydrophobicContact CB-CE 3.39Å; A550-M615 HydrophobicContact CB-SD 4.4Å
551	P	90.7	Very high	94.2	Very high	111 Å²	111	37.5 Å²	37.5	72%	0.721	21%	0.213	S	C	*	.	S	Bend	trans	-73.3	2.5	174.6	32.9	-37.2	0	0	0	113.8	A581	P551-A581 WeakPolarHBondContact O-CB 3.48Å
552	I	93.2	Very high	94.1	Very high	73 Å²	73	41.5 Å²	41.5	37%	0.374	24%	0.238	S	C	.	.	S	Bend	trans	-127.1	149.7	177.6	57.5	176.5	0	0	0	109.1	A550 M615	A550-I552 HydrophobicContact CB-CG1 4.34Å; A550-I552 PolarHBondContact O-N 3.33Å; A550-I552 VanDerWaalsContact O-N 3.13Å; I552-M615 HydrophobicContact CD1-CB 4.07Å; I552-M615 HydrophobicContact CD1-CE 4.1Å; I552-M615 HydrophobicContact CG1-CE 3.98Å
553	P	92.6	Very high	93.9	Very high	64 Å²	64	42.5 Å²	42.5	42%	0.416	25%	0.246	S	C	.	.			trans	-66	148.1	177.8	29.1	-35.2	0	0	0	111.3	L579	P553-L579 CarbonylContact C-O 3.56Å; P553-L579 VanDerWaalsContact CA-O 3.23Å; P553-L579 WeakPolarHBondContact CA-O 3.23Å; P553-L579 WeakPolarHBondContact CB-O 3.26Å
554	A	94.4	Very high	93.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	122.2	171.4	0	0	0	0	0	108.8	I557 E578 L579 S614 M615	A554-I557 HydrophobicContact CB-CD1 3.97Å; A554-I557 HydrophobicContact CB-CG1 4.48Å; A554-I557 WeakPolarHBondContact O-CD1 3.42Å; A554-E578 CarbonylContact O-C 3.55Å; A554-E578 VanDerWaalsContact O-CA 3.32Å; A554-E578 WeakPolarHBondContact O-CA 3.46Å; A554-L579 HydrophobicContact CB-CB 4.48Å; A554-L579 PolarHBondContact N-O 3.03Å; A554-L579 PolarHBondContact O-N 3.39Å; A554-S614 CarbonylContact C-O 3.52Å; A554-S614 VanDerWaalsContact CA-O 3.28Å; A554-S614 WeakPolarHBondContact CA-O 3.25Å; A554-M615 HydrophobicContact CB-CG 3.73Å; A554-M615 HydrophobicContact CB-SD 4.37Å
555	T	94.1	Very high	92.6	Very high	34 Å²	34	54.2 Å²	54.2	21%	0.209	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	171.5	-174.8	60.9	0	0	0	0	111.4	I557 S577 E578 S614	T555-I557 PolarHBondContact O-N 2.99Å; T555-I557 VanDerWaalsContact O-N 3.16Å; T555-S577 CarbonylContact C-O 3.59Å; T555-E578 HydrophobicContact CG2-CB 4.34Å; T555-E578 HydrophobicContact CG2-CG 3.97Å; T555-S614 PolarHBondContact N-O 3.38Å; T555-S614 PolarHBondContact O-N 3.29Å
556	N	93.1	Very high	91.9	Very high	85 Å²	85	55 Å²	55	46%	0.455	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.5	37.7	-178.7	-55.5	-43.8	0	0	0	113.3	H558 S577 S612 S614	N556-H558 PolarHBondContact O-CD2 3.04Å; N556-H558 PolarHBondContact O-N 3.28Å; N556-S577 PolarHBondContact N-O 3.46Å; N556-S577 VanDerWaalsContact N-O 3.15Å; N556-S612 VanDerWaalsContact O-O 3.13Å; N556-S614 PolarHBondContact ND2-OG 2.7Å
557	I	95.1	Very high	91.5	Very high	6 Å²	6	55.3 Å²	55.3	3%	0.031	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	111.7	-178.3	-59.8	168.2	0	0	0	108.5	M546 A554 T555 S577 L579 I591 L611 S612 F613	M546-I557 HydrophobicContact SD-CG2 3.51Å; M546-I557 VanDerWaalsContact SD-CG2 3.51Å; A554-I557 HydrophobicContact CB-CD1 3.97Å; A554-I557 HydrophobicContact CB-CG1 4.48Å; A554-I557 WeakPolarHBondContact O-CD1 3.42Å; T555-I557 PolarHBondContact O-N 2.99Å; T555-I557 VanDerWaalsContact O-N 3.16Å; I557-S577 PolarHBondContact N-O 2.86Å; I557-L579 HydrophobicContact CD1-CB 4.17Å; I557-L579 HydrophobicContact CD1-CD1 3.76Å; I557-L579 HydrophobicContact CD1-CG 3.79Å; I557-I591 HydrophobicContact CB-CD1 4.1Å; I557-I591 HydrophobicContact CD1-CD1 3.61Å; I557-I591 HydrophobicContact CG1-CD1 4.43Å; I557-I591 HydrophobicContact CG2-CD1 4.3Å; I557-L611 HydrophobicContact CG2-CD1 4.3Å; I557-S612 WeakPolarHBondContact CA-O 3.23Å; I557-F613 HydrophobicContact CG1-CB 3.86Å
558	H	94.7	Very high	91.2	Very high	104 Å²	104	53.6 Å²	53.6	48%	0.481	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	126.7	176.7	-63.9	-72.4	0	0	0	110.2	N556 S612	N556-H558 PolarHBondContact O-CD2 3.04Å; N556-H558 PolarHBondContact O-N 3.28Å; H558-S612 PolarHBondContact N-O 3.07Å; H558-S612 PolarHBondContact O-N 3.16Å
559	F	96.1	Very high	91.1	Very high	12 Å²	12	55.6 Å²	55.6	5%	0.053	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	125.1	174.9	-174.5	-88.3	0	0	0	109.6	V524 F526 I544 M546 A561 L571 Y609 R610 L611	V524-F559 HydrophobicContact CG1-CE2 4.31Å; F526-F559 HydrophobicContact CE1-CE1 4.3Å; F526-F559 AromaticContact CE1-CZ 3.8Å; F526-F559 HydrophobicContact CE1-CZ 3.8Å; F526-F559 HydrophobicContact CZ-CE1 4.24Å; F526-F559 AromaticContact CZ-CZ 3.77Å; F526-F559 HydrophobicContact CZ-CZ 3.77Å; I544-F559 HydrophobicContact CD1-CD1 3.49Å; I544-F559 VanDerWaalsContact CD1-CD1 3.49Å; I544-F559 HydrophobicContact CD1-CE1 3.36Å; I544-F559 HydrophobicContact CD1-CG 4.31Å; I544-F559 HydrophobicContact CD1-CZ 4.1Å; M546-F559 HydrophobicContact CE-CB 3.46Å; M546-F559 VanDerWaalsContact CE-CB 3.46Å; M546-F559 HydrophobicContact CE-CD2 4.37Å; M546-F559 HydrophobicContact CE-CG 4.02Å; F559-A561 HydrophobicContact CE1-CB 4.04Å; F559-L571 HydrophobicContact CD1-CD1 4.26Å; F559-L571 HydrophobicContact CD1-CD2 4.23Å; F559-L571 WeakPolarHBondContact O-CD1 3.5Å; F559-Y609 AromaticContact CE2-CD2 3.82Å; F559-Y609 HydrophobicContact CE2-CD2 3.82Å; F559-Y609 AromaticContact CE2-CG 3.92Å; F559-Y609 HydrophobicContact CE2-CG 3.92Å; F559-Y609 VanDerWaalsContact CZ-CB 3.47Å; F559-Y609 HydrophobicContact CZ-CD2 4.41Å; F559-Y609 HydrophobicContact CZ-CG 4.04Å; F559-R610 WeakPolarHBondContact CA-O 3.34Å; F559-L611 HydrophobicContact CD2-CB 4.33Å; F559-L611 HydrophobicContact CD2-CD1 4.23Å
560	E	93.9	Very high	91	Very high	100 Å²	100	54.2 Å²	54.2	47%	0.467	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	140.6	174.9	-54.3	-174.9	135	0	0	109.2	Y609 R610	E560-Y609 CarbonylContact O-C 3.51Å; E560-Y609 VanDerWaalsContact O-CA 3.24Å; E560-Y609 WeakPolarHBondContact O-CA 3.29Å; E560-R610 HydrophobicContact CB-CB 4.29Å; E560-R610 PolarHBondContact N-O 3.41Å; E560-R610 PolarHBondContact O-N 3.47Å; E560-R610 WeakPolarHBondContact OE2-CD 3.43Å; E560-R610 IonicContact OE2-CZ 2.74Å; E560-R610 IonicContact OE2-NE 3.18Å; E560-R610 IonicContact OE2-NH1 2.94Å; E560-R610 PolarHBondContact OE2-NH1 2.92Å
