A0A077Z2L0_TRITR Loading...

T-complex protein 1 subunit gamma

AlphaFold DB , UniProt , Accession A0A077Z2L0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 545 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	38.5	Very low	45.5	Very low	240 Å²	240	155.3 Å²	155.3	100%	1.182	84%	0.839	S	S	*	*				0	125.4	0	-85.2	178.3	-174.9	0	0	108	A3	M1-A3 PolarHBondContact O-N 3.45Å
2	F	37	Very low	46.5	Very low	222 Å²	222	156 Å²	156	97%	0.974	84%	0.841	S	S	*	*			trans	-70.7	116.1	-160.9	-74	-100.3	0	0	0	113.2
3	A	41.6	Very low	47.7	Very low	97 Å²	97	148.9 Å²	148.9	80%	0.802	80%	0.802	S	S	*	*			trans	-90.3	106.6	163.7	0	0	0	0	0	108.7	M1 K5	M1-A3 PolarHBondContact O-N 3.45Å; A3-K5 PolarHBondContact O-N 3.44Å; A3-K5 VanDerWaalsContact O-N 3.17Å
4	A	43	Very low	49	Very low	96 Å²	96	143.1 Å²	143.1	79%	0.793	78%	0.779	S	S	*	*			trans	-61.9	112.5	172.9	0	0	0	0	0	109.7	R6	A4-R6 PolarHBondContact O-N 3.12Å
5	K	42.6	Very low	49.9	Very low	207 Å²	207	147.6 Å²	147.6	90%	0.9	79%	0.792	S	S	*	*			trans	-62.7	106.2	167.2	-79.9	-176.9	174.8	-178.6	0	107.9	A3 A7	A3-K5 PolarHBondContact O-N 3.44Å; A3-K5 VanDerWaalsContact O-N 3.17Å; K5-A7 PolarHBondContact O-N 2.96Å
6	R	42	Very low	50.9	Low	238 Å²	238	143.8 Å²	143.8	90%	0.898	78%	0.781	S	S	*	*			trans	-58.4	115.2	166.8	-77.8	179.8	169.8	172.7	-3.7	108	A4 V8	A4-R6 PolarHBondContact O-N 3.12Å; R6-V8 PolarHBondContact O-N 3.24Å
7	A	43.9	Very low	51.8	Low	97 Å²	97	137.1 Å²	137.1	80%	0.802	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-63.9	118.4	171	0	0	0	0	0	108.5	K5	K5-A7 PolarHBondContact O-N 2.96Å
8	V	52.3	Low	53	Low	126 Å²	126	138.5 Å²	138.5	76%	0.764	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-71	125	171.4	-176.8	0	0	0	0	106.7	R6 I10	R6-V8 PolarHBondContact O-N 3.24Å; V8-I10 PolarHBondContact O-N 2.65Å
9	P	47.9	Very low	54.3	Low	104 Å²	104	134.8 Å²	134.8	68%	0.675	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-62	122.2	178.1	24.1	-31.1	0	0	0	109.5	I11	P9-I11 PolarHBondContact O-N 2.97Å
10	I	50.6	Low	55.5	Low	155 Å²	155	133.7 Å²	133.7	80%	0.795	71%	0.711	S	S	*	*			trans	-77.5	105.7	171.7	-60	172	0	0	0	106.5	V8 L12	V8-I10 PolarHBondContact O-N 2.65Å; I10-L12 PolarHBondContact O-N 3.09Å
11	I	60.6	Low	56.7	Low	126 Å²	126	134.1 Å²	134.1	65%	0.646	70%	0.703	S	S	*	*			trans	-80.9	106.8	171.3	-57.9	173.3	0	0	0	106.9	P9 L13	P9-I11 PolarHBondContact O-N 2.97Å; I11-L13 HydrophobicContact CG2-CD2 4.14Å; I11-L13 HydrophobicContact CG2-CG 4.48Å; I11-L13 PolarHBondContact O-N 3.21Å
12	L	58.1	Low	58.7	Low	164 Å²	164	124.3 Å²	124.3	86%	0.859	66%	0.663	S	S	*	*			trans	-75.8	102.8	170.6	-85.6	152.2	0	0	0	108.5	I10	I10-L12 PolarHBondContact O-N 3.09Å
13	L	61.7	Low	60.6	Low	64 Å²	64	118.4 Å²	118.4	34%	0.335	64%	0.639	S	S	.	*			trans	-76.9	143.6	169.4	-64.8	173.7	0	0	0	109.5	I11 T17 Q19 L530	I11-L13 HydrophobicContact CG2-CD2 4.14Å; I11-L13 HydrophobicContact CG2-CG 4.48Å; I11-L13 PolarHBondContact O-N 3.21Å; L13-T17 HydrophobicContact CD2-CG2 4.13Å; L13-Q19 HydrophobicContact CD1-CB 4.17Å; L13-Q19 HydrophobicContact CD1-CG 4.48Å; L13-L530 HydrophobicContact CD1-CD2 4.23Å; L13-L530 HydrophobicContact CD2-CD2 4.09Å
14	S	66.1	Low	62.6	Low	68 Å²	68	117.2 Å²	117.2	48%	0.476	63%	0.629	S	S	.	*			trans	-65	145.5	169.2	61.5	0	0	0	0	109.5	S16 T17	S14-S16 PolarHBondContact O-N 3.36Å; S14-S16 PolarHBondContact OG-OG 3.3Å; S14-T17 WeakPolarHBondContact O-CB 3.43Å; S14-T17 PolarHBondContact O-N 2.93Å; S14-T17 PolarHBondContact O-OG1 3.39Å; S14-T17 PolarHBondContact OG-OG1 2.96Å
15	E	62.3	Low	64.6	Low	210 Å²	210	112.7 Å²	112.7	98%	0.981	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.2	-21.6	-176.8	-67.4	-178.4	163.3	0	0	114
16	S	65.7	Low	66.4	Low	87 Å²	87	103.4 Å²	103.4	61%	0.608	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-9.2	176.8	55.4	0	0	0	0	114.6	S14 K18	S14-S16 PolarHBondContact O-N 3.36Å; S14-S16 PolarHBondContact OG-OG 3.3Å; S16-K18 PolarHBondContact O-N 2.98Å
17	T	67.2	Low	68.3	Low	30 Å²	30	94.9 Å²	94.9	18%	0.184	52%	0.523	C	S	.	.			trans	-81.6	116	-174.8	-53.6	0	0	0	0	109.9	L13 S14 L530 S531	L13-T17 HydrophobicContact CD2-CG2 4.13Å; S14-T17 WeakPolarHBondContact O-CB 3.43Å; S14-T17 PolarHBondContact O-N 2.93Å; S14-T17 PolarHBondContact O-OG1 3.39Å; S14-T17 PolarHBondContact OG-OG1 2.96Å; T17-L530 HydrophobicContact CG2-CD2 4.2Å; T17-S531 WeakPolarHBondContact CA-O 3.47Å; T17-S531 WeakPolarHBondContact CG2-O 3.31Å
18	K	72.5	Confident	70.3	Confident	162 Å²	162	91.1 Å²	91.1	70%	0.704	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	132.4	169.3	-68.9	-175.9	179.5	-178.6	0	108.8	S16 S531	S16-K18 PolarHBondContact O-N 2.98Å; K18-S531 PolarHBondContact N-O 2.83Å; K18-S531 PolarHBondContact O-N 2.7Å
19	Q	77.2	Confident	72	Confident	68 Å²	68	85.2 Å²	85.2	32%	0.318	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	121.8	-178.8	175.1	174.7	64.9	0	0	109.1	L13 R21 E528 L530	L13-Q19 HydrophobicContact CD1-CB 4.17Å; L13-Q19 HydrophobicContact CD1-CG 4.48Å; Q19-R21 HydrophobicContact CG-CG 3.83Å; Q19-E528 HydrophobicContact CG-CG 4.23Å; Q19-E528 VanDerWaalsContact NE2-CD 3.32Å; Q19-E528 PolarHBondContact NE2-OE1 3.12Å; Q19-L530 HydrophobicContact CB-CD2 4.06Å; Q19-L530 HydrophobicContact CG-CD2 3.99Å
20	E	79.7	Confident	73.6	Confident	113 Å²	113	80.6 Å²	80.6	53%	0.528	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	136	168.2	-64.1	177.7	-174	0	0	107.4	V25 E528 I529	E20-V25 HydrophobicContact CB-CG2 3.5Å; E20-V25 VanDerWaalsContact O-CG2 3.23Å; E20-V25 WeakPolarHBondContact O-CG2 3.46Å; E20-E528 WeakPolarHBondContact O-CA 3.49Å; E20-E528 WeakPolarHBondContact O-CG 3.36Å; E20-I529 PolarHBondContact N-O 3.46Å; E20-I529 PolarHBondContact O-N 3.01Å; E20-I529 VanDerWaalsContact O-N 3.09Å
21	R	81.3	Confident	75.3	Confident	142 Å²	142	79.9 Å²	79.9	54%	0.536	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	151.2	-172.4	-85.1	177.7	162.5	170.6	2.4	112.8	Q19 D527 E528	Q19-R21 HydrophobicContact CG-CG 3.83Å; R21-D527 CarbonylContact C-O 3.41Å; R21-E528 HydrophobicContact CG-CB 4.34Å; R21-E528 HydrophobicContact CG-CG 3.7Å; R21-E528 IonicContact CZ-OE2 3.42Å; R21-E528 IonicContact NE-OE1 2.76Å; R21-E528 IonicContact NE-OE2 3.6Å; R21-E528 PolarHBondContact NE-OE2 3.33Å; R21-E528 IonicContact NH2-OE1 2.88Å; R21-E528 IonicContact NH2-OE2 3.03Å; R21-E528 PolarHBondContact NH2-OE2 3.26Å; R21-E528 VanDerWaalsContact NH2-OE2 3.1Å
22	G	78.5	Confident	76.5	Confident	34 Å²	34	74.5 Å²	74.5	35%	0.351	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	-153.9	167.5	0	0	0	0	0	113.3	A24 V25 D527	G22-A24 PolarHBondContact O-N 3.44Å; G22-A24 VanDerWaalsContact O-N 3.15Å; G22-V25 WeakPolarHBondContact O-CB 3.48Å; G22-V25 PolarHBondContact O-N 3.22Å; G22-V25 VanDerWaalsContact O-N 3.08Å; G22-D527 PolarHBondContact N-O 3.24Å
23	H	78	Confident	77.9	Confident	99 Å²	99	66.7 Å²	66.7	46%	0.458	36%	0.355	S	S	.	.	H	α-helix	trans	-60.3	-26.8	-175.6	-67.1	-62.3	0	0	0	113.8	V25 Q26 L27	H23-V25 VanDerWaalsContact C-N 3.29Å; H23-V25 PolarHBondContact O-N 2.93Å; H23-Q26 PolarHBondContact ND1-OE1 3.48Å; H23-Q26 WeakPolarHBondContact O-CB 3.43Å; H23-Q26 PolarHBondContact O-N 3.36Å; H23-Q26 VanDerWaalsContact O-N 3.17Å; H23-L27 WeakPolarHBondContact O-CG 3.35Å; H23-L27 PolarHBondContact O-N 3.09Å
24	A	82.6	Confident	79	Confident	72 Å²	72	69.1 Å²	69.1	60%	0.595	36%	0.359	S	S	*	.	H	α-helix	trans	-60	-38.8	175.9	0	0	0	0	0	112.3	G22 L27 G28	G22-A24 PolarHBondContact O-N 3.44Å; G22-A24 VanDerWaalsContact O-N 3.15Å; A24-L27 PolarHBondContact O-N 3.05Å; A24-G28 PolarHBondContact O-N 3.06Å
25	V	85.7	Confident	80	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.006	36%	0.357	C	S	.	.	H	α-helix	trans	-66.6	-42	175.5	171.5	0	0	0	0	110.9	E20 G22 H23 L27 G28 N29 I526 I529	E20-V25 HydrophobicContact CB-CG2 3.5Å; E20-V25 VanDerWaalsContact O-CG2 3.23Å; E20-V25 WeakPolarHBondContact O-CG2 3.46Å; G22-V25 WeakPolarHBondContact O-CB 3.48Å; G22-V25 PolarHBondContact O-N 3.22Å; G22-V25 VanDerWaalsContact O-N 3.08Å; H23-V25 VanDerWaalsContact C-N 3.29Å; H23-V25 PolarHBondContact O-N 2.93Å; V25-L27 VanDerWaalsContact C-N 3.35Å; V25-L27 PolarHBondContact O-N 3.14Å; V25-G28 PolarHBondContact O-N 3.25Å; V25-N29 WeakPolarHBondContact O-CB 3.49Å; V25-N29 PolarHBondContact O-N 2.83Å; V25-N29 PolarHBondContact O-ND2 3.03Å; V25-I526 HydrophobicContact CG1-CG2 4.1Å; V25-I529 HydrophobicContact CG1-CD1 3.79Å; V25-I529 HydrophobicContact CG1-CG1 3.68Å
26	Q	81.3	Confident	81.3	Confident	11 Å²	11	58.8 Å²	58.8	5%	0.051	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-44.6	178.4	-65.9	178.2	-33.8	0	0	110.9	H23 N29 I30 P125 L524 I526	H23-Q26 PolarHBondContact ND1-OE1 3.48Å; H23-Q26 WeakPolarHBondContact O-CB 3.43Å; H23-Q26 PolarHBondContact O-N 3.36Å; H23-Q26 VanDerWaalsContact O-N 3.17Å; Q26-N29 WeakPolarHBondContact O-CB 3.46Å; Q26-N29 PolarHBondContact O-N 3.36Å; Q26-I30 VanDerWaalsContact O-CD1 3.28Å; Q26-I30 WeakPolarHBondContact O-CD1 3.24Å; Q26-I30 WeakPolarHBondContact O-CG1 3.29Å; Q26-I30 PolarHBondContact O-N 2.68Å; Q26-P125 VanDerWaalsContact NE2-CG 3.32Å; Q26-L524 PolarHBondContact NE2-O 2.9Å; Q26-L524 VanDerWaalsContact NE2-O 3.1Å; Q26-I526 WeakPolarHBondContact CG-O 3.47Å
27	L	82	Confident	82.3	Confident	59 Å²	59	54.7 Å²	54.7	31%	0.309	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-44.7	174	-67.6	171.5	0	0	0	111.7	H23 A24 V25 N29 I30 E31 E116	H23-L27 WeakPolarHBondContact O-CG 3.35Å; H23-L27 PolarHBondContact O-N 3.09Å; A24-L27 PolarHBondContact O-N 3.05Å; V25-L27 VanDerWaalsContact C-N 3.35Å; V25-L27 PolarHBondContact O-N 3.14Å; L27-N29 VanDerWaalsContact C-N 3.32Å; L27-N29 PolarHBondContact O-N 3.31Å; L27-I30 HydrophobicContact CD2-CD1 4.38Å; L27-I30 WeakPolarHBondContact O-CB 3.32Å; L27-I30 PolarHBondContact O-N 3.31Å; L27-I30 VanDerWaalsContact O-N 3.13Å; L27-E31 WeakPolarHBondContact O-CG 3.25Å; L27-E31 PolarHBondContact O-N 3.22Å; L27-E116 HydrophobicContact CD2-CG 3.96Å
28	G	86	Confident	83.3	Confident	19 Å²	19	57.3 Å²	57.3	20%	0.196	29%	0.294	C	S	.	.	H	α-helix	trans	-60.4	-39.4	175.1	0	0	0	0	0	113.2	A24 V25 I30 E31 A32	A24-G28 PolarHBondContact O-N 3.06Å; V25-G28 PolarHBondContact O-N 3.25Å; G28-I30 VanDerWaalsContact C-N 3.34Å; G28-I30 PolarHBondContact O-N 3.16Å; G28-E31 PolarHBondContact O-N 2.88Å; G28-A32 VanDerWaalsContact O-CB 3.31Å; G28-A32 WeakPolarHBondContact O-CB 3.41Å; G28-A32 PolarHBondContact O-N 2.85Å
29	N	86.3	Confident	84.1	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-41.5	174.1	-69.9	-29.3	0	0	0	111.9	V25 Q26 L27 A33 H77 A79 I526	V25-N29 WeakPolarHBondContact O-CB 3.49Å; V25-N29 PolarHBondContact O-N 2.83Å; V25-N29 PolarHBondContact O-ND2 3.03Å; Q26-N29 WeakPolarHBondContact O-CB 3.46Å; Q26-N29 PolarHBondContact O-N 3.36Å; L27-N29 VanDerWaalsContact C-N 3.32Å; L27-N29 PolarHBondContact O-N 3.31Å; N29-A33 WeakPolarHBondContact O-CB 3.38Å; N29-A33 PolarHBondContact O-N 3.16Å; N29-H77 PolarHBondContact OD1-CE1 3.4Å; N29-H77 VanDerWaalsContact OD1-CE1 3.29Å; N29-A79 HydrophobicContact CB-CB 4.04Å; N29-I526 WeakPolarHBondContact ND2-CB 3.44Å
30	I	82.5	Confident	84.8	Confident	7 Å²	7	48.9 Å²	48.9	4%	0.036	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-49.8	177.7	-67	158.5	0	0	0	110.4	Q26 L27 G28 A32 A33 R34 A109 L112	Q26-I30 VanDerWaalsContact O-CD1 3.28Å; Q26-I30 WeakPolarHBondContact O-CD1 3.24Å; Q26-I30 WeakPolarHBondContact O-CG1 3.29Å; Q26-I30 PolarHBondContact O-N 2.68Å; L27-I30 HydrophobicContact CD2-CD1 4.38Å; L27-I30 WeakPolarHBondContact O-CB 3.32Å; L27-I30 PolarHBondContact O-N 3.31Å; L27-I30 VanDerWaalsContact O-N 3.13Å; G28-I30 VanDerWaalsContact C-N 3.34Å; G28-I30 PolarHBondContact O-N 3.16Å; I30-A32 VanDerWaalsContact C-N 3.32Å; I30-A32 PolarHBondContact O-N 3.49Å; I30-A33 PolarHBondContact O-N 3.41Å; I30-R34 WeakPolarHBondContact O-CB 3.01Å; I30-R34 PolarHBondContact O-N 3.46Å; I30-A109 HydrophobicContact CG2-CB 3.86Å; I30-L112 HydrophobicContact CB-CB 4.45Å; I30-L112 HydrophobicContact CD1-CB 3.5Å; I30-L112 HydrophobicContact CD1-CD1 4.28Å; I30-L112 HydrophobicContact CD1-CD2 4.04Å; I30-L112 HydrophobicContact CD1-CG 4.09Å; I30-L112 HydrophobicContact CG1-CB 3.51Å; I30-L112 HydrophobicContact CG1-CD1 3.55Å; I30-L112 HydrophobicContact CG1-CD2 4.21Å; I30-L112 HydrophobicContact CG1-CG 3.86Å; I30-L112 HydrophobicContact CG2-CB 4.05Å
31	E	85.1	Confident	85.2	Confident	140 Å²	140	45.6 Å²	45.6	65%	0.654	24%	0.244	S	C	*	.	H	α-helix	trans	-60.4	-41.8	178.8	-72.3	-178.6	175.5	0	0	111.9	L27 G28 R34 A35	L27-E31 WeakPolarHBondContact O-CG 3.25Å; L27-E31 PolarHBondContact O-N 3.22Å; G28-E31 PolarHBondContact O-N 2.88Å; E31-R34 WeakPolarHBondContact O-CB 3.4Å; E31-R34 PolarHBondContact O-N 3.32Å; E31-A35 PolarHBondContact O-N 3.04Å
32	A	87.6	Confident	85.6	Confident	14 Å²	14	41 Å²	41	12%	0.116	23%	0.231	C	C	.	.	H	α-helix	trans	-64.7	-42.9	177.1	0	0	0	0	0	112.4	G28 I30 R34 A35 I36 H77 A79 A80	G28-A32 VanDerWaalsContact O-CB 3.31Å; G28-A32 WeakPolarHBondContact O-CB 3.41Å; G28-A32 PolarHBondContact O-N 2.85Å; I30-A32 VanDerWaalsContact C-N 3.32Å; I30-A32 PolarHBondContact O-N 3.49Å; A32-R34 VanDerWaalsContact C-N 3.3Å; A32-R34 PolarHBondContact O-N 2.71Å; A32-A35 PolarHBondContact O-N 3.11Å; A32-I36 WeakPolarHBondContact O-CG1 3.42Å; A32-I36 PolarHBondContact O-N 3.08Å; A32-H77 HydrophobicContact CB-CB 4.02Å; A32-H77 VanDerWaalsContact CB-CG 3.5Å; A32-H77 VanDerWaalsContact CB-ND1 3.31Å; A32-H77 WeakPolarHBondContact CB-ND1 3.4Å; A32-A79 HydrophobicContact CB-CB 4.28Å; A32-A80 HydrophobicContact CB-CB 4.41Å
33	A	86.3	Confident	86.1	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.5	-38.3	174.9	0	0	0	0	0	111.6	N29 I30 I36 A37 M83 L523	N29-A33 WeakPolarHBondContact O-CB 3.38Å; N29-A33 PolarHBondContact O-N 3.16Å; I30-A33 PolarHBondContact O-N 3.41Å; A33-I36 PolarHBondContact O-N 3.17Å; A33-A37 PolarHBondContact O-N 3.36Å; A33-A37 VanDerWaalsContact O-N 3.11Å; A33-M83 HydrophobicContact CB-CG 4.16Å; A33-M83 HydrophobicContact CB-SD 4.32Å; A33-L523 HydrophobicContact CB-CD1 3.87Å
34	R	84.7	Confident	86.6	Confident	114 Å²	114	35.8 Å²	35.8	43%	0.43	20%	0.199	S	C	.	.	H	α-helix	trans	-62.8	-46.3	176	-177.3	-180	171.3	174.2	-1.7	113.7	I30 E31 A32 I36 A37 E38 N106	I30-R34 WeakPolarHBondContact O-CB 3.01Å; I30-R34 PolarHBondContact O-N 3.46Å; E31-R34 WeakPolarHBondContact O-CB 3.4Å; E31-R34 PolarHBondContact O-N 3.32Å; A32-R34 VanDerWaalsContact C-N 3.3Å; A32-R34 PolarHBondContact O-N 2.71Å; R34-I36 PolarHBondContact O-N 2.71Å; R34-A37 PolarHBondContact O-N 3.42Å; R34-E38 HydrophobicContact CG-CG 4.33Å; R34-E38 IonicContact CZ-OE1 3.41Å; R34-E38 IonicContact NE-OE1 2.78Å; R34-E38 PolarHBondContact NE-OE1 3.24Å; R34-E38 IonicContact NH2-OE1 2.71Å; R34-E38 PolarHBondContact NH2-OE1 3.11Å; R34-E38 WeakPolarHBondContact O-CG 3.29Å; R34-E38 PolarHBondContact O-N 2.67Å; R34-N106 WeakPolarHBondContact CA-OD1 3.49Å; R34-N106 WeakPolarHBondContact CB-OD1 3.3Å; R34-N106 PolarHBondContact N-OD1 3.36Å
35	A	88	Confident	86.8	Confident	53 Å²	53	33 Å²	33	44%	0.438	18%	0.177	S	C	.	.	H	α-helix	trans	-56.5	-42	176.8	0	0	0	0	0	111.4	E31 A32 V39	E31-A35 PolarHBondContact O-N 3.04Å; A32-A35 PolarHBondContact O-N 3.11Å; A35-V39 WeakPolarHBondContact O-CG2 3.49Å; A35-V39 PolarHBondContact O-N 2.92Å
36	I	89.3	Confident	86.7	Confident	9 Å²	9	35.8 Å²	35.8	5%	0.046	20%	0.195	C	C	.	.	H	α-helix	trans	-66.8	-43	179.4	-65.3	-60.6	0	0	0	112.4	A32 A33 R34 V39 V40 L70 V75 A80 M83 I102	A32-I36 WeakPolarHBondContact O-CG1 3.42Å; A32-I36 PolarHBondContact O-N 3.08Å; A33-I36 PolarHBondContact O-N 3.17Å; R34-I36 PolarHBondContact O-N 2.71Å; I36-V39 WeakPolarHBondContact O-CB 3.3Å; I36-V39 PolarHBondContact O-N 3.43Å; I36-V40 PolarHBondContact O-N 2.77Å; I36-L70 HydrophobicContact CG2-CD2 3.58Å; I36-V75 HydrophobicContact CD1-CG1 4.23Å; I36-V75 HydrophobicContact CD1-CG2 3.74Å; I36-A80 HydrophobicContact CD1-CB 4.01Å; I36-A80 HydrophobicContact CG1-CB 3.58Å; I36-M83 HydrophobicContact CG2-CB 4.36Å; I36-I102 HydrophobicContact CG2-CG2 3.96Å
37	A	87.5	Confident	86.9	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-70.9	-35.6	178.6	0	0	0	0	0	113.5	A33 R34 V39 V40 R41 I102 N106	A33-A37 PolarHBondContact O-N 3.36Å; A33-A37 VanDerWaalsContact O-N 3.11Å; R34-A37 PolarHBondContact O-N 3.42Å; A37-V39 PolarHBondContact O-N 3.29Å; A37-V40 PolarHBondContact O-N 2.96Å; A37-R41 VanDerWaalsContact O-CB 3.32Å; A37-R41 WeakPolarHBondContact O-CB 3.41Å; A37-R41 PolarHBondContact O-N 2.97Å; A37-I102 HydrophobicContact CB-CG2 4.22Å; A37-N106 HydrophobicContact CB-CB 3.07Å; A37-N106 VanDerWaalsContact CB-ND2 3.3Å; A37-N106 WeakPolarHBondContact CB-ND2 3.41Å
38	E	87.9	Confident	87.1	Confident	85 Å²	85	39 Å²	39	40%	0.397	21%	0.207	S	C	.	.	H	α-helix	trans	-60.6	-34.6	173.6	-75.9	-178.3	-179	0	0	111.6	R34	R34-E38 HydrophobicContact CG-CG 4.33Å; R34-E38 IonicContact CZ-OE1 3.41Å; R34-E38 IonicContact NE-OE1 2.78Å; R34-E38 PolarHBondContact NE-OE1 3.24Å; R34-E38 IonicContact NH2-OE1 2.71Å; R34-E38 PolarHBondContact NH2-OE1 3.11Å; R34-E38 WeakPolarHBondContact O-CG 3.29Å; R34-E38 PolarHBondContact O-N 2.67Å
39	V	89.4	Confident	87.1	Confident	53 Å²	53	44.1 Å²	44.1	32%	0.321	23%	0.227	S	C	.	.	H	α-helix	trans	-60.7	-52.2	173.1	173.2	0	0	0	0	110.5	A35 I36 A37 K51 V69 I73	A35-V39 WeakPolarHBondContact O-CG2 3.49Å; A35-V39 PolarHBondContact O-N 2.92Å; I36-V39 WeakPolarHBondContact O-CB 3.3Å; I36-V39 PolarHBondContact O-N 3.43Å; A37-V39 PolarHBondContact O-N 3.29Å; V39-K51 WeakPolarHBondContact O-CE 3.35Å; V39-K51 PolarHBondContact O-NZ 3.08Å; V39-V69 HydrophobicContact CG1-CG1 4.21Å; V39-I73 HydrophobicContact CG1-CD1 3.86Å
40	V	90.2	Very high	87.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-85	-8.4	-174.8	-61.3	0	0	0	0	114.6	I36 A37 T42 C43 V69 L70 T99 I102 I103	I36-V40 PolarHBondContact O-N 2.77Å; A37-V40 PolarHBondContact O-N 2.96Å; V40-T42 VanDerWaalsContact C-N 3.25Å; V40-T42 PolarHBondContact O-N 3.39Å; V40-C43 WeakPolarHBondContact O-CA 3.2Å; V40-C43 WeakPolarHBondContact O-CB 3.18Å; V40-C43 PolarHBondContact O-N 3.35Å; V40-V69 HydrophobicContact CG1-CG1 4.44Å; V40-L70 HydrophobicContact CG1-CD1 4.07Å; V40-L70 HydrophobicContact CG1-CD2 3.81Å; V40-L70 HydrophobicContact CG1-CG 3.76Å; V40-T99 HydrophobicContact CB-CG2 4.27Å; V40-T99 HydrophobicContact CG2-CG2 4.42Å; V40-I102 HydrophobicContact CG2-CB 4.06Å; V40-I102 HydrophobicContact CG2-CG2 3.58Å; V40-I103 HydrophobicContact CG2-CG1 4.42Å
41	R	88.5	Confident	87.4	Confident	45 Å²	45	51.3 Å²	51.3	17%	0.17	26%	0.263	C	S	.	.	H	α-helix	trans	-56.5	-37.3	-178.6	-174.6	175.8	-76.7	167.5	-6.5	113.1	A37 C43 L44 T457 N461	A37-R41 VanDerWaalsContact O-CB 3.32Å; A37-R41 WeakPolarHBondContact O-CB 3.41Å; A37-R41 PolarHBondContact O-N 2.97Å; R41-C43 PolarHBondContact O-N 3.42Å; R41-L44 PolarHBondContact O-N 3.4Å; R41-T457 HydrophobicContact CG-CG2 3.48Å; R41-T457 VanDerWaalsContact CG-CG2 3.48Å; R41-T457 VanDerWaalsContact O-CG2 3.25Å; R41-T457 WeakPolarHBondContact O-CG2 3.49Å; R41-N461 PolarHBondContact O-ND2 2.94Å
42	T	90.1	Very high	87.6	Confident	45 Å²	45	50.8 Å²	50.8	28%	0.276	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-7.7	178.1	64.1	0	0	0	0	113.7	V40 M49 K51	V40-T42 VanDerWaalsContact C-N 3.25Å; V40-T42 PolarHBondContact O-N 3.39Å; T42-M49 PolarHBondContact O-N 3.45Å; T42-K51 PolarHBondContact OG1-NZ 2.86Å; T42-K51 VanDerWaalsContact OG1-NZ 3.07Å
43	C	88.8	Confident	87.7	Confident	5 Å²	5	51.6 Å²	51.6	3%	0.034	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-4.3	179.1	-65	0	0	0	0	113.1	V40 R41 A48 K51 S64 T99	V40-C43 WeakPolarHBondContact O-CA 3.2Å; V40-C43 WeakPolarHBondContact O-CB 3.18Å; V40-C43 PolarHBondContact O-N 3.35Å; R41-C43 PolarHBondContact O-N 3.42Å; C43-A48 WeakPolarHBondContact O-CB 3.45Å; C43-K51 WeakPolarHBondContact SG-CE 3.49Å; C43-S64 VanDerWaalsContact CB-O 3.26Å; C43-S64 WeakPolarHBondContact CB-O 3.44Å; C43-T99 HydrophobicContact CB-CG2 4.29Å
44	L	89.1	Confident	87.8	Confident	18 Å²	18	56.4 Å²	56.4	9%	0.094	29%	0.294	C	S	.	.	S	Bend	trans	-89.2	130	-176.8	-173.8	72.7	0	0	0	112.6	R41 T99 I103 I454 T457 L458 N461	R41-L44 PolarHBondContact O-N 3.4Å; L44-T99 HydrophobicContact CB-CG2 4.16Å; L44-T99 HydrophobicContact CD1-CG2 4.32Å; L44-I103 HydrophobicContact CB-CD1 3.77Å; L44-I103 HydrophobicContact CD1-CD1 4.48Å; L44-I103 HydrophobicContact CD2-CD1 3.79Å; L44-I103 HydrophobicContact CG-CD1 4.21Å; L44-I454 HydrophobicContact CD2-CD1 3.78Å; L44-I454 HydrophobicContact CD2-CG2 4.4Å; L44-T457 HydrophobicContact CB-CG2 3.99Å; L44-T457 HydrophobicContact CD2-CG2 3.83Å; L44-T457 HydrophobicContact CG-CG2 4.48Å; L44-L458 HydrophobicContact CG-CD2 4.29Å; L44-N461 PolarHBondContact O-ND2 3.03Å
45	G	86.9	Confident	88	Confident	14 Å²	14	54.4 Å²	54.4	14%	0.144	29%	0.291	C	S	.	.	S	Bend	trans	98.5	176.2	169.7	0	0	0	0	0	114.9	R47 A48 S169 L458	G45-R47 PolarHBondContact O-N 3.26Å; G45-A48 WeakPolarHBondContact O-CB 3.36Å; G45-A48 PolarHBondContact O-N 3.37Å; G45-S169 WeakPolarHBondContact O-CB 3.39Å; G45-L458 VanDerWaalsContact CA-CD2 3.44Å
46	P	83.3	Confident	88	Confident	59 Å²	59	58.2 Å²	58.2	38%	0.383	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-16.1	-172.5	28.8	-36.5	0	0	0	114.7	I490	P46-I490 HydrophobicContact CB-CG1 4.27Å; P46-I490 HydrophobicContact CG-CG1 4.19Å
47	R	85.3	Confident	88	Confident	119 Å²	119	63.9 Å²	63.9	45%	0.449	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	33.1	171.7	-72.4	-172.5	164.1	178.2	2.6	111.5	G45 S462 I490	G45-R47 PolarHBondContact O-N 3.26Å; R47-S462 PolarHBondContact NH1-O 3.06Å; R47-S462 VanDerWaalsContact NH1-O 3.11Å; R47-I490 PolarHBondContact NE-O 2.86Å; R47-I490 PolarHBondContact NH1-O 2.98Å; R47-I490 VanDerWaalsContact NH1-O 3.08Å; R47-I490 PolarHBondContact NH2-O 3.29Å
48	A	86.5	Confident	87.9	Confident	19 Å²	19	66.2 Å²	66.2	16%	0.157	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-57.6	137.9	174.3	0	0	0	0	0	110.9	C43 G45	C43-A48 WeakPolarHBondContact O-CB 3.45Å; G45-A48 WeakPolarHBondContact O-CB 3.36Å; G45-A48 PolarHBondContact O-N 3.37Å
49	M	85.9	Confident	87.8	Confident	126 Å²	126	64 Å²	64	62%	0.621	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-86.1	133.3	175.8	-64	-67.4	-73.2	0	0	109.6	T42	T42-M49 PolarHBondContact O-N 3.45Å
50	L	87.1	Confident	87.6	Confident	112 Å²	112	65 Å²	65	59%	0.586	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-69.5	139.3	174.4	-65.3	171.4	0	0	0	110.6	I62	L50-I62 HydrophobicContact CB-CG2 4.12Å; L50-I62 HydrophobicContact CD1-CG2 4.14Å
51	K	88.5	Confident	87.3	Confident	47 Å²	47	66.7 Å²	66.7	20%	0.204	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	134.1	170.2	-66	-172.4	-171.9	-70.6	0	109.8	V39 T42 C43 I62 T63 V69	V39-K51 WeakPolarHBondContact O-CE 3.35Å; V39-K51 PolarHBondContact O-NZ 3.08Å; T42-K51 PolarHBondContact OG1-NZ 2.86Å; T42-K51 VanDerWaalsContact OG1-NZ 3.07Å; C43-K51 WeakPolarHBondContact SG-CE 3.49Å; K51-I62 WeakPolarHBondContact O-CA 3.23Å; K51-T63 PolarHBondContact N-O 2.59Å; K51-T63 PolarHBondContact O-N 2.83Å; K51-V69 HydrophobicContact CB-CG2 4.12Å; K51-V69 HydrophobicContact CD-CG1 3.8Å; K51-V69 HydrophobicContact CD-CG2 3.89Å; K51-V69 HydrophobicContact CG-CG2 4.44Å
52	M	89.1	Confident	87.2	Confident	130 Å²	130	68.5 Å²	68.5	64%	0.64	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.4	170.3	-178.1	-179.9	-72.9	0	0	108.2	V61 I62	M52-V61 WeakPolarHBondContact CA-O 3.47Å; M52-I62 HydrophobicContact CB-CG1 4.43Å; M52-I62 HydrophobicContact CE-CD1 3.72Å; M52-I62 HydrophobicContact CE-CG1 4.01Å; M52-I62 HydrophobicContact CG-CG1 4.22Å
53	L	89.2	Confident	86.9	Confident	31 Å²	31	66.4 Å²	66.4	16%	0.162	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	137.1	179.3	-57.6	162.4	0	0	0	107.7	T60 V61 V69 E72	L53-T60 CarbonylContact O-C 3.59Å; L53-T60 WeakPolarHBondContact O-CA 3.36Å; L53-V61 HydrophobicContact CB-CB 4.46Å; L53-V61 PolarHBondContact N-O 2.69Å; L53-V61 PolarHBondContact O-N 2.91Å; L53-V69 HydrophobicContact CD1-CB 4.23Å; L53-V69 HydrophobicContact CD1-CG1 4.34Å; L53-V69 HydrophobicContact CD1-CG2 4.13Å; L53-E72 HydrophobicContact CB-CB 4.44Å; L53-E72 HydrophobicContact CD1-CB 3.9Å; L53-E72 HydrophobicContact CD1-CG 3.94Å
54	V	89.4	Confident	86.8	Confident	101 Å²	101	66.3 Å²	66.3	61%	0.612	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	114.4	179.2	-174.5	0	0	0	0	107.2	G59 T60	V54-G59 WeakPolarHBondContact CA-O 3.27Å; V54-T60 HydrophobicContact CG2-CG2 4.39Å
55	D	87.2	Confident	86.6	Confident	72 Å²	72	66 Å²	66	39%	0.385	38%	0.382	S	S	.	.			trans	-71.2	159.5	173.6	-179.3	23.5	0	0	0	110.3	V57 G58 G59	D55-V57 PolarHBondContact O-N 3.09Å; D55-V57 VanDerWaalsContact O-N 3.15Å; D55-G58 WeakPolarHBondContact O-CA 2.84Å; D55-G58 PolarHBondContact O-N 3.33Å; D55-G59 PolarHBondContact N-O 2.89Å