561	A	93.6	Very high	91.1	Very high	14 Å²	14	56.5 Å²	56.5	12%	0.116	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	133.2	178.5	0	0	0	0	0	110.5	F559 V569 L571 L595 L607 Q608	F559-A561 HydrophobicContact CE1-CB 4.04Å; A561-V569 HydrophobicContact CB-CG2 3.96Å; A561-L571 HydrophobicContact CB-CD1 3.89Å; A561-L571 HydrophobicContact CB-CG 4.31Å; A561-L595 HydrophobicContact CB-CD1 3.89Å; A561-L607 HydrophobicContact CB-CD1 4.3Å; A561-L607 HydrophobicContact CB-CD2 4.37Å; A561-Q608 WeakPolarHBondContact CA-O 3.42Å
562	T	91.3	Very high	91.3	Very high	87 Å²	87	51.7 Å²	51.7	53%	0.534	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	134.3	178	-57.8	0	0	0	0	109.7	Q608	T562-Q608 PolarHBondContact N-O 3.28Å; T562-Q608 PolarHBondContact O-N 3.5Å
563	A	89	Confident	91.3	Very high	21 Å²	21	53.4 Å²	53.4	17%	0.174	29%	0.293	C	S	.	.			trans	-119	165.9	179.4	0	0	0	0	0	111.4	V567 V569 L607	A563-V567 HydrophobicContact CB-CB 3.97Å; A563-V567 HydrophobicContact CB-CG1 3.89Å; A563-V569 HydrophobicContact CB-CB 3.99Å; A563-V569 HydrophobicContact CB-CG1 4.16Å; A563-L607 HydrophobicContact CB-CD1 4.11Å
564	P	85.1	Confident	91.4	Very high	51 Å²	51	52.9 Å²	52.9	33%	0.331	29%	0.29	S	S	.	.			trans	-60.6	157.8	172.4	-21.7	34.5	0	0	0	112	S566 V567 Q606	P564-S566 PolarHBondContact O-N 2.85Å; P564-V567 PolarHBondContact O-N 3.18Å; P564-Q606 WeakPolarHBondContact CD-O 3.44Å
565	K	80.6	Confident	91.3	Very high	222 Å²	222	56.7 Å²	56.7	97%	0.965	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.3	-176.9	-66.1	-175.2	179.2	-178.1	0	115.1	V567	K565-V567 VanDerWaalsContact C-N 3.29Å
566	S	81.9	Confident	91.2	Very high	32 Å²	32	56.4 Å²	56.4	22%	0.224	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-8	173.4	47.5	0	0	0	0	113.8	P564 E603	P564-S566 PolarHBondContact O-N 2.85Å; S566-E603 WeakPolarHBondContact CB-OE2 3.49Å; S566-E603 PolarHBondContact OG-OE2 3.4Å
567	V	87.8	Confident	91.1	Very high	10 Å²	10	54.7 Å²	54.7	6%	0.061	32%	0.316	C	S	.	.	S	Bend	trans	-123.7	121	-175.1	-179.8	0	0	0	0	110	A563 P564 K565 A598 V605	A563-V567 HydrophobicContact CB-CB 3.97Å; A563-V567 HydrophobicContact CB-CG1 3.89Å; P564-V567 PolarHBondContact O-N 3.18Å; K565-V567 VanDerWaalsContact C-N 3.29Å; V567-A598 CarbonylContact C-O 3.58Å; V567-A598 VanDerWaalsContact CA-O 3.27Å; V567-A598 WeakPolarHBondContact CA-O 3.38Å; V567-A598 WeakPolarHBondContact CG1-O 3.34Å; V567-V605 HydrophobicContact CG1-CG1 4.13Å; V567-V605 HydrophobicContact CG1-CG2 4.45Å; V567-V605 HydrophobicContact CG2-CG1 4.38Å; V567-V605 HydrophobicContact CG2-CG2 4.03Å
568	G	88.3	Confident	91	Very high	12 Å²	12	60.2 Å²	60.2	12%	0.124	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	134.5	172.1	0	0	0	0	0	110.4	L496 L597 A598	L496-G568 WeakPolarHBondContact CD1-O 3.16Å; G568-L597 CarbonylContact O-C 3.58Å; G568-L597 WeakPolarHBondContact O-CA 3.46Å; G568-A598 PolarHBondContact N-O 3.34Å; G568-A598 PolarHBondContact O-N 2.98Å
569	V	92.6	Very high	91	Very high	50 Å²	50	55.5 Å²	55.5	30%	0.303	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135	174.8	60.4	0	0	0	0	110.5	A561 A563 L595 L597 L607	A561-V569 HydrophobicContact CB-CG2 3.96Å; A563-V569 HydrophobicContact CB-CB 3.99Å; A563-V569 HydrophobicContact CB-CG1 4.16Å; V569-L595 HydrophobicContact CG2-CD1 3.66Å; V569-L597 HydrophobicContact CB-CD2 4.1Å; V569-L597 HydrophobicContact CG2-CD2 3.83Å; V569-L607 HydrophobicContact CG2-CD1 4.42Å
570	K	92.3	Very high	90.8	Very high	50 Å²	50	58.7 Å²	58.7	22%	0.217	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	126.6	173.2	178.6	175.8	-178.5	-173.2	0	110.6	L496 A497 V499 L596	L496-K570 HydrophobicContact CB-CB 3.91Å; L496-K570 HydrophobicContact CB-CD 3.97Å; L496-K570 HydrophobicContact CD1-CB 3.85Å; L496-K570 WeakPolarHBondContact O-CD 3.27Å; L496-K570 PolarHBondContact O-NZ 3.16Å; A497-K570 PolarHBondContact O-NZ 3Å; V499-K570 PolarHBondContact O-NZ 3.22Å; K570-L596 HydrophobicContact CB-CB 4.33Å; K570-L596 HydrophobicContact CD-CD1 4.34Å; K570-L596 PolarHBondContact N-O 3.41Å; K570-L596 PolarHBondContact O-N 2.89Å
571	L	93.8	Very high	90.7	Very high	49 Å²	49	55.9 Å²	55.9	26%	0.257	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	134.4	166.5	-75.6	161.1	0	0	0	109.1	I544 F559 A561 Q593 L595	I544-L571 HydrophobicContact CD1-CD2 3.8Å; F559-L571 HydrophobicContact CD1-CD1 4.26Å; F559-L571 HydrophobicContact CD1-CD2 4.23Å; F559-L571 WeakPolarHBondContact O-CD1 3.5Å; A561-L571 HydrophobicContact CB-CD1 3.89Å; A561-L571 HydrophobicContact CB-CG 4.31Å; L571-Q593 HydrophobicContact CD2-CG 4.24Å; L571-L595 HydrophobicContact CD2-CB 3.85Å; L571-L595 HydrophobicContact CD2-CD1 3.86Å; L571-L595 HydrophobicContact CD2-CG 4.42Å; L571-L595 HydrophobicContact CG-CD1 4.05Å
572	Q	93.3	Very high	90.6	Very high	10 Å²	10	59.3 Å²	59.3	5%	0.047	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-82.6	166.5	165.4	-62	-170.2	35.1	0	0	110.1	F500 V501 Q593 I594	F500-Q572 HydrophobicContact CD2-CG 4.41Å; V501-Q572 PolarHBondContact O-NE2 3.29Å; V501-Q572 PolarHBondContact O-OE1 3.46Å; Q572-Q593 VanDerWaalsContact O-CG 3.32Å; Q572-Q593 WeakPolarHBondContact O-CG 3.47Å; Q572-Q593 PolarHBondContact O-NE2 3.35Å; Q572-I594 HydrophobicContact CB-CB 4.13Å; Q572-I594 HydrophobicContact CG-CB 4.08Å; Q572-I594 HydrophobicContact CG-CG2 4.39Å; Q572-I594 PolarHBondContact N-O 3.49Å
573	P	93	Very high	90.5	Very high	108 Å²	108	58.3 Å²	58.3	70%	0.701	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-55.5	138.2	171.3	-25.1	35.7	0	0	0	111.7
574	P	94.6	Very high	90.4	Very high	53 Å²	53	62.5 Å²	62.5	34%	0.344	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-73.7	160.4	173.5	32.8	-35.6	0	0	0	111.2	G576 I591 T592 Q593	P574-G576 WeakPolarHBondContact CB-O 3.3Å; P574-G576 PolarHBondContact O-N 3.37Å; P574-I591 HydrophobicContact CB-CG2 3.95Å; P574-T592 CarbonylContact C-O 3.55Å; P574-T592 WeakPolarHBondContact CA-O 3.07Å; P574-Q593 HydrophobicContact CB-CB 3.99Å; P574-Q593 HydrophobicContact CB-CG 3.96Å
575	S	92.9	Very high	90.6	Very high	80 Å²	80	67.4 Å²	67.4	56%	0.559	39%	0.387	S	S	*	.	S	Bend	trans	-67.8	-15.2	175.6	69.9	0	0	0	0	113.9	T592	S575-T592 PolarHBondContact N-O 3.12Å; S575-T592 PolarHBondContact OG-N 2.9Å
576	G	91.6	Very high	90.8	Very high	28 Å²	28	62 Å²	62	29%	0.289	37%	0.368	S	S	.	.			trans	-177.2	173.7	177.6	0	0	0	0	0	111.2	P574 I591	P574-G576 WeakPolarHBondContact CB-O 3.3Å; P574-G576 PolarHBondContact O-N 3.37Å; G576-I591 WeakPolarHBondContact O-CG2 3.26Å
577	S	91.6	Very high	91	Very high	50 Å²	50	66.1 Å²	66.1	35%	0.35	39%	0.393	S	S	.	.	S	Bend	trans	-119.6	4.3	178.2	53	0	0	0	0	113.2	T555 N556 I557	T555-S577 CarbonylContact C-O 3.59Å; N556-S577 PolarHBondContact N-O 3.46Å; N556-S577 VanDerWaalsContact N-O 3.15Å; I557-S577 PolarHBondContact N-O 2.86Å
578	E	92.9	Very high	90.9	Very high	122 Å²	122	69.6 Å²	69.6	57%	0.57	42%	0.416	S	S	*	.			trans	-139.4	142.6	-174.5	-55.6	-174.7	179	0	0	110.8	A554 T555	A554-E578 CarbonylContact O-C 3.55Å; A554-E578 VanDerWaalsContact O-CA 3.32Å; A554-E578 WeakPolarHBondContact O-CA 3.46Å; T555-E578 HydrophobicContact CG2-CB 4.34Å; T555-E578 HydrophobicContact CG2-CG 3.97Å
579	L	94.3	Very high	91	Very high	5 Å²	5	71.1 Å²	71.1	3%	0.026	43%	0.428	C	S	.	.	B	Isolated β-bridge	trans	-119.5	128.5	171.6	-72.5	170.9	0	0	0	108.8	L522 P553 A554 I557 A589 I591	L522-L579 HydrophobicContact CD1-CD1 3.74Å; P553-L579 CarbonylContact C-O 3.56Å; P553-L579 VanDerWaalsContact CA-O 3.23Å; P553-L579 WeakPolarHBondContact CA-O 3.23Å; P553-L579 WeakPolarHBondContact CB-O 3.26Å; A554-L579 HydrophobicContact CB-CB 4.48Å; A554-L579 PolarHBondContact N-O 3.03Å; A554-L579 PolarHBondContact O-N 3.39Å; I557-L579 HydrophobicContact CD1-CB 4.17Å; I557-L579 HydrophobicContact CD1-CD1 3.76Å; I557-L579 HydrophobicContact CD1-CG 3.79Å; L579-A589 HydrophobicContact CD2-CB 4.21Å; L579-I591 HydrophobicContact CD1-CD1 4.43Å; L579-I591 HydrophobicContact CD2-CD1 4.26Å; L579-I591 HydrophobicContact CD2-CG1 3.88Å; L579-I591 HydrophobicContact CG-CD1 3.85Å; L579-I591 HydrophobicContact CG-CG1 4.06Å
580	P	93.1	Very high	91.1	Very high	78 Å²	78	71 Å²	71	51%	0.506	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-64.2	162.9	175	29.3	-36.3	0	0	0	111.4	F582 A589	P580-F582 PolarHBondContact O-N 3.44Å; P580-A589 HydrophobicContact CG-CB 3.56Å
581	A	91.9	Very high	91.3	Very high	42 Å²	42	68.9 Å²	68.9	35%	0.347	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-55.5	139.3	169.1	0	0	0	0	0	110.8	P551 N583	P551-A581 WeakPolarHBondContact O-CB 3.48Å; A581-N583 PolarHBondContact O-N 2.86Å
582	F	91.3	Very high	91.4	Very high	86 Å²	86	68.4 Å²	68.4	38%	0.377	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-60.2	121.3	179.4	178.2	-103.3	0	0	0	111	A550 P580 P584 P588	A550-F582 VanDerWaalsContact O-CB 3.27Å; A550-F582 WeakPolarHBondContact O-CB 3.44Å; A550-F582 PolarHBondContact O-N 2.82Å; P580-F582 PolarHBondContact O-N 3.44Å; F582-P584 HydrophobicContact CD1-CG 4.38Å; F582-P584 HydrophobicContact CE1-CB 4.49Å; F582-P584 HydrophobicContact CE1-CG 3.88Å; F582-P588 HydrophobicContact CE2-CG 4.43Å
583	N	88.2	Confident	91.5	Very high	66 Å²	66	68.6 Å²	68.6	35%	0.353	42%	0.423	S	S	.	.			trans	-118	112.3	178.2	-177.1	-13.4	0	0	0	109.4	A581 I585 L586	A581-N583 PolarHBondContact O-N 2.86Å; N583-I585 PolarHBondContact O-N 2.77Å; N583-I585 WeakPolarHBondContact OD1-CB 3.46Å; N583-I585 PolarHBondContact OD1-N 3.01Å; N583-L586 HydrophobicContact CB-CB 4.42Å; N583-L586 PolarHBondContact O-N 2.94Å; N583-L586 VanDerWaalsContact O-N 3.16Å; N583-L586 VanDerWaalsContact O-O 3.13Å
584	P	87.5	Confident	91.6	Very high	109 Å²	109	64 Å²	64	71%	0.708	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-15.6	179.5	-24.2	32.9	0	0	0	115.6	F582	F582-P584 HydrophobicContact CD1-CG 4.38Å; F582-P584 HydrophobicContact CE1-CB 4.49Å; F582-P584 HydrophobicContact CE1-CG 3.88Å
585	I	89.7	Confident	91.6	Very high	154 Å²	154	61.5 Å²	61.5	79%	0.79	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-25.9	-177.3	-54.8	174.4	0	0	0	111.6	N583	N583-I585 PolarHBondContact O-N 2.77Å; N583-I585 WeakPolarHBondContact OD1-CB 3.46Å; N583-I585 PolarHBondContact OD1-N 3.01Å
586	L	84	Confident	91.6	Very high	108 Å²	108	57.7 Å²	57.7	57%	0.565	35%	0.35	S	S	*	.	S	Bend	trans	-105.1	153.3	-176.6	-63.7	178.4	0	0	0	110.9	N583	N583-L586 HydrophobicContact CB-CB 4.42Å; N583-L586 PolarHBondContact O-N 2.94Å; N583-L586 VanDerWaalsContact O-N 3.16Å; N583-L586 VanDerWaalsContact O-O 3.13Å
587	P	85.9	Confident	91.6	Very high	118 Å²	118	56.4 Å²	56.4	77%	0.766	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-54	135.3	168.9	-24.7	34.8	0	0	0	110.8	A589	P587-A589 PolarHBondContact O-N 3.05Å
588	P	86.5	Confident	91.6	Very high	84 Å²	84	54 Å²	54	55%	0.545	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-57.5	125.3	178.2	-26.2	34.9	0	0	0	111.5	L547 F582	L547-P588 HydrophobicContact CD2-CB 4.5Å; F582-P588 HydrophobicContact CE2-CG 4.43Å
589	A	90.9	Very high	91.4	Very high	44 Å²	44	48.3 Å²	48.3	36%	0.364	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-67.5	144.1	172	0	0	0	0	0	110.3	L579 P580 P587	L579-A589 HydrophobicContact CD2-CB 4.21Å; P580-A589 HydrophobicContact CG-CB 3.56Å; P587-A589 PolarHBondContact O-N 3.05Å
590	A	94.7	Very high	90.9	Very high	47 Å²	47	50.3 Å²	50.3	39%	0.388	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	141.7	177.9	0	0	0	0	0	110.8	M546 L547	M546-A590 CarbonylContact O-C 3.54Å; M546-A590 VanDerWaalsContact O-CA 3.25Å; M546-A590 WeakPolarHBondContact O-CA 3.33Å; L547-A590 HydrophobicContact CD2-CB 4.28Å; L547-A590 HydrophobicContact CG-CB 4Å
591	I	95.9	Very high	90.5	Very high	5 Å²	5	51.3 Å²	51.3	3%	0.026	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	131	164.8	-68.2	165.2	0	0	0	107.2	M546 I557 P574 G576 L579	M546-I591 HydrophobicContact CB-CB 4.28Å; M546-I591 PolarHBondContact N-O 2.92Å; M546-I591 PolarHBondContact O-N 3.07Å; M546-I591 HydrophobicContact SD-CG2 4.43Å; I557-I591 HydrophobicContact CB-CD1 4.1Å; I557-I591 HydrophobicContact CD1-CD1 3.61Å; I557-I591 HydrophobicContact CG1-CD1 4.43Å; I557-I591 HydrophobicContact CG2-CD1 4.3Å; P574-I591 HydrophobicContact CB-CG2 3.95Å; G576-I591 WeakPolarHBondContact O-CG2 3.26Å; L579-I591 HydrophobicContact CD1-CD1 4.43Å; L579-I591 HydrophobicContact CD2-CD1 4.26Å; L579-I591 HydrophobicContact CD2-CG1 3.88Å; L579-I591 HydrophobicContact CG-CD1 3.85Å; L579-I591 HydrophobicContact CG-CG1 4.06Å