56	T	88.3	Confident	86.6	Confident	132 Å²	132	65.3 Å²	65.3	81%	0.81	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-30.1	174.3	58.2	0	0	0	0	114	G58	T56-G58 VanDerWaalsContact C-N 3.3Å
57	V	90.4	Very high	86.8	Confident	128 Å²	128	62.5 Å²	62.5	78%	0.776	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-8.3	177.6	-172	0	0	0	0	112.3	D55	D55-V57 PolarHBondContact O-N 3.09Å; D55-V57 VanDerWaalsContact O-N 3.15Å
58	G	85.6	Confident	86.8	Confident	50 Å²	50	56.9 Å²	56.9	52%	0.515	34%	0.336	S	S	.	.	S	Bend	trans	90.2	8	-176.5	0	0	0	0	0	114.4	D55 T56	D55-G58 WeakPolarHBondContact O-CA 2.84Å; D55-G58 PolarHBondContact O-N 3.33Å; T56-G58 VanDerWaalsContact C-N 3.3Å
59	G	85.1	Confident	87	Confident	38 Å²	38	56 Å²	56	39%	0.392	33%	0.328	S	S	.	.			trans	-67	134.6	170.2	0	0	0	0	0	111	V54 D55	V54-G59 WeakPolarHBondContact CA-O 3.27Å; D55-G59 PolarHBondContact N-O 2.89Å
60	T	86	Confident	87.2	Confident	74 Å²	74	50 Å²	50	45%	0.454	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	126	178.8	60	0	0	0	0	110.9	L53 V54	L53-T60 CarbonylContact O-C 3.59Å; L53-T60 WeakPolarHBondContact O-CA 3.36Å; V54-T60 HydrophobicContact CG2-CG2 4.39Å
61	V	83.4	Confident	87.3	Confident	35 Å²	35	49.5 Å²	49.5	21%	0.212	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	120.7	172.7	-177	0	0	0	0	108.4	M52 L53 T63	M52-V61 WeakPolarHBondContact CA-O 3.47Å; L53-V61 HydrophobicContact CB-CB 4.46Å; L53-V61 PolarHBondContact N-O 2.69Å; L53-V61 PolarHBondContact O-N 2.91Å; V61-T63 HydrophobicContact CG1-CG2 4.28Å
62	I	85.8	Confident	87.2	Confident	84 Å²	84	51.3 Å²	51.3	43%	0.431	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	118.5	174.5	-55	173.1	0	0	0	107.3	L50 K51 M52	L50-I62 HydrophobicContact CB-CG2 4.12Å; L50-I62 HydrophobicContact CD1-CG2 4.14Å; K51-I62 WeakPolarHBondContact O-CA 3.23Å; M52-I62 HydrophobicContact CB-CG1 4.43Å; M52-I62 HydrophobicContact CE-CD1 3.72Å; M52-I62 HydrophobicContact CE-CG1 4.01Å; M52-I62 HydrophobicContact CG-CG1 4.22Å
63	T	85	Confident	87.3	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	153.8	-178.5	-170.1	0	0	0	0	112.6	K51 V61 D65 A68 V69 E393	K51-T63 PolarHBondContact N-O 2.59Å; K51-T63 PolarHBondContact O-N 2.83Å; V61-T63 HydrophobicContact CG1-CG2 4.28Å; T63-D65 PolarHBondContact OG1-N 3.31Å; T63-D65 VanDerWaalsContact OG1-N 3.13Å; T63-A68 HydrophobicContact CG2-CB 3.73Å; T63-V69 HydrophobicContact CG2-CG2 3.95Å; T63-E393 PolarHBondContact OG1-OE1 3.26Å; T63-E393 PolarHBondContact OG1-OE2 3.36Å
64	S	85.4	Confident	87.3	Confident	4 Å²	4	54.7 Å²	54.7	3%	0.028	31%	0.313	C	S	.	.			trans	-97.8	-9.7	167.2	48.7	0	0	0	0	112.6	C43 G66 N170	C43-S64 VanDerWaalsContact CB-O 3.26Å; C43-S64 WeakPolarHBondContact CB-O 3.44Å; S64-G66 PolarHBondContact O-N 3.19Å; S64-N170 PolarHBondContact OG-OD1 3.47Å
65	D	85.2	Confident	87.3	Confident	10 Å²	10	51.3 Å²	51.3	5%	0.053	29%	0.292	C	S	.	.			trans	-72	117.1	179.9	170.4	26.4	0	0	0	110.7	T63 N67 A68 V69 R71	T63-D65 PolarHBondContact OG1-N 3.31Å; T63-D65 VanDerWaalsContact OG1-N 3.13Å; D65-N67 PolarHBondContact O-N 3.01Å; D65-N67 PolarHBondContact OD1-N 3.26Å; D65-A68 HydrophobicContact CB-CB 4.03Å; D65-A68 PolarHBondContact O-N 3.03Å; D65-A68 WeakPolarHBondContact OD2-CB 3.32Å; D65-A68 PolarHBondContact OD2-N 3.45Å; D65-V69 WeakPolarHBondContact O-CG2 3.42Å; D65-V69 PolarHBondContact O-N 3.42Å; D65-R71 IonicContact OD2-NH2 3.61Å
66	G	86.2	Confident	87.4	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.7	-33.3	177.9	0	0	0	0	0	113.2	S64 V69 L70 T99	S64-G66 PolarHBondContact O-N 3.19Å; G66-V69 PolarHBondContact O-N 3.15Å; G66-L70 WeakPolarHBondContact O-CB 3.4Å; G66-L70 WeakPolarHBondContact O-CG 3.37Å; G66-L70 PolarHBondContact O-N 3.41Å; G66-T99 WeakPolarHBondContact CA-OG1 3.28Å; G66-T99 PolarHBondContact N-OG1 2.9Å
67	N	87.7	Confident	87.5	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-73	-40.1	178.6	-177.2	50.2	0	0	0	112.1	D65 V69 L70 R71 S87 D91 T98	D65-N67 PolarHBondContact O-N 3.01Å; D65-N67 PolarHBondContact OD1-N 3.26Å; N67-V69 VanDerWaalsContact C-N 3.3Å; N67-V69 PolarHBondContact O-N 3.15Å; N67-L70 PolarHBondContact O-N 3.28Å; N67-R71 VanDerWaalsContact ND2-CZ 3.29Å; N67-R71 PolarHBondContact ND2-NH2 2.96Å; N67-R71 VanDerWaalsContact ND2-NH2 3.13Å; N67-R71 WeakPolarHBondContact O-CG 3.46Å; N67-R71 PolarHBondContact O-N 3.23Å; N67-R71 VanDerWaalsContact O-N 3.1Å; N67-R71 PolarHBondContact O-NE 3.44Å; N67-S87 PolarHBondContact OD1-OG 2.84Å; N67-D91 WeakPolarHBondContact ND2-CB 3.35Å; N67-D91 PolarHBondContact ND2-OD1 3.16Å; N67-D91 PolarHBondContact ND2-OD2 3.46Å; N67-T98 HydrophobicContact CB-CG2 3.88Å
68	A	86.1	Confident	87.5	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-59.1	-42.1	169.6	0	0	0	0	0	111.6	T63 D65 R71	T63-A68 HydrophobicContact CG2-CB 3.73Å; D65-A68 HydrophobicContact CB-CB 4.03Å; D65-A68 PolarHBondContact O-N 3.03Å; D65-A68 WeakPolarHBondContact OD2-CB 3.32Å; D65-A68 PolarHBondContact OD2-N 3.45Å; A68-R71 PolarHBondContact O-N 3.46Å
69	V	90	Very high	87.6	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.5	-49.5	175.5	173.5	0	0	0	0	111.8	V39 V40 K51 L53 T63 D65 G66 N67 R71 E72 I73	V39-V69 HydrophobicContact CG1-CG1 4.21Å; V40-V69 HydrophobicContact CG1-CG1 4.44Å; K51-V69 HydrophobicContact CB-CG2 4.12Å; K51-V69 HydrophobicContact CD-CG1 3.8Å; K51-V69 HydrophobicContact CD-CG2 3.89Å; K51-V69 HydrophobicContact CG-CG2 4.44Å; L53-V69 HydrophobicContact CD1-CB 4.23Å; L53-V69 HydrophobicContact CD1-CG1 4.34Å; L53-V69 HydrophobicContact CD1-CG2 4.13Å; T63-V69 HydrophobicContact CG2-CG2 3.95Å; D65-V69 WeakPolarHBondContact O-CG2 3.42Å; D65-V69 PolarHBondContact O-N 3.42Å; G66-V69 PolarHBondContact O-N 3.15Å; N67-V69 VanDerWaalsContact C-N 3.3Å; N67-V69 PolarHBondContact O-N 3.15Å; V69-R71 PolarHBondContact O-N 2.92Å; V69-E72 PolarHBondContact O-N 3.18Å; V69-I73 HydrophobicContact CG1-CD1 3.72Å; V69-I73 WeakPolarHBondContact O-CG1 3.34Å; V69-I73 PolarHBondContact O-N 3.06Å
70	L	90.8	Very high	87.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.1	-21.5	-177	-69.6	173.6	0	0	0	113.6	I36 V40 G66 N67 I84 I102	I36-L70 HydrophobicContact CG2-CD2 3.58Å; V40-L70 HydrophobicContact CG1-CD1 4.07Å; V40-L70 HydrophobicContact CG1-CD2 3.81Å; V40-L70 HydrophobicContact CG1-CG 3.76Å; G66-L70 WeakPolarHBondContact O-CB 3.4Å; G66-L70 WeakPolarHBondContact O-CG 3.37Å; G66-L70 PolarHBondContact O-N 3.41Å; N67-L70 PolarHBondContact O-N 3.28Å; L70-I84 HydrophobicContact CB-CG1 4.24Å; L70-I84 HydrophobicContact CB-CG2 4.36Å; L70-I84 HydrophobicContact CD2-CG1 4.19Å; L70-I84 WeakPolarHBondContact O-CG2 3.29Å; L70-I102 HydrophobicContact CD1-CB 4.47Å; L70-I102 HydrophobicContact CD1-CD1 4.22Å; L70-I102 HydrophobicContact CD1-CG1 3.73Å; L70-I102 HydrophobicContact CD1-CG2 4.34Å
71	R	88.5	Confident	88	Confident	101 Å²	101	44 Å²	44	38%	0.381	22%	0.223	S	C	.	.	H	α-helix	trans	-73	-31.9	176.1	-81.3	-177.4	-78.3	-165.7	-4	113.3	D65 N67 A68 V69 R88	D65-R71 IonicContact OD2-NH2 3.61Å; N67-R71 VanDerWaalsContact ND2-CZ 3.29Å; N67-R71 PolarHBondContact ND2-NH2 2.96Å; N67-R71 VanDerWaalsContact ND2-NH2 3.13Å; N67-R71 WeakPolarHBondContact O-CG 3.46Å; N67-R71 PolarHBondContact O-N 3.23Å; N67-R71 VanDerWaalsContact O-N 3.1Å; N67-R71 PolarHBondContact O-NE 3.44Å; A68-R71 PolarHBondContact O-N 3.46Å; V69-R71 PolarHBondContact O-N 2.92Å; R71-R88 HydrophobicContact CG-CG 4.47Å
72	E	87.8	Confident	88.4	Confident	85 Å²	85	43.9 Å²	43.9	40%	0.397	22%	0.224	S	C	.	.	H	α-helix	trans	-88	-12.7	-178.2	-56.2	-59.7	150	0	0	113	L53 V69	L53-E72 HydrophobicContact CB-CB 4.44Å; L53-E72 HydrophobicContact CD1-CB 3.9Å; L53-E72 HydrophobicContact CD1-CG 3.94Å; V69-E72 PolarHBondContact O-N 3.18Å
73	I	89.7	Confident	88.5	Confident	49 Å²	49	40 Å²	40	25%	0.251	20%	0.204	S	C	.	.			trans	-89	122.4	-178.9	-63.4	169.5	0	0	0	110.3	V39 V69 V75	V39-I73 HydrophobicContact CG1-CD1 3.86Å; V69-I73 HydrophobicContact CG1-CD1 3.72Å; V69-I73 WeakPolarHBondContact O-CG1 3.34Å; V69-I73 PolarHBondContact O-N 3.06Å; I73-V75 HydrophobicContact CG2-CG2 3.82Å
74	E	90	Very high	88.8	Confident	184 Å²	184	40.5 Å²	40.5	86%	0.86	21%	0.207	S	C	*	.			trans	-87.8	125.8	168	-64	-170.1	164.1	0	0	111
75	V	90.1	Very high	89	Confident	29 Å²	29	45.9 Å²	45.9	18%	0.176	23%	0.232	C	C	.	.			trans	-123.4	133.8	-178.2	-154	0	0	0	0	111	I36 I73 A80 K81 I84	I36-V75 HydrophobicContact CD1-CG1 4.23Å; I36-V75 HydrophobicContact CD1-CG2 3.74Å; I73-V75 HydrophobicContact CG2-CG2 3.82Å; V75-A80 HydrophobicContact CB-CB 4.02Å; V75-A80 HydrophobicContact CG1-CB 3.45Å; V75-A80 VanDerWaalsContact CG1-CB 3.45Å; V75-A80 HydrophobicContact CG2-CB 4.39Å; V75-K81 WeakPolarHBondContact O-CE 3.36Å; V75-I84 HydrophobicContact CG2-CD1 3.41Å; V75-I84 VanDerWaalsContact CG2-CD1 3.41Å
76	P	89.3	Confident	89.2	Confident	118 Å²	118	46.9 Å²	46.9	77%	0.766	24%	0.237	S	C	*	.			trans	-75.7	-35.9	179.5	27.7	-34.1	0	0	0	113.1
77	H	89.5	Confident	89.4	Confident	47 Å²	47	46.9 Å²	46.9	22%	0.218	24%	0.237	C	C	.	.	S	Bend	trans	-74.6	131.6	-171.1	-164.6	-77.5	0	0	0	112.3	N29 A32 A79 A80 K81	N29-H77 PolarHBondContact OD1-CE1 3.4Å; N29-H77 VanDerWaalsContact OD1-CE1 3.29Å; A32-H77 HydrophobicContact CB-CB 4.02Å; A32-H77 VanDerWaalsContact CB-CG 3.5Å; A32-H77 VanDerWaalsContact CB-ND1 3.31Å; A32-H77 WeakPolarHBondContact CB-ND1 3.4Å; H77-A79 WeakPolarHBondContact ND1-CB 3.44Å; H77-A79 PolarHBondContact ND1-N 2.98Å; H77-A79 VanDerWaalsContact ND1-N 3.16Å; H77-A79 PolarHBondContact O-N 3.5Å; H77-A80 HydrophobicContact CB-CB 4.27Å; H77-A80 WeakPolarHBondContact O-CB 3.29Å; H77-A80 PolarHBondContact O-N 3.21Å; H77-A80 VanDerWaalsContact O-N 3.16Å; H77-K81 PolarHBondContact O-N 3.36Å; H77-K81 VanDerWaalsContact O-N 3.09Å
78	P	89.7	Confident	89.6	Confident	62 Å²	62	52 Å²	52	40%	0.403	26%	0.256	S	S	.	.	H	α-helix	trans	-64	-37.2	-175.4	24.2	-34.2	0	0	0	113.7	A80 K81 S82 I529	P78-A80 VanDerWaalsContact C-N 3.32Å; P78-A80 PolarHBondContact O-N 3.31Å; P78-K81 PolarHBondContact O-N 3.42Å; P78-S82 PolarHBondContact O-N 3.17Å; P78-S82 PolarHBondContact O-OG 3.23Å; P78-I529 HydrophobicContact CG-CD1 4.09Å; P78-I529 HydrophobicContact CG-CG2 4.43Å
79	A	87.8	Confident	89.9	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-60.4	-41.4	174.5	0	0	0	0	0	112.1	N29 A32 H77 S82 M83 L523	N29-A79 HydrophobicContact CB-CB 4.04Å; A32-A79 HydrophobicContact CB-CB 4.28Å; H77-A79 WeakPolarHBondContact ND1-CB 3.44Å; H77-A79 PolarHBondContact ND1-N 2.98Å; H77-A79 VanDerWaalsContact ND1-N 3.16Å; H77-A79 PolarHBondContact O-N 3.5Å; A79-S82 WeakPolarHBondContact O-CB 3.11Å; A79-S82 PolarHBondContact O-N 3.19Å; A79-M83 WeakPolarHBondContact O-CG 3.3Å; A79-M83 PolarHBondContact O-N 2.98Å; A79-L523 HydrophobicContact CB-CD2 3.66Å
80	A	89.6	Confident	89.9	Confident	1 Å²	1	56 Å²	56	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-67.8	-38.1	177.5	0	0	0	0	0	112.3	A32 I36 V75 H77 P78 S82 M83 I84	A32-A80 HydrophobicContact CB-CB 4.41Å; I36-A80 HydrophobicContact CD1-CB 4.01Å; I36-A80 HydrophobicContact CG1-CB 3.58Å; V75-A80 HydrophobicContact CB-CB 4.02Å; V75-A80 HydrophobicContact CG1-CB 3.45Å; V75-A80 VanDerWaalsContact CG1-CB 3.45Å; V75-A80 HydrophobicContact CG2-CB 4.39Å; H77-A80 HydrophobicContact CB-CB 4.27Å; H77-A80 WeakPolarHBondContact O-CB 3.29Å; H77-A80 PolarHBondContact O-N 3.21Å; H77-A80 VanDerWaalsContact O-N 3.16Å; P78-A80 VanDerWaalsContact C-N 3.32Å; P78-A80 PolarHBondContact O-N 3.31Å; A80-S82 VanDerWaalsContact C-N 3.32Å; A80-S82 PolarHBondContact O-N 3.27Å; A80-M83 WeakPolarHBondContact O-CB 3.41Å; A80-M83 PolarHBondContact O-N 3.09Å; A80-I84 WeakPolarHBondContact O-CG1 3.44Å; A80-I84 PolarHBondContact O-N 3.21Å; A80-I84 VanDerWaalsContact O-N 3.1Å
81	K	91.3	Very high	89.8	Confident	111 Å²	111	57.4 Å²	57.4	48%	0.483	29%	0.288	S	S	.	.	H	α-helix	trans	-60.1	-43.4	171.2	-68.1	-176.1	-178.4	-177.3	0	111.7	V75 H77 P78 M83 I84 E85	V75-K81 WeakPolarHBondContact O-CE 3.36Å; H77-K81 PolarHBondContact O-N 3.36Å; H77-K81 VanDerWaalsContact O-N 3.09Å; P78-K81 PolarHBondContact O-N 3.42Å; K81-M83 VanDerWaalsContact C-N 3.32Å; K81-M83 PolarHBondContact O-N 3.43Å; K81-I84 PolarHBondContact O-N 3.47Å; K81-I84 VanDerWaalsContact O-N 3.15Å; K81-E85 PolarHBondContact O-N 2.98Å
82	S	89.9	Confident	89.8	Confident	34 Å²	34	59.4 Å²	59.4	24%	0.238	30%	0.301	C	S	.	.	H	α-helix	trans	-60.2	-42.8	177.3	-54.3	0	0	0	0	111.1	P78 A79 A80 I84 E85 I86	P78-S82 PolarHBondContact O-N 3.17Å; P78-S82 PolarHBondContact O-OG 3.23Å; A79-S82 WeakPolarHBondContact O-CB 3.11Å; A79-S82 PolarHBondContact O-N 3.19Å; A80-S82 VanDerWaalsContact C-N 3.32Å; A80-S82 PolarHBondContact O-N 3.27Å; S82-I84 VanDerWaalsContact C-N 3.35Å; S82-I84 PolarHBondContact O-N 3.25Å; S82-E85 PolarHBondContact O-N 3.4Å; S82-I86 WeakPolarHBondContact O-CD1 3.48Å; S82-I86 VanDerWaalsContact O-CG1 3.32Å; S82-I86 WeakPolarHBondContact O-CG1 3.36Å; S82-I86 PolarHBondContact O-N 3.27Å
83	M	88.3	Confident	89.8	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.01	31%	0.307	C	S	.	.	H	α-helix	trans	-58.4	-44.3	174.1	-67.9	-64.8	-70.3	0	0	112.1	A33 I36 A79 A80 K81 E85 I86 S87 I102 T519 L523	A33-M83 HydrophobicContact CB-CG 4.16Å; A33-M83 HydrophobicContact CB-SD 4.32Å; I36-M83 HydrophobicContact CG2-CB 4.36Å; A79-M83 WeakPolarHBondContact O-CG 3.3Å; A79-M83 PolarHBondContact O-N 2.98Å; A80-M83 WeakPolarHBondContact O-CB 3.41Å; A80-M83 PolarHBondContact O-N 3.09Å; K81-M83 VanDerWaalsContact C-N 3.32Å; K81-M83 PolarHBondContact O-N 3.43Å; M83-E85 VanDerWaalsContact C-N 3.35Å; M83-E85 PolarHBondContact O-N 3.32Å; M83-I86 PolarHBondContact O-N 3.06Å; M83-S87 PolarHBondContact O-N 2.98Å; M83-S87 VanDerWaalsContact O-N 3.1Å; M83-I102 HydrophobicContact CB-CD1 4.27Å; M83-I102 HydrophobicContact CE-CD1 3.99Å; M83-I102 HydrophobicContact CE-CG2 4.24Å; M83-I102 WeakPolarHBondContact O-CD1 3.26Å; M83-T519 HydrophobicContact CE-CG2 4.47Å; M83-T519 HydrophobicContact SD-CG2 3.37Å; M83-T519 WeakPolarHBondContact SD-CG2 3.46Å; M83-L523 HydrophobicContact SD-CD1 4.18Å
84	I	91.1	Very high	89.6	Confident	10 Å²	10	58.6 Å²	58.6	5%	0.051	30%	0.297	C	S	.	.	H	α-helix	trans	-63.1	-41.7	177.4	-66.6	170.8	0	0	0	111.2	L70 V75 A80 K81 S82 I86 S87 R88	L70-I84 HydrophobicContact CB-CG1 4.24Å; L70-I84 HydrophobicContact CB-CG2 4.36Å; L70-I84 HydrophobicContact CD2-CG1 4.19Å; L70-I84 WeakPolarHBondContact O-CG2 3.29Å; V75-I84 HydrophobicContact CG2-CD1 3.41Å; V75-I84 VanDerWaalsContact CG2-CD1 3.41Å; A80-I84 WeakPolarHBondContact O-CG1 3.44Å; A80-I84 PolarHBondContact O-N 3.21Å; A80-I84 VanDerWaalsContact O-N 3.1Å; K81-I84 PolarHBondContact O-N 3.47Å; K81-I84 VanDerWaalsContact O-N 3.15Å; S82-I84 VanDerWaalsContact C-N 3.35Å; S82-I84 PolarHBondContact O-N 3.25Å; I84-I86 VanDerWaalsContact C-N 3.33Å; I84-I86 PolarHBondContact O-N 3.26Å; I84-S87 WeakPolarHBondContact O-CB 3.5Å; I84-S87 PolarHBondContact O-N 3.46Å; I84-R88 WeakPolarHBondContact O-CG 3.34Å; I84-R88 PolarHBondContact O-N 3.27Å; I84-R88 VanDerWaalsContact O-N 3.14Å
85	E	90.6	Very high	89.3	Confident	118 Å²	118	49.9 Å²	49.9	55%	0.551	26%	0.257	S	S	*	.	H	α-helix	trans	-62.3	-40.4	176.7	-72.4	178.4	-179.4	0	0	112	K81 S82 M83 S87 R88 T89	K81-E85 PolarHBondContact O-N 2.98Å; S82-E85 PolarHBondContact O-N 3.4Å; M83-E85 VanDerWaalsContact C-N 3.35Å; M83-E85 PolarHBondContact O-N 3.32Å; E85-S87 PolarHBondContact O-N 3.48Å; E85-R88 WeakPolarHBondContact O-CB 3.33Å; E85-R88 PolarHBondContact O-N 2.94Å; E85-R88 VanDerWaalsContact O-N 3.11Å; E85-T89 PolarHBondContact O-N 3.04Å; E85-T89 PolarHBondContact O-OG1 3.18Å
86	I	90	Very high	89	Confident	30 Å²	30	50.5 Å²	50.5	15%	0.154	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-42	175.8	-68.9	154.3	0	0	0	111.4	S82 M83 I84 R88 T89 Q90 V101 T519	S82-I86 WeakPolarHBondContact O-CD1 3.48Å; S82-I86 VanDerWaalsContact O-CG1 3.32Å; S82-I86 WeakPolarHBondContact O-CG1 3.36Å; S82-I86 PolarHBondContact O-N 3.27Å; M83-I86 PolarHBondContact O-N 3.06Å; I84-I86 VanDerWaalsContact C-N 3.33Å; I84-I86 PolarHBondContact O-N 3.26Å; I86-R88 VanDerWaalsContact C-N 3.28Å; I86-R88 PolarHBondContact O-N 3.32Å; I86-T89 PolarHBondContact O-N 2.93Å; I86-Q90 WeakPolarHBondContact O-CB 3.22Å; I86-Q90 PolarHBondContact O-N 3.27Å; I86-V101 HydrophobicContact CG2-CG1 3.76Å; I86-T519 HydrophobicContact CD1-CG2 3.35Å; I86-T519 WeakPolarHBondContact CD1-OG1 3.38Å
87	S	90.2	Very high	88.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.5	-43.5	172.8	-179.6	0	0	0	0	111.4	N67 M83 I84 E85 Q90 D91	N67-S87 PolarHBondContact OD1-OG 2.84Å; M83-S87 PolarHBondContact O-N 2.98Å; M83-S87 VanDerWaalsContact O-N 3.1Å; I84-S87 WeakPolarHBondContact O-CB 3.5Å; I84-S87 PolarHBondContact O-N 3.46Å; E85-S87 PolarHBondContact O-N 3.48Å; S87-Q90 PolarHBondContact O-N 3.36Å; S87-D91 WeakPolarHBondContact O-CB 3.12Å; S87-D91 PolarHBondContact O-N 2.98Å
88	R	91	Very high	88.6	Confident	110 Å²	110	43.2 Å²	43.2	42%	0.415	22%	0.217	S	C	.	.	H	α-helix	trans	-65.7	-40.1	179.2	-67.5	174.5	179.6	-171.7	-2	112.1	R71 I84 E85 I86 Q92	R71-R88 HydrophobicContact CG-CG 4.47Å; I84-R88 WeakPolarHBondContact O-CG 3.34Å; I84-R88 PolarHBondContact O-N 3.27Å; I84-R88 VanDerWaalsContact O-N 3.14Å; E85-R88 WeakPolarHBondContact O-CB 3.33Å; E85-R88 PolarHBondContact O-N 2.94Å; E85-R88 VanDerWaalsContact O-N 3.11Å; I86-R88 VanDerWaalsContact C-N 3.28Å; I86-R88 PolarHBondContact O-N 3.32Å; R88-Q92 WeakPolarHBondContact O-CG 3.47Å; R88-Q92 PolarHBondContact O-N 3.23Å; R88-Q92 VanDerWaalsContact O-N 3.14Å
89	T	91.7	Very high	88.6	Confident	82 Å²	82	40.9 Å²	40.9	50%	0.503	20%	0.201	S	C	.	.	H	α-helix	trans	-67.3	-41	176.1	-57.8	0	0	0	0	111.2	E85 I86 D91 Q92 E93	E85-T89 PolarHBondContact O-N 3.04Å; E85-T89 PolarHBondContact O-OG1 3.18Å; I86-T89 PolarHBondContact O-N 2.93Å; T89-D91 PolarHBondContact O-N 3.25Å; T89-Q92 PolarHBondContact O-N 3.43Å; T89-E93 WeakPolarHBondContact O-CG 3.37Å; T89-E93 PolarHBondContact O-N 3.35Å; T89-E93 VanDerWaalsContact O-N 3.11Å
90	Q	90.6	Very high	88.6	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-60.5	-46	175.7	-173.8	69.1	40.2	0	0	111.6	I86 S87 Q92 E93 T94 V101 T515	I86-Q90 WeakPolarHBondContact O-CB 3.22Å; I86-Q90 PolarHBondContact O-N 3.27Å; S87-Q90 PolarHBondContact O-N 3.36Å; Q90-Q92 VanDerWaalsContact C-N 3.32Å; Q90-Q92 PolarHBondContact O-N 3.36Å; Q90-E93 PolarHBondContact O-N 3.42Å; Q90-T94 PolarHBondContact NE2-OG1 2.94Å; Q90-T94 PolarHBondContact O-N 2.97Å; Q90-T94 PolarHBondContact O-OG1 2.98Å; Q90-T94 VanDerWaalsContact O-OG1 3.08Å; Q90-V101 HydrophobicContact CB-CG2 4.4Å; Q90-V101 HydrophobicContact CG-CB 4.44Å; Q90-V101 HydrophobicContact CG-CG2 3.68Å; Q90-T515 PolarHBondContact OE1-OG1 2.88Å
91	D	89.9	Confident	88.6	Confident	30 Å²	30	41.2 Å²	41.2	16%	0.16	20%	0.203	C	C	.	.	H	α-helix	trans	-57.7	-43.3	177.3	-171	76.8	0	0	0	112	N67 S87 T89 G95 T98	N67-D91 WeakPolarHBondContact ND2-CB 3.35Å; N67-D91 PolarHBondContact ND2-OD1 3.16Å; N67-D91 PolarHBondContact ND2-OD2 3.46Å; S87-D91 WeakPolarHBondContact O-CB 3.12Å; S87-D91 PolarHBondContact O-N 2.98Å; T89-D91 PolarHBondContact O-N 3.25Å; D91-G95 WeakPolarHBondContact O-CA 3.44Å; D91-G95 PolarHBondContact O-N 3.31Å; D91-T98 HydrophobicContact CB-CG2 3.67Å
92	Q	88.1	Confident	88.4	Confident	143 Å²	143	36 Å²	36	67%	0.668	18%	0.18	S	C	*	.	H	α-helix	trans	-68.7	-34.5	179.3	-72.2	175.7	9.3	0	0	113.5	R88 T89 Q90	R88-Q92 WeakPolarHBondContact O-CG 3.47Å; R88-Q92 PolarHBondContact O-N 3.23Å; R88-Q92 VanDerWaalsContact O-N 3.14Å; T89-Q92 PolarHBondContact O-N 3.43Å; Q90-Q92 VanDerWaalsContact C-N 3.32Å; Q90-Q92 PolarHBondContact O-N 3.36Å
93	E	86.5	Confident	88.3	Confident	112 Å²	112	34.3 Å²	34.3	52%	0.523	17%	0.169	S	C	.	.	H	α-helix	trans	-80.5	-52	-177.3	-73.6	-61.8	144	0	0	112.3	T89 Q90 R406	T89-E93 WeakPolarHBondContact O-CG 3.37Å; T89-E93 PolarHBondContact O-N 3.35Å; T89-E93 VanDerWaalsContact O-N 3.11Å; Q90-E93 PolarHBondContact O-N 3.42Å; E93-R406 PolarHBondContact O-NH1 2.95Å
94	T	86.4	Confident	87.9	Confident	4 Å²	4	34.8 Å²	34.8	3%	0.025	17%	0.171	C	C	.	.	H	α-helix	trans	-110.4	-22.5	-171.8	59.4	0	0	0	0	114.3	Q90 D96 H403 N407 Q511	Q90-T94 PolarHBondContact NE2-OG1 2.94Å; Q90-T94 PolarHBondContact O-N 2.97Å; Q90-T94 PolarHBondContact O-OG1 2.98Å; Q90-T94 VanDerWaalsContact O-OG1 3.08Å; T94-D96 PolarHBondContact O-N 3.39Å; T94-D96 VanDerWaalsContact O-N 3.16Å; T94-D96 PolarHBondContact OG1-O 3.21Å; T94-H403 WeakPolarHBondContact O-CB 3.38Å; T94-N407 PolarHBondContact O-ND2 2.81Å; T94-Q511 HydrophobicContact CG2-CB 3.97Å; T94-Q511 HydrophobicContact CG2-CG 4.01Å
95	G	82.9	Confident	86.5	Confident	2 Å²	2	34.3 Å²	34.3	2%	0.021	17%	0.169	C	C	.	.	S	Bend	trans	65.3	5.6	-176.4	0	0	0	0	0	115.7	D91	D91-G95 WeakPolarHBondContact O-CA 3.44Å; D91-G95 PolarHBondContact O-N 3.31Å
96	D	84.6	Confident	84.8	Confident	41 Å²	41	28.9 Å²	28.9	22%	0.219	14%	0.144	C	C	.	.	S	Bend	trans	-150.2	163.4	175.6	-175.2	21.5	0	0	0	108.6	T94 T98 V404 V508	T94-D96 PolarHBondContact O-N 3.39Å; T94-D96 VanDerWaalsContact O-N 3.16Å; T94-D96 PolarHBondContact OG1-O 3.21Å; D96-T98 VanDerWaalsContact C-N 3.35Å; D96-V404 HydrophobicContact CB-CG2 4Å; D96-V508 HydrophobicContact CB-CG1 4.17Å; D96-V508 HydrophobicContact CB-CG2 4.46Å
97	G	83.4	Confident	83	Confident	5 Å²	5	27.6 Å²	27.6	5%	0.052	14%	0.137	C	C	.	.			trans	83.7	6.3	178.4	0	0	0	0	0	114.3	T99 S100 V101	G97-T99 PolarHBondContact O-N 2.88Å; G97-S100 WeakPolarHBondContact O-CB 3.27Å; G97-S100 PolarHBondContact O-N 2.82Å; G97-S100 VanDerWaalsContact O-N 3.12Å; G97-V101 WeakPolarHBondContact O-CG2 3.02Å; G97-V101 PolarHBondContact O-N 3.08Å
98	T	87.3	Confident	81	Confident	8 Å²	8	27.6 Å²	27.6	5%	0.049	14%	0.138	C	C	.	.	H	α-helix	trans	-55.1	-52.4	-179.4	55.2	0	0	0	0	112.1	N67 D91 D96 S100 V101 I102	N67-T98 HydrophobicContact CB-CG2 3.88Å; D91-T98 HydrophobicContact CB-CG2 3.67Å; D96-T98 VanDerWaalsContact C-N 3.35Å; T98-S100 VanDerWaalsContact C-N 3.31Å; T98-S100 PolarHBondContact O-N 3.17Å; T98-V101 PolarHBondContact O-N 3.13Å; T98-I102 WeakPolarHBondContact O-CG1 3.14Å; T98-I102 PolarHBondContact O-N 3.19Å
99	T	88.8	Confident	78.7	Confident	13 Å²	13	22.4 Å²	22.4	8%	0.08	12%	0.118	C	C	.	.	H	α-helix	trans	-63.4	-38.8	177.1	-54.2	0	0	0	0	111.5	V40 C43 L44 G66 G97 I102 I103	V40-T99 HydrophobicContact CB-CG2 4.27Å; V40-T99 HydrophobicContact CG2-CG2 4.42Å; C43-T99 HydrophobicContact CB-CG2 4.29Å; L44-T99 HydrophobicContact CB-CG2 4.16Å; L44-T99 HydrophobicContact CD1-CG2 4.32Å; G66-T99 WeakPolarHBondContact CA-OG1 3.28Å; G66-T99 PolarHBondContact N-OG1 2.9Å; G97-T99 PolarHBondContact O-N 2.88Å; T99-I102 PolarHBondContact O-N 3.41Å; T99-I103 HydrophobicContact CG2-CD1 3.73Å; T99-I103 HydrophobicContact CG2-CG1 4.43Å; T99-I103 WeakPolarHBondContact O-CB 3.25Å; T99-I103 VanDerWaalsContact O-CG1 3.29Å; T99-I103 WeakPolarHBondContact O-CG1 3.14Å; T99-I103 PolarHBondContact O-N 3.37Å
100	S	88.4	Confident	76.8	Confident	8 Å²	8	21.8 Å²	21.8	6%	0.056	11%	0.11	C	C	.	.	H	α-helix	trans	-66.4	-37.3	178.9	-63.3	0	0	0	0	111.8	G97 T98 L104	G97-S100 WeakPolarHBondContact O-CB 3.27Å; G97-S100 PolarHBondContact O-N 2.82Å; G97-S100 VanDerWaalsContact O-N 3.12Å; T98-S100 VanDerWaalsContact C-N 3.31Å; T98-S100 PolarHBondContact O-N 3.17Å; S100-L104 VanDerWaalsContact O-CB 3.23Å; S100-L104 WeakPolarHBondContact O-CB 3.45Å; S100-L104 WeakPolarHBondContact O-CG 3.29Å; S100-L104 PolarHBondContact O-N 3.49Å
101	V	89.4	Confident	75.2	Confident	1 Å²	1	22 Å²	22	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-64.4	-40.4	175.2	170.1	0	0	0	0	111.7	I86 Q90 G97 T98 G105 V512 T515	I86-V101 HydrophobicContact CG2-CG1 3.76Å; Q90-V101 HydrophobicContact CB-CG2 4.4Å; Q90-V101 HydrophobicContact CG-CB 4.44Å; Q90-V101 HydrophobicContact CG-CG2 3.68Å; G97-V101 WeakPolarHBondContact O-CG2 3.02Å; G97-V101 PolarHBondContact O-N 3.08Å; T98-V101 PolarHBondContact O-N 3.13Å; V101-G105 WeakPolarHBondContact O-CA 3.38Å; V101-G105 PolarHBondContact O-N 3.34Å; V101-V512 HydrophobicContact CG2-CB 3.79Å; V101-V512 HydrophobicContact CG2-CG1 3.7Å; V101-V512 HydrophobicContact CG2-CG2 3.62Å; V101-T515 VanDerWaalsContact CG2-OG1 3.32Å; V101-T515 WeakPolarHBondContact CG2-OG1 3.49Å
102	I	88.5	Confident	73.7	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-73.9	-38.5	-178.6	-61.6	-65.3	0	0	0	111.1	I36 A37 V40 L70 M83 T98 T99 N106	I36-I102 HydrophobicContact CG2-CG2 3.96Å; A37-I102 HydrophobicContact CB-CG2 4.22Å; V40-I102 HydrophobicContact CG2-CB 4.06Å; V40-I102 HydrophobicContact CG2-CG2 3.58Å; L70-I102 HydrophobicContact CD1-CB 4.47Å; L70-I102 HydrophobicContact CD1-CD1 4.22Å; L70-I102 HydrophobicContact CD1-CG1 3.73Å; L70-I102 HydrophobicContact CD1-CG2 4.34Å; M83-I102 HydrophobicContact CB-CD1 4.27Å; M83-I102 HydrophobicContact CE-CD1 3.99Å; M83-I102 HydrophobicContact CE-CG2 4.24Å; M83-I102 WeakPolarHBondContact O-CD1 3.26Å; T98-I102 WeakPolarHBondContact O-CG1 3.14Å; T98-I102 PolarHBondContact O-N 3.19Å; T99-I102 PolarHBondContact O-N 3.41Å; I102-N106 VanDerWaalsContact O-CB 3.31Å; I102-N106 WeakPolarHBondContact O-CB 3.45Å; I102-N106 PolarHBondContact O-N 3.03Å