592	T	95.4	Very high	90	Very high	39 Å²	39	55.3 Å²	55.3	24%	0.239	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	137.8	171.7	56.8	0	0	0	0	110.2	I544 P574 S575	I544-T592 CarbonylContact O-C 3.6Å; I544-T592 VanDerWaalsContact O-CA 3.28Å; I544-T592 WeakPolarHBondContact O-CA 3.34Å; P574-T592 CarbonylContact C-O 3.55Å; P574-T592 WeakPolarHBondContact CA-O 3.07Å; S575-T592 PolarHBondContact N-O 3.12Å; S575-T592 PolarHBondContact OG-N 2.9Å
593	Q	95.4	Very high	89.7	Confident	15 Å²	15	55.1 Å²	55.1	7%	0.07	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	137.7	175.2	-168.7	175.2	13.2	0	0	110	I544 L571 Q572 P574	I544-Q593 HydrophobicContact CB-CB 4.3Å; I544-Q593 WeakPolarHBondContact CB-O 3.48Å; I544-Q593 PolarHBondContact N-O 3.43Å; I544-Q593 PolarHBondContact O-N 3.35Å; L571-Q593 HydrophobicContact CD2-CG 4.24Å; Q572-Q593 VanDerWaalsContact O-CG 3.32Å; Q572-Q593 WeakPolarHBondContact O-CG 3.47Å; Q572-Q593 PolarHBondContact O-NE2 3.35Å; P574-Q593 HydrophobicContact CB-CB 3.99Å; P574-Q593 HydrophobicContact CB-CG 3.96Å
594	I	95.4	Very high	89.4	Confident	12 Å²	12	59.9 Å²	59.9	6%	0.062	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.5	-177.9	-57.7	167.6	0	0	0	109.6	V501 L503 I506 V541 Q572 L596	V501-I594 WeakPolarHBondContact O-CD1 3.34Å; L503-I594 HydrophobicContact CB-CD1 4.2Å; L503-I594 HydrophobicContact CD1-CD1 4.24Å; L503-I594 HydrophobicContact CD1-CG1 4.37Å; I506-I594 HydrophobicContact CD1-CD1 3.87Å; I506-I594 HydrophobicContact CD1-CG1 4.18Å; I506-I594 HydrophobicContact CD1-CG2 4.49Å; V541-I594 HydrophobicContact CG1-CG2 3.82Å; Q572-I594 HydrophobicContact CB-CB 4.13Å; Q572-I594 HydrophobicContact CG-CB 4.08Å; Q572-I594 HydrophobicContact CG-CG2 4.39Å; Q572-I594 PolarHBondContact N-O 3.49Å; I594-L596 HydrophobicContact CG2-CD2 4.06Å; I594-L596 HydrophobicContact CG2-CG 4.45Å
595	L	94.6	Very high	89.2	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	128.1	174.3	168.7	68.2	0	0	0	109.1	F526 V542 I544 A561 V569 L571 L597 L607	F526-L595 HydrophobicContact CE2-CD2 4.02Å; F526-L595 HydrophobicContact CZ-CD2 3.88Å; V542-L595 HydrophobicContact CB-CB 4.11Å; V542-L595 HydrophobicContact CB-CD2 4.26Å; V542-L595 HydrophobicContact CB-CG 4.35Å; V542-L595 HydrophobicContact CG1-CD2 4.48Å; V542-L595 PolarHBondContact N-O 3.33Å; V542-L595 PolarHBondContact O-N 3.42Å; I544-L595 HydrophobicContact CD1-CB 3.91Å; I544-L595 HydrophobicContact CD1-CD2 4.32Å; I544-L595 HydrophobicContact CG1-CB 4.11Å; A561-L595 HydrophobicContact CB-CD1 3.89Å; V569-L595 HydrophobicContact CG2-CD1 3.66Å; L571-L595 HydrophobicContact CD2-CB 3.85Å; L571-L595 HydrophobicContact CD2-CD1 3.86Å; L571-L595 HydrophobicContact CD2-CG 4.42Å; L571-L595 HydrophobicContact CG-CD1 4.05Å; L595-L597 HydrophobicContact CD1-CD2 4.08Å; L595-L597 HydrophobicContact CD1-CG 4.5Å; L595-L597 HydrophobicContact CD2-CD1 4.45Å; L595-L597 HydrophobicContact CD2-CG 4.48Å; L595-L597 HydrophobicContact CG-CD2 4.32Å; L595-L597 HydrophobicContact CG-CG 4.24Å; L595-L607 HydrophobicContact CD2-CD2 3.7Å
596	L	92.8	Very high	89.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.6	176.7	-56.6	175.2	0	0	0	108.9	L496 V499 V501 V539 V541 K570 I594	L496-L596 HydrophobicContact CD1-CB 4.33Å; V499-L596 HydrophobicContact CB-CD1 4.27Å; V499-L596 HydrophobicContact CG1-CD1 3.9Å; V501-L596 HydrophobicContact CB-CD2 4.47Å; V501-L596 HydrophobicContact CG2-CD2 3.83Å; V539-L596 HydrophobicContact CG1-CB 4.18Å; V539-L596 HydrophobicContact CG1-CD2 4.28Å; V541-L596 HydrophobicContact CB-CD2 4.22Å; V541-L596 HydrophobicContact CG1-CD2 3.98Å; V541-L596 HydrophobicContact CG2-CD2 3.8Å; K570-L596 HydrophobicContact CB-CB 4.33Å; K570-L596 HydrophobicContact CD-CD1 4.34Å; K570-L596 PolarHBondContact N-O 3.41Å; K570-L596 PolarHBondContact O-N 2.89Å; I594-L596 HydrophobicContact CG2-CD2 4.06Å; I594-L596 HydrophobicContact CG2-CG 4.45Å
597	L	91.9	Very high	89.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	114.3	177.5	-61.3	174.3	0	0	0	109.3	V539 L540 V542 G568 V569 L595 L607 L629 W635	V539-L597 CarbonylContact C-O 3.55Å; V539-L597 VanDerWaalsContact CA-O 3.29Å; V539-L597 WeakPolarHBondContact CA-O 3.26Å; L540-L597 HydrophobicContact CB-CB 4.38Å; L540-L597 HydrophobicContact CD2-CD1 4.48Å; L540-L597 PolarHBondContact N-O 3.36Å; L540-L597 PolarHBondContact O-N 3.44Å; V542-L597 HydrophobicContact CG2-CD1 4.4Å; G568-L597 CarbonylContact O-C 3.58Å; G568-L597 WeakPolarHBondContact O-CA 3.46Å; V569-L597 HydrophobicContact CB-CD2 4.1Å; V569-L597 HydrophobicContact CG2-CD2 3.83Å; L595-L597 HydrophobicContact CD1-CD2 4.08Å; L595-L597 HydrophobicContact CD1-CG 4.5Å; L595-L597 HydrophobicContact CD2-CD1 4.45Å; L595-L597 HydrophobicContact CD2-CG 4.48Å; L595-L597 HydrophobicContact CG-CD2 4.32Å; L595-L597 HydrophobicContact CG-CG 4.24Å; L597-L607 HydrophobicContact CD2-CD1 3.73Å; L597-L629 HydrophobicContact CD1-CD1 4.03Å; L597-L629 HydrophobicContact CD1-CD2 4.49Å; L597-W635 HydrophobicContact CB-CH2 4.27Å; L597-W635 VanDerWaalsContact O-CZ3 3.24Å; L597-W635 WeakPolarHBondContact O-CZ3 3.47Å
598	A	90.8	Very high	89.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.9	177.4	0	0	0	0	0	110.6	V494 L496 D538 V539 V567 G568	V494-A598 HydrophobicContact CG1-CB 3.46Å; V494-A598 VanDerWaalsContact CG1-CB 3.46Å; L496-A598 HydrophobicContact CD1-CB 3.91Å; L496-A598 HydrophobicContact CD2-CB 3.96Å; L496-A598 HydrophobicContact CG-CB 3.92Å; D538-A598 CarbonylContact O-C 3.59Å; D538-A598 WeakPolarHBondContact O-CA 3.22Å; V539-A598 HydrophobicContact CG2-CB 3.88Å; V567-A598 CarbonylContact C-O 3.58Å; V567-A598 VanDerWaalsContact CA-O 3.27Å; V567-A598 WeakPolarHBondContact CA-O 3.38Å; V567-A598 WeakPolarHBondContact CG1-O 3.34Å; G568-A598 PolarHBondContact N-O 3.34Å; G568-A598 PolarHBondContact O-N 2.98Å
599	N	89.6	Confident	90.3	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.011	21%	0.212	C	C	.	.			trans	-131.5	74.7	-176.6	-175.6	9.8	0	0	0	111	D538 N601 K602 E603 V605 P632 W635	D538-N599 PolarHBondContact O-N 2.56Å; N599-N601 PolarHBondContact O-N 3.23Å; N599-K602 PolarHBondContact O-N 3.13Å; N599-K602 PolarHBondContact OD1-N 3.3Å; N599-K602 VanDerWaalsContact OD1-N 3.13Å; N599-E603 PolarHBondContact ND2-N 2.89Å; N599-E603 PolarHBondContact ND2-O 3.14Å; N599-E603 PolarHBondContact OD1-N 3.15Å; N599-E603 VanDerWaalsContact OD1-N 3.1Å; N599-V605 HydrophobicContact CB-CG2 4.36Å; N599-V605 VanDerWaalsContact ND2-CG2 3.34Å; N599-V605 WeakPolarHBondContact ND2-CG2 3.3Å; N599-P632 WeakPolarHBondContact ND2-CG 3.21Å; N599-W635 HydrophobicContact CB-CE3 4.33Å; N599-W635 HydrophobicContact CB-CH2 3.42Å; N599-W635 VanDerWaalsContact CB-CH2 3.42Å; N599-W635 HydrophobicContact CB-CZ2 4.43Å; N599-W635 HydrophobicContact CB-CZ3 3.36Å
600	P	84.3	Confident	90.5	Very high	47 Å²	47	45 Å²	45	31%	0.305	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-26.5	-178.2	26.6	-34.7	0	0	0	112.9	V494	V494-P600 HydrophobicContact CG1-CG 4.26Å; V494-P600 HydrophobicContact CG2-CG 3.8Å
601	N	82.8	Confident	90.6	Very high	99 Å²	99	42.8 Å²	42.8	53%	0.529	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-7.8	-178.8	-65.8	2.7	0	0	0	113.8	N599 E603	N599-N601 PolarHBondContact O-N 3.23Å; N601-E603 HydrophobicContact CB-CG 3.82Å; N601-E603 VanDerWaalsContact CB-OE1 3.32Å; N601-E603 WeakPolarHBondContact CB-OE1 3.2Å; N601-E603 PolarHBondContact ND2-OE1 3.2Å; N601-E603 PolarHBondContact O-N 2.97Å
602	K	83.3	Confident	90.6	Very high	126 Å²	126	43.9 Å²	43.9	55%	0.548	21%	0.208	S	C	.	.			trans	55.3	29.6	-173.7	-61.3	-171.9	175.8	-170.6	0	114.6	N599 P632 E633	N599-K602 PolarHBondContact O-N 3.13Å; N599-K602 PolarHBondContact OD1-N 3.3Å; N599-K602 VanDerWaalsContact OD1-N 3.13Å; K602-P632 HydrophobicContact CB-CB 3.85Å; K602-P632 HydrophobicContact CG-CB 4.22Å; K602-E633 HydrophobicContact CD-CG 4.47Å
603	E	83.6	Confident	90.6	Very high	83 Å²	83	42 Å²	42	39%	0.388	20%	0.197	S	C	.	.			trans	-73.5	155.8	178.5	-71.9	166.8	-157.6	0	0	111.6	S566 N599 N601 V605 P632	S566-E603 WeakPolarHBondContact CB-OE2 3.49Å; S566-E603 PolarHBondContact OG-OE2 3.4Å; N599-E603 PolarHBondContact ND2-N 2.89Å; N599-E603 PolarHBondContact ND2-O 3.14Å; N599-E603 PolarHBondContact OD1-N 3.15Å; N599-E603 VanDerWaalsContact OD1-N 3.1Å; N601-E603 HydrophobicContact CB-CG 3.82Å; N601-E603 VanDerWaalsContact CB-OE1 3.32Å; N601-E603 WeakPolarHBondContact CB-OE1 3.2Å; N601-E603 PolarHBondContact ND2-OE1 3.2Å; N601-E603 PolarHBondContact O-N 2.97Å; E603-V605 PolarHBondContact O-N 3.01Å; E603-V605 VanDerWaalsContact O-N 3.13Å; E603-P632 WeakPolarHBondContact O-CG 3.43Å
604	K	81.9	Confident	90.5	Very high	165 Å²	165	42.1 Å²	42.1	72%	0.717	20%	0.199	S	C	*	.			trans	-65.8	114.6	173.9	-172.7	-177.3	179.6	-171.2	0	109.8
605	V	84.6	Confident	90.3	Very high	6 Å²	6	42.7 Å²	42.7	4%	0.036	20%	0.201	C	C	.	.			trans	-81.8	126.3	-176.8	-173	0	0	0	0	110.8	V567 N599 E603 L629 W635	V567-V605 HydrophobicContact CG1-CG1 4.13Å; V567-V605 HydrophobicContact CG1-CG2 4.45Å; V567-V605 HydrophobicContact CG2-CG1 4.38Å; V567-V605 HydrophobicContact CG2-CG2 4.03Å; N599-V605 HydrophobicContact CB-CG2 4.36Å; N599-V605 VanDerWaalsContact ND2-CG2 3.34Å; N599-V605 WeakPolarHBondContact ND2-CG2 3.3Å; E603-V605 PolarHBondContact O-N 3.01Å; E603-V605 VanDerWaalsContact O-N 3.13Å; V605-L629 HydrophobicContact CB-CD1 3.74Å; V605-L629 HydrophobicContact CG1-CD1 3.62Å; V605-W635 HydrophobicContact CG2-CH2 4.12Å; V605-W635 HydrophobicContact CG2-CZ2 4.19Å
606	Q	86.7	Confident	89.8	Confident	60 Å²	60	45.2 Å²	45.2	28%	0.28	23%	0.228	S	C	.	.			trans	-111	107	165.8	-179.7	-177.2	54.5	0	0	108	P564 E627	P564-Q606 WeakPolarHBondContact CD-O 3.44Å; Q606-E627 HydrophobicContact CB-CG 4.41Å; Q606-E627 HydrophobicContact CG-CG 3.85Å; Q606-E627 PolarHBondContact NE2-OE1 3.29Å
607	L	92.8	Very high	89.4	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	136.5	178.3	-169.1	74.5	0	0	0	109.8	F526 A561 A563 V569 L595 L597 R625 V626 L629	F526-L607 HydrophobicContact CE2-CD2 3.72Å; F526-L607 HydrophobicContact CZ-CD2 3.9Å; A561-L607 HydrophobicContact CB-CD1 4.3Å; A561-L607 HydrophobicContact CB-CD2 4.37Å; A563-L607 HydrophobicContact CB-CD1 4.11Å; V569-L607 HydrophobicContact CG2-CD1 4.42Å; L595-L607 HydrophobicContact CD2-CD2 3.7Å; L597-L607 HydrophobicContact CD2-CD1 3.73Å; L607-R625 CarbonylContact O-C 3.55Å; L607-R625 VanDerWaalsContact O-CA 3.3Å; L607-R625 WeakPolarHBondContact O-CA 3.35Å; L607-V626 HydrophobicContact CB-CB 4.33Å; L607-V626 PolarHBondContact N-O 2.73Å; L607-V626 PolarHBondContact O-N 2.79Å; L607-L629 HydrophobicContact CB-CD1 4.31Å
608	Q	93.5	Very high	89.2	Confident	86 Å²	86	61 Å²	61	40%	0.402	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	140.3	168	-54.5	-168.7	0.9	0	0	108.9	A561 T562 G624 R625	A561-Q608 WeakPolarHBondContact CA-O 3.42Å; T562-Q608 PolarHBondContact N-O 3.28Å; T562-Q608 PolarHBondContact O-N 3.5Å; Q608-G624 WeakPolarHBondContact CA-O 3.38Å; Q608-R625 HydrophobicContact CG-CG 4.22Å