103	I	86	Confident	72.2	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-63.9	-60.6	173	-67	168.1	0	0	0	109.1	V40 L44 T99 G105 N106 D107 I453 I454 T457	V40-I103 HydrophobicContact CG2-CG1 4.42Å; L44-I103 HydrophobicContact CB-CD1 3.77Å; L44-I103 HydrophobicContact CD1-CD1 4.48Å; L44-I103 HydrophobicContact CD2-CD1 3.79Å; L44-I103 HydrophobicContact CG-CD1 4.21Å; T99-I103 HydrophobicContact CG2-CD1 3.73Å; T99-I103 HydrophobicContact CG2-CG1 4.43Å; T99-I103 WeakPolarHBondContact O-CB 3.25Å; T99-I103 VanDerWaalsContact O-CG1 3.29Å; T99-I103 WeakPolarHBondContact O-CG1 3.14Å; T99-I103 PolarHBondContact O-N 3.37Å; I103-G105 PolarHBondContact O-N 2.9Å; I103-N106 CarbonylContact O-C 3.53Å; I103-N106 VanDerWaalsContact O-C 3.31Å; I103-N106 VanDerWaalsContact O-CA 3.28Å; I103-N106 WeakPolarHBondContact O-CA 2.97Å; I103-N106 VanDerWaalsContact O-CB 3.32Å; I103-N106 WeakPolarHBondContact O-CB 3.36Å; I103-N106 PolarHBondContact O-N 3.1Å; I103-D107 WeakPolarHBondContact CG2-OD2 3.46Å; I103-D107 VanDerWaalsContact O-CG 3.32Å; I103-D107 PolarHBondContact O-N 3.38Å; I103-I453 HydrophobicContact CG2-CG1 4.1Å; I103-I453 HydrophobicContact CG2-CG2 4.15Å; I103-I454 HydrophobicContact CB-CD1 4.46Å; I103-I454 HydrophobicContact CG2-CD1 4.03Å; I103-T457 HydrophobicContact CD1-CG2 4.44Å
104	L	80.2	Confident	70.9	Confident	11 Å²	11	12.5 Å²	12.5	6%	0.058	7%	0.073	C	C	.	.	H	α-helix	trans	-62.2	-29.3	179.5	-73.6	166.4	0	0	0	113.5	S100 N106 D107 A108 F451 I453 I454 V512 Y513 A516	S100-L104 VanDerWaalsContact O-CB 3.23Å; S100-L104 WeakPolarHBondContact O-CB 3.45Å; S100-L104 WeakPolarHBondContact O-CG 3.29Å; S100-L104 PolarHBondContact O-N 3.49Å; L104-N106 VanDerWaalsContact C-N 3.31Å; L104-D107 CarbonylContact O-C 3.51Å; L104-D107 VanDerWaalsContact O-C 3.3Å; L104-D107 WeakPolarHBondContact O-CA 3.32Å; L104-D107 PolarHBondContact O-N 2.89Å; L104-D107 VanDerWaalsContact O-N 3.14Å; L104-A108 PolarHBondContact O-N 3.23Å; L104-F451 HydrophobicContact CD2-CD1 4.39Å; L104-I453 HydrophobicContact CD2-CG2 3.87Å; L104-I454 HydrophobicContact CD1-CD1 4.3Å; L104-I454 HydrophobicContact CD1-CG1 4.11Å; L104-I454 HydrophobicContact CD2-CD1 4.4Å; L104-I454 HydrophobicContact CD2-CG1 3.88Å; L104-I454 HydrophobicContact CG-CD1 3.98Å; L104-I454 HydrophobicContact CG-CG1 3.93Å; L104-V512 HydrophobicContact CD1-CG1 3.55Å; L104-Y513 HydrophobicContact CD1-CD1 3.94Å; L104-Y513 HydrophobicContact CD1-CE1 3.88Å; L104-A516 HydrophobicContact CB-CB 3.82Å
105	G	61.7	Low	69.4	Low	1 Å²	1	12.3 Å²	12.3	1%	0.01	7%	0.072	C	C	.	.	H	α-helix	trans	-69.7	-31.5	173.2	0	0	0	0	0	111.7	V101 I103 A108 A109	V101-G105 WeakPolarHBondContact O-CA 3.38Å; V101-G105 PolarHBondContact O-N 3.34Å; I103-G105 PolarHBondContact O-N 2.9Å; G105-A108 WeakPolarHBondContact O-CA 3.24Å; G105-A108 WeakPolarHBondContact O-CB 3.32Å; G105-A108 PolarHBondContact O-N 3.35Å; G105-A109 PolarHBondContact O-N 3.03Å
106	N	56.1	Low	68.5	Low	4 Å²	4	16 Å²	16	2%	0.021	9%	0.088	C	C	.	.	H	α-helix	trans	-81.3	-17.9	165.7	176.3	53.9	0	0	0	113.4	R34 A37 I102 I103 L104 A109 E110	R34-N106 WeakPolarHBondContact CA-OD1 3.49Å; R34-N106 WeakPolarHBondContact CB-OD1 3.3Å; R34-N106 PolarHBondContact N-OD1 3.36Å; A37-N106 HydrophobicContact CB-CB 3.07Å; A37-N106 VanDerWaalsContact CB-ND2 3.3Å; A37-N106 WeakPolarHBondContact CB-ND2 3.41Å; I102-N106 VanDerWaalsContact O-CB 3.31Å; I102-N106 WeakPolarHBondContact O-CB 3.45Å; I102-N106 PolarHBondContact O-N 3.03Å; I103-N106 CarbonylContact O-C 3.53Å; I103-N106 VanDerWaalsContact O-C 3.31Å; I103-N106 VanDerWaalsContact O-CA 3.28Å; I103-N106 WeakPolarHBondContact O-CA 2.97Å; I103-N106 VanDerWaalsContact O-CB 3.32Å; I103-N106 WeakPolarHBondContact O-CB 3.36Å; I103-N106 PolarHBondContact O-N 3.1Å; L104-N106 VanDerWaalsContact C-N 3.31Å; N106-A109 CarbonylContact O-C 3.59Å; N106-A109 WeakPolarHBondContact O-CA 3.27Å; N106-A109 WeakPolarHBondContact O-CB 3.31Å; N106-A109 PolarHBondContact O-N 3.05Å; N106-A109 VanDerWaalsContact OD1-CB 3.31Å; N106-A109 WeakPolarHBondContact OD1-CB 3.26Å; N106-E110 PolarHBondContact O-N 3.2Å
107	D	52.5	Low	67.7	Low	2 Å²	2	16.8 Å²	16.8	1%	0.011	10%	0.096	C	C	.	.	H	α-helix	trans	-86	-9.7	166	-50.1	-55.9	0	0	0	111.1	I103 L104 E110 I111 A450 I453	I103-D107 WeakPolarHBondContact CG2-OD2 3.46Å; I103-D107 VanDerWaalsContact O-CG 3.32Å; I103-D107 PolarHBondContact O-N 3.38Å; L104-D107 CarbonylContact O-C 3.51Å; L104-D107 VanDerWaalsContact O-C 3.3Å; L104-D107 WeakPolarHBondContact O-CA 3.32Å; L104-D107 PolarHBondContact O-N 2.89Å; L104-D107 VanDerWaalsContact O-N 3.14Å; D107-E110 VanDerWaalsContact C-N 3.28Å; D107-E110 HydrophobicContact CB-CB 3.95Å; D107-E110 CarbonylContact O-C 3.54Å; D107-E110 WeakPolarHBondContact O-CA 3.45Å; D107-E110 PolarHBondContact O-N 3.49Å; D107-E110 VanDerWaalsContact O-N 3.07Å; D107-I111 WeakPolarHBondContact O-CB 3.4Å; D107-I111 WeakPolarHBondContact O-CG1 3.38Å; D107-I111 PolarHBondContact O-N 3.4Å; D107-A450 HydrophobicContact CB-CB 3.81Å; D107-A450 VanDerWaalsContact O-CB 3.27Å; D107-A450 WeakPolarHBondContact O-CB 3.32Å; D107-I453 HydrophobicContact CB-CB 4.4Å; D107-I453 HydrophobicContact CB-CG2 3.97Å; D107-I453 WeakPolarHBondContact OD1-CG1 3.47Å; D107-I453 WeakPolarHBondContact OD2-CB 3.46Å; D107-I453 VanDerWaalsContact OD2-CG1 3.26Å; D107-I453 WeakPolarHBondContact OD2-CG1 3.26Å; D107-I453 WeakPolarHBondContact OD2-CG2 3.25Å
108	A	47.8	Very low	67	Low	1 Å²	1	17.7 Å²	17.7	1%	0.008	10%	0.098	C	C	.	.	H	α-helix	trans	-65.3	-28.8	148.8	0	0	0	0	0	110.4	L104 G105 I111 L112 A520	L104-A108 PolarHBondContact O-N 3.23Å; G105-A108 WeakPolarHBondContact O-CA 3.24Å; G105-A108 WeakPolarHBondContact O-CB 3.32Å; G105-A108 PolarHBondContact O-N 3.35Å; A108-I111 CarbonylContact O-C 3.47Å; A108-I111 VanDerWaalsContact O-CB 3.29Å; A108-I111 WeakPolarHBondContact O-CB 3.5Å; A108-L112 WeakPolarHBondContact O-CD1 3.22Å; A108-L112 WeakPolarHBondContact O-CG 3.36Å; A108-L112 PolarHBondContact O-N 3.39Å; A108-A520 HydrophobicContact CB-CB 3.11Å
109	A	42.9	Very low	66.1	Low	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-80.3	-12.8	160.2	0	0	0	0	0	115.8	I30 G105 N106 L112 N113	I30-A109 HydrophobicContact CG2-CB 3.86Å; G105-A109 PolarHBondContact O-N 3.03Å; N106-A109 CarbonylContact O-C 3.59Å; N106-A109 WeakPolarHBondContact O-CA 3.27Å; N106-A109 WeakPolarHBondContact O-CB 3.31Å; N106-A109 PolarHBondContact O-N 3.05Å; N106-A109 VanDerWaalsContact OD1-CB 3.31Å; N106-A109 WeakPolarHBondContact OD1-CB 3.26Å; A109-L112 VanDerWaalsContact C-N 3.28Å; A109-L112 HydrophobicContact CB-CB 4.24Å; A109-L112 HydrophobicContact CB-CD1 4.06Å; A109-L112 CarbonylContact O-C 3.41Å; A109-L112 WeakPolarHBondContact O-CA 3.39Å; A109-L112 WeakPolarHBondContact O-CB 3.39Å; A109-L112 PolarHBondContact O-N 3.08Å; A109-N113 WeakPolarHBondContact O-CB 3.28Å; A109-N113 PolarHBondContact O-N 2.8Å; A109-N113 PolarHBondContact O-ND2 3.03Å; A109-N113 PolarHBondContact O-OD1 3.37Å
110	E	51.8	Low	65.3	Low	70 Å²	70	22.6 Å²	22.6	33%	0.327	13%	0.128	S	C	.	.	H	α-helix	trans	-83.3	-31.7	164.2	-162.6	173.1	-153.2	0	0	110.8	N106 D107 N113 A114	N106-E110 PolarHBondContact O-N 3.2Å; D107-E110 VanDerWaalsContact C-N 3.28Å; D107-E110 HydrophobicContact CB-CB 3.95Å; D107-E110 CarbonylContact O-C 3.54Å; D107-E110 WeakPolarHBondContact O-CA 3.45Å; D107-E110 PolarHBondContact O-N 3.49Å; D107-E110 VanDerWaalsContact O-N 3.07Å; E110-N113 PolarHBondContact O-N 2.9Å; E110-A114 WeakPolarHBondContact O-CA 3.47Å; E110-A114 WeakPolarHBondContact O-CB 3.4Å; E110-A114 PolarHBondContact O-N 3.3Å
111	I	56.7	Low	64.5	Low	6 Å²	6	29.1 Å²	29.1	3%	0.031	16%	0.158	C	C	.	.	H	α-helix	trans	-58.1	-42.2	155.4	-72	157.9	0	0	0	107.2	D107 A108 A114 T115 L132 A446 V447 A450	D107-I111 WeakPolarHBondContact O-CB 3.4Å; D107-I111 WeakPolarHBondContact O-CG1 3.38Å; D107-I111 PolarHBondContact O-N 3.4Å; A108-I111 CarbonylContact O-C 3.47Å; A108-I111 VanDerWaalsContact O-CB 3.29Å; A108-I111 WeakPolarHBondContact O-CB 3.5Å; I111-A114 CarbonylContact O-C 3.54Å; I111-A114 PolarHBondContact O-N 2.98Å; I111-T115 HydrophobicContact CG2-CG2 4.17Å; I111-T115 WeakPolarHBondContact O-CA 3.38Å; I111-T115 WeakPolarHBondContact O-CB 3.43Å; I111-T115 WeakPolarHBondContact O-CG2 3.41Å; I111-T115 PolarHBondContact O-N 3.47Å; I111-T115 PolarHBondContact O-OG1 3Å; I111-T115 VanDerWaalsContact O-OG1 3.1Å; I111-L132 HydrophobicContact CD1-CD2 3.95Å; I111-L132 HydrophobicContact CG2-CD1 4.17Å; I111-L132 HydrophobicContact CG2-CD2 3.65Å; I111-L132 HydrophobicContact CG2-CG 4.43Å; I111-A446 HydrophobicContact CG1-CB 4.4Å; I111-V447 HydrophobicContact CD1-CB 4.19Å; I111-V447 HydrophobicContact CD1-CG2 3.61Å; I111-V447 HydrophobicContact CG1-CB 4.46Å; I111-V447 HydrophobicContact CG1-CG2 3.97Å; I111-A450 HydrophobicContact CD1-CB 4.11Å; I111-A450 HydrophobicContact CG1-CB 3.87Å
112	L	57.3	Low	63.6	Low	2 Å²	2	32 Å²	32	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-68.6	-37.4	176.4	-63.3	156.3	0	0	0	113.3	I30 A108 A109 T115 E116 L524	I30-L112 HydrophobicContact CB-CB 4.45Å; I30-L112 HydrophobicContact CD1-CB 3.5Å; I30-L112 HydrophobicContact CD1-CD1 4.28Å; I30-L112 HydrophobicContact CD1-CD2 4.04Å; I30-L112 HydrophobicContact CD1-CG 4.09Å; I30-L112 HydrophobicContact CG1-CB 3.51Å; I30-L112 HydrophobicContact CG1-CD1 3.55Å; I30-L112 HydrophobicContact CG1-CD2 4.21Å; I30-L112 HydrophobicContact CG1-CG 3.86Å; I30-L112 HydrophobicContact CG2-CB 4.05Å; A108-L112 WeakPolarHBondContact O-CD1 3.22Å; A108-L112 WeakPolarHBondContact O-CG 3.36Å; A108-L112 PolarHBondContact O-N 3.39Å; A109-L112 VanDerWaalsContact C-N 3.28Å; A109-L112 HydrophobicContact CB-CB 4.24Å; A109-L112 HydrophobicContact CB-CD1 4.06Å; A109-L112 CarbonylContact O-C 3.41Å; A109-L112 WeakPolarHBondContact O-CA 3.39Å; A109-L112 WeakPolarHBondContact O-CB 3.39Å; A109-L112 PolarHBondContact O-N 3.08Å; L112-T115 VanDerWaalsContact CA-OG1 3.23Å; L112-T115 WeakPolarHBondContact CA-OG1 3.36Å; L112-T115 CarbonylContact O-C 3.56Å; L112-T115 WeakPolarHBondContact O-CA 3.34Å; L112-T115 PolarHBondContact O-N 3.34Å; L112-T115 PolarHBondContact O-OG1 2.71Å; L112-E116 WeakPolarHBondContact O-CA 3.25Å; L112-E116 WeakPolarHBondContact O-CB 3.45Å; L112-E116 PolarHBondContact O-N 3.42Å; L112-L524 HydrophobicContact CD2-CD1 3.69Å; L112-L524 HydrophobicContact CD2-CD2 3.08Å; L112-L524 HydrophobicContact CD2-CG 3.24Å; L112-L524 HydrophobicContact CG-CG 4.44Å
113	N	57.8	Low	63.1	Low	49 Å²	49	32.9 Å²	32.9	26%	0.262	19%	0.191	S	C	.	.	H	α-helix	trans	-73	-35.8	176.3	-68.9	-28.8	0	0	0	110.7	A109 E110 T115 E116 P117	A109-N113 WeakPolarHBondContact O-CB 3.28Å; A109-N113 PolarHBondContact O-N 2.8Å; A109-N113 PolarHBondContact O-ND2 3.03Å; A109-N113 PolarHBondContact O-OD1 3.37Å; E110-N113 PolarHBondContact O-N 2.9Å; N113-T115 VanDerWaalsContact C-N 3.25Å; N113-E116 WeakPolarHBondContact O-CB 3.3Å; N113-E116 PolarHBondContact O-N 3.49Å; N113-P117 WeakPolarHBondContact O-CD 3.25Å
114	A	57.5	Low	62.9	Low	34 Å²	34	38.4 Å²	38.4	28%	0.281	22%	0.217	S	C	.	.	H	α-helix	trans	-70.6	-28.4	170.5	0	0	0	0	0	110.4	E110 I111 P117 F118 A446	E110-A114 WeakPolarHBondContact O-CA 3.47Å; E110-A114 WeakPolarHBondContact O-CB 3.4Å; E110-A114 PolarHBondContact O-N 3.3Å; I111-A114 CarbonylContact O-C 3.54Å; I111-A114 PolarHBondContact O-N 2.98Å; A114-P117 WeakPolarHBondContact O-CD 3.29Å; A114-F118 VanDerWaalsContact O-CD2 3.28Å; A114-F118 WeakPolarHBondContact O-CD2 2.93Å; A114-F118 WeakPolarHBondContact O-CE2 3.22Å; A114-A446 HydrophobicContact CB-CB 3.51Å
115	T	56.8	Low	63	Low	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-88.2	-8.3	170.3	75.1	0	0	0	0	114.6	I111 L112 N113 P117 F118 L119 I128	I111-T115 HydrophobicContact CG2-CG2 4.17Å; I111-T115 WeakPolarHBondContact O-CA 3.38Å; I111-T115 WeakPolarHBondContact O-CB 3.43Å; I111-T115 WeakPolarHBondContact O-CG2 3.41Å; I111-T115 PolarHBondContact O-N 3.47Å; I111-T115 PolarHBondContact O-OG1 3Å; I111-T115 VanDerWaalsContact O-OG1 3.1Å; L112-T115 VanDerWaalsContact CA-OG1 3.23Å; L112-T115 WeakPolarHBondContact CA-OG1 3.36Å; L112-T115 CarbonylContact O-C 3.56Å; L112-T115 WeakPolarHBondContact O-CA 3.34Å; L112-T115 PolarHBondContact O-N 3.34Å; L112-T115 PolarHBondContact O-OG1 2.71Å; N113-T115 VanDerWaalsContact C-N 3.25Å; T115-P117 VanDerWaalsContact C-N 3.32Å; T115-F118 VanDerWaalsContact CA-CD2 3.43Å; T115-F118 HydrophobicContact CG2-CD2 3.82Å; T115-F118 HydrophobicContact CG2-CE2 4.49Å; T115-F118 CarbonylContact O-C 3.54Å; T115-F118 VanDerWaalsContact O-CA 3.29Å; T115-F118 WeakPolarHBondContact O-CA 3.38Å; T115-F118 WeakPolarHBondContact O-CB 3.38Å; T115-F118 PolarHBondContact O-N 3.43Å; T115-L119 WeakPolarHBondContact O-CG 3.45Å; T115-L119 PolarHBondContact O-N 3.06Å; T115-I128 HydrophobicContact CG2-CD1 4.03Å; T115-I128 HydrophobicContact CG2-CG1 4.31Å; T115-I128 HydrophobicContact CG2-CG2 3.75Å
116	E	63.9	Low	64.2	Low	80 Å²	80	41.4 Å²	41.4	37%	0.374	24%	0.236	S	C	.	.	H	α-helix	trans	-61.8	-43.6	176.1	173.8	-174.4	-172	0	0	108.6	L27 L112 N113 F118 L119 T120	L27-E116 HydrophobicContact CD2-CG 3.96Å; L112-E116 WeakPolarHBondContact O-CA 3.25Å; L112-E116 WeakPolarHBondContact O-CB 3.45Å; L112-E116 PolarHBondContact O-N 3.42Å; N113-E116 WeakPolarHBondContact O-CB 3.3Å; N113-E116 PolarHBondContact O-N 3.49Å; E116-F118 VanDerWaalsContact C-N 3.29Å; E116-F118 PolarHBondContact O-N 3.1Å; E116-L119 PolarHBondContact O-N 3.08Å; E116-T120 VanDerWaalsContact O-CB 3.26Å; E116-T120 WeakPolarHBondContact O-CB 3.38Å; E116-T120 PolarHBondContact O-N 3.25Å; E116-T120 PolarHBondContact O-OG1 3.15Å
117	P	66.6	Low	65.6	Low	58 Å²	58	45.6 Å²	45.6	38%	0.377	26%	0.255	S	S	.	.	H	α-helix	trans	-54.6	-42.1	164.8	-26.3	32.3	0	0	0	113	N113 A114 T115 T120 Q121	N113-P117 WeakPolarHBondContact O-CD 3.25Å; A114-P117 WeakPolarHBondContact O-CD 3.29Å; T115-P117 VanDerWaalsContact C-N 3.32Å; P117-T120 CarbonylContact O-C 3.57Å; P117-T120 PolarHBondContact O-N 3.03Å; P117-Q121 WeakPolarHBondContact O-CB 3.29Å; P117-Q121 WeakPolarHBondContact O-CG 3.48Å; P117-Q121 PolarHBondContact O-N 3.21Å
118	F	68.8	Low	67.1	Low	24 Å²	24	45.5 Å²	45.5	11%	0.105	25%	0.254	C	S	.	.	H	α-helix	trans	-70	-38.4	-179.1	-55.4	-44.5	0	0	0	112.9	A114 T115 E116 Q121 G122 M123 F442	A114-F118 VanDerWaalsContact O-CD2 3.28Å; A114-F118 WeakPolarHBondContact O-CD2 2.93Å; A114-F118 WeakPolarHBondContact O-CE2 3.22Å; T115-F118 VanDerWaalsContact CA-CD2 3.43Å; T115-F118 HydrophobicContact CG2-CD2 3.82Å; T115-F118 HydrophobicContact CG2-CE2 4.49Å; T115-F118 CarbonylContact O-C 3.54Å; T115-F118 VanDerWaalsContact O-CA 3.29Å; T115-F118 WeakPolarHBondContact O-CA 3.38Å; T115-F118 WeakPolarHBondContact O-CB 3.38Å; T115-F118 PolarHBondContact O-N 3.43Å; E116-F118 VanDerWaalsContact C-N 3.29Å; E116-F118 PolarHBondContact O-N 3.1Å; F118-Q121 CarbonylContact O-C 3.58Å; F118-Q121 PolarHBondContact O-N 3.25Å; F118-G122 PolarHBondContact O-N 3.42Å; F118-M123 HydrophobicContact CB-CB 4.13Å; F118-M123 HydrophobicContact CB-CE 4.06Å; F118-M123 HydrophobicContact CB-SD 4.18Å; F118-M123 HydrophobicContact CD1-CE 4.28Å; F118-M123 HydrophobicContact CG-CE 4.16Å; F118-M123 WeakPolarHBondContact O-CB 3.23Å; F118-M123 PolarHBondContact O-N 3.32Å; F118-F442 HydrophobicContact CD2-CB 4.38Å; F118-F442 HydrophobicContact CE1-CB 3.77Å; F118-F442 AromaticContact CE1-CD1 3.94Å; F118-F442 HydrophobicContact CE1-CD1 3.94Å; F118-F442 AromaticContact CE1-CG 3.83Å; F118-F442 HydrophobicContact CE1-CG 3.83Å; F118-F442 HydrophobicContact CE2-CB 3.68Å; F118-F442 HydrophobicContact CZ-CB 3.39Å; F118-F442 AromaticContact CZ-CD1 3.91Å; F118-F442 HydrophobicContact CZ-CD1 3.91Å; F118-F442 AromaticContact CZ-CG 3.86Å; F118-F442 HydrophobicContact CZ-CG 3.86Å
119	L	69.4	Low	68.9	Low	10 Å²	10	45.9 Å²	45.9	5%	0.052	26%	0.256	C	S	.	.	H	α-helix	trans	-66.1	-43.4	173.2	-69.5	173.6	0	0	0	109.9	T115 E116 Q121 G122 P125 I128 L524	T115-L119 WeakPolarHBondContact O-CG 3.45Å; T115-L119 PolarHBondContact O-N 3.06Å; E116-L119 PolarHBondContact O-N 3.08Å; L119-Q121 VanDerWaalsContact C-N 3.29Å; L119-Q121 PolarHBondContact O-N 3.44Å; L119-G122 PolarHBondContact O-N 2.9Å; L119-P125 HydrophobicContact CD2-CG 3.95Å; L119-I128 HydrophobicContact CD2-CD1 3.89Å; L119-I128 HydrophobicContact CG-CD1 4.21Å; L119-L524 HydrophobicContact CD1-CD2 4.47Å
120	T	70.4	Confident	71.1	Confident	113 Å²	113	53 Å²	53	69%	0.693	28%	0.283	S	S	*	.	H	α-helix	trans	-67.8	-30.3	176	-48.2	0	0	0	0	111.9	E116 P117 G122	E116-T120 VanDerWaalsContact O-CB 3.26Å; E116-T120 WeakPolarHBondContact O-CB 3.38Å; E116-T120 PolarHBondContact O-N 3.25Å; E116-T120 PolarHBondContact O-OG1 3.15Å; P117-T120 CarbonylContact O-C 3.57Å; P117-T120 PolarHBondContact O-N 3.03Å; T120-G122 PolarHBondContact O-N 3.31Å
121	Q	71.4	Confident	72.9	Confident	146 Å²	146	49.7 Å²	49.7	68%	0.682	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-0.6	172.3	-73.8	166.8	17.1	0	0	113.2	P117 F118 L119	P117-Q121 WeakPolarHBondContact O-CB 3.29Å; P117-Q121 WeakPolarHBondContact O-CG 3.48Å; P117-Q121 PolarHBondContact O-N 3.21Å; F118-Q121 CarbonylContact O-C 3.58Å; F118-Q121 PolarHBondContact O-N 3.25Å; L119-Q121 VanDerWaalsContact C-N 3.29Å; L119-Q121 PolarHBondContact O-N 3.44Å
122	G	72.3	Confident	74.3	Confident	60 Å²	60	49.4 Å²	49.4	62%	0.619	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	87	15.3	174.7	0	0	0	0	0	115.5	F118 L119 T120 H124	F118-G122 PolarHBondContact O-N 3.42Å; L119-G122 PolarHBondContact O-N 2.9Å; T120-G122 PolarHBondContact O-N 3.31Å; G122-H124 PolarHBondContact O-N 3.12Å
123	M	77	Confident	75.9	Confident	20 Å²	20	53.4 Å²	53.4	10%	0.099	29%	0.285	C	S	.	.			trans	-69	124.5	172.8	-170.1	-178.4	-63.2	0	0	110.1	F118 H127 I128 E439	F118-M123 HydrophobicContact CB-CB 4.13Å; F118-M123 HydrophobicContact CB-CE 4.06Å; F118-M123 HydrophobicContact CB-SD 4.18Å; F118-M123 HydrophobicContact CD1-CE 4.28Å; F118-M123 HydrophobicContact CG-CE 4.16Å; F118-M123 WeakPolarHBondContact O-CB 3.23Å; F118-M123 PolarHBondContact O-N 3.32Å; M123-H127 HydrophobicContact CG-CB 4.25Å; M123-H127 HydrophobicContact SD-CB 4.48Å; M123-I128 HydrophobicContact CG-CG1 4.38Å; M123-I128 HydrophobicContact SD-CD1 4.4Å; M123-I128 HydrophobicContact SD-CG1 3.75Å; M123-E439 HydrophobicContact CE-CB 3.62Å; M123-E439 HydrophobicContact CE-CG 3.84Å; M123-E439 HydrophobicContact SD-CB 4.35Å
124	H	82.3	Confident	77.5	Confident	115 Å²	115	52.6 Å²	52.6	53%	0.532	29%	0.285	S	S	.	.			trans	-67.6	133	-179.7	-168.1	-85.4	0	0	0	110.9	G122 V126 H127	G122-H124 PolarHBondContact O-N 3.12Å; H124-V126 VanDerWaalsContact CE1-CG2 3.4Å; H124-V126 WeakPolarHBondContact CE1-CG2 3.47Å; H124-V126 WeakPolarHBondContact ND1-CB 3.46Å; H124-V126 WeakPolarHBondContact ND1-CG2 3.08Å; H124-V126 PolarHBondContact ND1-N 3.45Å; H124-V126 PolarHBondContact O-N 2.98Å; H124-H127 PolarHBondContact O-N 3.12Å
125	P	82	Confident	79	Confident	16 Å²	16	51 Å²	51	10%	0.104	27%	0.272	C	S	.	.	H	α-helix	trans	-50.9	-32	-176.6	-28.8	32	0	0	0	115.1	Q26 L119 H127 I128 I129	Q26-P125 VanDerWaalsContact NE2-CG 3.32Å; L119-P125 HydrophobicContact CD2-CG 3.95Å; P125-H127 VanDerWaalsContact C-N 3.27Å; P125-H127 PolarHBondContact O-N 3.09Å; P125-I128 WeakPolarHBondContact O-CB 3.43Å; P125-I128 PolarHBondContact O-N 3.45Å; P125-I128 VanDerWaalsContact O-N 3.15Å; P125-I129 VanDerWaalsContact O-CG1 3.3Å; P125-I129 WeakPolarHBondContact O-CG1 3.26Å; P125-I129 PolarHBondContact O-N 3.44Å
126	V	86.8	Confident	80.7	Confident	60 Å²	60	51.9 Å²	51.9	36%	0.364	28%	0.276	S	S	.	.	H	α-helix	trans	-58.8	-34.7	176.8	173.7	0	0	0	0	112.9	H124 R130	H124-V126 VanDerWaalsContact CE1-CG2 3.4Å; H124-V126 WeakPolarHBondContact CE1-CG2 3.47Å; H124-V126 WeakPolarHBondContact ND1-CB 3.46Å; H124-V126 WeakPolarHBondContact ND1-CG2 3.08Å; H124-V126 PolarHBondContact ND1-N 3.45Å; H124-V126 PolarHBondContact O-N 2.98Å; V126-R130 WeakPolarHBondContact O-CG 3.41Å; V126-R130 PolarHBondContact O-N 2.89Å
127	H	85.3	Confident	82	Confident	91 Å²	91	53.8 Å²	53.8	42%	0.421	29%	0.288	S	S	.	.	H	α-helix	trans	-68.2	-41.4	176.8	-68.4	-68	0	0	0	111.2	M123 H124 P125 R130 A131	M123-H127 HydrophobicContact CG-CB 4.25Å; M123-H127 HydrophobicContact SD-CB 4.48Å; H124-H127 PolarHBondContact O-N 3.12Å; P125-H127 VanDerWaalsContact C-N 3.27Å; P125-H127 PolarHBondContact O-N 3.09Å; H127-R130 PolarHBondContact O-N 3.15Å; H127-A131 PolarHBondContact O-N 2.91Å; H127-A131 VanDerWaalsContact O-N 3.09Å
128	I	83.7	Confident	83.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61.4	-49.4	174.9	-58.4	167.7	0	0	0	109.7	T115 L119 M123 P125 R130 A131 L132 V443 L524	T115-I128 HydrophobicContact CG2-CD1 4.03Å; T115-I128 HydrophobicContact CG2-CG1 4.31Å; T115-I128 HydrophobicContact CG2-CG2 3.75Å; L119-I128 HydrophobicContact CD2-CD1 3.89Å; L119-I128 HydrophobicContact CG-CD1 4.21Å; M123-I128 HydrophobicContact CG-CG1 4.38Å; M123-I128 HydrophobicContact SD-CD1 4.4Å; M123-I128 HydrophobicContact SD-CG1 3.75Å; P125-I128 WeakPolarHBondContact O-CB 3.43Å; P125-I128 PolarHBondContact O-N 3.45Å; P125-I128 VanDerWaalsContact O-N 3.15Å; I128-R130 PolarHBondContact O-N 3.3Å; I128-A131 PolarHBondContact O-N 3.4Å; I128-A131 VanDerWaalsContact O-N 3.12Å; I128-L132 HydrophobicContact CG2-CD1 3.94Å; I128-L132 HydrophobicContact CG2-CG 4.29Å; I128-L132 WeakPolarHBondContact O-CG 2.94Å; I128-L132 PolarHBondContact O-N 3.35Å; I128-V443 HydrophobicContact CG1-CG2 4.34Å; I128-V443 HydrophobicContact CG2-CG1 4.2Å; I128-V443 HydrophobicContact CG2-CG2 4.35Å; I128-L524 HydrophobicContact CB-CD1 4.41Å; I128-L524 HydrophobicContact CG2-CD1 3.77Å
129	I	87	Confident	84.2	Confident	10 Å²	10	51.8 Å²	51.8	5%	0.051	28%	0.275	C	S	.	.	H	α-helix	trans	-56.6	-46.9	179.1	-69.7	161.5	0	0	0	111.7	P125 A131 L132 Q133 I521 L524 R525	P125-I129 VanDerWaalsContact O-CG1 3.3Å; P125-I129 WeakPolarHBondContact O-CG1 3.26Å; P125-I129 PolarHBondContact O-N 3.44Å; I129-A131 VanDerWaalsContact C-N 3.32Å; I129-A131 PolarHBondContact O-N 2.85Å; I129-L132 PolarHBondContact O-N 3.03Å; I129-Q133 WeakPolarHBondContact O-CG 3.3Å; I129-Q133 PolarHBondContact O-N 2.98Å; I129-I521 HydrophobicContact CB-CG2 4.44Å; I129-I521 HydrophobicContact CG1-CG2 4.17Å; I129-I521 HydrophobicContact CG2-CB 4.46Å; I129-I521 HydrophobicContact CG2-CG1 4.21Å; I129-I521 HydrophobicContact CG2-CG2 3.57Å; I129-L524 HydrophobicContact CD1-CB 4.23Å; I129-L524 HydrophobicContact CG1-CB 4.17Å; I129-L524 HydrophobicContact CG1-CD1 4.21Å; I129-R525 HydrophobicContact CD1-CG 3.5Å
130	R	89.2	Confident	85.2	Confident	150 Å²	150	52.3 Å²	52.3	57%	0.566	28%	0.279	S	S	*	.	H	α-helix	trans	-63.4	-39.3	178.7	-75.1	178.6	179.1	175.2	1.3	112	V126 H127 I128 A134	V126-R130 WeakPolarHBondContact O-CG 3.41Å; V126-R130 PolarHBondContact O-N 2.89Å; H127-R130 PolarHBondContact O-N 3.15Å; I128-R130 PolarHBondContact O-N 3.3Å; R130-A134 PolarHBondContact O-N 3.42Å; R130-A134 VanDerWaalsContact O-N 3.12Å
131	A	87.8	Confident	86.2	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-67.1	-39.9	177.1	0	0	0	0	0	111.7	H127 I128 I129 A134 A135 Q440 V443	H127-A131 PolarHBondContact O-N 2.91Å; H127-A131 VanDerWaalsContact O-N 3.09Å; I128-A131 PolarHBondContact O-N 3.4Å; I128-A131 VanDerWaalsContact O-N 3.12Å; I129-A131 VanDerWaalsContact C-N 3.32Å; I129-A131 PolarHBondContact O-N 2.85Å; A131-A134 PolarHBondContact O-N 2.83Å; A131-A135 WeakPolarHBondContact O-CB 3.45Å; A131-A135 PolarHBondContact O-N 3.35Å; A131-Q440 HydrophobicContact CB-CB 4.14Å; A131-Q440 HydrophobicContact CB-CG 4.07Å; A131-V443 HydrophobicContact CB-CB 3.68Å; A131-V443 HydrophobicContact CB-CG1 3.73Å; A131-V443 HydrophobicContact CB-CG2 3.98Å
132	L	88.2	Confident	86.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.2	-43.4	175.1	-70.8	173.5	0	0	0	112.7	I111 I128 I129 A134 A135 L136 V443 V447 I517 A520 I521 L524	I111-L132 HydrophobicContact CD1-CD2 3.95Å; I111-L132 HydrophobicContact CG2-CD1 4.17Å; I111-L132 HydrophobicContact CG2-CD2 3.65Å; I111-L132 HydrophobicContact CG2-CG 4.43Å; I128-L132 HydrophobicContact CG2-CD1 3.94Å; I128-L132 HydrophobicContact CG2-CG 4.29Å; I128-L132 WeakPolarHBondContact O-CG 2.94Å; I128-L132 PolarHBondContact O-N 3.35Å; I129-L132 PolarHBondContact O-N 3.03Å; L132-A134 VanDerWaalsContact C-N 3.32Å; L132-A134 PolarHBondContact O-N 3.36Å; L132-A135 PolarHBondContact O-N 3.43Å; L132-L136 WeakPolarHBondContact O-CB 2.96Å; L132-L136 PolarHBondContact O-N 3.04Å; L132-V443 HydrophobicContact CD2-CG1 3.8Å; L132-V443 HydrophobicContact CG-CG1 3.92Å; L132-V447 HydrophobicContact CD2-CG2 3.45Å; L132-V447 VanDerWaalsContact CD2-CG2 3.45Å; L132-I517 HydrophobicContact CB-CG2 3.99Å; L132-A520 HydrophobicContact CD1-CB 4.29Å; L132-I521 HydrophobicContact CB-CD1 4.07Å; L132-I521 HydrophobicContact CB-CG1 4.05Å; L132-I521 HydrophobicContact CD1-CG1 4.08Å; L132-L524 HydrophobicContact CD1-CD1 3.98Å
133	Q	90.8	Very high	87.6	Confident	86 Å²	86	40.4 Å²	40.4	40%	0.402	21%	0.207	S	C	.	.	H	α-helix	trans	-61.1	-41.8	175.3	-71.5	179.8	-36.3	0	0	111.9	I129 L136 I137 I521	I129-Q133 WeakPolarHBondContact O-CG 3.3Å; I129-Q133 PolarHBondContact O-N 2.98Å; Q133-L136 PolarHBondContact O-N 2.9Å; Q133-I137 WeakPolarHBondContact O-CG1 3.48Å; Q133-I137 PolarHBondContact O-N 3.44Å; Q133-I521 HydrophobicContact CG-CD1 3.55Å
134	A	91.1	Very high	87.9	Confident	32 Å²	32	42 Å²	42	26%	0.264	22%	0.216	S	C	.	.	H	α-helix	trans	-65.4	-44.4	176.6	0	0	0	0	0	111.6	R130 A131 L132 L136 I137 D138 Y444	R130-A134 PolarHBondContact O-N 3.42Å; R130-A134 VanDerWaalsContact O-N 3.12Å; A131-A134 PolarHBondContact O-N 2.83Å; L132-A134 VanDerWaalsContact C-N 3.32Å; L132-A134 PolarHBondContact O-N 3.36Å; A134-L136 VanDerWaalsContact C-N 3.3Å; A134-L136 PolarHBondContact O-N 2.69Å; A134-I137 PolarHBondContact O-N 3.19Å; A134-D138 PolarHBondContact O-N 2.92Å; A134-Y444 VanDerWaalsContact C-OH 3.25Å; A134-Y444 HydrophobicContact CB-CE2 4.42Å; A134-Y444 WeakPolarHBondContact CB-OH 3.33Å
135	A	89.3	Confident	87.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.4	-38.7	176.9	0	0	0	0	0	111.9	A131 L132 D138 V139 Y444 V447	A131-A135 WeakPolarHBondContact O-CB 3.45Å; A131-A135 PolarHBondContact O-N 3.35Å; L132-A135 PolarHBondContact O-N 3.43Å; A135-D138 WeakPolarHBondContact O-CB 3.27Å; A135-D138 PolarHBondContact O-N 2.92Å; A135-V139 WeakPolarHBondContact O-CG2 3.45Å; A135-V139 PolarHBondContact O-N 3.34Å; A135-Y444 HydrophobicContact CB-CD1 4.36Å; A135-Y444 HydrophobicContact CB-CD2 4.39Å; A135-Y444 HydrophobicContact CB-CE1 4.04Å; A135-Y444 HydrophobicContact CB-CE2 4.09Å; A135-Y444 PolarHBondContact N-OH 3.35Å; A135-V447 HydrophobicContact CB-CG1 4.37Å; A135-V447 HydrophobicContact CB-CG2 4.28Å
136	L	90.8	Very high	87.7	Confident	18 Å²	18	49.5 Å²	49.5	9%	0.094	25%	0.251	C	S	.	.	H	α-helix	trans	-61.8	-44.4	176.1	175.2	60.4	0	0	0	112.4	L132 Q133 A134 D138 V139 V140 K514 I517 E518	L132-L136 WeakPolarHBondContact O-CB 2.96Å; L132-L136 PolarHBondContact O-N 3.04Å; Q133-L136 PolarHBondContact O-N 2.9Å; A134-L136 VanDerWaalsContact C-N 3.3Å; A134-L136 PolarHBondContact O-N 2.69Å; L136-D138 PolarHBondContact O-N 3.43Å; L136-V139 PolarHBondContact O-N 3.48Å; L136-V140 HydrophobicContact CD1-CG2 3.81Å; L136-V140 HydrophobicContact CG-CG2 4.39Å; L136-V140 VanDerWaalsContact O-CG2 3.28Å; L136-V140 WeakPolarHBondContact O-CG2 3.41Å; L136-V140 PolarHBondContact O-N 2.7Å; L136-K514 HydrophobicContact CD1-CB 4.32Å; L136-K514 HydrophobicContact CD1-CG 3.86Å; L136-K514 HydrophobicContact CD2-CG 4.43Å; L136-I517 HydrophobicContact CB-CB 4.44Å; L136-I517 HydrophobicContact CB-CD1 3.91Å; L136-I517 HydrophobicContact CB-CG2 4.07Å; L136-I517 HydrophobicContact CD1-CB 4.41Å; L136-I517 HydrophobicContact CD1-CD1 3.87Å; L136-I517 HydrophobicContact CD2-CB 4.39Å; L136-I517 HydrophobicContact CD2-CG2 4.36Å; L136-I517 HydrophobicContact CG-CD1 4.44Å; L136-E518 HydrophobicContact CD2-CG 4.37Å
137	I	92.9	Very high	87.4	Confident	120 Å²	120	47.4 Å²	47.4	62%	0.615	24%	0.237	S	C	*	.	H	α-helix	trans	-58.9	-42.2	177.9	-67.5	166.1	0	0	0	110	Q133 A134 V140 A141	Q133-I137 WeakPolarHBondContact O-CG1 3.48Å; Q133-I137 PolarHBondContact O-N 3.44Å; A134-I137 PolarHBondContact O-N 3.19Å; I137-V140 PolarHBondContact O-N 2.76Å; I137-A141 WeakPolarHBondContact O-CB 3.5Å; I137-A141 PolarHBondContact O-N 2.83Å
138	D	90.8	Very high	87.1	Confident	39 Å²	39	44 Å²	44	21%	0.209	23%	0.228	C	C	.	.	H	α-helix	trans	-66.5	-43.9	179.1	-67.4	-32.6	0	0	0	113.1	A134 A135 L136 A141 H142 K432 Y444	A134-D138 PolarHBondContact O-N 2.92Å; A135-D138 WeakPolarHBondContact O-CB 3.27Å; A135-D138 PolarHBondContact O-N 2.92Å; L136-D138 PolarHBondContact O-N 3.43Å; D138-A141 PolarHBondContact O-N 3.31Å; D138-H142 WeakPolarHBondContact O-CB 3.27Å; D138-H142 PolarHBondContact O-N 3.2Å; D138-K432 HydrophobicContact CB-CD 4.41Å; D138-K432 IonicContact OD1-NZ 2.67Å; D138-K432 PolarHBondContact OD1-NZ 3.35Å; D138-K432 VanDerWaalsContact OD2-CD 3.29Å; D138-K432 WeakPolarHBondContact OD2-CD 3.14Å; D138-K432 WeakPolarHBondContact OD2-CE 3.35Å; D138-K432 IonicContact OD2-NZ 2.71Å; D138-K432 PolarHBondContact OD2-NZ 2.71Å; D138-Y444 PolarHBondContact OD2-OH 3.36Å
139	V	90	Very high	87.1	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-57.5	-51.7	175.4	171.9	0	0	0	0	110	A135 L136 A141 H142 C143 L425 I429 F451 Y513	A135-V139 WeakPolarHBondContact O-CG2 3.45Å; A135-V139 PolarHBondContact O-N 3.34Å; L136-V139 PolarHBondContact O-N 3.48Å; V139-A141 PolarHBondContact O-N 2.93Å; V139-H142 PolarHBondContact O-N 3.37Å; V139-C143 PolarHBondContact O-N 2.84Å; V139-C143 PolarHBondContact O-SG 3.1Å; V139-L425 HydrophobicContact CG1-CD1 4.14Å; V139-L425 HydrophobicContact CG1-CD2 4.29Å; V139-I429 HydrophobicContact CG2-CD1 3.43Å; V139-I429 VanDerWaalsContact CG2-CD1 3.43Å; V139-I429 HydrophobicContact CG2-CG1 4.25Å; V139-F451 HydrophobicContact CG1-CZ 4Å; V139-F451 HydrophobicContact CG2-CE2 3.93Å; V139-F451 HydrophobicContact CG2-CZ 3.91Å; V139-Y513 HydrophobicContact CG1-CD2 3.72Å; V139-Y513 HydrophobicContact CG1-CG 4.19Å
140	V	90.5	Very high	87.1	Confident	22 Å²	22	53 Å²	53	13%	0.133	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-41.3	-176.1	173.8	0	0	0	0	111.3	L136 I137 N144 V510 K514	L136-V140 HydrophobicContact CD1-CG2 3.81Å; L136-V140 HydrophobicContact CG-CG2 4.39Å; L136-V140 VanDerWaalsContact O-CG2 3.28Å; L136-V140 WeakPolarHBondContact O-CG2 3.41Å; L136-V140 PolarHBondContact O-N 2.7Å; I137-V140 PolarHBondContact O-N 2.76Å; V140-N144 PolarHBondContact O-N 3.13Å; V140-N144 PolarHBondContact O-ND2 2.61Å; V140-V510 HydrophobicContact CG1-CG1 4.07Å; V140-V510 HydrophobicContact CG2-CG1 4.29Å; V140-K514 HydrophobicContact CG2-CD 4.44Å; V140-K514 HydrophobicContact CG2-CG 3.92Å
141	A	90.1	Very high	86.9	Confident	43 Å²	43	46.8 Å²	46.8	36%	0.355	26%	0.255	S	S	.	.	H	α-helix	trans	-61.2	-46.3	175.4	0	0	0	0	0	111.1	I137 D138 V139 C143 N144 D145	I137-A141 WeakPolarHBondContact O-CB 3.5Å; I137-A141 PolarHBondContact O-N 2.83Å; D138-A141 PolarHBondContact O-N 3.31Å; V139-A141 PolarHBondContact O-N 2.93Å; A141-C143 PolarHBondContact O-N 2.65Å; A141-N144 PolarHBondContact O-N 3.14Å; A141-D145 WeakPolarHBondContact O-CB 2.8Å; A141-D145 PolarHBondContact O-N 3.37Å; A141-D145 VanDerWaalsContact O-N 3.09Å
142	H	87.7	Confident	86.8	Confident	26 Å²	26	50.9 Å²	50.9	12%	0.12	28%	0.277	C	S	.	.	H	α-helix	trans	-63.5	-43.4	-179.1	-164.4	90.7	0	0	0	112.9	D138 V139 N144 K146 L425	D138-H142 WeakPolarHBondContact O-CB 3.27Å; D138-H142 PolarHBondContact O-N 3.2Å; V139-H142 PolarHBondContact O-N 3.37Å; H142-N144 VanDerWaalsContact C-N 3.34Å; H142-N144 PolarHBondContact O-N 3.02Å; H142-K146 PolarHBondContact O-N 3Å; H142-K146 VanDerWaalsContact O-N 3.08Å; H142-L425 HydrophobicContact CB-CD2 4.29Å
143	C	85.9	Confident	86.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.284	C	S	.	.	I	π-helix	trans	-58.6	-43.8	176.3	-70.4	0	0	0	0	112.5	V139 A141 G148 L506 V510	V139-C143 PolarHBondContact O-N 2.84Å; V139-C143 PolarHBondContact O-SG 3.1Å; A141-C143 PolarHBondContact O-N 2.65Å; C143-G148 PolarHBondContact O-N 3.28Å; C143-L506 HydrophobicContact CB-CD1 4.01Å; C143-V510 HydrophobicContact CB-CG2 3.88Å
144	N	83.3	Confident	86	Confident	54 Å²	54	55 Å²	55	29%	0.289	30%	0.302	S	S	.	.	I	π-helix	trans	-73.7	-37.2	-175.1	-75.5	-37	0	0	0	113.4	V140 A141 H142 K413	V140-N144 PolarHBondContact O-N 3.13Å; V140-N144 PolarHBondContact O-ND2 2.61Å; A141-N144 PolarHBondContact O-N 3.14Å; H142-N144 VanDerWaalsContact C-N 3.34Å; H142-N144 PolarHBondContact O-N 3.02Å; N144-K413 PolarHBondContact O-NZ 3.11Å
145	D	81.9	Confident	85.8	Confident	133 Å²	133	56.1 Å²	56.1	71%	0.711	30%	0.303	S	S	*	.	I	π-helix	trans	-92.5	-37.8	-169.3	-67.6	-14.6	0	0	0	113.3	A141	A141-D145 WeakPolarHBondContact O-CB 2.8Å; A141-D145 PolarHBondContact O-N 3.37Å; A141-D145 VanDerWaalsContact O-N 3.09Å
146	K	79.6	Confident	85.5	Confident	154 Å²	154	59.3 Å²	59.3	67%	0.67	32%	0.318	S	S	*	.	I	π-helix	trans	-114	-39.5	-167.3	-64.5	-170.5	-177.9	-177.1	0	114.8	H142	H142-K146 PolarHBondContact O-N 3Å; H142-K146 VanDerWaalsContact O-N 3.08Å
147	M	79.6	Confident	85.3	Confident	16 Å²	16	64.9 Å²	64.9	8%	0.079	34%	0.344	C	S	.	.	I	π-helix	trans	-93.7	-23	-171.3	-60.8	177.6	70.1	0	0	114	K149 L415 A421 A424 L425	M147-K149 PolarHBondContact O-N 3.12Å; M147-K149 VanDerWaalsContact O-N 3.17Å; M147-L415 HydrophobicContact CB-CD2 3.42Å; M147-L415 VanDerWaalsContact CB-CD2 3.42Å; M147-A421 HydrophobicContact CE-CB 3.86Å; M147-A424 HydrophobicContact CE-CB 3.64Å; M147-A424 HydrophobicContact SD-CB 4.44Å; M147-L425 HydrophobicContact SD-CD2 3.92Å; M147-L425 HydrophobicContact SD-CG 4Å
148	G	78.1	Confident	84.9	Confident	21 Å²	21	62.7 Å²	62.7	22%	0.216	33%	0.331	C	S	.	.			trans	-69	109	-174.8	0	0	0	0	0	113.1	C143	C143-G148 PolarHBondContact O-N 3.28Å
149	K	85.1	Confident	84.7	Confident	111 Å²	111	60.9 Å²	60.9	48%	0.483	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	126.3	170.3	-176.9	-178.4	176.8	-174.3	0	109.8	M147 K413 V414 W503	M147-K149 PolarHBondContact O-N 3.12Å; M147-K149 VanDerWaalsContact O-N 3.17Å; K149-K413 CarbonylContact O-C 3.58Å; K149-K413 WeakPolarHBondContact O-CA 3.5Å; K149-V414 HydrophobicContact CB-CG2 4.19Å; K149-V414 PolarHBondContact N-O 3.49Å; K149-V414 PolarHBondContact O-N 2.76Å; K149-W503 HydrophobicContact CB-CZ3 4.36Å; K149-W503 HydrophobicContact CD-CH2 3.43Å; K149-W503 VanDerWaalsContact CD-CH2 3.43Å; K149-W503 HydrophobicContact CD-CZ2 4.02Å; K149-W503 HydrophobicContact CD-CZ3 3.92Å
150	S	87.2	Confident	84.6	Confident	87 Å²	87	61.9 Å²	61.9	61%	0.608	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	135.1	175	-68.7	0	0	0	0	111.9	P412	S150-P412 CarbonylContact C-O 3.55Å; S150-P412 VanDerWaalsContact CA-O 3.26Å; S150-P412 WeakPolarHBondContact CA-O 3.43Å
151	I	84.9	Confident	84.4	Confident	19 Å²	19	64 Å²	64	10%	0.097	33%	0.334	C	S	.	.			trans	-108.4	147.5	177	-70.9	-171.3	0	0	0	110.2	E158 V162 P412 V414	I151-E158 HydrophobicContact CG2-CB 4.04Å; I151-V162 HydrophobicContact CD1-CG2 3.35Å; I151-P412 PolarHBondContact N-O 3.24Å; I151-V414 HydrophobicContact CD1-CB 3.99Å; I151-V414 HydrophobicContact CD1-CG1 3.27Å; I151-V414 HydrophobicContact CD1-CG2 3.51Å; I151-V414 HydrophobicContact CG1-CG1 4.07Å; I151-V414 HydrophobicContact CG1-CG2 3.78Å
152	N	85	Confident	84.2	Confident	87 Å²	87	61.9 Å²	61.9	47%	0.465	32%	0.317	S	S	.	.			trans	-86	111.1	171	-172.1	-2.4	0	0	0	111	N154 N155 E158	N152-N154 PolarHBondContact O-N 2.65Å; N152-N154 VanDerWaalsContact O-N 3.14Å; N152-N154 PolarHBondContact OD1-N 2.69Å; N152-N154 VanDerWaalsContact OD1-N 3.13Å; N152-N155 HydrophobicContact CB-CB 4.26Å; N152-N155 PolarHBondContact O-N 3.28Å; N152-E158 PolarHBondContact N-OE2 2.78Å
153	I	80.7	Confident	84.1	Confident	27 Å²	27	60.7 Å²	60.7	14%	0.138	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.2	-179.7	-53.1	169.4	0	0	0	112.1	N155 F409 P412	I153-N155 VanDerWaalsContact C-N 3.31Å; I153-F409 HydrophobicContact CG2-CD1 3.88Å; I153-F409 HydrophobicContact CG2-CD2 3.89Å; I153-F409 HydrophobicContact CG2-CE1 3.65Å; I153-F409 HydrophobicContact CG2-CE2 3.67Å; I153-F409 HydrophobicContact CG2-CG 3.99Å; I153-F409 HydrophobicContact CG2-CZ 3.55Å; I153-P412 HydrophobicContact CD1-CB 3.87Å; I153-P412 HydrophobicContact CD1-CG 4.2Å; I153-P412 HydrophobicContact CG1-CB 3.73Å
154	N	82.2	Confident	84.2	Confident	146 Å²	146	66.2 Å²	66.2	78%	0.781	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-15.4	-179.9	-63	-32.6	0	0	0	112.9	N152 E156	N152-N154 PolarHBondContact O-N 2.65Å; N152-N154 VanDerWaalsContact O-N 3.14Å; N152-N154 PolarHBondContact OD1-N 2.69Å; N152-N154 VanDerWaalsContact OD1-N 3.13Å; N154-E156 PolarHBondContact O-N 3.39Å
155	N	85.7	Confident	84.2	Confident	55 Å²	55	65 Å²	65	29%	0.294	33%	0.328	S	S	.	.			trans	-86	103.8	175.4	-170.5	-1.6	0	0	0	109.3	N152 I153 E157 E158 L159	N152-N155 HydrophobicContact CB-CB 4.26Å; N152-N155 PolarHBondContact O-N 3.28Å; I153-N155 VanDerWaalsContact C-N 3.31Å; N155-E157 VanDerWaalsContact C-N 3.29Å; N155-E157 PolarHBondContact O-N 3.35Å; N155-E157 PolarHBondContact OD1-N 2.66Å; N155-E158 HydrophobicContact CB-CB 4.24Å; N155-E158 HydrophobicContact CB-CG 4.34Å; N155-E158 WeakPolarHBondContact ND2-CG 3.26Å; N155-E158 PolarHBondContact ND2-OE1 3.07Å; N155-E158 PolarHBondContact O-N 3.32Å; N155-L159 PolarHBondContact O-N 3.23Å
156	E	84.3	Confident	84.2	Confident	66 Å²	66	59.5 Å²	59.5	31%	0.308	30%	0.3	S	S	.	.	H	α-helix	trans	-63.2	-34.9	-177	-171.1	164.7	151	0	0	112.3	N154 L159 L160 H181 K188	N154-E156 PolarHBondContact O-N 3.39Å; E156-L159 PolarHBondContact O-N 3.29Å; E156-L160 HydrophobicContact CG-CD1 3.96Å; E156-L160 HydrophobicContact CG-CG 4.17Å; E156-L160 WeakPolarHBondContact O-CB 3.25Å; E156-L160 WeakPolarHBondContact O-CG 3.45Å; E156-L160 PolarHBondContact O-N 2.76Å; E156-H181 IonicContact OE1-CE1 3.35Å; E156-H181 IonicContact OE1-ND1 3.13Å; E156-H181 PolarHBondContact OE1-ND1 3.24Å; E156-K188 IonicContact OE2-NZ 3.31Å; E156-K188 PolarHBondContact OE2-NZ 3.16Å
157	E	86	Confident	84.3	Confident	136 Å²	136	52.3 Å²	52.3	64%	0.636	27%	0.269	S	S	*	.	H	α-helix	trans	-65.3	-44.2	180	-64.6	-173	165.8	0	0	112.1	N155 L159 L160 H161	N155-E157 VanDerWaalsContact C-N 3.29Å; N155-E157 PolarHBondContact O-N 3.35Å; N155-E157 PolarHBondContact OD1-N 2.66Å; E157-L159 VanDerWaalsContact C-N 3.32Å; E157-L159 PolarHBondContact O-N 3.12Å; E157-L160 PolarHBondContact O-N 2.75Å; E157-H161 PolarHBondContact O-CD2 3.45Å; E157-H161 PolarHBondContact O-N 3.45Å
158	E	84.5	Confident	84	Confident	74 Å²	74	53 Å²	53	35%	0.346	28%	0.279	S	S	.	.	H	α-helix	trans	-60.9	-43.2	175.7	-79.3	174.3	-142.9	0	0	111.3	I151 N152 N155 H161 V162	I151-E158 HydrophobicContact CG2-CB 4.04Å; N152-E158 PolarHBondContact N-OE2 2.78Å; N155-E158 HydrophobicContact CB-CB 4.24Å; N155-E158 HydrophobicContact CB-CG 4.34Å; N155-E158 WeakPolarHBondContact ND2-CG 3.26Å; N155-E158 PolarHBondContact ND2-OE1 3.07Å; N155-E158 PolarHBondContact O-N 3.32Å; E158-H161 PolarHBondContact O-N 3.41Å; E158-V162 WeakPolarHBondContact O-CG2 3.35Å; E158-V162 PolarHBondContact O-N 3.37Å
159	L	86.5	Confident	83.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.5	-44.8	177.3	-176.4	65.8	0	0	0	111.3	N155 E156 E157 H161 V162 V163 V184 V405 V408 F409	N155-L159 PolarHBondContact O-N 3.23Å; E156-L159 PolarHBondContact O-N 3.29Å; E157-L159 VanDerWaalsContact C-N 3.32Å; E157-L159 PolarHBondContact O-N 3.12Å; L159-H161 VanDerWaalsContact C-N 3.26Å; L159-H161 PolarHBondContact O-N 3.09Å; L159-V162 PolarHBondContact O-N 2.88Å; L159-V163 VanDerWaalsContact O-CG2 3.27Å; L159-V163 WeakPolarHBondContact O-CG2 3.16Å; L159-V163 PolarHBondContact O-N 2.66Å; L159-V184 HydrophobicContact CD2-CB 4.26Å; L159-V184 HydrophobicContact CD2-CG1 3.65Å; L159-V184 HydrophobicContact CD2-CG2 3.63Å; L159-V184 HydrophobicContact CG-CG2 4.03Å; L159-V405 HydrophobicContact CD2-CG1 4.41Å; L159-V408 HydrophobicContact CD1-CB 4.13Å; L159-V408 HydrophobicContact CD1-CG1 3.75Å; L159-F409 HydrophobicContact CD1-CE2 4.42Å; L159-F409 HydrophobicContact CD2-CE2 3.73Å; L159-F409 HydrophobicContact CD2-CZ 4.48Å
160	L	87.2	Confident	82.8	Confident	23 Å²	23	50.2 Å²	50.2	12%	0.12	27%	0.268	C	S	.	.	H	α-helix	trans	-61.2	-35.2	177	-70.8	171.1	0	0	0	111.8	E156 E157 V163 R164 M180 V184	E156-L160 HydrophobicContact CG-CD1 3.96Å; E156-L160 HydrophobicContact CG-CG 4.17Å; E156-L160 WeakPolarHBondContact O-CB 3.25Å; E156-L160 WeakPolarHBondContact O-CG 3.45Å; E156-L160 PolarHBondContact O-N 2.76Å; E157-L160 PolarHBondContact O-N 2.75Å; L160-V163 PolarHBondContact O-N 3.34Å; L160-R164 WeakPolarHBondContact O-CB 3.31Å; L160-R164 PolarHBondContact O-N 3.3Å; L160-M180 HydrophobicContact CD2-CB 3.65Å; L160-V184 HydrophobicContact CD2-CG2 4.2Å
161	H	86.4	Confident	82	Confident	65 Å²	65	46.8 Å²	46.8	30%	0.301	24%	0.243	S	C	.	.	H	α-helix	trans	-63.7	-42.8	174.3	-74.4	-54.7	0	0	0	112.8	E157 E158 L159 R164 S165 N501	E157-H161 PolarHBondContact O-CD2 3.45Å; E157-H161 PolarHBondContact O-N 3.45Å; E158-H161 PolarHBondContact O-N 3.41Å; L159-H161 VanDerWaalsContact C-N 3.26Å; L159-H161 PolarHBondContact O-N 3.09Å; H161-R164 PolarHBondContact O-N 2.87Å; H161-S165 PolarHBondContact O-N 2.97Å; H161-N501 HydrophobicContact CB-CB 4.27Å
162	V	86.1	Confident	81.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-46.9	176.4	-178.5	0	0	0	0	110.8	I151 E158 L159 R164 S165 C166 V404 V408 V414 W503 P505	I151-V162 HydrophobicContact CD1-CG2 3.35Å; E158-V162 WeakPolarHBondContact O-CG2 3.35Å; E158-V162 PolarHBondContact O-N 3.37Å; L159-V162 PolarHBondContact O-N 2.88Å; V162-R164 VanDerWaalsContact C-N 3.32Å; V162-R164 PolarHBondContact O-N 3.05Å; V162-S165 VanDerWaalsContact O-CB 3.31Å; V162-S165 WeakPolarHBondContact O-CB 3.5Å; V162-S165 PolarHBondContact O-N 3.4Å; V162-S165 VanDerWaalsContact O-N 3.15Å; V162-C166 PolarHBondContact O-N 2.97Å; V162-V404 HydrophobicContact CG1-CG1 4.37Å; V162-V408 HydrophobicContact CG1-CG2 3.84Å; V162-V414 HydrophobicContact CG1-CG1 4.31Å; V162-V414 HydrophobicContact CG2-CG1 3.96Å; V162-W503 HydrophobicContact CG2-CB 4.11Å; V162-P505 HydrophobicContact CG1-CG 4.2Å
163	V	86.8	Confident	80.6	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.3	-40.2	-179.5	-178.3	0	0	0	0	110.9	L159 L160 S165 C166 I167 M180 V404 V405	L159-V163 VanDerWaalsContact O-CG2 3.27Å; L159-V163 WeakPolarHBondContact O-CG2 3.16Å; L159-V163 PolarHBondContact O-N 2.66Å; L160-V163 PolarHBondContact O-N 3.34Å; V163-S165 VanDerWaalsContact C-N 3.29Å; V163-S165 PolarHBondContact O-N 3.15Å; V163-C166 PolarHBondContact O-N 3.2Å; V163-I167 HydrophobicContact CG1-CD1 3.35Å; V163-I167 HydrophobicContact CG1-CG1 4.24Å; V163-I167 WeakPolarHBondContact O-CB 3.41Å; V163-I167 VanDerWaalsContact O-CG1 3.3Å; V163-I167 WeakPolarHBondContact O-CG1 3.17Å; V163-I167 PolarHBondContact O-N 2.95Å; V163-M180 HydrophobicContact CB-CG 4.37Å; V163-M180 HydrophobicContact CG1-CB 4.37Å; V163-M180 HydrophobicContact CG1-CG 3.8Å; V163-V404 HydrophobicContact CG2-CG1 4.48Å; V163-V405 HydrophobicContact CG1-CG2 4.42Å; V163-V405 HydrophobicContact CG2-CG2 3.34Å
164	R	87.4	Confident	80.3	Confident	116 Å²	116	51.5 Å²	51.5	44%	0.438	29%	0.29	S	S	.	.	H	α-helix	trans	-58.4	-41.4	174	-174	-178.6	-66.7	-119	-3.2	112.1	L160 H161 V162 G168 M176 N177 M180	L160-R164 WeakPolarHBondContact O-CB 3.31Å; L160-R164 PolarHBondContact O-N 3.3Å; H161-R164 PolarHBondContact O-N 2.87Å; V162-R164 VanDerWaalsContact C-N 3.32Å; V162-R164 PolarHBondContact O-N 3.05Å; R164-G168 WeakPolarHBondContact O-CA 3.34Å; R164-G168 PolarHBondContact O-N 2.87Å; R164-M176 HydrophobicContact CG-SD 3.84Å; R164-N177 PolarHBondContact NH2-OD1 3.5Å; R164-M180 HydrophobicContact CB-SD 3.58Å; R164-M180 VanDerWaalsContact CB-SD 3.58Å; R164-M180 HydrophobicContact CG-SD 4.22Å
165	S	83.6	Confident	80.2	Confident	29 Å²	29	45.1 Å²	45.1	20%	0.203	26%	0.255	C	S	.	.	H	α-helix	trans	-60.4	-49.3	179.6	-176.3	0	0	0	0	111.5	H161 V162 V163 V502 W503	H161-S165 PolarHBondContact O-N 2.97Å; V162-S165 VanDerWaalsContact O-CB 3.31Å; V162-S165 WeakPolarHBondContact O-CB 3.5Å; V162-S165 PolarHBondContact O-N 3.4Å; V162-S165 VanDerWaalsContact O-N 3.15Å; V163-S165 VanDerWaalsContact C-N 3.29Å; V163-S165 PolarHBondContact O-N 3.15Å; S165-V502 VanDerWaalsContact OG-CG1 3.26Å; S165-V502 WeakPolarHBondContact OG-CG1 3.37Å; S165-W503 VanDerWaalsContact CB-O 3.27Å; S165-W503 WeakPolarHBondContact CB-O 3.49Å; S165-W503 PolarHBondContact OG-N 3.34Å; S165-W503 VanDerWaalsContact OG-N 3.09Å; S165-W503 PolarHBondContact OG-O 3.31Å; S165-W503 VanDerWaalsContact OG-O 3.12Å
166	C	81.1	Confident	80.1	Confident	17 Å²	17	43.5 Å²	43.5	12%	0.115	25%	0.246	C	C	.	.	H	α-helix	trans	-71.5	-39.5	-177.2	-62.4	0	0	0	0	113.1	V162 V163 G168 V404	V162-C166 PolarHBondContact O-N 2.97Å; V163-C166 PolarHBondContact O-N 3.2Å; C166-G168 VanDerWaalsContact C-N 3.35Å; C166-V404 HydrophobicContact CB-CB 4.48Å; C166-V404 HydrophobicContact CB-CG1 4.1Å; C166-V404 HydrophobicContact CB-CG2 3.73Å
167	I	81.5	Confident	80.2	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.021	25%	0.25	C	C	.	.	H	α-helix	trans	-81.6	-19.3	-176.2	-65.8	175.6	0	0	0	112.6	V163 S169 N170 I171 M176 V179 M180 A401	V163-I167 HydrophobicContact CG1-CD1 3.35Å; V163-I167 HydrophobicContact CG1-CG1 4.24Å; V163-I167 WeakPolarHBondContact O-CB 3.41Å; V163-I167 VanDerWaalsContact O-CG1 3.3Å; V163-I167 WeakPolarHBondContact O-CG1 3.17Å; V163-I167 PolarHBondContact O-N 2.95Å; I167-S169 PolarHBondContact O-N 3.36Å; I167-N170 PolarHBondContact O-N 3.43Å; I167-N170 VanDerWaalsContact O-N 3.11Å; I167-I171 HydrophobicContact CG2-CB 3.95Å; I167-I171 HydrophobicContact CG2-CD1 3.04Å; I167-I171 HydrophobicContact CG2-CG1 3.46Å; I167-I171 VanDerWaalsContact CG2-CG1 3.46Å; I167-M176 HydrophobicContact CG2-CG 4.44Å; I167-V179 HydrophobicContact CD1-CG1 4.12Å; I167-M180 HydrophobicContact CD1-CG 4.47Å; I167-A401 HydrophobicContact CD1-CB 3.22Å; I167-A401 HydrophobicContact CG1-CB 4.08Å
168	G	74.6	Confident	80.2	Confident	29 Å²	29	39.2 Å²	39.2	30%	0.299	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-23.6	-169.3	0	0	0	0	0	115.5	R164 C166	R164-G168 WeakPolarHBondContact O-CA 3.34Å; R164-G168 PolarHBondContact O-N 2.87Å; C166-G168 VanDerWaalsContact C-N 3.35Å
169	S	69.2	Low	80.3	Confident	38 Å²	38	35.7 Å²	35.7	27%	0.266	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-21.7	-177.7	56.7	0	0	0	0	115.8	G45 I167	G45-S169 WeakPolarHBondContact O-CB 3.39Å; I167-S169 PolarHBondContact O-N 3.36Å
170	N	67.4	Low	80.3	Confident	36 Å²	36	35.7 Å²	35.7	19%	0.193	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-15.6	-165.1	-61	-17.1	0	0	0	113.8	S64 I167 N397	S64-N170 PolarHBondContact OG-OD1 3.47Å; I167-N170 PolarHBondContact O-N 3.43Å; I167-N170 VanDerWaalsContact O-N 3.11Å; N170-N397 WeakPolarHBondContact CB-OD1 3.35Å; N170-N397 PolarHBondContact ND2-OD1 2.97Å
171	I	70.3	Confident	80.4	Confident	16 Å²	16	38.4 Å²	38.4	8%	0.082	23%	0.225	C	C	.	.	S	Bend	trans	-113.2	141.7	-170.7	-59.2	-170.3	0	0	0	112.6	I167 W175 M176 V179 N397	I167-I171 HydrophobicContact CG2-CB 3.95Å; I167-I171 HydrophobicContact CG2-CD1 3.04Å; I167-I171 HydrophobicContact CG2-CG1 3.46Å; I167-I171 VanDerWaalsContact CG2-CG1 3.46Å; I171-W175 HydrophobicContact CB-CE3 4.19Å; I171-W175 HydrophobicContact CB-CZ3 4.28Å; I171-W175 HydrophobicContact CD1-CE3 3.93Å; I171-W175 HydrophobicContact CD1-CH2 3.73Å; I171-W175 HydrophobicContact CD1-CZ3 3.48Å; I171-W175 VanDerWaalsContact CD1-CZ3 3.48Å; I171-W175 HydrophobicContact CG1-CE3 4Å; I171-W175 HydrophobicContact CG1-CH2 4.3Å; I171-W175 HydrophobicContact CG1-CZ3 3.59Å; I171-W175 HydrophobicContact CG2-CB 3.95Å; I171-W175 HydrophobicContact CG2-CD2 3.96Å; I171-W175 HydrophobicContact CG2-CE3 3.36Å; I171-W175 HydrophobicContact CG2-CG 4.27Å; I171-W175 HydrophobicContact CG2-CZ3 3.91Å; I171-M176 HydrophobicContact CB-CE 4.44Å; I171-M176 HydrophobicContact CG2-CB 3.99Å; I171-V179 HydrophobicContact CD1-CB 4.39Å; I171-V179 HydrophobicContact CD1-CG1 4.24Å; I171-V179 HydrophobicContact CD1-CG2 4.12Å; I171-N397 HydrophobicContact CD1-CB 3.63Å; I171-N397 HydrophobicContact CG1-CB 3.76Å
172	S	69.4	Low	80.6	Confident	73 Å²	73	35.8 Å²	35.8	51%	0.51	21%	0.213	S	C	.	.			trans	-62.2	139.7	165.8	67.8	0	0	0	0	111.9	A174 W175 M176	S172-A174 PolarHBondContact O-N 2.93Å; S172-W175 PolarHBondContact O-N 3.24Å; S172-W175 VanDerWaalsContact O-N 3.09Å; S172-M176 PolarHBondContact O-N 3.28Å; S172-M176 VanDerWaalsContact O-N 3.15Å
173	S	72	Confident	80.9	Confident	97 Å²	97	35.8 Å²	35.8	68%	0.678	21%	0.213	S	C	*	.	H	α-helix	trans	-53.7	-34.9	-173.9	54.6	0	0	0	0	114.9
174	A	73.7	Confident	81.1	Confident	61 Å²	61	35.8 Å²	35.8	50%	0.504	21%	0.213	S	C	.	.	H	α-helix	trans	-66.7	-43.1	-179.9	0	0	0	0	0	112.5	S172	S172-A174 PolarHBondContact O-N 2.93Å