609	Y	95.1	Very high	89.4	Confident	23 Å²	23	68 Å²	68	9%	0.09	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	155.1	176.9	74.1	-94.3	0	0	0	112.1	V516 F517 F559 E560 L611 S623 G624 V626	V516-Y609 HydrophobicContact CG1-CD1 3.55Å; V516-Y609 HydrophobicContact CG1-CE1 3.33Å; V516-Y609 HydrophobicContact CG1-CE2 4.41Å; V516-Y609 HydrophobicContact CG1-CG 4.16Å; V516-Y609 PolarHBondContact O-OH 3.33Å; F517-Y609 HydrophobicContact CB-CE2 4.41Å; F559-Y609 AromaticContact CE2-CD2 3.82Å; F559-Y609 HydrophobicContact CE2-CD2 3.82Å; F559-Y609 AromaticContact CE2-CG 3.92Å; F559-Y609 HydrophobicContact CE2-CG 3.92Å; F559-Y609 VanDerWaalsContact CZ-CB 3.47Å; F559-Y609 HydrophobicContact CZ-CD2 4.41Å; F559-Y609 HydrophobicContact CZ-CG 4.04Å; E560-Y609 CarbonylContact O-C 3.51Å; E560-Y609 VanDerWaalsContact O-CA 3.24Å; E560-Y609 WeakPolarHBondContact O-CA 3.29Å; Y609-L611 HydrophobicContact CD2-CB 4.32Å; Y609-L611 HydrophobicContact CE2-CB 4.37Å; Y609-S623 VanDerWaalsContact O-CA 3.24Å; Y609-S623 WeakPolarHBondContact O-CA 3.01Å; Y609-S623 WeakPolarHBondContact O-CB 3.49Å; Y609-G624 PolarHBondContact N-O 3.22Å; Y609-G624 PolarHBondContact O-N 3.2Å; Y609-G624 VanDerWaalsContact O-N 3.1Å; Y609-V626 HydrophobicContact CD1-CG2 3.99Å; Y609-V626 HydrophobicContact CE1-CG2 4.19Å
610	R	95.7	Very high	89.5	Confident	130 Å²	130	68.8 Å²	68.8	49%	0.491	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.4	163.3	-176.5	-175.4	-66.1	146.4	-8.5	108.5	F559 E560 E622	F559-R610 WeakPolarHBondContact CA-O 3.34Å; E560-R610 HydrophobicContact CB-CB 4.29Å; E560-R610 PolarHBondContact N-O 3.41Å; E560-R610 PolarHBondContact O-N 3.47Å; E560-R610 WeakPolarHBondContact OE2-CD 3.43Å; E560-R610 IonicContact OE2-CZ 2.74Å; E560-R610 IonicContact OE2-NE 3.18Å; E560-R610 IonicContact OE2-NH1 2.94Å; E560-R610 PolarHBondContact OE2-NH1 2.92Å; R610-E622 CarbonylContact C-O 3.49Å; R610-E622 WeakPolarHBondContact CA-O 3.4Å
611	L	96.3	Very high	89.9	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	117.7	177.3	172.7	65.7	0	0	0	107.9	F517 L522 V524 I557 F559 Y609 F613 S621 E622	F517-L611 HydrophobicContact CB-CD2 4.27Å; F517-L611 HydrophobicContact CD1-CD2 3.46Å; F517-L611 VanDerWaalsContact CD1-CD2 3.46Å; F517-L611 HydrophobicContact CE1-CD2 3.87Å; F517-L611 HydrophobicContact CG-CD2 3.84Å; L522-L611 HydrophobicContact CD2-CD2 4.04Å; V524-L611 HydrophobicContact CG2-CD1 4.48Å; V524-L611 HydrophobicContact CG2-CD2 3.72Å; I557-L611 HydrophobicContact CG2-CD1 4.3Å; F559-L611 HydrophobicContact CD2-CB 4.33Å; F559-L611 HydrophobicContact CD2-CD1 4.23Å; Y609-L611 HydrophobicContact CD2-CB 4.32Å; Y609-L611 HydrophobicContact CE2-CB 4.37Å; L611-F613 HydrophobicContact CD2-CD1 4.32Å; L611-F613 HydrophobicContact CD2-CE1 4.19Å; L611-F613 HydrophobicContact CG-CD1 3.98Å; L611-F613 HydrophobicContact CG-CE1 4.26Å; L611-S621 CarbonylContact O-C 3.59Å; L611-S621 WeakPolarHBondContact O-CA 3.39Å; L611-E622 PolarHBondContact N-O 2.83Å; L611-E622 PolarHBondContact O-N 2.97Å
612	S	95.7	Very high	90.5	Very high	28 Å²	28	68.9 Å²	68.9	20%	0.196	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	139.9	172.6	59.1	0	0	0	0	110.6	N556 I557 H558 H620	N556-S612 VanDerWaalsContact O-O 3.13Å; I557-S612 WeakPolarHBondContact CA-O 3.23Å; H558-S612 PolarHBondContact N-O 3.07Å; H558-S612 PolarHBondContact O-N 3.16Å; S612-H620 VanDerWaalsContact CA-O 3.31Å; S612-H620 WeakPolarHBondContact CA-O 3.27Å
613	F	95.8	Very high	91	Very high	1 Å²	1	67.1 Å²	67.1	0%	0.004	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	163.5	179.2	59.5	-81.6	0	0	0	110.6	F517 H520 L522 I557 L611 M615 H620	F517-F613 HydrophobicContact CE1-CE1 4.35Å; F517-F613 HydrophobicContact CE1-CZ 4.49Å; H520-F613 HydrophobicContact CB-CE2 4.14Å; H520-F613 HydrophobicContact CB-CZ 3.97Å; H520-F613 AromaticContact CD2-CZ 3.96Å; L522-F613 HydrophobicContact CB-CZ 4.45Å; L522-F613 HydrophobicContact CD2-CB 4.4Å; L522-F613 HydrophobicContact CD2-CD1 3.62Å; L522-F613 HydrophobicContact CD2-CD2 4.01Å; L522-F613 HydrophobicContact CD2-CE1 3.74Å; L522-F613 HydrophobicContact CD2-CE2 4.12Å; L522-F613 HydrophobicContact CD2-CG 3.75Å; L522-F613 HydrophobicContact CD2-CZ 3.98Å; I557-F613 HydrophobicContact CG1-CB 3.86Å; L611-F613 HydrophobicContact CD2-CD1 4.32Å; L611-F613 HydrophobicContact CD2-CE1 4.19Å; L611-F613 HydrophobicContact CG-CD1 3.98Å; L611-F613 HydrophobicContact CG-CE1 4.26Å; F613-M615 HydrophobicContact CD2-CG 4.03Å; F613-M615 HydrophobicContact CD2-SD 4.13Å; F613-M615 HydrophobicContact CE2-CG 4.17Å; F613-M615 HydrophobicContact CE2-SD 3.72Å; F613-H620 HydrophobicContact CD1-CB 4.09Å; F613-H620 HydrophobicContact CD2-CB 4.16Å; F613-H620 HydrophobicContact CE1-CB 3.66Å; F613-H620 HydrophobicContact CE2-CB 3.74Å; F613-H620 AromaticContact CE2-CD2 3.85Å; F613-H620 AromaticContact CE2-CG 3.85Å; F613-H620 HydrophobicContact CG-CB 4.33Å; F613-H620 HydrophobicContact CZ-CB 3.48Å; F613-H620 VanDerWaalsContact CZ-CB 3.48Å; F613-H620 AromaticContact CZ-CG 3.86Å; F613-H620 PolarHBondContact N-O 3.47Å; F613-H620 PolarHBondContact O-N 2.64Å
614	S	93.3	Very high	91.4	Very high	16 Å²	16	64.2 Å²	64.2	11%	0.112	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135.6	174.6	-58.5	0	0	0	0	109.4	A554 T555 N556 Q618	A554-S614 CarbonylContact C-O 3.52Å; A554-S614 VanDerWaalsContact CA-O 3.28Å; A554-S614 WeakPolarHBondContact CA-O 3.25Å; T555-S614 PolarHBondContact N-O 3.38Å; T555-S614 PolarHBondContact O-N 3.29Å; N556-S614 PolarHBondContact ND2-OG 2.7Å; S614-Q618 CarbonylContact C-O 3.57Å; S614-Q618 WeakPolarHBondContact CA-O 3.37Å
615	M	91	Very high	91.8	Very high	24 Å²	24	63.9 Å²	63.9	12%	0.118	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	108.4	173.4	-86.3	178.6	56	0	0	109.1	H520 A550 I552 A554 F613 E617 Q618	H520-M615 WeakPolarHBondContact O-CE 3.36Å; A550-M615 HydrophobicContact CB-CE 3.39Å; A550-M615 HydrophobicContact CB-SD 4.4Å; I552-M615 HydrophobicContact CD1-CB 4.07Å; I552-M615 HydrophobicContact CD1-CE 4.1Å; I552-M615 HydrophobicContact CG1-CE 3.98Å; A554-M615 HydrophobicContact CB-CG 3.73Å; A554-M615 HydrophobicContact CB-SD 4.37Å; F613-M615 HydrophobicContact CD2-CG 4.03Å; F613-M615 HydrophobicContact CD2-SD 4.13Å; F613-M615 HydrophobicContact CE2-CG 4.17Å; F613-M615 HydrophobicContact CE2-SD 3.72Å; M615-E617 PolarHBondContact O-N 2.76Å; M615-Q618 PolarHBondContact N-O 3.21Å; M615-Q618 PolarHBondContact O-N 2.98Å; M615-Q618 VanDerWaalsContact O-N 3.15Å
616	G	84.4	Confident	92.1	Very high	54 Å²	54	64.1 Å²	64.1	56%	0.557	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	-124.5	-164.4	0	0	0	0	0	110.4