175	W	81.5	Confident	81.2	Confident	13 Å²	13	33.3 Å²	33.3	5%	0.049	21%	0.208	C	C	.	.	H	α-helix	trans	-77.9	-29.1	-177.3	-177.7	40	0	0	0	112.3	I171 S172 N177 I178 V179 I216 M394 N397	I171-W175 HydrophobicContact CB-CE3 4.19Å; I171-W175 HydrophobicContact CB-CZ3 4.28Å; I171-W175 HydrophobicContact CD1-CE3 3.93Å; I171-W175 HydrophobicContact CD1-CH2 3.73Å; I171-W175 HydrophobicContact CD1-CZ3 3.48Å; I171-W175 VanDerWaalsContact CD1-CZ3 3.48Å; I171-W175 HydrophobicContact CG1-CE3 4Å; I171-W175 HydrophobicContact CG1-CH2 4.3Å; I171-W175 HydrophobicContact CG1-CZ3 3.59Å; I171-W175 HydrophobicContact CG2-CB 3.95Å; I171-W175 HydrophobicContact CG2-CD2 3.96Å; I171-W175 HydrophobicContact CG2-CE3 3.36Å; I171-W175 HydrophobicContact CG2-CG 4.27Å; I171-W175 HydrophobicContact CG2-CZ3 3.91Å; S172-W175 PolarHBondContact O-N 3.24Å; S172-W175 VanDerWaalsContact O-N 3.09Å; W175-N177 VanDerWaalsContact C-N 3.32Å; W175-N177 PolarHBondContact O-N 3.11Å; W175-I178 PolarHBondContact O-N 3.3Å; W175-I178 VanDerWaalsContact O-N 3.08Å; W175-V179 HydrophobicContact CD2-CG2 3.7Å; W175-V179 HydrophobicContact CE3-CG2 4.44Å; W175-V179 HydrophobicContact CG-CG2 4.04Å; W175-V179 HydrophobicContact CH2-CG2 3.8Å; W175-V179 HydrophobicContact CZ2-CG2 3.15Å; W175-V179 HydrophobicContact CZ3-CG2 4.48Å; W175-V179 WeakPolarHBondContact O-CG2 3.5Å; W175-V179 PolarHBondContact O-N 2.93Å; W175-I216 HydrophobicContact CB-CG2 3.98Å; W175-I216 HydrophobicContact CG-CG2 3.61Å; W175-M394 HydrophobicContact CD2-CE 3.97Å; W175-M394 HydrophobicContact CD2-CG 4.01Å; W175-M394 HydrophobicContact CE3-CG 3.86Å; W175-M394 HydrophobicContact CG-CE 4.31Å; W175-M394 HydrophobicContact CH2-CB 3.47Å; W175-M394 VanDerWaalsContact CH2-CB 3.47Å; W175-M394 HydrophobicContact CH2-CG 3.61Å; W175-M394 WeakPolarHBondContact CH2-O 3.23Å; W175-M394 HydrophobicContact CZ2-CB 3.4Å; W175-M394 VanDerWaalsContact CZ2-CB 3.4Å; W175-M394 HydrophobicContact CZ2-CE 3.83Å; W175-M394 HydrophobicContact CZ2-CG 3.54Å; W175-M394 WeakPolarHBondContact CZ2-O 3.4Å; W175-M394 HydrophobicContact CZ3-CB 4.01Å; W175-M394 HydrophobicContact CZ3-CG 3.66Å; W175-N397 HydrophobicContact CH2-CB 3.63Å; W175-N397 HydrophobicContact CZ3-CB 3.85Å
176	M	82.7	Confident	81.6	Confident	21 Å²	21	32 Å²	32	10%	0.103	20%	0.199	C	C	.	.	H	α-helix	trans	-51.8	-46.8	-179.3	-168.5	-179.6	-68.6	0	0	112.8	R164 I167 I171 S172 I178 V179 M180	R164-M176 HydrophobicContact CG-SD 3.84Å; I167-M176 HydrophobicContact CG2-CG 4.44Å; I171-M176 HydrophobicContact CB-CE 4.44Å; I171-M176 HydrophobicContact CG2-CB 3.99Å; S172-M176 PolarHBondContact O-N 3.28Å; S172-M176 VanDerWaalsContact O-N 3.15Å; M176-I178 VanDerWaalsContact C-N 3.33Å; M176-I178 PolarHBondContact O-N 2.9Å; M176-V179 PolarHBondContact O-N 3.35Å; M176-M180 HydrophobicContact CG-CE 3.99Å; M176-M180 HydrophobicContact CG-CG 4.38Å; M176-M180 HydrophobicContact CG-SD 4.16Å; M176-M180 WeakPolarHBondContact O-CB 3.43Å; M176-M180 WeakPolarHBondContact O-CG 3.37Å; M176-M180 PolarHBondContact O-N 3.45Å
177	N	85.4	Confident	82.1	Confident	72 Å²	72	31.1 Å²	31.1	39%	0.385	19%	0.193	S	C	.	.	H	α-helix	trans	-61.1	-42.3	-179.3	-68.9	-29.6	0	0	0	112	R164 W175 M180 H181	R164-N177 PolarHBondContact NH2-OD1 3.5Å; W175-N177 VanDerWaalsContact C-N 3.32Å; W175-N177 PolarHBondContact O-N 3.11Å; N177-M180 HydrophobicContact CB-CE 4.47Å; N177-M180 PolarHBondContact O-N 3.32Å; N177-M180 VanDerWaalsContact OD1-CE 3.3Å; N177-M180 WeakPolarHBondContact OD1-CE 3.3Å; N177-H181 PolarHBondContact O-CD2 3.44Å; N177-H181 PolarHBondContact O-N 3.09Å
178	I	86.5	Confident	82.4	Confident	39 Å²	39	34.9 Å²	34.9	20%	0.2	21%	0.209	C	C	.	.	H	α-helix	trans	-65.1	-47.1	-179.9	-53.5	169.7	0	0	0	109.6	W175 M176 M180 H181 M182 E217	W175-I178 PolarHBondContact O-N 3.3Å; W175-I178 VanDerWaalsContact O-N 3.08Å; M176-I178 VanDerWaalsContact C-N 3.33Å; M176-I178 PolarHBondContact O-N 2.9Å; I178-M180 PolarHBondContact O-N 2.97Å; I178-H181 PolarHBondContact O-N 3.29Å; I178-M182 HydrophobicContact CG2-CE 3.76Å; I178-M182 HydrophobicContact CG2-CG 4.3Å; I178-M182 HydrophobicContact CG2-SD 3.99Å; I178-M182 WeakPolarHBondContact O-CB 3.44Å; I178-M182 VanDerWaalsContact O-CG 3.23Å; I178-M182 WeakPolarHBondContact O-CG 3.4Å; I178-M182 PolarHBondContact O-N 2.94Å; I178-E217 HydrophobicContact CD1-CB 4.43Å; I178-E217 HydrophobicContact CD1-CG 4.2Å
179	V	86.1	Confident	83.1	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.5	-46.1	178.8	176.1	0	0	0	0	111.7	I167 I171 W175 M176 M182 A183 L398 A401	I167-V179 HydrophobicContact CD1-CG1 4.12Å; I171-V179 HydrophobicContact CD1-CB 4.39Å; I171-V179 HydrophobicContact CD1-CG1 4.24Å; I171-V179 HydrophobicContact CD1-CG2 4.12Å; W175-V179 HydrophobicContact CD2-CG2 3.7Å; W175-V179 HydrophobicContact CE3-CG2 4.44Å; W175-V179 HydrophobicContact CG-CG2 4.04Å; W175-V179 HydrophobicContact CH2-CG2 3.8Å; W175-V179 HydrophobicContact CZ2-CG2 3.15Å; W175-V179 HydrophobicContact CZ3-CG2 4.48Å; W175-V179 WeakPolarHBondContact O-CG2 3.5Å; W175-V179 PolarHBondContact O-N 2.93Å; M176-V179 PolarHBondContact O-N 3.35Å; V179-M182 HydrophobicContact CG2-CE 4.4Å; V179-M182 PolarHBondContact O-N 2.96Å; V179-A183 VanDerWaalsContact O-CB 3.27Å; V179-A183 WeakPolarHBondContact O-CB 3.34Å; V179-A183 PolarHBondContact O-N 3.42Å; V179-L398 HydrophobicContact CG1-CD1 3.86Å; V179-A401 HydrophobicContact CG1-CB 3.82Å
180	M	87	Confident	83.9	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-60.3	-50.5	-177.7	-71.9	-173.3	-61.9	0	0	111.4	L160 V163 R164 I167 M176 N177 I178 A183 V184	L160-M180 HydrophobicContact CD2-CB 3.65Å; V163-M180 HydrophobicContact CB-CG 4.37Å; V163-M180 HydrophobicContact CG1-CB 4.37Å; V163-M180 HydrophobicContact CG1-CG 3.8Å; R164-M180 HydrophobicContact CB-SD 3.58Å; R164-M180 VanDerWaalsContact CB-SD 3.58Å; R164-M180 HydrophobicContact CG-SD 4.22Å; I167-M180 HydrophobicContact CD1-CG 4.47Å; M176-M180 HydrophobicContact CG-CE 3.99Å; M176-M180 HydrophobicContact CG-CG 4.38Å; M176-M180 HydrophobicContact CG-SD 4.16Å; M176-M180 WeakPolarHBondContact O-CB 3.43Å; M176-M180 WeakPolarHBondContact O-CG 3.37Å; M176-M180 PolarHBondContact O-N 3.45Å; N177-M180 HydrophobicContact CB-CE 4.47Å; N177-M180 PolarHBondContact O-N 3.32Å; N177-M180 VanDerWaalsContact OD1-CE 3.3Å; N177-M180 WeakPolarHBondContact OD1-CE 3.3Å; I178-M180 PolarHBondContact O-N 2.97Å; M180-A183 PolarHBondContact O-N 2.99Å; M180-V184 VanDerWaalsContact O-CG2 3.3Å; M180-V184 WeakPolarHBondContact O-CG2 3.32Å; M180-V184 PolarHBondContact O-N 3.41Å
181	H	89.1	Confident	84.8	Confident	79 Å²	79	33.3 Å²	33.3	37%	0.366	19%	0.192	S	C	.	.	H	α-helix	trans	-64.3	-43.7	178	-71.6	-68.1	0	0	0	111.8	E156 N177 I178 A183 V184 D185	E156-H181 IonicContact OE1-CE1 3.35Å; E156-H181 IonicContact OE1-ND1 3.13Å; E156-H181 PolarHBondContact OE1-ND1 3.24Å; N177-H181 PolarHBondContact O-CD2 3.44Å; N177-H181 PolarHBondContact O-N 3.09Å; I178-H181 PolarHBondContact O-N 3.29Å; H181-A183 VanDerWaalsContact C-N 3.34Å; H181-A183 PolarHBondContact O-N 3.25Å; H181-V184 PolarHBondContact O-N 3.23Å; H181-D185 WeakPolarHBondContact O-CB 3.36Å; H181-D185 PolarHBondContact O-N 3.38Å
182	M	91.1	Very high	85.4	Confident	10 Å²	10	34.8 Å²	34.8	5%	0.049	20%	0.2	C	C	.	.	H	α-helix	trans	-59	-43.1	176.7	-75.7	-169.9	-52.6	0	0	112.6	I178 V179 A186 L221 L381 L383 L398	I178-M182 HydrophobicContact CG2-CE 3.76Å; I178-M182 HydrophobicContact CG2-CG 4.3Å; I178-M182 HydrophobicContact CG2-SD 3.99Å; I178-M182 WeakPolarHBondContact O-CB 3.44Å; I178-M182 VanDerWaalsContact O-CG 3.23Å; I178-M182 WeakPolarHBondContact O-CG 3.4Å; I178-M182 PolarHBondContact O-N 2.94Å; V179-M182 HydrophobicContact CG2-CE 4.4Å; V179-M182 PolarHBondContact O-N 2.96Å; M182-A186 WeakPolarHBondContact O-CB 3.5Å; M182-A186 PolarHBondContact O-N 3.48Å; M182-L221 HydrophobicContact CG-CB 4.42Å; M182-L381 HydrophobicContact CB-CD2 3.95Å; M182-L381 HydrophobicContact CG-CD2 4.47Å; M182-L381 HydrophobicContact SD-CD2 4.41Å; M182-L383 HydrophobicContact CE-CD2 4.19Å; M182-L398 HydrophobicContact CE-CD1 4.47Å
183	A	91.6	Very high	86	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-67.7	-45	-179.4	0	0	0	0	0	111.5	V179 M180 H181 A186 I187 A401 L402 V405	V179-A183 VanDerWaalsContact O-CB 3.27Å; V179-A183 WeakPolarHBondContact O-CB 3.34Å; V179-A183 PolarHBondContact O-N 3.42Å; M180-A183 PolarHBondContact O-N 2.99Å; H181-A183 VanDerWaalsContact C-N 3.34Å; H181-A183 PolarHBondContact O-N 3.25Å; A183-A186 PolarHBondContact O-N 3.12Å; A183-I187 WeakPolarHBondContact O-CG1 3.34Å; A183-I187 PolarHBondContact O-N 3.13Å; A183-A401 HydrophobicContact CB-CB 3.82Å; A183-L402 HydrophobicContact CB-CD2 4.01Å; A183-L402 HydrophobicContact CB-CG 4.33Å; A183-V405 HydrophobicContact CB-CG2 4.36Å
184	V	91.1	Very high	86.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-48.2	177.1	171	0	0	0	0	110.9	L159 L160 M180 H181 I187 K188 V405	L159-V184 HydrophobicContact CD2-CB 4.26Å; L159-V184 HydrophobicContact CD2-CG1 3.65Å; L159-V184 HydrophobicContact CD2-CG2 3.63Å; L159-V184 HydrophobicContact CG-CG2 4.03Å; L160-V184 HydrophobicContact CD2-CG2 4.2Å; M180-V184 VanDerWaalsContact O-CG2 3.3Å; M180-V184 WeakPolarHBondContact O-CG2 3.32Å; M180-V184 PolarHBondContact O-N 3.41Å; H181-V184 PolarHBondContact O-N 3.23Å; V184-I187 PolarHBondContact O-N 3.13Å; V184-K188 HydrophobicContact CG1-CD 3.96Å; V184-K188 VanDerWaalsContact CG1-CE 3.44Å; V184-K188 HydrophobicContact CG1-CG 4.44Å; V184-K188 WeakPolarHBondContact O-CB 3.48Å; V184-K188 VanDerWaalsContact O-CG 3.31Å; V184-K188 WeakPolarHBondContact O-CG 3.28Å; V184-K188 PolarHBondContact O-N 2.94Å; V184-V405 HydrophobicContact CG2-CG2 4.12Å
185	D	90.4	Very high	86.4	Confident	65 Å²	65	37.6 Å²	37.6	35%	0.348	20%	0.201	S	C	.	.	H	α-helix	trans	-66.1	-40.2	-179.7	-72.1	-18.3	0	0	0	112	H181 K188 L189 L221	H181-D185 WeakPolarHBondContact O-CB 3.36Å; H181-D185 PolarHBondContact O-N 3.38Å; D185-K188 PolarHBondContact O-N 2.91Å; D185-L189 VanDerWaalsContact O-CG 3.24Å; D185-L189 WeakPolarHBondContact O-CG 3.47Å; D185-L189 PolarHBondContact O-N 2.98Å; D185-L221 HydrophobicContact CB-CD2 3.31Å
186	A	92.2	Very high	86.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61	-46	176.1	0	0	0	0	0	111.9	M182 A183 L189 V190 L221 L381 L402	M182-A186 WeakPolarHBondContact O-CB 3.5Å; M182-A186 PolarHBondContact O-N 3.48Å; A183-A186 PolarHBondContact O-N 3.12Å; A186-L189 PolarHBondContact O-N 3.24Å; A186-V190 WeakPolarHBondContact O-CG2 3.43Å; A186-V190 PolarHBondContact O-N 3.1Å; A186-L221 HydrophobicContact CB-CD1 3.98Å; A186-L381 HydrophobicContact CB-CD1 4.37Å; A186-L381 HydrophobicContact CB-CD2 4.35Å; A186-L402 HydrophobicContact CB-CD2 3.89Å
187	I	91.3	Very high	85.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-69	-41	179.4	-63.7	-63.9	0	0	0	111.2	A183 V184 L189 V190 T191 I200 I202 L402 V405 R406 F409	A183-I187 WeakPolarHBondContact O-CG1 3.34Å; A183-I187 PolarHBondContact O-N 3.13Å; V184-I187 PolarHBondContact O-N 3.13Å; I187-L189 PolarHBondContact O-N 3.03Å; I187-V190 PolarHBondContact O-N 3.19Å; I187-T191 WeakPolarHBondContact O-CB 3.35Å; I187-T191 PolarHBondContact O-N 2.86Å; I187-T191 PolarHBondContact O-OG1 3.36Å; I187-I200 HydrophobicContact CD1-CG2 3.94Å; I187-I200 HydrophobicContact CG2-CD1 3.99Å; I187-I200 HydrophobicContact CG2-CG2 4.26Å; I187-I202 HydrophobicContact CD1-CD1 4Å; I187-I202 HydrophobicContact CD1-CG1 3.74Å; I187-L402 HydrophobicContact CD1-CB 4.43Å; I187-L402 HydrophobicContact CD1-CD2 4.01Å; I187-L402 HydrophobicContact CG1-CD2 3.95Å; I187-V405 HydrophobicContact CB-CB 4.49Å; I187-V405 HydrophobicContact CB-CG1 3.69Å; I187-V405 HydrophobicContact CG1-CB 4Å; I187-V405 HydrophobicContact CG1-CG1 3.75Å; I187-V405 HydrophobicContact CG2-CG1 3.82Å; I187-R406 HydrophobicContact CD1-CB 4.45Å; I187-F409 HydrophobicContact CG2-CD1 4.41Å; I187-F409 HydrophobicContact CG2-CD2 4.26Å; I187-F409 HydrophobicContact CG2-CE2 4.46Å; I187-F409 HydrophobicContact CG2-CG 4.23Å
188	K	88.6	Confident	85.7	Confident	83 Å²	83	47.4 Å²	47.4	36%	0.361	25%	0.252	S	S	.	.	H	α-helix	trans	-56.3	-39.6	174.1	-76.6	174	-179.4	170.6	0	111.7	E156 V184 D185 F409	E156-K188 IonicContact OE2-NZ 3.31Å; E156-K188 PolarHBondContact OE2-NZ 3.16Å; V184-K188 HydrophobicContact CG1-CD 3.96Å; V184-K188 VanDerWaalsContact CG1-CE 3.44Å; V184-K188 HydrophobicContact CG1-CG 4.44Å; V184-K188 WeakPolarHBondContact O-CB 3.48Å; V184-K188 VanDerWaalsContact O-CG 3.31Å; V184-K188 WeakPolarHBondContact O-CG 3.28Å; V184-K188 PolarHBondContact O-N 2.94Å; D185-K188 PolarHBondContact O-N 2.91Å; K188-F409 HydrophobicContact CG-CE1 4.45Å; K188-F409 HydrophobicContact CG-CZ 3.91Å
189	L	87.3	Confident	85.5	Confident	44 Å²	44	51.3 Å²	51.3	23%	0.23	27%	0.269	C	S	.	.	H	α-helix	trans	-71.7	-39.1	178.2	-71.2	168.6	0	0	0	113.7	D185 A186 I187 L221 K223 C379	D185-L189 VanDerWaalsContact O-CG 3.24Å; D185-L189 WeakPolarHBondContact O-CG 3.47Å; D185-L189 PolarHBondContact O-N 2.98Å; A186-L189 PolarHBondContact O-N 3.24Å; I187-L189 PolarHBondContact O-N 3.03Å; L189-L221 HydrophobicContact CD1-CD2 3.89Å; L189-L221 HydrophobicContact CD1-CG 4.48Å; L189-K223 HydrophobicContact CD1-CD 4.4Å; L189-K223 HydrophobicContact CD1-CG 3.84Å; L189-K223 HydrophobicContact CD2-CD 4.32Å; L189-C379 HydrophobicContact CD1-CB 4.4Å
190	V	87.9	Confident	85.6	Confident	1 Å²	1	52 Å²	52	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-84.6	-17	-175.7	172	0	0	0	0	112.6	A186 I187 I192 Y205 V206	A186-V190 WeakPolarHBondContact O-CG2 3.43Å; A186-V190 PolarHBondContact O-N 3.1Å; I187-V190 PolarHBondContact O-N 3.19Å; V190-I192 PolarHBondContact O-N 2.79Å; V190-Y205 HydrophobicContact CG1-CD2 4.04Å; V190-Y205 HydrophobicContact CG1-CG 4.35Å; V190-V206 HydrophobicContact CB-CG2 4.45Å; V190-V206 HydrophobicContact CG2-CG2 3.76Å
191	T	85.7	Confident	85.6	Confident	25 Å²	25	54.5 Å²	54.5	15%	0.153	29%	0.286	C	S	.	.			trans	-64.3	120.7	179.2	-61.9	0	0	0	0	110.8	I187 K198 I200	I187-T191 WeakPolarHBondContact O-CB 3.35Å; I187-T191 PolarHBondContact O-N 2.86Å; I187-T191 PolarHBondContact O-OG1 3.36Å; T191-K198 HydrophobicContact CG2-CB 4.21Å; T191-K198 HydrophobicContact CG2-CD 4.1Å; T191-K198 HydrophobicContact CG2-CG 4.38Å; T191-I200 HydrophobicContact CG2-CD1 4.39Å; T191-I200 HydrophobicContact CG2-CG1 4.15Å
192	I	83.6	Confident	85.5	Confident	47 Å²	47	51.5 Å²	51.5	24%	0.241	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	114.8	171.8	-58.6	171.8	0	0	0	107.6	V190 T194 Q199 K377	V190-I192 PolarHBondContact O-N 2.79Å; I192-T194 HydrophobicContact CG2-CG2 4Å; I192-T194 PolarHBondContact O-N 2.96Å; I192-Q199 PolarHBondContact N-O 3.25Å; I192-Q199 PolarHBondContact O-N 3.24Å; I192-K377 HydrophobicContact CD1-CD 4.42Å
193	D	81.5	Confident	85.3	Confident	121 Å²	121	59.8 Å²	59.8	65%	0.647	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	112.7	170.3	-66.4	-41.8	0	0	0	108.8	K198	D193-K198 WeakPolarHBondContact OD1-CE 3.46Å; D193-K198 WeakPolarHBondContact OD1-CG 3.46Å
194	T	79.4	Confident	85	Confident	36 Å²	36	67.7 Å²	67.7	22%	0.221	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	158.9	172.7	73.7	0	0	0	0	109.9	I192 F196 G197 Q199	I192-T194 HydrophobicContact CG2-CG2 4Å; I192-T194 PolarHBondContact O-N 2.96Å; T194-F196 PolarHBondContact O-N 3.46Å; T194-F196 VanDerWaalsContact O-N 3.08Å; T194-G197 CarbonylContact C-O 3.5Å; T194-G197 WeakPolarHBondContact CA-O 3.3Å; T194-G197 WeakPolarHBondContact CB-O 3.47Å; T194-G197 PolarHBondContact N-O 3.07Å; T194-G197 PolarHBondContact O-N 3.28Å; T194-G197 VanDerWaalsContact O-O 3.05Å; T194-G197 PolarHBondContact OG1-O 3.17Å; T194-Q199 HydrophobicContact CG2-CB 4.4Å; T194-Q199 HydrophobicContact CG2-CG 4.03Å
195	P	75.3	Confident	85	Confident	133 Å²	133	69.7 Å²	69.7	86%	0.864	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.2	177.1	-25.3	34.7	0	0	0	114.3
196	F	74.7	Confident	85.1	Confident	202 Å²	202	67.1 Å²	67.1	89%	0.886	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	1	179.7	-59.5	-75.8	0	0	0	113.6	T194	T194-F196 PolarHBondContact O-N 3.46Å; T194-F196 VanDerWaalsContact O-N 3.08Å
197	G	77.7	Confident	85.1	Confident	38 Å²	38	68 Å²	68	39%	0.392	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	129.1	-177.6	-177.2	0	0	0	0	0	113	T194	T194-G197 CarbonylContact C-O 3.5Å; T194-G197 WeakPolarHBondContact CA-O 3.3Å; T194-G197 WeakPolarHBondContact CB-O 3.47Å; T194-G197 PolarHBondContact N-O 3.07Å; T194-G197 PolarHBondContact O-N 3.28Å; T194-G197 VanDerWaalsContact O-O 3.05Å; T194-G197 PolarHBondContact OG1-O 3.17Å
198	K	80.9	Confident	85.3	Confident	72 Å²	72	69.7 Å²	69.7	31%	0.313	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	125.8	177.9	-60.7	-169.5	172.1	179.8	0	110	T191 D193 L410	T191-K198 HydrophobicContact CG2-CB 4.21Å; T191-K198 HydrophobicContact CG2-CD 4.1Å; T191-K198 HydrophobicContact CG2-CG 4.38Å; D193-K198 WeakPolarHBondContact OD1-CE 3.46Å; D193-K198 WeakPolarHBondContact OD1-CG 3.46Å; K198-L410 WeakPolarHBondContact O-CD2 3.18Å
199	Q	84	Confident	85.5	Confident	121 Å²	121	66.9 Å²	66.9	57%	0.565	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	124.6	172.3	-68.2	-171.3	-5	0	0	109.7	I192 T194	I192-Q199 PolarHBondContact N-O 3.25Å; I192-Q199 PolarHBondContact O-N 3.24Å; T194-Q199 HydrophobicContact CG2-CB 4.4Å; T194-Q199 HydrophobicContact CG2-CG 4.03Å
200	I	86.3	Confident	85.7	Confident	15 Å²	15	69 Å²	69	8%	0.077	34%	0.341	C	S	.	.			trans	-131.2	109.4	-179.1	-55.2	172.7	0	0	0	107.6	I187 T191 I202 R406 F409	I187-I200 HydrophobicContact CD1-CG2 3.94Å; I187-I200 HydrophobicContact CG2-CD1 3.99Å; I187-I200 HydrophobicContact CG2-CG2 4.26Å; T191-I200 HydrophobicContact CG2-CD1 4.39Å; T191-I200 HydrophobicContact CG2-CG1 4.15Å; I200-I202 HydrophobicContact CG2-CG1 4.17Å; I200-R406 HydrophobicContact CB-CG 4.23Å; I200-R406 HydrophobicContact CD1-CG 4.42Å; I200-R406 HydrophobicContact CG2-CB 4.31Å; I200-R406 HydrophobicContact CG2-CG 4.14Å; I200-R406 PolarHBondContact O-NE 3.45Å; I200-F409 HydrophobicContact CD1-CB 3.65Å; I200-F409 HydrophobicContact CD1-CD1 4.42Å; I200-F409 HydrophobicContact CD1-CG 4.3Å
201	D	86.9	Confident	86	Confident	53 Å²	53	69.1 Å²	69.1	28%	0.283	34%	0.342	S	S	.	.			trans	-112.3	94.2	175.1	-173.9	-16.7	0	0	0	109.8	K203 R204 Y205	D201-K203 PolarHBondContact OD1-N 3.44Å; D201-R204 PolarHBondContact OD1-N 2.82Å; D201-R204 WeakPolarHBondContact OD2-CD 3.46Å; D201-R204 VanDerWaalsContact OD2-CG 3.24Å; D201-R204 WeakPolarHBondContact OD2-CG 2.95Å; D201-R204 IonicContact OD2-NE 3.77Å; D201-Y205 HydrophobicContact CB-CD2 3.88Å; D201-Y205 HydrophobicContact CB-CE2 3.97Å; D201-Y205 PolarHBondContact O-N 3.4Å
202	I	87.9	Confident	86.2	Confident	16 Å²	16	71.1 Å²	71.1	8%	0.082	36%	0.355	C	S	.	.	H	α-helix	trans	-65.6	-45.6	179.8	-56.9	169.2	0	0	0	109.8	I187 I200 R204 V206 L402 R406	I187-I202 HydrophobicContact CD1-CD1 4Å; I187-I202 HydrophobicContact CD1-CG1 3.74Å; I200-I202 HydrophobicContact CG2-CG1 4.17Å; I202-R204 PolarHBondContact O-N 3.29Å; I202-V206 HydrophobicContact CG2-CB 4.05Å; I202-V206 HydrophobicContact CG2-CG2 4.13Å; I202-V206 WeakPolarHBondContact O-CA 3.44Å; I202-V206 VanDerWaalsContact O-CB 3.32Å; I202-V206 WeakPolarHBondContact O-CB 3.07Å; I202-V206 PolarHBondContact O-N 3.14Å; I202-L402 HydrophobicContact CD1-CB 4.06Å; I202-L402 HydrophobicContact CG2-CB 4.19Å; I202-L402 HydrophobicContact CG2-CD1 4.03Å; I202-R406 HydrophobicContact CD1-CB 3.86Å; I202-R406 HydrophobicContact CD1-CG 4.33Å
203	K	86.9	Confident	86.5	Confident	183 Å²	183	70.1 Å²	70.1	80%	0.796	36%	0.356	S	S	*	.	H	α-helix	trans	-61.9	-40.7	-172	-174.3	174.5	-176.9	173.4	0	112.6	D201 R329	D201-K203 PolarHBondContact OD1-N 3.44Å; K203-R329 PolarHBondContact O-NH2 3.32Å; K203-R329 VanDerWaalsContact O-NH2 3.14Å
204	R	86.5	Confident	86.8	Confident	167 Å²	167	66 Å²	66	63%	0.63	34%	0.343	S	S	*	.	H	α-helix	trans	-84.8	-40.7	-178.9	-64.3	-172	-173.8	-178.4	-0.6	112.8	D201 I202 R329	D201-R204 PolarHBondContact OD1-N 2.82Å; D201-R204 WeakPolarHBondContact OD2-CD 3.46Å; D201-R204 VanDerWaalsContact OD2-CG 3.24Å; D201-R204 WeakPolarHBondContact OD2-CG 2.95Å; D201-R204 IonicContact OD2-NE 3.77Å; I202-R204 PolarHBondContact O-N 3.29Å; R204-R329 WeakPolarHBondContact O-CG 3.29Å; R204-R329 PolarHBondContact O-NE 3.11Å; R204-R329 PolarHBondContact O-NH2 2.86Å
205	Y	89.8	Confident	87.2	Confident	42 Å²	42	70.3 Å²	70.3	17%	0.165	36%	0.361	C	S	.	.	H	α-helix	trans	-104.9	-13	-168.1	-56.8	-51.4	0	0	0	115.4	V190 D201 K332 A378 C379	V190-Y205 HydrophobicContact CG1-CD2 4.04Å; V190-Y205 HydrophobicContact CG1-CG 4.35Å; D201-Y205 HydrophobicContact CB-CD2 3.88Å; D201-Y205 HydrophobicContact CB-CE2 3.97Å; D201-Y205 PolarHBondContact O-N 3.4Å; Y205-K332 HydrophobicContact CD1-CG 4.14Å; Y205-K332 HydrophobicContact CE1-CD 4.27Å; Y205-K332 HydrophobicContact CE1-CG 3.68Å; Y205-K332 WeakPolarHBondContact OH-CE 3.35Å; Y205-A378 HydrophobicContact CD1-CB 4.31Å; Y205-A378 CarbonylContact O-C 3.6Å; Y205-A378 VanDerWaalsContact O-CA 3.28Å; Y205-A378 WeakPolarHBondContact O-CA 3.28Å; Y205-A378 WeakPolarHBondContact O-CB 3.48Å; Y205-C379 PolarHBondContact O-N 2.7Å
206	V	92.5	Very high	87.7	Confident	10 Å²	10	66 Å²	66	6%	0.061	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	109.7	171.4	-174	0	0	0	0	108.5	V190 I202 L381 L402	V190-V206 HydrophobicContact CB-CG2 4.45Å; V190-V206 HydrophobicContact CG2-CG2 3.76Å; I202-V206 HydrophobicContact CG2-CB 4.05Å; I202-V206 HydrophobicContact CG2-CG2 4.13Å; I202-V206 WeakPolarHBondContact O-CA 3.44Å; I202-V206 VanDerWaalsContact O-CB 3.32Å; I202-V206 WeakPolarHBondContact O-CB 3.07Å; I202-V206 PolarHBondContact O-N 3.14Å; V206-L381 HydrophobicContact CG1-CD1 3.4Å; V206-L381 VanDerWaalsContact CG1-CD1 3.4Å; V206-L381 HydrophobicContact CG1-CG 4.05Å; V206-L402 HydrophobicContact CG1-CD1 4.06Å
207	R	93.3	Very high	88.4	Confident	20 Å²	20	62 Å²	62	8%	0.075	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	136.6	170.9	177.4	-179.6	175.6	151	-7.6	109.2	E209 V226 D326 C379 T380 L381	R207-E209 IonicContact CZ-OE2 3.75Å; R207-E209 IonicContact NE-OE2 3.96Å; R207-E209 PolarHBondContact NE-OE2 2.88Å; R207-E209 IonicContact NH2-OE1 3.73Å; R207-E209 IonicContact NH2-OE2 3.68Å; R207-E209 PolarHBondContact NH2-OE2 2.94Å; R207-V226 PolarHBondContact NE-O 3.42Å; R207-V226 PolarHBondContact NH1-O 2.78Å; R207-V226 PolarHBondContact NH2-O 3.06Å; R207-D326 IonicContact CZ-OD1 3.95Å; R207-D326 IonicContact CZ-OD2 2.84Å; R207-D326 IonicContact NH1-OD1 2.81Å; R207-D326 PolarHBondContact NH1-OD1 2.94Å; R207-D326 IonicContact NH1-OD2 3.79Å; R207-D326 PolarHBondContact NH1-OD2 2.84Å; R207-C379 PolarHBondContact N-O 2.86Å; R207-T380 HydrophobicContact CB-CG2 4.08Å; R207-T380 HydrophobicContact CG-CG2 4.01Å; R207-T380 CarbonylContact O-C 3.54Å; R207-T380 VanDerWaalsContact O-CA 3.27Å; R207-T380 WeakPolarHBondContact O-CA 3.39Å; R207-L381 PolarHBondContact O-N 3.03Å
208	V	93.9	Very high	88.9	Confident	35 Å²	35	64.4 Å²	64.4	21%	0.212	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.2	166.9	-175.1	0	0	0	0	108.3	K210 L381 L383 D395 L398	V208-K210 HydrophobicContact CG1-CG 4.32Å; V208-L381 WeakPolarHBondContact CA-O 3.15Å; V208-L381 HydrophobicContact CG2-CB 4.41Å; V208-L381 HydrophobicContact CG2-CD1 4.43Å; V208-L383 HydrophobicContact CG1-CD1 3.54Å; V208-L383 HydrophobicContact CG1-CG 3.95Å; V208-D395 WeakPolarHBondContact CG1-OD1 3.45Å; V208-L398 HydrophobicContact CG1-CD2 4.37Å; V208-L398 HydrophobicContact CG2-CD2 4.24Å
209	E	93.2	Very high	89.4	Confident	24 Å²	24	61.3 Å²	61.3	11%	0.112	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	116.6	175	-167.6	66.8	-169.4	0	0	109.3	R207 V211 F367 T380 L381 L382 L383	R207-E209 IonicContact CZ-OE2 3.75Å; R207-E209 IonicContact NE-OE2 3.96Å; R207-E209 PolarHBondContact NE-OE2 2.88Å; R207-E209 IonicContact NH2-OE1 3.73Å; R207-E209 IonicContact NH2-OE2 3.68Å; R207-E209 PolarHBondContact NH2-OE2 2.94Å; E209-V211 HydrophobicContact CG-CG2 4.1Å; E209-F367 HydrophobicContact CG-CE1 4.23Å; E209-T380 HydrophobicContact CB-CG2 3.94Å; E209-L381 PolarHBondContact N-O 3.28Å; E209-L382 HydrophobicContact CB-CD1 4.16Å; E209-L382 HydrophobicContact CG-CD1 4.24Å; E209-L383 PolarHBondContact O-N 3.33Å
210	K	92.9	Very high	89.8	Confident	87 Å²	87	59.9 Å²	59.9	38%	0.378	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	110.2	-177.9	-67.7	176.1	-74.9	-152.8	0	109.5	V208 L391 D395	V208-K210 HydrophobicContact CG1-CG 4.32Å; K210-L391 HydrophobicContact CB-CD1 4.42Å; K210-L391 HydrophobicContact CD-CB 4.49Å; K210-D395 HydrophobicContact CD-CB 3.92Å; K210-D395 IonicContact NZ-OD2 3.75Å; K210-D395 PolarHBondContact NZ-OD2 3.33Å
211	V	92.5	Very high	90.1	Very high	5 Å²	5	60.9 Å²	60.9	3%	0.03	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	114.7	179.8	-174.4	0	0	0	0	109.5	E209 I362 F367 L382 L383	E209-V211 HydrophobicContact CG-CG2 4.1Å; V211-I362 HydrophobicContact CG1-CG2 3.79Å; V211-F367 HydrophobicContact CB-CZ 4.43Å; V211-F367 HydrophobicContact CG1-CE2 4.01Å; V211-F367 HydrophobicContact CG1-CZ 4.01Å; V211-F367 HydrophobicContact CG2-CE1 3.83Å; V211-F367 HydrophobicContact CG2-CE2 4.11Å; V211-F367 HydrophobicContact CG2-CZ 3.51Å; V211-L382 HydrophobicContact CB-CD1 4.34Å; V211-L382 HydrophobicContact CG2-CD1 3.55Å; V211-L383 PolarHBondContact N-O 2.82Å
212	P	91.7	Very high	90.4	Very high	66 Å²	66	58.9 Å²	58.9	43%	0.429	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	148.3	178.5	28.4	-34	0	0	0	111.6	R384 K388 L391	P212-R384 PolarHBondContact O-NH1 3.27Å; P212-K388 HydrophobicContact CB-CG 4.48Å; P212-L391 HydrophobicContact CB-CD1 4.32Å
213	G	89.1	Confident	90.6	Very high	26 Å²	26	62.4 Å²	62.4	27%	0.268	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	89.6	174.8	-176.2	0	0	0	0	0	113.7	R384 G385	G213-R384 VanDerWaalsContact O-CZ 3.27Å; G213-R384 PolarHBondContact O-NE 3.06Å; G213-R384 PolarHBondContact O-NH1 3.2Å; G213-G385 WeakPolarHBondContact CA-O 3.16Å; G213-G385 PolarHBondContact N-O 2.74Å; G213-G385 PolarHBondContact O-N 3.1Å
214	G	86.8	Confident	90.9	Very high	35 Å²	35	53.7 Å²	53.7	36%	0.361	27%	0.266	S	S	.	.	S	Bend	trans	77.3	-178.3	-173.5	0	0	0	0	0	113.2	E218	G214-E218 WeakPolarHBondContact CA-OE2 3.43Å
215	Q	88	Confident	91.2	Very high	127 Å²	127	45.8 Å²	45.8	59%	0.593	24%	0.236	S	C	*	.			trans	-91.6	157.7	173.1	-62.9	-173.6	-24.8	0	0	111.1	E217 E218 R384	Q215-E217 WeakPolarHBondContact CB-OE2 3.41Å; Q215-E217 PolarHBondContact O-N 2.69Å; Q215-E218 HydrophobicContact CB-CG 4.38Å; Q215-E218 PolarHBondContact N-OE1 2.78Å; Q215-E218 WeakPolarHBondContact O-CB 3.28Å; Q215-E218 PolarHBondContact O-N 3.39Å; Q215-E218 VanDerWaalsContact O-N 3.13Å; Q215-R384 VanDerWaalsContact O-CB 3.32Å; Q215-R384 WeakPolarHBondContact O-CB 3.44Å
216	I	86.9	Confident	91.5	Very high	41 Å²	41	43.8 Å²	43.8	21%	0.21	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-64	-33.3	-179.7	-67.7	170.2	0	0	0	110.3	W175 E218 S219 M394	W175-I216 HydrophobicContact CB-CG2 3.98Å; W175-I216 HydrophobicContact CG-CG2 3.61Å; I216-E218 PolarHBondContact O-N 3.21Å; I216-S219 WeakPolarHBondContact O-CB 3.29Å; I216-S219 PolarHBondContact O-N 3.32Å; I216-S219 PolarHBondContact O-OG 3.2Å; I216-M394 HydrophobicContact CB-CE 4.43Å; I216-M394 HydrophobicContact CG1-CE 4.25Å; I216-M394 HydrophobicContact CG1-SD 4.39Å; I216-M394 HydrophobicContact CG2-CE 3.67Å
217	E	88	Confident	91.5	Very high	119 Å²	119	43.4 Å²	43.4	56%	0.556	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-62.9	-20.8	176.4	-64.1	79.6	-178.7	0	0	113.8	I178 Q215 S219	I178-E217 HydrophobicContact CD1-CB 4.43Å; I178-E217 HydrophobicContact CD1-CG 4.2Å; Q215-E217 WeakPolarHBondContact CB-OE2 3.41Å; Q215-E217 PolarHBondContact O-N 2.69Å; E217-S219 PolarHBondContact O-N 2.82Å
218	E	89.6	Confident	91.5	Very high	88 Å²	88	45.9 Å²	45.9	41%	0.411	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-75.8	-8.5	174.1	-64.7	173.3	-160.7	0	0	112.7	G214 Q215 I216 K220 R384	G214-E218 WeakPolarHBondContact CA-OE2 3.43Å; Q215-E218 HydrophobicContact CB-CG 4.38Å; Q215-E218 PolarHBondContact N-OE1 2.78Å; Q215-E218 WeakPolarHBondContact O-CB 3.28Å; Q215-E218 PolarHBondContact O-N 3.39Å; Q215-E218 VanDerWaalsContact O-N 3.13Å; I216-E218 PolarHBondContact O-N 3.21Å; E218-K220 PolarHBondContact O-N 3.18Å; E218-R384 HydrophobicContact CB-CB 4.01Å; E218-R384 HydrophobicContact CB-CG 3.93Å; E218-R384 IonicContact OE2-CZ 2.88Å; E218-R384 IonicContact OE2-NE 3.15Å; E218-R384 PolarHBondContact OE2-NE 3.17Å; E218-R384 IonicContact OE2-NH2 2.78Å; E218-R384 PolarHBondContact OE2-NH2 3.27Å
219	S	90.6	Very high	91.5	Very high	7 Å²	7	47.8 Å²	47.8	5%	0.049	25%	0.246	C	C	.	.			trans	-65.4	130.5	176.4	-56.7	0	0	0	0	110.2	I216 E217 L382 R384	I216-S219 WeakPolarHBondContact O-CB 3.29Å; I216-S219 PolarHBondContact O-N 3.32Å; I216-S219 PolarHBondContact O-OG 3.2Å; E217-S219 PolarHBondContact O-N 2.82Å; S219-L382 CarbonylContact C-O 3.58Å; S219-L382 WeakPolarHBondContact CA-O 3.15Å; S219-L382 WeakPolarHBondContact CB-O 3.37Å; S219-R384 PolarHBondContact OG-N 2.81Å; S219-R384 PolarHBondContact OG-O 3.02Å
220	K	92	Very high	91.4	Very high	91 Å²	91	48.9 Å²	48.9	40%	0.396	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	148.9	-173.8	62.1	-177.3	179.9	-174.5	0	112.4	E218 I222 L382	E218-K220 PolarHBondContact O-N 3.18Å; K220-I222 HydrophobicContact CD-CG1 4.46Å; K220-I222 HydrophobicContact CG-CD1 4.41Å; K220-I222 HydrophobicContact CG-CG1 4.13Å; K220-L382 HydrophobicContact CG-CB 4.42Å; K220-L382 HydrophobicContact CG-CD2 4.38Å; K220-L382 PolarHBondContact N-O 3.39Å; K220-L382 PolarHBondContact O-N 3.13Å
221	L	93.3	Very high	91.3	Very high	37 Å²	37	45.4 Å²	45.4	19%	0.194	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	124.4	166.9	174.2	67	0	0	0	109.6	M182 D185 A186 L189 C379 L381	M182-L221 HydrophobicContact CG-CB 4.42Å; D185-L221 HydrophobicContact CB-CD2 3.31Å; A186-L221 HydrophobicContact CB-CD1 3.98Å; L189-L221 HydrophobicContact CD1-CD2 3.89Å; L189-L221 HydrophobicContact CD1-CG 4.48Å; L221-C379 HydrophobicContact CD1-CB 3.74Å; L221-L381 HydrophobicContact CB-CD2 4.11Å; L221-L381 HydrophobicContact CD1-CD2 3.55Å; L221-L381 HydrophobicContact CD1-CG 4.19Å; L221-L381 HydrophobicContact CG-CD2 4.41Å
222	I	92.8	Very high	91.1	Very high	10 Å²	10	47.2 Å²	47.2	5%	0.051	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.7	175.9	-62.5	164.9	0	0	0	108.1	K220 G224 V226 F369 I371 C379 T380 L382	K220-I222 HydrophobicContact CD-CG1 4.46Å; K220-I222 HydrophobicContact CG-CD1 4.41Å; K220-I222 HydrophobicContact CG-CG1 4.13Å; I222-G224 PolarHBondContact O-N 3.42Å; I222-V226 HydrophobicContact CB-CG2 4.41Å; I222-V226 HydrophobicContact CD1-CG2 3.44Å; I222-V226 VanDerWaalsContact CD1-CG2 3.44Å; I222-V226 HydrophobicContact CG2-CG2 4.26Å; I222-F369 HydrophobicContact CD1-CD1 3.88Å; I222-F369 HydrophobicContact CD1-CE1 3.55Å; I222-I371 HydrophobicContact CG2-CG1 4.33Å; I222-C379 WeakPolarHBondContact O-CA 3.39Å; I222-C379 WeakPolarHBondContact O-CB 3.47Å; I222-T380 WeakPolarHBondContact CB-O 3.41Å; I222-T380 PolarHBondContact N-O 3.35Å; I222-T380 PolarHBondContact O-N 3.13Å; I222-L382 HydrophobicContact CD1-CB 3.89Å; I222-L382 HydrophobicContact CD1-CD2 4.14Å
223	K	92.8	Very high	91	Very high	91 Å²	91	47.7 Å²	47.7	40%	0.396	24%	0.243	S	C	.	.	S	Bend	trans	-74.5	71.1	174.9	-62.2	-173.6	179.1	-179.3	0	110.3	L189 N372 A376	L189-K223 HydrophobicContact CD1-CD 4.4Å; L189-K223 HydrophobicContact CD1-CG 3.84Å; L189-K223 HydrophobicContact CD2-CD 4.32Å; K223-N372 PolarHBondContact O-N 2.98Å; K223-A376 HydrophobicContact CB-CB 4.01Å
224	G	92.4	Very high	90.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.5	-161.4	-172.5	0	0	0	0	0	114	I222 V370 C379 T380	I222-G224 PolarHBondContact O-N 3.42Å; G224-V370 CarbonylContact C-O 3.16Å; G224-V370 WeakPolarHBondContact CA-O 3.46Å; G224-C379 CarbonylContact O-C 3.54Å; G224-C379 VanDerWaalsContact O-C 3.25Å; G224-C379 WeakPolarHBondContact O-CA 3.33Å; G224-T380 WeakPolarHBondContact O-CB 3.4Å; G224-T380 PolarHBondContact O-N 2.88Å; G224-T380 PolarHBondContact O-OG1 2.84Å
225	V	94	Very high	91	Very high	1 Å²	1	53 Å²	53	1%	0.006	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	130.9	-179.9	-172.1	0	0	0	0	110.2	L227 R329 L330 V333 V370 T380	V225-L227 HydrophobicContact CG1-CD2 3.89Å; V225-L227 HydrophobicContact CG1-CG 4.12Å; V225-R329 HydrophobicContact CG2-CB 3.73Å; V225-L330 HydrophobicContact CB-CD2 3.78Å; V225-L330 HydrophobicContact CB-CG 4.32Å; V225-L330 HydrophobicContact CG1-CD2 4.22Å; V225-L330 HydrophobicContact CG1-CG 4.36Å; V225-L330 HydrophobicContact CG2-CD2 3.93Å; V225-L330 HydrophobicContact CG2-CG 4.2Å; V225-V333 HydrophobicContact CG2-CG2 3.93Å; V225-V370 PolarHBondContact N-O 3.25Å; V225-V370 PolarHBondContact O-N 2.92Å; V225-T380 WeakPolarHBondContact CA-OG1 3.25Å
226	V	94.4	Very high	91.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	132.4	168.4	-173.4	0	0	0	0	109.2	R207 I222 F367 T368 F369 T380	R207-V226 PolarHBondContact NE-O 3.42Å; R207-V226 PolarHBondContact NH1-O 2.78Å; R207-V226 PolarHBondContact NH2-O 3.06Å; I222-V226 HydrophobicContact CB-CG2 4.41Å; I222-V226 HydrophobicContact CD1-CG2 3.44Å; I222-V226 VanDerWaalsContact CD1-CG2 3.44Å; I222-V226 HydrophobicContact CG2-CG2 4.26Å; V226-F367 HydrophobicContact CG1-CB 4.12Å; V226-F367 HydrophobicContact CG1-CD1 3.95Å; V226-F367 HydrophobicContact CG1-CG 4.42Å; V226-T368 CarbonylContact C-O 3.36Å; V226-T368 VanDerWaalsContact CA-O 3.31Å; V226-T368 WeakPolarHBondContact CA-O 3.44Å; V226-F369 HydrophobicContact CB-CD1 4.43Å; V226-F369 HydrophobicContact CB-CE1 4.28Å; V226-F369 HydrophobicContact CG1-CD1 4.17Å; V226-F369 HydrophobicContact CG1-CE1 3.72Å; V226-F369 HydrophobicContact CG1-CE2 4.45Å; V226-F369 HydrophobicContact CG1-CZ 3.86Å; V226-F369 HydrophobicContact CG2-CD1 3.56Å; V226-F369 HydrophobicContact CG2-CE1 3.52Å; V226-F369 HydrophobicContact CG2-CZ 4.47Å; V226-T380 HydrophobicContact CB-CG2 3.87Å; V226-T380 HydrophobicContact CG2-CG2 3.81Å; V226-T380 PolarHBondContact N-OG1 3.4Å
227	L	94.4	Very high	91.3	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138	179.2	-57.4	167.2	0	0	0	110.3	V225 K229 F298 I322 D326 L330 F367 T368	V225-L227 HydrophobicContact CG1-CD2 3.89Å; V225-L227 HydrophobicContact CG1-CG 4.12Å; L227-K229 PolarHBondContact O-N 3.39Å; L227-F298 HydrophobicContact CD1-CD1 4.22Å; L227-F298 HydrophobicContact CD1-CE1 3.7Å; L227-I322 HydrophobicContact CD2-CG2 4.39Å; L227-D326 HydrophobicContact CD2-CB 3.78Å; L227-L330 HydrophobicContact CD1-CD1 4.23Å; L227-F367 CarbonylContact O-C 3.3Å; L227-F367 VanDerWaalsContact O-CA 3.32Å; L227-F367 WeakPolarHBondContact O-CA 3.42Å; L227-T368 PolarHBondContact N-O 3.28Å; L227-T368 PolarHBondContact O-N 3.25Å
228	N	92.9	Very high	91.5	Very high	72 Å²	72	46.7 Å²	46.7	39%	0.385	25%	0.245	S	C	.	.	S	Bend	trans	-82	58.4	172.1	65.7	-27.1	0	0	0	111.4	F367	N228-F367 HydrophobicContact CB-CD1 4.15Å; N228-F367 HydrophobicContact CB-CE1 3.82Å
229	K	92.7	Very high	91.8	Very high	75 Å²	75	50.1 Å²	50.1	33%	0.326	25%	0.254	S	S	.	.			trans	-138.7	140.8	-180	-60.7	-65.4	171.9	-165.3	0	110.1	L227 I319 R321 T368	L227-K229 PolarHBondContact O-N 3.39Å; K229-I319 HydrophobicContact CB-CG2 3.78Å; K229-I319 HydrophobicContact CG-CG2 4.22Å; K229-R321 WeakPolarHBondContact CE-O 3.11Å; K229-T368 PolarHBondContact O-OG1 3.37Å
230	D	92.3	Very high	91.9	Very high	47 Å²	47	50.7 Å²	50.7	25%	0.251	26%	0.256	S	S	.	.			trans	-98.2	168.2	170.1	-161.9	6.4	0	0	0	110.4	R238 Y366	D230-R238 IonicContact OD1-NH2 3.31Å; D230-R238 IonicContact OD2-NH2 2.77Å; D230-R238 PolarHBondContact OD2-NH2 3Å; D230-Y366 HydrophobicContact CB-CD2 4.32Å; D230-Y366 HydrophobicContact CB-CG 4.23Å; D230-Y366 WeakPolarHBondContact OD2-CD2 3.23Å
231	I	90	Very high	92	Very high	14 Å²	14	54 Å²	54	7%	0.072	27%	0.271	C	S	.	.			trans	-64.7	152.1	165.9	39.9	166.7	0	0	0	111.4	M236 R238 I359	I231-M236 HydrophobicContact CB-CB 4.31Å; I231-M236 HydrophobicContact CB-SD 4.41Å; I231-M236 HydrophobicContact CD1-CB 4.09Å; I231-M236 WeakPolarHBondContact CD1-O 3.31Å; I231-M236 HydrophobicContact CG2-CB 4.13Å; I231-M236 HydrophobicContact CG2-SD 4.38Å; I231-R238 HydrophobicContact CD1-CG 3.33Å; I231-R238 HydrophobicContact CG1-CG 4.21Å; I231-I359 HydrophobicContact CB-CD1 4.01Å; I231-I359 HydrophobicContact CD1-CD1 4.45Å; I231-I359 HydrophobicContact CG1-CD1 3.71Å; I231-I359 HydrophobicContact CG2-CD1 3.58Å
232	L	88.7	Confident	91.9	Very high	42 Å²	42	57.8 Å²	57.8	22%	0.22	29%	0.291	C	S	.	.	S	Bend	trans	-77.5	-34.4	-177.1	-62.5	177.5	0	0	0	113.9	M236 V303 Q308 V318 R320	L232-M236 HydrophobicContact CB-CE 4.47Å; L232-M236 HydrophobicContact CB-SD 4.48Å; L232-V303 HydrophobicContact CD1-CB 3.82Å; L232-V303 HydrophobicContact CD1-CG1 3.96Å; L232-V303 HydrophobicContact CD1-CG2 4.33Å; L232-Q308 HydrophobicContact CB-CG 4.06Å; L232-Q308 HydrophobicContact CD1-CG 3.78Å; L232-V318 HydrophobicContact CD1-CB 4.2Å; L232-V318 HydrophobicContact CD1-CG1 4.07Å; L232-R320 HydrophobicContact CD1-CB 4.31Å; L232-R320 HydrophobicContact CD1-CG 4.33Å; L232-R320 VanDerWaalsContact CD2-CD 3.46Å; L232-R320 HydrophobicContact CD2-CG 3.78Å; L232-R320 VanDerWaalsContact CD2-NE 3.29Å
233	H	89.4	Confident	91.9	Very high	77 Å²	77	57.3 Å²	57.3	36%	0.356	29%	0.289	S	S	.	.	S	Bend	trans	-128.2	135.4	-174.4	-170	-86	0	0	0	110.9	S235 M236 V312	H233-S235 PolarHBondContact CE1-OG 3.27Å; H233-S235 WeakPolarHBondContact ND1-CB 3.48Å; H233-S235 PolarHBondContact ND1-N 3.25Å; H233-S235 VanDerWaalsContact ND1-N 3.19Å; H233-S235 PolarHBondContact ND1-OG 3.07Å; H233-S235 PolarHBondContact O-N 3.43Å; H233-S235 VanDerWaalsContact O-N 3.15Å; H233-M236 HydrophobicContact CB-CE 4.04Å; H233-M236 HydrophobicContact CB-CG 4.07Å; H233-M236 HydrophobicContact CB-SD 4.2Å; H233-M236 WeakPolarHBondContact O-CB 3.32Å; H233-M236 PolarHBondContact O-N 3.14Å; H233-V312 HydrophobicContact CB-CG2 3.78Å
234	A	87.6	Confident	92	Very high	93 Å²	93	56.4 Å²	56.4	77%	0.769	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-28.7	-174	0	0	0	0	0	113.9	M236	A234-M236 VanDerWaalsContact C-N 3.28Å; A234-M236 PolarHBondContact O-N 3.11Å
235	S	89.3	Confident	92.2	Very high	80 Å²	80	56.4 Å²	56.4	56%	0.559	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-6.7	176.3	-47.8	0	0	0	0	114.3	H233	H233-S235 PolarHBondContact CE1-OG 3.27Å; H233-S235 WeakPolarHBondContact ND1-CB 3.48Å; H233-S235 PolarHBondContact ND1-N 3.25Å; H233-S235 VanDerWaalsContact ND1-N 3.19Å; H233-S235 PolarHBondContact ND1-OG 3.07Å; H233-S235 PolarHBondContact O-N 3.43Å; H233-S235 VanDerWaalsContact O-N 3.15Å
236	M	90.1	Very high	92.3	Very high	6 Å²	6	56.4 Å²	56.4	3%	0.03	28%	0.283	C	S	.	.	S	Bend	trans	-71.6	140.9	176.3	-71.3	177.3	178.1	0	0	110.7	I231 L232 H233 A234 R238 Q308 V312 V318	I231-M236 HydrophobicContact CB-CB 4.31Å; I231-M236 HydrophobicContact CB-SD 4.41Å; I231-M236 HydrophobicContact CD1-CB 4.09Å; I231-M236 WeakPolarHBondContact CD1-O 3.31Å; I231-M236 HydrophobicContact CG2-CB 4.13Å; I231-M236 HydrophobicContact CG2-SD 4.38Å; L232-M236 HydrophobicContact CB-CE 4.47Å; L232-M236 HydrophobicContact CB-SD 4.48Å; H233-M236 HydrophobicContact CB-CE 4.04Å; H233-M236 HydrophobicContact CB-CG 4.07Å; H233-M236 HydrophobicContact CB-SD 4.2Å; H233-M236 WeakPolarHBondContact O-CB 3.32Å; H233-M236 PolarHBondContact O-N 3.14Å; A234-M236 VanDerWaalsContact C-N 3.28Å; A234-M236 PolarHBondContact O-N 3.11Å; M236-R238 PolarHBondContact O-N 3.05Å; M236-Q308 HydrophobicContact CE-CB 4.43Å; M236-V312 HydrophobicContact CE-CG2 3.49Å; M236-V312 VanDerWaalsContact CE-CG2 3.49Å; M236-V312 HydrophobicContact CG-CG2 3.75Å; M236-V312 HydrophobicContact SD-CG2 4.47Å; M236-V318 HydrophobicContact CE-CB 4.12Å; M236-V318 HydrophobicContact CE-CG2 3.93Å; M236-V318 HydrophobicContact SD-CB 4.41Å; M236-V318 PolarHBondContact SD-N 2.82Å
237	P	90.7	Very high	92.4	Very high	40 Å²	40	56.4 Å²	56.4	26%	0.26	28%	0.283	S	S	.	.			trans	-57.3	120.1	175.1	-25	33	0	0	0	112.5	I240 N315 S317	P237-I240 HydrophobicContact CB-CD1 4.25Å; P237-I240 HydrophobicContact CB-CG1 3.96Å; P237-N315 HydrophobicContact CG-CB 4.46Å; P237-S317 WeakPolarHBondContact CD-OG 3.44Å; P237-S317 PolarHBondContact O-OG 2.91Å
238	R	92.6	Very high	92.4	Very high	107 Å²	107	56.3 Å²	56.3	40%	0.404	28%	0.283	S	S	.	.	S	Bend	trans	-80.4	-13.6	175.2	-75.6	-173.1	162.3	-170.6	-8.9	114.3	D230 I231 M236 Y358 I359	D230-R238 IonicContact OD1-NH2 3.31Å; D230-R238 IonicContact OD2-NH2 2.77Å; D230-R238 PolarHBondContact OD2-NH2 3Å; I231-R238 HydrophobicContact CD1-CG 3.33Å; I231-R238 HydrophobicContact CG1-CG 4.21Å; M236-R238 PolarHBondContact O-N 3.05Å; R238-Y358 CarbonylContact O-C 3.57Å; R238-Y358 VanDerWaalsContact O-CA 3.23Å; R238-Y358 WeakPolarHBondContact O-CA 3.31Å; R238-I359 PolarHBondContact O-N 3.39Å
239	R	94.2	Very high	92.5	Very high	161 Å²	161	54.8 Å²	54.8	61%	0.608	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.1	127	179.5	-174.4	168.9	-174.2	168.6	8.2	110.1	E356 F357	R239-E356 IonicContact CZ-OE1 2.69Å; R239-E356 IonicContact NE-OE1 3.61Å; R239-E356 PolarHBondContact NE-OE1 3.16Å; R239-E356 IonicContact NH2-OE1 2.87Å; R239-E356 PolarHBondContact NH2-OE1 3.26Å; R239-E356 IonicContact NH2-OE2 3.17Å; R239-E356 PolarHBondContact NH2-OE2 2.95Å; R239-F357 CarbonylContact C-O 3.42Å; R239-F357 VanDerWaalsContact CA-O 3.25Å; R239-F357 WeakPolarHBondContact CA-O 3.31Å
240	I	93.7	Very high	92.5	Very high	18 Å²	18	51.5 Å²	51.5	9%	0.092	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	123.7	-177.3	-54.4	169.3	0	0	0	107.8	P237 P243 N295 F357	P237-I240 HydrophobicContact CB-CD1 4.25Å; P237-I240 HydrophobicContact CB-CG1 3.96Å; I240-P243 HydrophobicContact CB-CB 4.27Å; I240-P243 HydrophobicContact CG2-CB 3.83Å; I240-N295 HydrophobicContact CD1-CB 4.23Å; I240-N295 HydrophobicContact CG2-CB 4.05Å; I240-F357 HydrophobicContact CB-CB 4.33Å; I240-F357 HydrophobicContact CB-CD1 4.16Å; I240-F357 HydrophobicContact CD1-CD1 3.85Å; I240-F357 HydrophobicContact CD1-CE1 4.22Å; I240-F357 HydrophobicContact CG1-CD1 3.93Å; I240-F357 PolarHBondContact N-O 2.73Å; I240-F357 PolarHBondContact O-N 2.92Å
241	K	92.8	Very high	92.4	Very high	162 Å²	162	49.3 Å²	49.3	70%	0.704	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	135.3	171.6	-66.6	-173.1	177.3	-174.9	0	109.4
242	N	91.4	Very high	92.6	Very high	115 Å²	115	48.7 Å²	48.7	62%	0.615	25%	0.246	S	C	*	.	S	Bend	trans	47.1	59.9	-175.9	-57.3	-48	0	0	0	113	A354 S355	N242-A354 WeakPolarHBondContact CA-O 3.41Å; N242-S355 PolarHBondContact N-O 3.22Å; N242-S355 PolarHBondContact OD1-O 2.77Å
243	P	93.8	Very high	92.7	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.254	C	S	.	.			trans	-65.4	137.8	-176.6	29.2	-35.8	0	0	0	111.4	I240 V245 L296 A354 F357	I240-P243 HydrophobicContact CB-CB 4.27Å; I240-P243 HydrophobicContact CG2-CB 3.83Å; P243-V245 HydrophobicContact CB-CG2 4.11Å; P243-V245 HydrophobicContact CG-CG2 4.12Å; P243-L296 HydrophobicContact CB-CB 4.35Å; P243-L296 HydrophobicContact CB-CD2 4.43Å; P243-A354 HydrophobicContact CG-CB 3.82Å; P243-F357 HydrophobicContact CB-CB 4.3Å; P243-F357 HydrophobicContact CG-CB 3.9Å
244	R	95.1	Very high	92.7	Very high	72 Å²	72	50.7 Å²	50.7	27%	0.272	25%	0.254	S	S	.	.			trans	-83.7	114.1	163.4	-64.3	-173.7	69.4	-149.4	1	109.1	L292 K293 N295 L296 V350 G351 T352	R244-L292 PolarHBondContact NH1-O 3.39Å; R244-L292 PolarHBondContact NH2-O 2.99Å; R244-K293 PolarHBondContact NH1-O 2.93Å; R244-N295 PolarHBondContact N-OD1 3.01Å; R244-N295 PolarHBondContact O-N 2.9Å; R244-L296 PolarHBondContact O-N 3.43Å; R244-L296 VanDerWaalsContact O-N 3.08Å; R244-V350 HydrophobicContact CB-CG1 3.96Å; R244-G351 WeakPolarHBondContact CA-O 3.39Å; R244-T352 HydrophobicContact CG-CG2 4.45Å
245	V	95.3	Very high	92.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	133.7	-168.3	-172.8	0	0	0	0	111.2	P243 L247 L296 F298 T334 G351	P243-V245 HydrophobicContact CB-CG2 4.11Å; P243-V245 HydrophobicContact CG-CG2 4.12Å; V245-L247 HydrophobicContact CG1-CD2 3.97Å; V245-L296 WeakPolarHBondContact CA-O 3.46Å; V245-L296 HydrophobicContact CG2-CB 4.42Å; V245-L296 HydrophobicContact CG2-CD2 4.18Å; V245-F298 HydrophobicContact CG1-CD2 3.43Å; V245-F298 VanDerWaalsContact CG1-CD2 3.43Å; V245-F298 HydrophobicContact CG1-CE2 3.58Å; V245-T334 HydrophobicContact CB-CG2 4.04Å; V245-T334 HydrophobicContact CG1-CG2 4.04Å; V245-T334 HydrophobicContact CG2-CG2 3.9Å; V245-G351 PolarHBondContact N-O 3.43Å; V245-G351 PolarHBondContact O-N 3.15Å
246	I	96.1	Very high	92.3	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.01	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	138.3	169.3	-66	-179.7	0	0	0	109.3	L248 I289 L292 P294 L296 V297 F298 L345 V350	I246-L248 HydrophobicContact CG2-CD2 4.3Å; I246-L248 HydrophobicContact CG2-CG 4.07Å; I246-I289 HydrophobicContact CD1-CG2 4.32Å; I246-L292 HydrophobicContact CD1-CB 4.31Å; I246-L292 HydrophobicContact CD1-CD1 4.08Å; I246-P294 HydrophobicContact CD1-CB 3.67Å; I246-P294 HydrophobicContact CD1-CG 3.75Å; I246-P294 HydrophobicContact CG1-CB 3.93Å; I246-P294 HydrophobicContact CG1-CG 4.49Å; I246-L296 PolarHBondContact N-O 3.25Å; I246-V297 HydrophobicContact CB-CG2 4.46Å; I246-F298 PolarHBondContact O-N 3.08Å; I246-L345 HydrophobicContact CD1-CD1 4.33Å; I246-L345 HydrophobicContact CG2-CD1 4.05Å; I246-L345 HydrophobicContact CG2-CD2 3.79Å; I246-V350 HydrophobicContact CD1-CG2 4.27Å; I246-V350 HydrophobicContact CG1-CG1 4.5Å; I246-V350 HydrophobicContact CG1-CG2 4.16Å
247	L	96.4	Very high	92	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	122.5	177.8	-55.3	-178.9	0	0	0	109.8	V245 F298 L330 A331 A336 I338 V339	V245-L247 HydrophobicContact CG1-CD2 3.97Å; L247-F298 HydrophobicContact CD2-CB 3.63Å; L247-F298 HydrophobicContact CD2-CD2 3.65Å; L247-F298 HydrophobicContact CD2-CG 4.01Å; L247-L330 HydrophobicContact CD1-CB 4.03Å; L247-L330 HydrophobicContact CD2-CB 3.99Å; L247-L330 HydrophobicContact CD2-CD1 4.15Å; L247-A331 VanDerWaalsContact CD1-CA 3.5Å; L247-A331 HydrophobicContact CD1-CB 3.7Å; L247-A336 HydrophobicContact CD1-CB 3.85Å; L247-A336 HydrophobicContact CG-CB 3.79Å; L247-I338 HydrophobicContact CB-CG1 4.19Å; L247-I338 HydrophobicContact CD1-CG1 4.09Å; L247-V339 PolarHBondContact O-N 3.27Å; L247-V339 VanDerWaalsContact O-N 3.12Å
248	L	95.7	Very high	91.8	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	132	-179.7	-66.7	172.9	0	0	0	111.3	I246 L252 I289 V297 F298 C299 E300 V339 P342 L345	I246-L248 HydrophobicContact CG2-CD2 4.3Å; I246-L248 HydrophobicContact CG2-CG 4.07Å; L248-L252 HydrophobicContact CD1-CD2 4Å; L248-I289 HydrophobicContact CD1-CD1 3.72Å; L248-I289 HydrophobicContact CD1-CG1 4.48Å; L248-V297 HydrophobicContact CD1-CG1 4.01Å; L248-F298 PolarHBondContact N-O 3.11Å; L248-C299 CarbonylContact O-C 3.4Å; L248-C299 WeakPolarHBondContact O-CA 3.44Å; L248-E300 PolarHBondContact O-N 2.93Å; L248-V339 WeakPolarHBondContact CA-O 3.45Å; L248-V339 HydrophobicContact CD2-CB 4.48Å; L248-P342 HydrophobicContact CD1-CG 4.17Å; L248-P342 HydrophobicContact CD2-CG 4.36Å; L248-L345 HydrophobicContact CD2-CD1 4.21Å; L248-L345 HydrophobicContact CD2-CD2 4.13Å; L248-L345 HydrophobicContact CD2-CG 4.39Å
249	D	94.4	Very high	91.7	Very high	39 Å²	39	68.1 Å²	68.1	21%	0.209	32%	0.316	C	S	.	.	S	Bend	trans	-79	-33.4	170.5	-165.8	-16.7	0	0	0	111.2	K301 R324 I338 V339	D249-K301 VanDerWaalsContact O-CG 3.29Å; D249-K301 WeakPolarHBondContact O-CG 3.28Å; D249-R324 VanDerWaalsContact CG-NH1 3.29Å; D249-R324 IonicContact OD1-NH1 3.84Å; D249-R324 IonicContact OD2-CZ 2.81Å; D249-R324 IonicContact OD2-NH1 2.84Å; D249-R324 PolarHBondContact OD2-NH1 3.09Å; D249-I338 HydrophobicContact CB-CG2 4.21Å; D249-V339 PolarHBondContact N-O 2.96Å
250	S	92.3	Very high	91.2	Very high	6 Å²	6	70.3 Å²	70.3	4%	0.042	33%	0.333	C	S	.	.	S	Bend	trans	-75.9	168.5	177.3	66.2	0	0	0	0	112.9	H340	S250-H340 WeakPolarHBondContact CB-O 3.41Å; S250-H340 PolarHBondContact OG-O 3.36Å
251	G	91.5	Very high	90.6	Very high	2 Å²	2	72 Å²	72	2%	0.021	35%	0.349	C	S	.	.			trans	-93.9	155.3	170	0	0	0	0	0	111.2	E253 G302	G251-E253 VanDerWaalsContact C-N 3.32Å; G251-E253 PolarHBondContact O-N 2.98Å; G251-G302 CarbonylContact C-O 3.31Å; G251-G302 WeakPolarHBondContact CA-O 3.34Å
252	L	92.7	Very high	90	Very high	1 Å²	1	69.3 Å²	69.3	1%	0.005	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-94.9	68.2	172.3	-59.5	177.7	0	0	0	109.3	L248 I289 G302 V303 S304 A307 L311 P342	L248-L252 HydrophobicContact CD1-CD2 4Å; L252-I289 HydrophobicContact CD1-CD1 3.94Å; L252-I289 HydrophobicContact CD2-CD1 3.64Å; L252-I289 HydrophobicContact CG-CD1 4.45Å; L252-G302 PolarHBondContact N-O 3.49Å; L252-V303 HydrophobicContact CB-CB 4.48Å; L252-V303 HydrophobicContact CB-CG1 4.14Å; L252-V303 HydrophobicContact CB-CG2 4.3Å; L252-V303 HydrophobicContact CD1-CG1 4.4Å; L252-V303 HydrophobicContact CD1-CG2 4.4Å; L252-V303 HydrophobicContact CG-CG2 4.47Å; L252-S304 WeakPolarHBondContact O-CB 3.19Å; L252-S304 PolarHBondContact O-N 2.91Å; L252-S304 PolarHBondContact O-OG 3.18Å; L252-A307 HydrophobicContact CB-CB 3.84Å; L252-L311 HydrophobicContact CD1-CD1 3.8Å; L252-P342 HydrophobicContact CD2-CG 3.94Å
253	E	91.8	Very high	89.3	Confident	83 Å²	83	69.9 Å²	69.9	39%	0.388	35%	0.348	S	S	.	.	S	Bend	trans	-143	160.8	-178.8	63.9	-169.2	177.2	0	0	110.2	G251 H255	G251-E253 VanDerWaalsContact C-N 3.32Å; G251-E253 PolarHBondContact O-N 2.98Å; E253-H255 PolarHBondContact O-N 3.44Å