617	E	84.8	Confident	92	Very high	206 Å²	206	66 Å²	66	96%	0.963	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-8.1	177.4	-59.8	-172	163.4	0	0	113.7	M615	M615-E617 PolarHBondContact O-N 2.76Å
618	Q	88.4	Confident	91.5	Very high	125 Å²	125	73 Å²	73	58%	0.584	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	125	-175.1	-167.1	171.3	-10.8	0	0	111.5	S614 M615 H620	S614-Q618 CarbonylContact C-O 3.57Å; S614-Q618 WeakPolarHBondContact CA-O 3.37Å; M615-Q618 PolarHBondContact N-O 3.21Å; M615-Q618 PolarHBondContact O-N 2.98Å; M615-Q618 VanDerWaalsContact O-N 3.15Å; Q618-H620 WeakPolarHBondContact CG-NE2 3.38Å; Q618-H620 PolarHBondContact NE2-CE1 3.04Å
619	Q	93.2	Very high	91.2	Very high	148 Å²	148	70.2 Å²	70.2	69%	0.692	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	132.9	173.7	-169.6	176.9	7.8	0	0	110.7
620	H	92.1	Very high	90.8	Very high	17 Å²	17	69.9 Å²	69.9	8%	0.079	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	145.4	177.4	-64.9	-94.7	0	0	0	109.8	H520 S612 F613 Q618	H520-H620 AromaticContact CD2-CE1 3.87Å; H520-H620 AromaticContact CD2-ND1 3.33Å; H520-H620 PolarHBondContact CD2-ND1 3.12Å; H520-H620 VanDerWaalsContact CD2-ND1 3.33Å; H520-H620 AromaticContact CE1-CE1 3.48Å; H520-H620 PolarHBondContact CE1-CE1 3.17Å; H520-H620 VanDerWaalsContact CE1-CE1 3.48Å; H520-H620 AromaticContact CE1-ND1 3.44Å; H520-H620 PolarHBondContact CE1-ND1 2.93Å; H520-H620 AromaticContact CG-CE1 3.67Å; H520-H620 AromaticContact CG-ND1 3.6Å; H520-H620 AromaticContact ND1-CE1 3.41Å; H520-H620 PolarHBondContact ND1-CE1 2.74Å; H520-H620 AromaticContact ND1-ND1 3.66Å; H520-H620 AromaticContact NE2-CE1 3.75Å; H520-H620 AromaticContact NE2-ND1 3.21Å; H520-H620 PolarHBondContact NE2-ND1 3.31Å; S612-H620 VanDerWaalsContact CA-O 3.31Å; S612-H620 WeakPolarHBondContact CA-O 3.27Å; F613-H620 HydrophobicContact CD1-CB 4.09Å; F613-H620 HydrophobicContact CD2-CB 4.16Å; F613-H620 HydrophobicContact CE1-CB 3.66Å; F613-H620 HydrophobicContact CE2-CB 3.74Å; F613-H620 AromaticContact CE2-CD2 3.85Å; F613-H620 AromaticContact CE2-CG 3.85Å; F613-H620 HydrophobicContact CG-CB 4.33Å; F613-H620 HydrophobicContact CZ-CB 3.48Å; F613-H620 VanDerWaalsContact CZ-CB 3.48Å; F613-H620 AromaticContact CZ-CG 3.86Å; F613-H620 PolarHBondContact N-O 3.47Å; F613-H620 PolarHBondContact O-N 2.64Å; Q618-H620 WeakPolarHBondContact CG-NE2 3.38Å; Q618-H620 PolarHBondContact NE2-CE1 3.04Å
621	S	94.1	Very high	90.3	Very high	77 Å²	77	67.8 Å²	67.8	54%	0.538	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	93.6	179.4	169.3	0	0	0	0	109.5	L611	L611-S621 CarbonylContact O-C 3.59Å; L611-S621 WeakPolarHBondContact O-CA 3.39Å
622	E	94.5	Very high	89.7	Confident	71 Å²	71	68.9 Å²	68.9	33%	0.332	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	150.6	-175.4	-64.6	-58.9	142.4	0	0	111.1	F517 H520 R610 L611	F517-E622 HydrophobicContact CD2-CB 4.24Å; F517-E622 HydrophobicContact CE2-CB 3.71Å; F517-E622 HydrophobicContact CE2-CG 3.58Å; F517-E622 HydrophobicContact CZ-CB 4.24Å; F517-E622 HydrophobicContact CZ-CG 3.77Å; H520-E622 IonicContact NE2-OE1 2.76Å; R610-E622 CarbonylContact C-O 3.49Å; R610-E622 WeakPolarHBondContact CA-O 3.4Å; L611-E622 PolarHBondContact N-O 2.83Å; L611-E622 PolarHBondContact O-N 2.97Å
623	S	93.3	Very high	89.1	Confident	90 Å²	90	75.2 Å²	75.2	63%	0.629	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.2	139.4	177.5	66.1	0	0	0	0	111.6	Y609	Y609-S623 VanDerWaalsContact O-CA 3.24Å; Y609-S623 WeakPolarHBondContact O-CA 3.01Å; Y609-S623 WeakPolarHBondContact O-CB 3.49Å
624	G	91.9	Very high	88.5	Confident	22 Å²	22	80.6 Å²	80.6	23%	0.227	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	-177.9	-174.7	0	0	0	0	0	113.3	Q608 Y609	Q608-G624 WeakPolarHBondContact CA-O 3.38Å; Y609-G624 PolarHBondContact N-O 3.22Å; Y609-G624 PolarHBondContact O-N 3.2Å; Y609-G624 VanDerWaalsContact O-N 3.1Å
625	R	91.9	Very high	88.2	Confident	158 Å²	158	81 Å²	81	60%	0.596	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.2	140.2	177.2	-55.4	-168.2	-177.2	175.1	3.8	110.3	L607 Q608	L607-R625 CarbonylContact O-C 3.55Å; L607-R625 VanDerWaalsContact O-CA 3.3Å; L607-R625 WeakPolarHBondContact O-CA 3.35Å; Q608-R625 HydrophobicContact CG-CG 4.22Å
626	V	90.8	Very high	87.6	Confident	10 Å²	10	81.2 Å²	81.2	6%	0.061	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	115.4	176.8	-175.5	0	0	0	0	108.3	I514 V516 F526 L607 Y609 L629	I514-V626 HydrophobicContact CD1-CG1 3.55Å; V516-V626 HydrophobicContact CB-CG2 4.3Å; V516-V626 HydrophobicContact CG1-CG2 3.65Å; V516-V626 HydrophobicContact CG2-CG2 3.88Å; F526-V626 HydrophobicContact CE2-CG1 4.48Å; F526-V626 HydrophobicContact CE2-CG2 4.34Å; L607-V626 HydrophobicContact CB-CB 4.33Å; L607-V626 PolarHBondContact N-O 2.73Å; L607-V626 PolarHBondContact O-N 2.79Å; Y609-V626 HydrophobicContact CD1-CG2 3.99Å; Y609-V626 HydrophobicContact CE1-CG2 4.19Å; V626-L629 HydrophobicContact CG1-CD2 4.32Å; V626-L629 HydrophobicContact CG1-CG 4.36Å
627	E	84.3	Confident	87.5	Confident	99 Å²	99	84.2 Å²	84.2	46%	0.463	43%	0.428	S	S	.	.			trans	-111.2	-9.1	178.8	-69.4	-177.7	-159.3	0	0	113.3	Q606 L629	Q606-E627 HydrophobicContact CB-CG 4.41Å; Q606-E627 HydrophobicContact CG-CG 3.85Å; Q606-E627 PolarHBondContact NE2-OE1 3.29Å; E627-L629 VanDerWaalsContact C-N 3.27Å; E627-L629 PolarHBondContact O-N 3.37Å
628	Q	82.3	Confident	87.3	Confident	149 Å²	149	75.2 Å²	75.2	70%	0.696	39%	0.386	S	S	*	.			trans	-92.7	47.8	-176	-62.9	177.2	-0.6	0	0	111.2	I514	I514-Q628 HydrophobicContact CD1-CB 4.46Å
629	L	86.6	Confident	87.3	Confident	26 Å²	26	72.8 Å²	72.8	14%	0.136	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-86.9	150	175.1	-67.7	172.2	0	0	0	110.7	F528 L597 V605 L607 V626 E627	F528-L629 HydrophobicContact CE1-CD2 3.74Å; F528-L629 HydrophobicContact CZ-CD2 4.07Å; L597-L629 HydrophobicContact CD1-CD1 4.03Å; L597-L629 HydrophobicContact CD1-CD2 4.49Å; V605-L629 HydrophobicContact CB-CD1 3.74Å; V605-L629 HydrophobicContact CG1-CD1 3.62Å; L607-L629 HydrophobicContact CB-CD1 4.31Å; V626-L629 HydrophobicContact CG1-CD2 4.32Å; V626-L629 HydrophobicContact CG1-CG 4.36Å; E627-L629 VanDerWaalsContact C-N 3.27Å; E627-L629 PolarHBondContact O-N 3.37Å