254	F	90	Very high	88.8	Confident	78 Å²	78	78.7 Å²	78.7	34%	0.342	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-67.6	117.1	177.2	-175	-100.3	0	0	0	110.5	E278 A281 V282	F254-E278 HydrophobicContact CB-CG 3.72Å; F254-E278 HydrophobicContact CD1-CG 4.47Å; F254-E278 HydrophobicContact CD2-CB 4.22Å; F254-E278 HydrophobicContact CD2-CG 4.01Å; F254-E278 HydrophobicContact CG-CB 4.42Å; F254-E278 HydrophobicContact CG-CG 3.82Å; F254-A281 HydrophobicContact CD2-CB 3.8Å; F254-A281 HydrophobicContact CE2-CB 3.93Å; F254-V282 HydrophobicContact CB-CG2 4.4Å
255	H	85	Confident	88	Confident	92 Å²	92	78.2 Å²	78.2	43%	0.426	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-78	135.8	179.8	-64.6	-51.7	0	0	0	111.2	E253	E253-H255 PolarHBondContact O-N 3.44Å
256	K	83.6	Confident	87.5	Confident	190 Å²	190	83.1 Å²	83.1	83%	0.826	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-75.3	145.5	168.1	-65.1	-175.2	-179.9	-176.7	0	109.3
257	F	82.3	Confident	87	Confident	120 Å²	120	87.8 Å²	87.8	53%	0.526	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-62.1	138.7	173.6	-60.5	-80.2	0	0	0	110.5	S259 A261 F263	F257-S259 VanDerWaalsContact C-N 3.27Å; F257-A261 HydrophobicContact CB-CB 4.16Å; F257-A261 HydrophobicContact CD2-CB 4.06Å; F257-A261 HydrophobicContact CG-CB 4.38Å; F257-F263 HydrophobicContact CD2-CE2 4.22Å; F257-F263 HydrophobicContact CD2-CZ 4.08Å; F257-F263 HydrophobicContact CE2-CE2 4.17Å; F257-F263 AromaticContact CE2-CZ 3.69Å; F257-F263 HydrophobicContact CE2-CZ 3.69Å
258	E	87.2	Confident	86.5	Confident	207 Å²	207	95.6 Å²	95.6	97%	0.967	50%	0.495	S	S	*	.	S	Bend	trans	-68.5	-30.1	174.6	-64.2	-174.2	160.5	0	0	111.8
259	S	89.8	Confident	86.2	Confident	83 Å²	83	99 Å²	99	58%	0.58	52%	0.523	S	S	*	.	S	Bend	trans	-72.1	150.1	170.7	56.5	0	0	0	0	111.5	F257 A261	F257-S259 VanDerWaalsContact C-N 3.27Å; S259-A261 PolarHBondContact O-N 3.28Å
260	Q	85	Confident	85.8	Confident	207 Å²	207	99.1 Å²	99.1	97%	0.967	53%	0.526	S	S	*	.			trans	-61.5	94.9	170.8	-67.9	-178	-5.5	0	0	110.4
261	A	79.8	Confident	85.5	Confident	53 Å²	53	101.9 Å²	101.9	44%	0.438	54%	0.543	S	S	.	.			trans	-109.5	113.1	175.3	0	0	0	0	0	108.9	F257 S259 F263	F257-A261 HydrophobicContact CB-CB 4.16Å; F257-A261 HydrophobicContact CD2-CB 4.06Å; F257-A261 HydrophobicContact CG-CB 4.38Å; S259-A261 PolarHBondContact O-N 3.28Å; A261-F263 HydrophobicContact CB-CE2 4.07Å; A261-F263 HydrophobicContact CB-CZ 4.33Å
262	S	81.1	Confident	85.4	Confident	106 Å²	106	105.4 Å²	105.4	74%	0.741	56%	0.564	S	S	*	*			trans	-101.5	131.2	168.5	54.5	0	0	0	0	109.3
263	F	76.6	Confident	85.2	Confident	127 Å²	127	108.1 Å²	108.1	56%	0.557	58%	0.583	S	S	*	*			trans	-106.5	114.7	175	-64.6	-82.3	0	0	0	108.7	F257 A261 M274	F257-F263 HydrophobicContact CD2-CE2 4.22Å; F257-F263 HydrophobicContact CD2-CZ 4.08Å; F257-F263 HydrophobicContact CE2-CE2 4.17Å; F257-F263 AromaticContact CE2-CZ 3.69Å; F257-F263 HydrophobicContact CE2-CZ 3.69Å; A261-F263 HydrophobicContact CB-CE2 4.07Å; A261-F263 HydrophobicContact CB-CZ 4.33Å; F263-M274 HydrophobicContact CB-CE 3.71Å; F263-M274 HydrophobicContact CB-SD 4.38Å; F263-M274 HydrophobicContact CD1-CE 4.03Å; F263-M274 HydrophobicContact CD2-CE 4.15Å; F263-M274 HydrophobicContact CG-CE 3.69Å
264	E	82.2	Confident	85	Confident	184 Å²	184	107.6 Å²	107.6	86%	0.86	58%	0.582	S	S	*	*			trans	-99.5	117.2	171.4	-69.6	-175.6	178.4	0	0	108.9
265	C	80.1	Confident	84.9	Confident	62 Å²	62	108.8 Å²	108.8	42%	0.419	59%	0.591	S	S	.	*			trans	-101.2	111.2	177.3	-66.8	0	0	0	0	109.8	V271 M274	C265-V271 HydrophobicContact CB-CG2 3.99Å; C265-M274 PolarHBondContact SG-SD 3.05Å
266	S	82.8	Confident	85.2	Confident	104 Å²	104	108.7 Å²	108.7	73%	0.727	59%	0.591	S	S	*	*			trans	-82.2	-35.3	171.1	49.2	0	0	0	0	112.8
267	D	87.2	Confident	85.5	Confident	100 Å²	100	103.4 Å²	103.4	54%	0.535	57%	0.574	S	S	.	*	S	Bend	trans	-119.9	146.5	-168.2	-58	-62.5	0	0	0	111.9	A269 S270	D267-A269 PolarHBondContact O-N 3.21Å; D267-S270 WeakPolarHBondContact O-CB 3.31Å; D267-S270 PolarHBondContact O-N 3.15Å; D267-S270 VanDerWaalsContact O-N 3.07Å
268	M	86.3	Confident	85.8	Confident	164 Å²	164	101.3 Å²	101.3	81%	0.808	57%	0.566	S	S	*	*	H	α-helix	trans	-59.3	-31.9	175.2	-73.5	-64.8	-160.2	0	0	112.5	S270 V271 T272	M268-S270 VanDerWaalsContact C-N 3.29Å; M268-S270 PolarHBondContact O-N 2.98Å; M268-V271 PolarHBondContact O-N 3.37Å; M268-T272 PolarHBondContact O-N 3.35Å; M268-T272 PolarHBondContact O-OG1 3.42Å
269	A	88.3	Confident	86.1	Confident	72 Å²	72	95.6 Å²	95.6	60%	0.595	54%	0.539	S	S	*	.	H	α-helix	trans	-62.4	-36.3	176.3	0	0	0	0	0	112.3	D267 V271 T272 S273	D267-A269 PolarHBondContact O-N 3.21Å; A269-V271 VanDerWaalsContact C-N 3.35Å; A269-T272 PolarHBondContact O-N 3.36Å; A269-S273 PolarHBondContact O-N 3.1Å
270	S	85.7	Confident	86.3	Confident	40 Å²	40	97.7 Å²	97.7	28%	0.28	54%	0.538	S	S	.	.	H	α-helix	trans	-63.9	-42.2	177.4	-54.7	0	0	0	0	110.8	D267 M268 T272 S273 M274	D267-S270 WeakPolarHBondContact O-CB 3.31Å; D267-S270 PolarHBondContact O-N 3.15Å; D267-S270 VanDerWaalsContact O-N 3.07Å; M268-S270 VanDerWaalsContact C-N 3.29Å; M268-S270 PolarHBondContact O-N 2.98Å; S270-T272 PolarHBondContact O-N 2.98Å; S270-S273 PolarHBondContact O-N 3.49Å; S270-S273 PolarHBondContact O-OG 3Å; S270-M274 WeakPolarHBondContact O-CG 2.91Å; S270-M274 PolarHBondContact O-N 2.63Å
271	V	86.1	Confident	86.6	Confident	64 Å²	64	89.2 Å²	89.2	39%	0.388	50%	0.504	S	S	.	.	H	α-helix	trans	-60.7	-46	176.9	-178.4	0	0	0	0	111.2	C265 M268 A269 S273 M274 L275	C265-V271 HydrophobicContact CB-CG2 3.99Å; M268-V271 PolarHBondContact O-N 3.37Å; A269-V271 VanDerWaalsContact C-N 3.35Å; V271-S273 PolarHBondContact O-N 3.41Å; V271-M274 PolarHBondContact O-N 2.94Å; V271-L275 WeakPolarHBondContact O-CG 2.98Å; V271-L275 PolarHBondContact O-N 2.92Å; V271-L275 VanDerWaalsContact O-N 3.12Å
272	T	90.5	Very high	87.2	Confident	77 Å²	77	86.8 Å²	86.8	47%	0.472	48%	0.483	S	S	.	.	H	α-helix	trans	-61.7	-43.5	176.9	-52.7	0	0	0	0	111.7	M268 A269 S270 M274 L275 E276	M268-T272 PolarHBondContact O-N 3.35Å; M268-T272 PolarHBondContact O-OG1 3.42Å; A269-T272 PolarHBondContact O-N 3.36Å; S270-T272 PolarHBondContact O-N 2.98Å; T272-M274 VanDerWaalsContact C-N 3.27Å; T272-M274 PolarHBondContact O-N 3.32Å; T272-L275 PolarHBondContact O-N 3.47Å; T272-E276 PolarHBondContact O-N 3.5Å
273	S	88.1	Confident	87.9	Confident	57 Å²	57	86.1 Å²	86.1	40%	0.399	47%	0.467	S	S	.	.	H	α-helix	trans	-62.7	-33.5	178.2	75.1	0	0	0	0	113.1	A269 S270 V271 T277	A269-S273 PolarHBondContact O-N 3.1Å; S270-S273 PolarHBondContact O-N 3.49Å; S270-S273 PolarHBondContact O-OG 3Å; V271-S273 PolarHBondContact O-N 3.41Å; S273-T277 WeakPolarHBondContact O-CB 3.35Å; S273-T277 PolarHBondContact O-N 3.38Å; S273-T277 PolarHBondContact O-OG1 2.92Å
274	M	86.5	Confident	88.7	Confident	73 Å²	73	82.6 Å²	82.6	36%	0.36	46%	0.461	S	S	.	.	H	α-helix	trans	-68	-45.3	175.4	-71.6	-179.2	74.6	0	0	111.5	F263 C265 S270 V271 T272 E276 T277 E278	F263-M274 HydrophobicContact CB-CE 3.71Å; F263-M274 HydrophobicContact CB-SD 4.38Å; F263-M274 HydrophobicContact CD1-CE 4.03Å; F263-M274 HydrophobicContact CD2-CE 4.15Å; F263-M274 HydrophobicContact CG-CE 3.69Å; C265-M274 PolarHBondContact SG-SD 3.05Å; S270-M274 WeakPolarHBondContact O-CG 2.91Å; S270-M274 PolarHBondContact O-N 2.63Å; V271-M274 PolarHBondContact O-N 2.94Å; T272-M274 VanDerWaalsContact C-N 3.27Å; T272-M274 PolarHBondContact O-N 3.32Å; M274-E276 VanDerWaalsContact C-N 3.33Å; M274-E276 PolarHBondContact O-N 3.17Å; M274-T277 WeakPolarHBondContact O-CB 2.98Å; M274-T277 PolarHBondContact O-N 3.44Å; M274-T277 VanDerWaalsContact O-N 3.09Å; M274-E278 PolarHBondContact O-N 3.25Å
275	L	88.3	Confident	89.2	Confident	103 Å²	103	75.6 Å²	75.6	54%	0.539	43%	0.429	S	S	.	.	H	α-helix	trans	-61.3	-41.7	176	-66.5	173.8	0	0	0	111.6	V271 T272 T277 E278 E279	V271-L275 WeakPolarHBondContact O-CG 2.98Å; V271-L275 PolarHBondContact O-N 2.92Å; V271-L275 VanDerWaalsContact O-N 3.12Å; T272-L275 PolarHBondContact O-N 3.47Å; L275-T277 VanDerWaalsContact C-N 3.29Å; L275-T277 PolarHBondContact O-N 2.95Å; L275-E278 WeakPolarHBondContact O-CB 3.3Å; L275-E278 PolarHBondContact O-N 3.3Å; L275-E279 PolarHBondContact O-N 2.86Å
276	E	91.8	Very high	89.9	Confident	90 Å²	90	72.6 Å²	72.6	42%	0.421	41%	0.409	S	S	.	.	H	α-helix	trans	-63.3	-35.6	173.7	-73.8	-175.4	-161.7	0	0	112.6	T272 M274 K280	T272-E276 PolarHBondContact O-N 3.5Å; M274-E276 VanDerWaalsContact C-N 3.33Å; M274-E276 PolarHBondContact O-N 3.17Å; E276-K280 VanDerWaalsContact O-CB 3.31Å; E276-K280 WeakPolarHBondContact O-CB 3.27Å; E276-K280 WeakPolarHBondContact O-CD 3.49Å; E276-K280 WeakPolarHBondContact O-CG 3.29Å; E276-K280 PolarHBondContact O-N 3.25Å; E276-K280 IonicContact OE2-NZ 3.36Å; E276-K280 PolarHBondContact OE2-NZ 2.84Å
277	T	89.8	Confident	90.4	Very high	78 Å²	78	70.8 Å²	70.8	48%	0.479	39%	0.391	S	S	.	.	H	α-helix	trans	-69.6	-41.3	178.4	-58.5	0	0	0	0	110.7	S273 M274 L275 K280 A281	S273-T277 WeakPolarHBondContact O-CB 3.35Å; S273-T277 PolarHBondContact O-N 3.38Å; S273-T277 PolarHBondContact O-OG1 2.92Å; M274-T277 WeakPolarHBondContact O-CB 2.98Å; M274-T277 PolarHBondContact O-N 3.44Å; M274-T277 VanDerWaalsContact O-N 3.09Å; L275-T277 VanDerWaalsContact C-N 3.29Å; L275-T277 PolarHBondContact O-N 2.95Å; T277-K280 PolarHBondContact O-N 2.64Å; T277-A281 WeakPolarHBondContact O-CB 3.34Å; T277-A281 PolarHBondContact O-N 3.5Å
278	E	89.6	Confident	90.7	Very high	76 Å²	76	67.8 Å²	67.8	36%	0.355	38%	0.378	S	S	.	.	H	α-helix	trans	-58	-49.6	172.4	-175.6	176.6	179.6	0	0	110.9	F254 M274 L275 K280 A281 V282	F254-E278 HydrophobicContact CB-CG 3.72Å; F254-E278 HydrophobicContact CD1-CG 4.47Å; F254-E278 HydrophobicContact CD2-CB 4.22Å; F254-E278 HydrophobicContact CD2-CG 4.01Å; F254-E278 HydrophobicContact CG-CB 4.42Å; F254-E278 HydrophobicContact CG-CG 3.82Å; M274-E278 PolarHBondContact O-N 3.25Å; L275-E278 WeakPolarHBondContact O-CB 3.3Å; L275-E278 PolarHBondContact O-N 3.3Å; E278-K280 PolarHBondContact O-N 3.38Å; E278-A281 PolarHBondContact O-N 3.16Å; E278-V282 WeakPolarHBondContact O-CG2 3.3Å; E278-V282 PolarHBondContact O-N 3.08Å
279	E	92.6	Very high	91.1	Very high	87 Å²	87	60 Å²	60	41%	0.407	34%	0.339	S	S	.	.	H	α-helix	trans	-61.8	-44.6	177.8	-169.8	-177.8	169.7	0	0	111.8	L275 A281 V282 K283 F310	L275-E279 PolarHBondContact O-N 2.86Å; E279-A281 VanDerWaalsContact C-N 3.35Å; E279-A281 PolarHBondContact O-N 2.75Å; E279-V282 PolarHBondContact O-N 2.94Å; E279-K283 WeakPolarHBondContact O-CB 3.21Å; E279-K283 PolarHBondContact O-N 2.81Å; E279-F310 HydrophobicContact CG-CE2 4.32Å; E279-F310 HydrophobicContact CG-CZ 4Å
280	K	93.3	Very high	91.4	Very high	127 Å²	127	58 Å²	58	55%	0.552	32%	0.318	S	S	*	.	H	α-helix	trans	-61.5	-41	177.1	-75.9	164.6	-169.8	156.4	0	112	E276 T277 E278 K283 A284	E276-K280 VanDerWaalsContact O-CB 3.31Å; E276-K280 WeakPolarHBondContact O-CB 3.27Å; E276-K280 WeakPolarHBondContact O-CD 3.49Å; E276-K280 WeakPolarHBondContact O-CG 3.29Å; E276-K280 PolarHBondContact O-N 3.25Å; E276-K280 IonicContact OE2-NZ 3.36Å; E276-K280 PolarHBondContact OE2-NZ 2.84Å; T277-K280 PolarHBondContact O-N 2.64Å; E278-K280 PolarHBondContact O-N 3.38Å; K280-K283 PolarHBondContact O-N 3.18Å; K280-A284 WeakPolarHBondContact O-CB 3.48Å; K280-A284 PolarHBondContact O-N 2.97Å
281	A	91.9	Very high	91.7	Very high	30 Å²	30	63.5 Å²	63.5	25%	0.248	34%	0.34	C	S	.	.	H	α-helix	trans	-66.7	-47.5	179.2	0	0	0	0	0	111.8	F254 T277 E278 E279 K283 A284 M285	F254-A281 HydrophobicContact CD2-CB 3.8Å; F254-A281 HydrophobicContact CE2-CB 3.93Å; T277-A281 WeakPolarHBondContact O-CB 3.34Å; T277-A281 PolarHBondContact O-N 3.5Å; E278-A281 PolarHBondContact O-N 3.16Å; E279-A281 VanDerWaalsContact C-N 3.35Å; E279-A281 PolarHBondContact O-N 2.75Å; A281-K283 VanDerWaalsContact C-N 3.31Å; A281-K283 PolarHBondContact O-N 2.94Å; A281-A284 PolarHBondContact O-N 3.45Å; A281-M285 WeakPolarHBondContact O-CG 3.3Å; A281-M285 PolarHBondContact O-N 3.23Å
282	V	93.4	Very high	92	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.006	33%	0.326	C	S	.	.	H	α-helix	trans	-63.1	-41.4	176	174.5	0	0	0	0	110.7	F254 E278 E279 M285 C286 L306 A307	F254-V282 HydrophobicContact CB-CG2 4.4Å; E278-V282 WeakPolarHBondContact O-CG2 3.3Å; E278-V282 PolarHBondContact O-N 3.08Å; E279-V282 PolarHBondContact O-N 2.94Å; V282-M285 PolarHBondContact O-N 3.26Å; V282-C286 PolarHBondContact O-N 2.91Å; V282-C286 PolarHBondContact O-SG 3.41Å; V282-C286 VanDerWaalsContact O-SG 3.4Å; V282-L306 HydrophobicContact CG1-CB 4.13Å; V282-A307 HydrophobicContact CG1-CB 3.74Å
283	K	94.1	Very high	92.1	Very high	93 Å²	93	65.1 Å²	65.1	40%	0.404	34%	0.336	S	S	.	.	H	α-helix	trans	-62.5	-42.7	177	-175.1	176.9	177.7	-179.6	0	112	E279 K280 A281 M285 C286 D287 F310	E279-K283 WeakPolarHBondContact O-CB 3.21Å; E279-K283 PolarHBondContact O-N 2.81Å; K280-K283 PolarHBondContact O-N 3.18Å; A281-K283 VanDerWaalsContact C-N 3.31Å; A281-K283 PolarHBondContact O-N 2.94Å; K283-M285 VanDerWaalsContact C-N 3.35Å; K283-M285 PolarHBondContact O-N 3.04Å; K283-C286 CarbonylContact O-C 3.58Å; K283-C286 PolarHBondContact O-N 3.46Å; K283-D287 WeakPolarHBondContact O-CB 3.37Å; K283-D287 VanDerWaalsContact O-CG 3.25Å; K283-D287 PolarHBondContact O-N 2.91Å; K283-F310 HydrophobicContact CB-CD2 4.4Å; K283-F310 HydrophobicContact CB-CE2 3.93Å; K283-F310 HydrophobicContact CB-CZ 4.1Å; K283-F310 HydrophobicContact CD-CE1 4.21Å; K283-F310 HydrophobicContact CD-CZ 4.2Å; K283-F310 HydrophobicContact CG-CE1 4.34Å; K283-F310 HydrophobicContact CG-CE2 4.39Å; K283-F310 HydrophobicContact CG-CZ 4.23Å
284	A	93.5	Very high	92.3	Very high	53 Å²	53	62.7 Å²	62.7	44%	0.438	32%	0.318	S	S	.	.	H	α-helix	trans	-59.5	-44.2	176.4	0	0	0	0	0	112	K280 A281 C286 D287 S288	K280-A284 WeakPolarHBondContact O-CB 3.48Å; K280-A284 PolarHBondContact O-N 2.97Å; A281-A284 PolarHBondContact O-N 3.45Å; A284-C286 VanDerWaalsContact C-N 3.35Å; A284-C286 PolarHBondContact O-N 3.12Å; A284-D287 PolarHBondContact O-N 3.33Å; A284-S288 PolarHBondContact O-N 2.92Å; A284-S288 VanDerWaalsContact O-N 3.16Å; A284-S288 PolarHBondContact O-OG 3.41Å
285	M	93.5	Very high	92.7	Very high	36 Å²	36	62.1 Å²	62.1	18%	0.177	32%	0.317	C	S	.	.	H	α-helix	trans	-61.3	-42.9	174.6	-64.1	175.1	-167.1	0	0	111.9	A281 V282 K283 I289 P342	A281-M285 WeakPolarHBondContact O-CG 3.3Å; A281-M285 PolarHBondContact O-N 3.23Å; V282-M285 PolarHBondContact O-N 3.26Å; K283-M285 VanDerWaalsContact C-N 3.35Å; K283-M285 PolarHBondContact O-N 3.04Å; M285-I289 WeakPolarHBondContact O-CG1 3.39Å; M285-I289 PolarHBondContact O-N 3.38Å; M285-P342 HydrophobicContact CB-CB 4.46Å; M285-P342 HydrophobicContact CB-CG 4.36Å
286	C	94.2	Very high	93	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-66.9	-38.9	176.9	-70.9	0	0	0	0	112.4	V282 K283 A284 I289 I290 F310	V282-C286 PolarHBondContact O-N 2.91Å; V282-C286 PolarHBondContact O-SG 3.41Å; V282-C286 VanDerWaalsContact O-SG 3.4Å; K283-C286 CarbonylContact O-C 3.58Å; K283-C286 PolarHBondContact O-N 3.46Å; A284-C286 VanDerWaalsContact C-N 3.35Å; A284-C286 PolarHBondContact O-N 3.12Å; C286-I289 WeakPolarHBondContact O-CB 3.25Å; C286-I289 PolarHBondContact O-N 3.03Å; C286-I290 HydrophobicContact CB-CD1 4.32Å; C286-I290 WeakPolarHBondContact O-CB 3.3Å; C286-I290 WeakPolarHBondContact O-CD1 3.22Å; C286-I290 WeakPolarHBondContact O-CG1 3.21Å; C286-I290 PolarHBondContact O-N 3.03Å; C286-F310 HydrophobicContact CB-CB 4.15Å
287	D	94.3	Very high	93.1	Very high	66 Å²	66	53 Å²	53	35%	0.353	27%	0.271	S	S	.	.	H	α-helix	trans	-63.2	-43.4	-179.6	-75.3	-22.1	0	0	0	110.6	K283 A284 I289 I290 E291	K283-D287 WeakPolarHBondContact O-CB 3.37Å; K283-D287 VanDerWaalsContact O-CG 3.25Å; K283-D287 PolarHBondContact O-N 2.91Å; A284-D287 PolarHBondContact O-N 3.33Å; D287-I289 VanDerWaalsContact C-N 3.26Å; D287-I289 PolarHBondContact O-N 3.13Å; D287-I290 PolarHBondContact O-N 3.49Å; D287-E291 WeakPolarHBondContact O-CG 3.24Å; D287-E291 PolarHBondContact O-N 3.46Å
288	S	93	Very high	93.4	Very high	36 Å²	36	49.4 Å²	49.4	25%	0.252	25%	0.249	S	C	.	.	H	α-helix	trans	-56.6	-39.1	173.2	-54.8	0	0	0	0	112.8	A284 P342	A284-S288 PolarHBondContact O-N 2.92Å; A284-S288 VanDerWaalsContact O-N 3.16Å; A284-S288 PolarHBondContact O-OG 3.41Å; S288-P342 WeakPolarHBondContact CB-O 3.49Å
289	I	94.1	Very high	93.7	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-69.6	-43.2	175.5	-65.4	169.2	0	0	0	110.5	I246 L248 L252 M285 C286 D287 E291 L292 P294 V297 L311 P342 L345	I246-I289 HydrophobicContact CD1-CG2 4.32Å; L248-I289 HydrophobicContact CD1-CD1 3.72Å; L248-I289 HydrophobicContact CD1-CG1 4.48Å; L252-I289 HydrophobicContact CD1-CD1 3.94Å; L252-I289 HydrophobicContact CD2-CD1 3.64Å; L252-I289 HydrophobicContact CG-CD1 4.45Å; M285-I289 WeakPolarHBondContact O-CG1 3.39Å; M285-I289 PolarHBondContact O-N 3.38Å; C286-I289 WeakPolarHBondContact O-CB 3.25Å; C286-I289 PolarHBondContact O-N 3.03Å; D287-I289 VanDerWaalsContact C-N 3.26Å; D287-I289 PolarHBondContact O-N 3.13Å; I289-E291 VanDerWaalsContact C-N 3.34Å; I289-E291 PolarHBondContact O-N 3.01Å; I289-L292 PolarHBondContact O-N 3.18Å; I289-P294 HydrophobicContact CG2-CG 3.7Å; I289-P294 WeakPolarHBondContact O-CD 3.33Å; I289-P294 WeakPolarHBondContact O-CG 3.32Å; I289-V297 HydrophobicContact CG2-CG2 3.76Å; I289-L311 HydrophobicContact CG2-CD2 4.32Å; I289-P342 HydrophobicContact CD1-CB 4.19Å; I289-P342 HydrophobicContact CD1-CG 4.41Å; I289-P342 HydrophobicContact CG1-CB 4.06Å; I289-L345 HydrophobicContact CG1-CD1 3.82Å
290	I	94.1	Very high	93.8	Very high	30 Å²	30	42.6 Å²	42.6	15%	0.154	22%	0.217	C	C	.	.	H	α-helix	trans	-66.4	-35.2	-177	-70.2	161.1	0	0	0	111.5	C286 D287 L292 K293 L311 K314 I316	C286-I290 HydrophobicContact CB-CD1 4.32Å; C286-I290 WeakPolarHBondContact O-CB 3.3Å; C286-I290 WeakPolarHBondContact O-CD1 3.22Å; C286-I290 WeakPolarHBondContact O-CG1 3.21Å; C286-I290 PolarHBondContact O-N 3.03Å; D287-I290 PolarHBondContact O-N 3.49Å; I290-L292 PolarHBondContact O-N 3.39Å; I290-K293 WeakPolarHBondContact O-CA 3.46Å; I290-K293 PolarHBondContact O-N 3.47Å; I290-L311 HydrophobicContact CD1-CD2 4.49Å; I290-L311 HydrophobicContact CG1-CD2 4.19Å; I290-K314 HydrophobicContact CD1-CG 3.89Å; I290-K314 HydrophobicContact CG1-CG 4.05Å; I290-K314 HydrophobicContact CG2-CD 4.27Å; I290-K314 HydrophobicContact CG2-CG 3.99Å; I290-I316 HydrophobicContact CG1-CD1 3.86Å
291	E	93.3	Very high	93.9	Very high	157 Å²	157	41.7 Å²	41.7	73%	0.734	21%	0.214	S	C	*	.	H	α-helix	trans	-54.4	-39.9	177.1	-78.8	-178.3	-178.3	0	0	112.2	D287 I289 K293	D287-E291 WeakPolarHBondContact O-CG 3.24Å; D287-E291 PolarHBondContact O-N 3.46Å; I289-E291 VanDerWaalsContact C-N 3.34Å; I289-E291 PolarHBondContact O-N 3.01Å; E291-K293 PolarHBondContact O-N 2.98Å
292	L	92	Very high	93.9	Very high	19 Å²	19	40.4 Å²	40.4	10%	0.099	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-8.3	177.9	-65.7	173.4	0	0	0	113.7	R244 I246 I289 I290 L345 E347 V350	R244-L292 PolarHBondContact NH1-O 3.39Å; R244-L292 PolarHBondContact NH2-O 2.99Å; I246-L292 HydrophobicContact CD1-CB 4.31Å; I246-L292 HydrophobicContact CD1-CD1 4.08Å; I289-L292 PolarHBondContact O-N 3.18Å; I290-L292 PolarHBondContact O-N 3.39Å; L292-L345 HydrophobicContact CD1-CB 3.49Å; L292-L345 VanDerWaalsContact CD1-CB 3.49Å; L292-L345 HydrophobicContact CD1-CD1 4.29Å; L292-L345 HydrophobicContact CD1-CG 4.42Å; L292-E347 HydrophobicContact CD2-CG 3.81Å; L292-V350 HydrophobicContact CB-CG2 4.25Å; L292-V350 HydrophobicContact CD1-CG2 4.19Å
293	K	92.3	Very high	94	Very high	156 Å²	156	40.6 Å²	40.6	68%	0.678	20%	0.204	S	C	*	.			trans	51.6	53.4	-178.1	-57.4	173.1	-175.4	170.9	0	114.2	R244 I290 E291	R244-K293 PolarHBondContact NH1-O 2.93Å; I290-K293 WeakPolarHBondContact O-CA 3.46Å; I290-K293 PolarHBondContact O-N 3.47Å; E291-K293 PolarHBondContact O-N 2.98Å
294	P	93.5	Very high	94	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.032	19%	0.194	C	C	.	.			trans	-72.3	162.5	172.7	34.1	-37.4	0	0	0	110.8	I246 I289 V297 I316	I246-P294 HydrophobicContact CD1-CB 3.67Å; I246-P294 HydrophobicContact CD1-CG 3.75Å; I246-P294 HydrophobicContact CG1-CB 3.93Å; I246-P294 HydrophobicContact CG1-CG 4.49Å; I289-P294 HydrophobicContact CG2-CG 3.7Å; I289-P294 WeakPolarHBondContact O-CD 3.33Å; I289-P294 WeakPolarHBondContact O-CG 3.32Å; P294-V297 HydrophobicContact CB-CG2 4.48Å; P294-V297 HydrophobicContact CG-CG2 4.21Å; P294-I316 HydrophobicContact CG-CD1 4.09Å; P294-I316 HydrophobicContact CG-CG2 4.36Å; P294-I316 WeakPolarHBondContact O-CG1 3.38Å
295	N	93.3	Very high	93.9	Very high	62 Å²	62	40.7 Å²	40.7	33%	0.332	20%	0.204	S	C	.	.	S	Bend	trans	-106.1	-22.7	170.1	-61.4	100.2	0	0	0	111.8	I240 R244 S317	I240-N295 HydrophobicContact CD1-CB 4.23Å; I240-N295 HydrophobicContact CG2-CB 4.05Å; R244-N295 PolarHBondContact N-OD1 3.01Å; R244-N295 PolarHBondContact O-N 2.9Å; N295-S317 PolarHBondContact O-N 3.26Å
296	L	94.8	Very high	93.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	130.6	-173.4	-175.7	63.4	0	0	0	110.3	P243 R244 V245 I246 F298 S317 F357	P243-L296 HydrophobicContact CB-CB 4.35Å; P243-L296 HydrophobicContact CB-CD2 4.43Å; R244-L296 PolarHBondContact O-N 3.43Å; R244-L296 VanDerWaalsContact O-N 3.08Å; V245-L296 WeakPolarHBondContact CA-O 3.46Å; V245-L296 HydrophobicContact CG2-CB 4.42Å; V245-L296 HydrophobicContact CG2-CD2 4.18Å; I246-L296 PolarHBondContact N-O 3.25Å; L296-F298 HydrophobicContact CD1-CE2 4.5Å; L296-F298 HydrophobicContact CD1-CZ 4.4Å; L296-F298 HydrophobicContact CD2-CD2 4.32Å; L296-F298 HydrophobicContact CD2-CE2 3.33Å; L296-F298 HydrophobicContact CD2-CZ 3.52Å; L296-F298 HydrophobicContact CG-CD2 4.21Å; L296-F298 HydrophobicContact CG-CE2 3.67Å; L296-F298 HydrophobicContact CG-CZ 4Å; L296-S317 CarbonylContact C-O 3.58Å; L296-S317 WeakPolarHBondContact CA-O 3.47Å; L296-F357 HydrophobicContact CD1-CD1 4.47Å; L296-F357 HydrophobicContact CD1-CD2 4.08Å; L296-F357 HydrophobicContact CD1-CE1 4.1Å; L296-F357 HydrophobicContact CD1-CE2 3.61Å; L296-F357 HydrophobicContact CD1-CG 4.46Å; L296-F357 HydrophobicContact CD1-CZ 3.64Å; L296-F357 HydrophobicContact CD2-CB 4.07Å; L296-F357 HydrophobicContact CD2-CD1 4.4Å; L296-F357 HydrophobicContact CD2-CD2 3.31Å; L296-F357 HydrophobicContact CD2-CE2 3.69Å; L296-F357 HydrophobicContact CD2-CG 3.69Å; L296-F357 HydrophobicContact CD2-CZ 4.41Å; L296-F357 HydrophobicContact CG-CD2 4.36Å; L296-F357 HydrophobicContact CG-CE2 4.32Å
297	V	95.3	Very high	93.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.6	177.8	-178.6	0	0	0	0	109.2	I246 L248 I289 P294 I316 S317 V318 I319	I246-V297 HydrophobicContact CB-CG2 4.46Å; L248-V297 HydrophobicContact CD1-CG1 4.01Å; I289-V297 HydrophobicContact CG2-CG2 3.76Å; P294-V297 HydrophobicContact CB-CG2 4.48Å; P294-V297 HydrophobicContact CG-CG2 4.21Å; V297-I316 HydrophobicContact CG2-CG2 3.67Å; V297-S317 PolarHBondContact N-O 3.24Å; V297-V318 WeakPolarHBondContact O-CA 3.38Å; V297-I319 PolarHBondContact O-N 3.07Å
298	F	95.9	Very high	93.8	Very high	3 Å²	3	39.8 Å²	39.8	1%	0.013	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123	174.7	-72.8	-75	0	0	0	108.8	L227 V245 I246 L247 L248 L296 I319 I322 L330 F357 V370	L227-F298 HydrophobicContact CD1-CD1 4.22Å; L227-F298 HydrophobicContact CD1-CE1 3.7Å; V245-F298 HydrophobicContact CG1-CD2 3.43Å; V245-F298 VanDerWaalsContact CG1-CD2 3.43Å; V245-F298 HydrophobicContact CG1-CE2 3.58Å; I246-F298 PolarHBondContact O-N 3.08Å; L247-F298 HydrophobicContact CD2-CB 3.63Å; L247-F298 HydrophobicContact CD2-CD2 3.65Å; L247-F298 HydrophobicContact CD2-CG 4.01Å; L248-F298 PolarHBondContact N-O 3.11Å; L296-F298 HydrophobicContact CD1-CE2 4.5Å; L296-F298 HydrophobicContact CD1-CZ 4.4Å; L296-F298 HydrophobicContact CD2-CD2 4.32Å; L296-F298 HydrophobicContact CD2-CE2 3.33Å; L296-F298 HydrophobicContact CD2-CZ 3.52Å; L296-F298 HydrophobicContact CG-CD2 4.21Å; L296-F298 HydrophobicContact CG-CE2 3.67Å; L296-F298 HydrophobicContact CG-CZ 4Å; F298-I319 WeakPolarHBondContact CA-O 3.42Å; F298-I319 HydrophobicContact CD1-CB 3.7Å; F298-I319 HydrophobicContact CD1-CD1 4.12Å; F298-I319 HydrophobicContact CD1-CG1 4.44Å; F298-I319 HydrophobicContact CD1-CG2 3.99Å; F298-I319 HydrophobicContact CE1-CB 3.96Å; F298-I319 HydrophobicContact CE1-CD1 3.45Å; F298-I319 VanDerWaalsContact CE1-CD1 3.45Å; F298-I319 HydrophobicContact CE1-CG1 4.23Å; F298-I319 HydrophobicContact CE1-CG2 4.23Å; F298-I319 HydrophobicContact CZ-CD1 4.18Å; F298-I322 HydrophobicContact CB-CD1 3.34Å; F298-I322 HydrophobicContact CD1-CD1 3.34Å; F298-I322 HydrophobicContact CD1-CG1 4.46Å; F298-I322 HydrophobicContact CE1-CD1 4.47Å; F298-I322 HydrophobicContact CG-CD1 3.76Å; F298-L330 HydrophobicContact CB-CD1 4.41Å; F298-L330 HydrophobicContact CD1-CD1 3.98Å; F298-L330 HydrophobicContact CD2-CD1 4.1Å; F298-L330 HydrophobicContact CE1-CD1 4.19Å; F298-L330 HydrophobicContact CE2-CD1 4.32Å; F298-L330 HydrophobicContact CE2-CD2 4.29Å; F298-L330 HydrophobicContact CG-CD1 3.92Å; F298-L330 HydrophobicContact CZ-CD1 4.37Å; F298-L330 HydrophobicContact CZ-CD2 4.26Å; F298-F357 HydrophobicContact CZ-CE2 4.44Å; F298-V370 HydrophobicContact CE1-CG2 4.48Å; F298-V370 HydrophobicContact CE2-CG2 4.16Å; F298-V370 HydrophobicContact CZ-CG2 3.53Å