630	P	86.8	Confident	87	Confident	16 Å²	16	68.8 Å²	68.8	10%	0.104	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-60.9	148.1	179.1	-21.6	32.7	0	0	0	112.4	L511 F528 W635 L638	L511-P630 HydrophobicContact CD1-CB 3.8Å; L511-P630 HydrophobicContact CD1-CG 3.52Å; F528-P630 HydrophobicContact CB-CG 4.32Å; F528-P630 HydrophobicContact CD1-CG 3.65Å; F528-P630 HydrophobicContact CD2-CG 3.82Å; F528-P630 VanDerWaalsContact CE1-CD 3.45Å; F528-P630 HydrophobicContact CE1-CG 3.9Å; F528-P630 HydrophobicContact CE2-CG 4.04Å; F528-P630 HydrophobicContact CG-CG 3.62Å; F528-P630 HydrophobicContact CZ-CG 4.08Å; P630-W635 PolarHBondContact O-NE1 2.75Å; P630-L638 HydrophobicContact CB-CD1 3.92Å; P630-L638 HydrophobicContact CB-CD2 3.95Å; P630-L638 HydrophobicContact CG-CD1 3.95Å
631	D	85.5	Confident	86.7	Confident	86 Å²	86	71.7 Å²	71.7	46%	0.46	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-52.5	126.8	179.3	-59.4	-51.2	0	0	0	111.4	E633 K634 W635	D631-E633 PolarHBondContact O-N 2.99Å; D631-K634 HydrophobicContact CB-CD 4.11Å; D631-K634 HydrophobicContact CB-CG 4.27Å; D631-K634 PolarHBondContact O-N 2.87Å; D631-K634 WeakPolarHBondContact OD2-CE 3.39Å; D631-K634 IonicContact OD2-NZ 3.21Å; D631-K634 PolarHBondContact OD2-NZ 2.9Å; D631-W635 PolarHBondContact O-NE1 2.65Å
632	P	83.9	Confident	86.2	Confident	24 Å²	24	71.4 Å²	71.4	16%	0.156	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-16.9	-180	-27.5	35.5	0	0	0	115.6	N599 K602 E603 W635	N599-P632 WeakPolarHBondContact ND2-CG 3.21Å; K602-P632 HydrophobicContact CB-CB 3.85Å; K602-P632 HydrophobicContact CG-CB 4.22Å; E603-P632 WeakPolarHBondContact O-CG 3.43Å; P632-W635 HydrophobicContact CG-CZ2 4.45Å
633	E	83.1	Confident	85.7	Confident	160 Å²	160	71.4 Å²	71.4	75%	0.748	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-22.9	175.4	-60.2	-173.5	155.6	0	0	113.6	K602 D631	K602-E633 HydrophobicContact CD-CG 4.47Å; D631-E633 PolarHBondContact O-N 2.99Å
634	K	83.3	Confident	85.2	Confident	115 Å²	115	70.1 Å²	70.1	50%	0.5	35%	0.35	S	S	.	.	S	Bend	trans	-97.9	-3.9	-177	-60.2	173.2	-176.9	157.9	0	113	D631 G636 N637 L638	D631-K634 HydrophobicContact CB-CD 4.11Å; D631-K634 HydrophobicContact CB-CG 4.27Å; D631-K634 PolarHBondContact O-N 2.87Å; D631-K634 WeakPolarHBondContact OD2-CE 3.39Å; D631-K634 IonicContact OD2-NZ 3.21Å; D631-K634 PolarHBondContact OD2-NZ 2.9Å; K634-G636 PolarHBondContact O-N 2.89Å; K634-N637 CarbonylContact O-C 3.4Å; K634-N637 PolarHBondContact O-N 3.19Å; K634-L638 HydrophobicContact CB-CD2 3.56Å; K634-L638 WeakPolarHBondContact O-CD2 3.33Å
635	W	85.3	Confident	84.7	Confident	23 Å²	23	73.6 Å²	73.6	9%	0.087	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	130.5	179.1	-67.1	10.6	0	0	0	110.1	D538 L540 L597 N599 V605 P630 D631 P632	D538-W635 WeakPolarHBondContact O-CZ3 3.42Å; L540-W635 HydrophobicContact CB-CD2 3.65Å; L540-W635 HydrophobicContact CB-CE3 3.65Å; L540-W635 HydrophobicContact CB-CG 4.3Å; L540-W635 HydrophobicContact CB-CH2 3.78Å; L540-W635 HydrophobicContact CB-CZ2 3.83Å; L540-W635 HydrophobicContact CB-CZ3 3.69Å; L540-W635 HydrophobicContact CD1-CG 4.42Å; L540-W635 HydrophobicContact CD2-CH2 4.45Å; L540-W635 HydrophobicContact CD2-CZ2 3.83Å; L540-W635 HydrophobicContact CG-CD2 4.48Å; L540-W635 HydrophobicContact CG-CZ2 4.44Å; L597-W635 HydrophobicContact CB-CH2 4.27Å; L597-W635 VanDerWaalsContact O-CZ3 3.24Å; L597-W635 WeakPolarHBondContact O-CZ3 3.47Å; N599-W635 HydrophobicContact CB-CE3 4.33Å; N599-W635 HydrophobicContact CB-CH2 3.42Å; N599-W635 VanDerWaalsContact CB-CH2 3.42Å; N599-W635 HydrophobicContact CB-CZ2 4.43Å; N599-W635 HydrophobicContact CB-CZ3 3.36Å; V605-W635 HydrophobicContact CG2-CH2 4.12Å; V605-W635 HydrophobicContact CG2-CZ2 4.19Å; P630-W635 PolarHBondContact O-NE1 2.75Å; D631-W635 PolarHBondContact O-NE1 2.65Å; P632-W635 HydrophobicContact CG-CZ2 4.45Å
636	G	78.8	Confident	84.2	Confident	29 Å²	29	67.1 Å²	67.1	30%	0.299	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	-0.4	-172.4	0	0	0	0	0	115.6	R530 S532 K634	R530-G636 CarbonylContact O-C 3.52Å; S532-G636 WeakPolarHBondContact OG-CA 3.45Å; S532-G636 PolarHBondContact OG-N 2.98Å; K634-G636 PolarHBondContact O-N 2.89Å
637	N	83.4	Confident	83.6	Confident	118 Å²	118	71.8 Å²	71.8	63%	0.631	36%	0.364	S	S	*	.			trans	-150.6	63.1	168.6	-170.7	36.2	0	0	0	111.1	R530 K634	R530-N637 PolarHBondContact O-N 2.93Å; K634-N637 CarbonylContact O-C 3.4Å; K634-N637 PolarHBondContact O-N 3.19Å
638	L	80.6	Confident	83.6	Confident	17 Å²	17	69.4 Å²	69.4	9%	0.089	36%	0.355	C	S	.	.			trans	-99.1	0	180	-58.4	-179.5	0	0	0	113.7	S509 S510 L511 F528 R530 L540 P630 K634	S509-L638 VanDerWaalsContact CA-O 3.27Å; S509-L638 WeakPolarHBondContact CA-O 3.24Å; S509-L638 VanDerWaalsContact CB-C 3.41Å; S509-L638 WeakPolarHBondContact CB-O 3.39Å; S509-L638 WeakPolarHBondContact CB-OXT 3.36Å; S510-L638 WeakPolarHBondContact CB-OXT 3.09Å; S510-L638 PolarHBondContact N-O 3.43Å; S510-L638 PolarHBondContact N-OXT 3.18Å; S510-L638 PolarHBondContact OG-OXT 3.35Å; L511-L638 HydrophobicContact CD1-CB 4.24Å; L511-L638 HydrophobicContact CD1-CD1 4.24Å; L511-L638 HydrophobicContact CD1-CD2 4.15Å; L511-L638 HydrophobicContact CD1-CG 4.46Å; L511-L638 HydrophobicContact CG-CB 4.49Å; F528-L638 HydrophobicContact CB-CD1 4.12Å; R530-L638 WeakPolarHBondContact CA-O 3.28Å; R530-L638 WeakPolarHBondContact CB-O 3.31Å; R530-L638 WeakPolarHBondContact CG-O 3.39Å; R530-L638 PolarHBondContact O-N 2.7Å; R530-L638 VanDerWaalsContact O-N 3.17Å; L540-L638 HydrophobicContact CD1-CD1 3.54Å; P630-L638 HydrophobicContact CB-CD1 3.92Å; P630-L638 HydrophobicContact CB-CD2 3.95Å; P630-L638 HydrophobicContact CG-CD1 3.95Å; K634-L638 HydrophobicContact CB-CD2 3.56Å; K634-L638 WeakPolarHBondContact O-CD2 3.33Å

Retrieved 638 of 638 residues in 360 ms (Link to these results)

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