299	C	95.7	Very high	93.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	132.7	176.1	-61.3	0	0	0	0	110.4	L248 K301 V303 I319 R320 R321 I322	L248-C299 CarbonylContact O-C 3.4Å; L248-C299 WeakPolarHBondContact O-CA 3.44Å; C299-K301 VanDerWaalsContact C-N 3.3Å; C299-V303 HydrophobicContact CB-CG2 3.97Å; C299-I319 PolarHBondContact N-O 3.37Å; C299-R320 CarbonylContact O-C 3.49Å; C299-R320 WeakPolarHBondContact O-CA 3.48Å; C299-R321 PolarHBondContact O-N 3.34Å; C299-I322 PolarHBondContact O-N 3.48Å
300	E	95.1	Very high	93.8	Very high	20 Å²	20	44.6 Å²	44.6	9%	0.093	22%	0.217	C	C	.	.	S	Bend	trans	-69.2	-30.1	172.8	-67.8	-169.6	-156.3	0	0	112	L248 R321 I322 R324 S327	L248-E300 PolarHBondContact O-N 2.93Å; E300-R321 VanDerWaalsContact O-CA 3.26Å; E300-R321 WeakPolarHBondContact O-CA 3.39Å; E300-I322 PolarHBondContact O-N 3.3Å; E300-R324 WeakPolarHBondContact OE1-CD 3.4Å; E300-R324 IonicContact OE1-CZ 3.98Å; E300-R324 IonicContact OE1-NE 3.27Å; E300-R324 IonicContact OE1-NH1 3.51Å; E300-R324 PolarHBondContact OE1-NH1 3.06Å; E300-R324 WeakPolarHBondContact OE2-CD 3.46Å; E300-R324 IonicContact OE2-NH1 3.4Å; E300-S327 WeakPolarHBondContact OE1-CB 3.38Å; E300-S327 PolarHBondContact OE1-OG 2.92Å; E300-S327 VanDerWaalsContact OE1-OG 3.05Å
301	K	94.1	Very high	93.7	Very high	109 Å²	109	43.1 Å²	43.1	47%	0.474	21%	0.21	S	C	.	.	S	Bend	trans	-101.9	-160.3	178	-49.9	-62.9	177.7	-175	0	112.3	D249 C299 R320 R321	D249-K301 VanDerWaalsContact O-CG 3.29Å; D249-K301 WeakPolarHBondContact O-CG 3.28Å; C299-K301 VanDerWaalsContact C-N 3.3Å; K301-R320 WeakPolarHBondContact O-CB 3.47Å; K301-R321 PolarHBondContact O-N 3.15Å
302	G	92.9	Very high	93.8	Very high	3 Å²	3	36.8 Å²	36.8	3%	0.031	18%	0.181	C	C	.	.			trans	-72.4	165.7	178.4	0	0	0	0	0	113	G251 L252	G251-G302 CarbonylContact C-O 3.31Å; G251-G302 WeakPolarHBondContact CA-O 3.34Å; L252-G302 PolarHBondContact N-O 3.49Å
303	V	94.3	Very high	93.8	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.024	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-135.7	122.3	172.6	175.4	0	0	0	0	105.2	L232 L252 C299 A307 Q308 V318 R320	L232-V303 HydrophobicContact CD1-CB 3.82Å; L232-V303 HydrophobicContact CD1-CG1 3.96Å; L232-V303 HydrophobicContact CD1-CG2 4.33Å; L252-V303 HydrophobicContact CB-CB 4.48Å; L252-V303 HydrophobicContact CB-CG1 4.14Å; L252-V303 HydrophobicContact CB-CG2 4.3Å; L252-V303 HydrophobicContact CD1-CG1 4.4Å; L252-V303 HydrophobicContact CD1-CG2 4.4Å; L252-V303 HydrophobicContact CG-CG2 4.47Å; C299-V303 HydrophobicContact CB-CG2 3.97Å; V303-A307 HydrophobicContact CG1-CB 3.94Å; V303-Q308 HydrophobicContact CG1-CG 3.88Å; V303-Q308 PolarHBondContact O-NE2 3.29Å; V303-V318 HydrophobicContact CB-CG1 4.44Å; V303-V318 HydrophobicContact CG1-CG1 4.13Å; V303-V318 HydrophobicContact CG2-CG1 3.77Å; V303-R320 HydrophobicContact CB-CB 4.23Å; V303-R320 HydrophobicContact CG2-CB 3.72Å; V303-R320 PolarHBondContact O-NH1 3.33Å
304	S	93.8	Very high	93.8	Very high	26 Å²	26	40 Å²	40	18%	0.182	20%	0.198	C	C	.	.			trans	-66.4	156.7	178.1	62.8	0	0	0	0	111.8	L252 L306 A307 Q308	L252-S304 WeakPolarHBondContact O-CB 3.19Å; L252-S304 PolarHBondContact O-N 2.91Å; L252-S304 PolarHBondContact O-OG 3.18Å; S304-L306 VanDerWaalsContact C-N 3.29Å; S304-L306 PolarHBondContact O-N 3.38Å; S304-A307 PolarHBondContact O-N 3.36Å; S304-A307 VanDerWaalsContact OG-CB 3.29Å; S304-A307 WeakPolarHBondContact OG-CB 3.37Å; S304-A307 PolarHBondContact OG-N 3.49Å; S304-Q308 WeakPolarHBondContact O-CG 3.32Å; S304-Q308 PolarHBondContact O-N 3.1Å; S304-Q308 PolarHBondContact O-NE2 3.38Å
305	D	92.4	Very high	93.7	Very high	122 Å²	122	44.8 Å²	44.8	65%	0.652	22%	0.223	S	C	*	.	H	α-helix	trans	-68.9	-30.5	179.5	-62	-27.7	0	0	0	112	Q308 H309	D305-Q308 WeakPolarHBondContact O-CB 3.47Å; D305-Q308 PolarHBondContact O-N 3.39Å; D305-Q308 PolarHBondContact OD1-NE2 3.42Å; D305-H309 PolarHBondContact O-N 3.38Å
306	L	92.7	Very high	93.8	Very high	68 Å²	68	42 Å²	42	36%	0.356	21%	0.208	S	C	.	.	H	α-helix	trans	-61.2	-48.4	170.6	-68.7	175.3	0	0	0	111.3	V282 S304 Q308 H309 F310	V282-L306 HydrophobicContact CG1-CB 4.13Å; S304-L306 VanDerWaalsContact C-N 3.29Å; S304-L306 PolarHBondContact O-N 3.38Å; L306-Q308 VanDerWaalsContact C-N 3.29Å; L306-Q308 PolarHBondContact O-N 2.83Å; L306-H309 WeakPolarHBondContact O-CB 3.11Å; L306-H309 PolarHBondContact O-N 2.96Å; L306-H309 VanDerWaalsContact O-N 3.14Å; L306-F310 HydrophobicContact CB-CE2 4.4Å; L306-F310 WeakPolarHBondContact O-CD2 3.24Å; L306-F310 PolarHBondContact O-N 2.9Å; L306-F310 VanDerWaalsContact O-N 3.12Å
307	A	93.8	Very high	93.7	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.2	-40.5	176.2	0	0	0	0	0	111.8	L252 V282 V303 S304 H309 F310 L311	L252-A307 HydrophobicContact CB-CB 3.84Å; V282-A307 HydrophobicContact CG1-CB 3.74Å; V303-A307 HydrophobicContact CG1-CB 3.94Å; S304-A307 PolarHBondContact O-N 3.36Å; S304-A307 VanDerWaalsContact OG-CB 3.29Å; S304-A307 WeakPolarHBondContact OG-CB 3.37Å; S304-A307 PolarHBondContact OG-N 3.49Å; A307-H309 VanDerWaalsContact C-N 3.33Å; A307-H309 PolarHBondContact O-N 3.23Å; A307-F310 PolarHBondContact O-N 3.2Å; A307-L311 WeakPolarHBondContact O-CB 3.17Å; A307-L311 VanDerWaalsContact O-CG 3.25Å; A307-L311 WeakPolarHBondContact O-CG 3.47Å; A307-L311 PolarHBondContact O-N 2.83Å
308	Q	93.4	Very high	93.7	Very high	16 Å²	16	42 Å²	42	8%	0.075	21%	0.208	C	C	.	.	H	α-helix	trans	-59	-45.1	175.1	-68.4	168.1	52.4	0	0	111.2	L232 M236 V303 S304 D305 L306 L311 V312	L232-Q308 HydrophobicContact CB-CG 4.06Å; L232-Q308 HydrophobicContact CD1-CG 3.78Å; M236-Q308 HydrophobicContact CE-CB 4.43Å; V303-Q308 HydrophobicContact CG1-CG 3.88Å; V303-Q308 PolarHBondContact O-NE2 3.29Å; S304-Q308 WeakPolarHBondContact O-CG 3.32Å; S304-Q308 PolarHBondContact O-N 3.1Å; S304-Q308 PolarHBondContact O-NE2 3.38Å; D305-Q308 WeakPolarHBondContact O-CB 3.47Å; D305-Q308 PolarHBondContact O-N 3.39Å; D305-Q308 PolarHBondContact OD1-NE2 3.42Å; L306-Q308 VanDerWaalsContact C-N 3.29Å; L306-Q308 PolarHBondContact O-N 2.83Å; Q308-L311 PolarHBondContact O-N 3.2Å; Q308-V312 WeakPolarHBondContact O-CB 3.49Å; Q308-V312 WeakPolarHBondContact O-CG2 3.37Å; Q308-V312 PolarHBondContact O-N 3.25Å
309	H	92.8	Very high	93.7	Very high	112 Å²	112	41.8 Å²	41.8	52%	0.519	21%	0.207	S	C	.	.	H	α-helix	trans	-60.5	-47.7	179.4	-175.1	70.8	0	0	0	112.3	D305 L306 A307 L311 V312 M313	D305-H309 PolarHBondContact O-N 3.38Å; L306-H309 WeakPolarHBondContact O-CB 3.11Å; L306-H309 PolarHBondContact O-N 2.96Å; L306-H309 VanDerWaalsContact O-N 3.14Å; A307-H309 VanDerWaalsContact C-N 3.33Å; A307-H309 PolarHBondContact O-N 3.23Å; H309-L311 VanDerWaalsContact C-N 3.35Å; H309-L311 PolarHBondContact O-N 2.73Å; H309-V312 PolarHBondContact O-N 3.45Å; H309-M313 PolarHBondContact O-N 3.39Å; H309-M313 VanDerWaalsContact O-N 3.17Å
310	F	93.3	Very high	93.6	Very high	24 Å²	24	46 Å²	46	11%	0.105	22%	0.223	C	C	.	.	H	α-helix	trans	-61.7	-41.1	178.2	-66.6	-56.1	0	0	0	112.8	E279 K283 C286 L306 A307 M313	E279-F310 HydrophobicContact CG-CE2 4.32Å; E279-F310 HydrophobicContact CG-CZ 4Å; K283-F310 HydrophobicContact CB-CD2 4.4Å; K283-F310 HydrophobicContact CB-CE2 3.93Å; K283-F310 HydrophobicContact CB-CZ 4.1Å; K283-F310 HydrophobicContact CD-CE1 4.21Å; K283-F310 HydrophobicContact CD-CZ 4.2Å; K283-F310 HydrophobicContact CG-CE1 4.34Å; K283-F310 HydrophobicContact CG-CE2 4.39Å; K283-F310 HydrophobicContact CG-CZ 4.23Å; C286-F310 HydrophobicContact CB-CB 4.15Å; L306-F310 HydrophobicContact CB-CE2 4.4Å; L306-F310 WeakPolarHBondContact O-CD2 3.24Å; L306-F310 PolarHBondContact O-N 2.9Å; L306-F310 VanDerWaalsContact O-N 3.12Å; A307-F310 PolarHBondContact O-N 3.2Å; F310-M313 HydrophobicContact CD1-CE 3.59Å; F310-M313 HydrophobicContact CE1-CE 4.21Å; F310-M313 HydrophobicContact CG-CE 4.49Å
311	L	94	Very high	93.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-73.8	-35	-179.6	-66.9	172.2	0	0	0	112.4	L252 I289 I290 A307 Q308 H309 K314 N315 I316 V318	L252-L311 HydrophobicContact CD1-CD1 3.8Å; I289-L311 HydrophobicContact CG2-CD2 4.32Å; I290-L311 HydrophobicContact CD1-CD2 4.49Å; I290-L311 HydrophobicContact CG1-CD2 4.19Å; A307-L311 WeakPolarHBondContact O-CB 3.17Å; A307-L311 VanDerWaalsContact O-CG 3.25Å; A307-L311 WeakPolarHBondContact O-CG 3.47Å; A307-L311 PolarHBondContact O-N 2.83Å; Q308-L311 PolarHBondContact O-N 3.2Å; H309-L311 VanDerWaalsContact C-N 3.35Å; H309-L311 PolarHBondContact O-N 2.73Å; L311-K314 CarbonylContact O-C 3.56Å; L311-K314 PolarHBondContact O-N 3.08Å; L311-K314 VanDerWaalsContact O-N 3.17Å; L311-N315 PolarHBondContact O-N 3.35Å; L311-I316 HydrophobicContact CB-CB 4.23Å; L311-I316 HydrophobicContact CD2-CB 4.3Å; L311-I316 HydrophobicContact CD2-CD1 3.81Å; L311-I316 HydrophobicContact CD2-CG2 4.35Å; L311-I316 PolarHBondContact O-N 3.33Å; L311-V318 HydrophobicContact CB-CG2 4.01Å; L311-V318 HydrophobicContact CD1-CG2 3.45Å; L311-V318 VanDerWaalsContact CD1-CG2 3.45Å; L311-V318 HydrophobicContact CG-CG2 4.33Å
312	V	93.4	Very high	93.6	Very high	23 Å²	23	47.6 Å²	47.6	14%	0.139	23%	0.226	C	C	.	.	H	α-helix	trans	-62.3	-42.6	174.1	169.1	0	0	0	0	111.3	H233 M236 Q308 H309 K314 N315	H233-V312 HydrophobicContact CB-CG2 3.78Å; M236-V312 HydrophobicContact CE-CG2 3.49Å; M236-V312 VanDerWaalsContact CE-CG2 3.49Å; M236-V312 HydrophobicContact CG-CG2 3.75Å; M236-V312 HydrophobicContact SD-CG2 4.47Å; Q308-V312 WeakPolarHBondContact O-CB 3.49Å; Q308-V312 WeakPolarHBondContact O-CG2 3.37Å; Q308-V312 PolarHBondContact O-N 3.25Å; H309-V312 PolarHBondContact O-N 3.45Å; V312-K314 PolarHBondContact O-N 3.48Å; V312-K314 VanDerWaalsContact O-N 3.07Å; V312-N315 PolarHBondContact O-N 2.95Å
313	M	92.1	Very high	93.6	Very high	112 Å²	112	54.3 Å²	54.3	55%	0.552	25%	0.254	S	S	*	.	H	α-helix	trans	-58.4	-23.6	177.3	-74.9	-169.2	-75.3	0	0	113.3	H309 F310	H309-M313 PolarHBondContact O-N 3.39Å; H309-M313 VanDerWaalsContact O-N 3.17Å; F310-M313 HydrophobicContact CD1-CE 3.59Å; F310-M313 HydrophobicContact CE1-CE 4.21Å; F310-M313 HydrophobicContact CG-CE 4.49Å
314	K	92.9	Very high	93.5	Very high	131 Å²	131	59.2 Å²	59.2	57%	0.57	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	8.9	177	-60.5	-60.4	-174.5	-179.8	0	113.6	I290 L311 V312 I316	I290-K314 HydrophobicContact CD1-CG 3.89Å; I290-K314 HydrophobicContact CG1-CG 4.05Å; I290-K314 HydrophobicContact CG2-CD 4.27Å; I290-K314 HydrophobicContact CG2-CG 3.99Å; L311-K314 CarbonylContact O-C 3.56Å; L311-K314 PolarHBondContact O-N 3.08Å; L311-K314 VanDerWaalsContact O-N 3.17Å; V312-K314 PolarHBondContact O-N 3.48Å; V312-K314 VanDerWaalsContact O-N 3.07Å; K314-I316 VanDerWaalsContact C-N 3.29Å; K314-I316 HydrophobicContact CB-CD1 3.9Å; K314-I316 HydrophobicContact CB-CG1 3.98Å; K314-I316 PolarHBondContact O-N 3.05Å
315	N	92	Very high	93.4	Very high	105 Å²	105	61.5 Å²	61.5	56%	0.561	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	38	-176.3	-68.1	-39.3	0	0	0	113.8	P237 L311 V312	P237-N315 HydrophobicContact CG-CB 4.46Å; L311-N315 PolarHBondContact O-N 3.35Å; V312-N315 PolarHBondContact O-N 2.95Å
316	I	94.4	Very high	93.5	Very high	3 Å²	3	56.1 Å²	56.1	2%	0.015	26%	0.256	C	S	.	.			trans	-97.8	120	176.6	-54.6	173.9	0	0	0	108.3	I290 P294 V297 L311 K314	I290-I316 HydrophobicContact CG1-CD1 3.86Å; P294-I316 HydrophobicContact CG-CD1 4.09Å; P294-I316 HydrophobicContact CG-CG2 4.36Å; P294-I316 WeakPolarHBondContact O-CG1 3.38Å; V297-I316 HydrophobicContact CG2-CG2 3.67Å; L311-I316 HydrophobicContact CB-CB 4.23Å; L311-I316 HydrophobicContact CD2-CB 4.3Å; L311-I316 HydrophobicContact CD2-CD1 3.81Å; L311-I316 HydrophobicContact CD2-CG2 4.35Å; L311-I316 PolarHBondContact O-N 3.33Å; K314-I316 VanDerWaalsContact C-N 3.29Å; K314-I316 HydrophobicContact CB-CD1 3.9Å; K314-I316 HydrophobicContact CB-CG1 3.98Å; K314-I316 PolarHBondContact O-N 3.05Å
317	S	94.5	Very high	93.5	Very high	0 Å²	0	53 Å²	53	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	140	174.8	-68.3	0	0	0	0	110.3	P237 N295 L296 V297	P237-S317 WeakPolarHBondContact CD-OG 3.44Å; P237-S317 PolarHBondContact O-OG 2.91Å; N295-S317 PolarHBondContact O-N 3.26Å; L296-S317 CarbonylContact C-O 3.58Å; L296-S317 WeakPolarHBondContact CA-O 3.47Å; V297-S317 PolarHBondContact N-O 3.24Å
318	V	94.6	Very high	93.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	134.1	-176.5	-171.7	0	0	0	0	110.6	L232 M236 V297 V303 L311	L232-V318 HydrophobicContact CD1-CB 4.2Å; L232-V318 HydrophobicContact CD1-CG1 4.07Å; M236-V318 HydrophobicContact CE-CB 4.12Å; M236-V318 HydrophobicContact CE-CG2 3.93Å; M236-V318 HydrophobicContact SD-CB 4.41Å; M236-V318 PolarHBondContact SD-N 2.82Å; V297-V318 WeakPolarHBondContact O-CA 3.38Å; V303-V318 HydrophobicContact CB-CG1 4.44Å; V303-V318 HydrophobicContact CG1-CG1 4.13Å; V303-V318 HydrophobicContact CG2-CG1 3.77Å; L311-V318 HydrophobicContact CB-CG2 4.01Å; L311-V318 HydrophobicContact CD1-CG2 3.45Å; L311-V318 VanDerWaalsContact CD1-CG2 3.45Å; L311-V318 HydrophobicContact CG-CG2 4.33Å
319	I	95	Very high	93.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.2	173.2	-67.1	171.4	0	0	0	108.3	K229 V297 F298 C299 I322 F357 T368	K229-I319 HydrophobicContact CB-CG2 3.78Å; K229-I319 HydrophobicContact CG-CG2 4.22Å; V297-I319 PolarHBondContact O-N 3.07Å; F298-I319 WeakPolarHBondContact CA-O 3.42Å; F298-I319 HydrophobicContact CD1-CB 3.7Å; F298-I319 HydrophobicContact CD1-CD1 4.12Å; F298-I319 HydrophobicContact CD1-CG1 4.44Å; F298-I319 HydrophobicContact CD1-CG2 3.99Å; F298-I319 HydrophobicContact CE1-CB 3.96Å; F298-I319 HydrophobicContact CE1-CD1 3.45Å; F298-I319 VanDerWaalsContact CE1-CD1 3.45Å; F298-I319 HydrophobicContact CE1-CG1 4.23Å; F298-I319 HydrophobicContact CE1-CG2 4.23Å; F298-I319 HydrophobicContact CZ-CD1 4.18Å; C299-I319 PolarHBondContact N-O 3.37Å; I319-I322 HydrophobicContact CG2-CD1 4Å; I319-I322 HydrophobicContact CG2-CG1 3.95Å; I319-F357 HydrophobicContact CD1-CE2 3.64Å; I319-F357 HydrophobicContact CD1-CZ 3.95Å; I319-T368 HydrophobicContact CD1-CG2 3.57Å; I319-T368 WeakPolarHBondContact CD1-OG1 3.42Å
320	R	93.9	Very high	93.5	Very high	89 Å²	89	51.4 Å²	51.4	34%	0.336	23%	0.234	S	C	.	.			trans	-110.3	164.9	-176.6	77.5	-174.7	174.4	179.9	-3.7	112.3	L232 C299 K301 V303	L232-R320 HydrophobicContact CD1-CB 4.31Å; L232-R320 HydrophobicContact CD1-CG 4.33Å; L232-R320 VanDerWaalsContact CD2-CD 3.46Å; L232-R320 HydrophobicContact CD2-CG 3.78Å; L232-R320 VanDerWaalsContact CD2-NE 3.29Å; C299-R320 CarbonylContact O-C 3.49Å; C299-R320 WeakPolarHBondContact O-CA 3.48Å; K301-R320 WeakPolarHBondContact O-CB 3.47Å; V303-R320 HydrophobicContact CB-CB 4.23Å; V303-R320 HydrophobicContact CG2-CB 3.72Å; V303-R320 PolarHBondContact O-NH1 3.33Å
321	R	93.9	Very high	93.5	Very high	151 Å²	151	51.1 Å²	51.1	57%	0.57	24%	0.236	S	C	*	.			trans	58.5	50.1	172.6	-62.5	-180	-174.2	-79.6	-0.9	113.1	K229 C299 E300 K301	K229-R321 WeakPolarHBondContact CE-O 3.11Å; C299-R321 PolarHBondContact O-N 3.34Å; E300-R321 VanDerWaalsContact O-CA 3.26Å; E300-R321 WeakPolarHBondContact O-CA 3.39Å; K301-R321 PolarHBondContact O-N 3.15Å
322	I	94.8	Very high	93.4	Very high	11 Å²	11	55.3 Å²	55.3	6%	0.056	25%	0.254	C	S	.	.			trans	-88	145.1	177	-56.4	156.7	0	0	0	109.1	L227 F298 C299 E300 I319 D326	L227-I322 HydrophobicContact CD2-CG2 4.39Å; F298-I322 HydrophobicContact CB-CD1 3.34Å; F298-I322 HydrophobicContact CD1-CD1 3.34Å; F298-I322 HydrophobicContact CD1-CG1 4.46Å; F298-I322 HydrophobicContact CE1-CD1 4.47Å; F298-I322 HydrophobicContact CG-CD1 3.76Å; C299-I322 PolarHBondContact O-N 3.48Å; E300-I322 PolarHBondContact O-N 3.3Å; I319-I322 HydrophobicContact CG2-CD1 4Å; I319-I322 HydrophobicContact CG2-CG1 3.95Å; I322-D326 HydrophobicContact CG2-CB 3.74Å
323	K	94	Very high	93.3	Very high	143 Å²	143	54.2 Å²	54.2	62%	0.622	25%	0.248	S	C	*	.			trans	-72.6	144.9	175.3	-65	179.1	179.5	177	0	109.9	T325 D326 S327	K323-T325 VanDerWaalsContact C-N 3.27Å; K323-T325 PolarHBondContact O-N 3.05Å; K323-D326 HydrophobicContact CB-CB 4.47Å; K323-D326 WeakPolarHBondContact O-CA 3.31Å; K323-D326 WeakPolarHBondContact O-CB 3.47Å; K323-D326 PolarHBondContact O-N 2.64Å; K323-S327 PolarHBondContact O-N 3.08Å
324	R	92.3	Very high	93.3	Very high	108 Å²	108	48.9 Å²	48.9	41%	0.408	22%	0.221	S	C	.	.	H	α-helix	trans	-52.4	-44.2	176.5	-177.6	57.3	176.2	-146.9	-7.6	113.5	D249 E300 D326 S327 D328	D249-R324 VanDerWaalsContact CG-NH1 3.29Å; D249-R324 IonicContact OD1-NH1 3.84Å; D249-R324 IonicContact OD2-CZ 2.81Å; D249-R324 IonicContact OD2-NH1 2.84Å; D249-R324 PolarHBondContact OD2-NH1 3.09Å; E300-R324 WeakPolarHBondContact OE1-CD 3.4Å; E300-R324 IonicContact OE1-CZ 3.98Å; E300-R324 IonicContact OE1-NE 3.27Å; E300-R324 IonicContact OE1-NH1 3.51Å; E300-R324 PolarHBondContact OE1-NH1 3.06Å; E300-R324 WeakPolarHBondContact OE2-CD 3.46Å; E300-R324 IonicContact OE2-NH1 3.4Å; R324-D326 PolarHBondContact O-N 3.4Å; R324-S327 WeakPolarHBondContact O-CA 3.33Å; R324-S327 VanDerWaalsContact O-CB 3.26Å; R324-S327 WeakPolarHBondContact O-CB 3.38Å; R324-S327 PolarHBondContact O-N 3.15Å; R324-S327 VanDerWaalsContact O-N 3.08Å; R324-D328 IonicContact NE-OD1 3.62Å; R324-D328 PolarHBondContact O-N 3.23Å
325	T	92.4	Very high	93.3	Very high	74 Å²	74	44.1 Å²	44.1	45%	0.454	21%	0.21	S	C	.	.	H	α-helix	trans	-62	-28.3	178.5	52.7	0	0	0	0	113.2	K323 R329	K323-T325 VanDerWaalsContact C-N 3.27Å; K323-T325 PolarHBondContact O-N 3.05Å; T325-R329 WeakPolarHBondContact O-CG 3.47Å; T325-R329 PolarHBondContact O-N 3.05Å; T325-R329 PolarHBondContact O-NH1 3.17Å
326	D	93.6	Very high	93.3	Very high	8 Å²	8	39.4 Å²	39.4	4%	0.043	19%	0.185	C	C	.	.	H	α-helix	trans	-80.6	-35.5	174.9	-66.9	-30.9	0	0	0	111.8	R207 L227 I322 K323 R324 D328 R329 L330	R207-D326 IonicContact CZ-OD1 3.95Å; R207-D326 IonicContact CZ-OD2 2.84Å; R207-D326 IonicContact NH1-OD1 2.81Å; R207-D326 PolarHBondContact NH1-OD1 2.94Å; R207-D326 IonicContact NH1-OD2 3.79Å; R207-D326 PolarHBondContact NH1-OD2 2.84Å; L227-D326 HydrophobicContact CD2-CB 3.78Å; I322-D326 HydrophobicContact CG2-CB 3.74Å; K323-D326 HydrophobicContact CB-CB 4.47Å; K323-D326 WeakPolarHBondContact O-CA 3.31Å; K323-D326 WeakPolarHBondContact O-CB 3.47Å; K323-D326 PolarHBondContact O-N 2.64Å; R324-D326 PolarHBondContact O-N 3.4Å; D326-D328 VanDerWaalsContact C-N 3.33Å; D326-R329 PolarHBondContact O-N 3.5Å; D326-R329 IonicContact OD1-NH1 2.66Å; D326-R329 PolarHBondContact OD1-NH1 3.49Å; D326-L330 WeakPolarHBondContact O-CB 3.46Å; D326-L330 VanDerWaalsContact O-CG 3.31Å; D326-L330 WeakPolarHBondContact O-CG 3.45Å; D326-L330 PolarHBondContact O-N 3.43Å
327	S	93.7	Very high	93.4	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-57.6	-46.5	171.2	-163.4	0	0	0	0	111	E300 K323 R324 R329 L330 A331 I338	E300-S327 WeakPolarHBondContact OE1-CB 3.38Å; E300-S327 PolarHBondContact OE1-OG 2.92Å; E300-S327 VanDerWaalsContact OE1-OG 3.05Å; K323-S327 PolarHBondContact O-N 3.08Å; R324-S327 WeakPolarHBondContact O-CA 3.33Å; R324-S327 VanDerWaalsContact O-CB 3.26Å; R324-S327 WeakPolarHBondContact O-CB 3.38Å; R324-S327 PolarHBondContact O-N 3.15Å; R324-S327 VanDerWaalsContact O-N 3.08Å; S327-R329 VanDerWaalsContact C-N 3.32Å; S327-R329 PolarHBondContact O-N 3.3Å; S327-L330 WeakPolarHBondContact O-CB 3.43Å; S327-L330 PolarHBondContact O-N 3.24Å; S327-A331 WeakPolarHBondContact O-CB 3.48Å; S327-A331 PolarHBondContact O-N 2.99Å; S327-I338 WeakPolarHBondContact OG-CD1 3.23Å
328	D	93.1	Very high	93.4	Very high	69 Å²	69	44.1 Å²	44.1	37%	0.369	21%	0.213	S	C	.	.	H	α-helix	trans	-61.4	-38.1	176.8	-65.7	-30.9	0	0	0	112.4	R324 D326 K332 I338	R324-D328 IonicContact NE-OD1 3.62Å; R324-D328 PolarHBondContact O-N 3.23Å; D326-D328 VanDerWaalsContact C-N 3.33Å; D328-K332 PolarHBondContact O-N 3.26Å; D328-I338 VanDerWaalsContact OD1-CD1 3.32Å; D328-I338 WeakPolarHBondContact OD1-CD1 3.31Å
329	R	92.8	Very high	93.4	Very high	25 Å²	25	45 Å²	45	9%	0.094	22%	0.218	C	C	.	.	H	α-helix	trans	-69.1	-44.6	175.3	-70.4	171.9	-172.3	114.7	5.8	111.4	K203 R204 V225 T325 D326 S327 A331 K332 V333 A378	K203-R329 PolarHBondContact O-NH2 3.32Å; K203-R329 VanDerWaalsContact O-NH2 3.14Å; R204-R329 WeakPolarHBondContact O-CG 3.29Å; R204-R329 PolarHBondContact O-NE 3.11Å; R204-R329 PolarHBondContact O-NH2 2.86Å; V225-R329 HydrophobicContact CG2-CB 3.73Å; T325-R329 WeakPolarHBondContact O-CG 3.47Å; T325-R329 PolarHBondContact O-N 3.05Å; T325-R329 PolarHBondContact O-NH1 3.17Å; D326-R329 PolarHBondContact O-N 3.5Å; D326-R329 IonicContact OD1-NH1 2.66Å; D326-R329 PolarHBondContact OD1-NH1 3.49Å; S327-R329 VanDerWaalsContact C-N 3.32Å; S327-R329 PolarHBondContact O-N 3.3Å; R329-A331 VanDerWaalsContact C-N 3.28Å; R329-A331 PolarHBondContact O-N 3.27Å; R329-K332 PolarHBondContact O-N 2.84Å; R329-K332 VanDerWaalsContact O-N 3.12Å; R329-V333 WeakPolarHBondContact O-CG2 3.32Å; R329-V333 PolarHBondContact O-N 3.28Å; R329-A378 HydrophobicContact CB-CB 4.34Å; R329-A378 HydrophobicContact CG-CB 4.46Å
330	L	93.8	Very high	93.4	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58	-43.6	176	-75.1	170.3	0	0	0	110.4	V225 L227 L247 F298 D326 S327 K332 V333 T334 V370	V225-L330 HydrophobicContact CB-CD2 3.78Å; V225-L330 HydrophobicContact CB-CG 4.32Å; V225-L330 HydrophobicContact CG1-CD2 4.22Å; V225-L330 HydrophobicContact CG1-CG 4.36Å; V225-L330 HydrophobicContact CG2-CD2 3.93Å; V225-L330 HydrophobicContact CG2-CG 4.2Å; L227-L330 HydrophobicContact CD1-CD1 4.23Å; L247-L330 HydrophobicContact CD1-CB 4.03Å; L247-L330 HydrophobicContact CD2-CB 3.99Å; L247-L330 HydrophobicContact CD2-CD1 4.15Å; F298-L330 HydrophobicContact CB-CD1 4.41Å; F298-L330 HydrophobicContact CD1-CD1 3.98Å; F298-L330 HydrophobicContact CD2-CD1 4.1Å; F298-L330 HydrophobicContact CE1-CD1 4.19Å; F298-L330 HydrophobicContact CE2-CD1 4.32Å; F298-L330 HydrophobicContact CE2-CD2 4.29Å; F298-L330 HydrophobicContact CG-CD1 3.92Å; F298-L330 HydrophobicContact CZ-CD1 4.37Å; F298-L330 HydrophobicContact CZ-CD2 4.26Å; D326-L330 WeakPolarHBondContact O-CB 3.46Å; D326-L330 VanDerWaalsContact O-CG 3.31Å; D326-L330 WeakPolarHBondContact O-CG 3.45Å; D326-L330 PolarHBondContact O-N 3.43Å; S327-L330 WeakPolarHBondContact O-CB 3.43Å; S327-L330 PolarHBondContact O-N 3.24Å; L330-K332 VanDerWaalsContact C-N 3.25Å; L330-K332 PolarHBondContact O-N 3.39Å; L330-V333 PolarHBondContact O-N 2.91Å; L330-V333 VanDerWaalsContact O-N 3.08Å; L330-T334 WeakPolarHBondContact O-CB 3.49Å; L330-T334 WeakPolarHBondContact O-CG2 3.37Å; L330-T334 PolarHBondContact O-N 3.05Å; L330-T334 PolarHBondContact O-OG1 3.34Å; L330-V370 HydrophobicContact CD2-CB 4.05Å; L330-V370 HydrophobicContact CD2-CG1 4.21Å; L330-V370 HydrophobicContact CD2-CG2 3.84Å
331	A	93.4	Very high	93.2	Very high	18 Å²	18	50.2 Å²	50.2	15%	0.149	25%	0.248	C	C	.	.	H	α-helix	trans	-55.7	-40.4	176.7	0	0	0	0	0	112.1	L247 S327 R329 G335 A336 I338	L247-A331 VanDerWaalsContact CD1-CA 3.5Å; L247-A331 HydrophobicContact CD1-CB 3.7Å; S327-A331 WeakPolarHBondContact O-CB 3.48Å; S327-A331 PolarHBondContact O-N 2.99Å; R329-A331 VanDerWaalsContact C-N 3.28Å; R329-A331 PolarHBondContact O-N 3.27Å; A331-G335 CarbonylContact O-C 3.23Å; A331-G335 WeakPolarHBondContact O-CA 3.21Å; A331-G335 PolarHBondContact O-N 3.29Å; A331-A336 WeakPolarHBondContact CA-O 2.81Å; A331-A336 VanDerWaalsContact CB-O 3.25Å; A331-A336 WeakPolarHBondContact CB-O 3.38Å; A331-I338 HydrophobicContact CB-CD1 4.42Å; A331-I338 HydrophobicContact CB-CG1 4.23Å
332	K	90.6	Very high	93.1	Very high	88 Å²	88	43.2 Å²	43.2	38%	0.383	22%	0.222	S	C	.	.	H	α-helix	trans	-70.6	-37.9	175.7	-66.2	-62.9	-178.1	-176.9	0	113.6	Y205 D328 R329 L330 K377 A378	Y205-K332 HydrophobicContact CD1-CG 4.14Å; Y205-K332 HydrophobicContact CE1-CD 4.27Å; Y205-K332 HydrophobicContact CE1-CG 3.68Å; Y205-K332 WeakPolarHBondContact OH-CE 3.35Å; D328-K332 PolarHBondContact O-N 3.26Å; R329-K332 PolarHBondContact O-N 2.84Å; R329-K332 VanDerWaalsContact O-N 3.12Å; L330-K332 VanDerWaalsContact C-N 3.25Å; L330-K332 PolarHBondContact O-N 3.39Å; K332-K377 HydrophobicContact CB-CB 4.34Å; K332-A378 HydrophobicContact CB-CB 4.35Å
333	V	92.3	Very high	92.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-75.2	-42.5	-178.6	173.8	0	0	0	0	111.6	V225 R329 L330 V370 N372 A378	V225-V333 HydrophobicContact CG2-CG2 3.93Å; R329-V333 WeakPolarHBondContact O-CG2 3.32Å; R329-V333 PolarHBondContact O-N 3.28Å; L330-V333 PolarHBondContact O-N 2.91Å; L330-V333 VanDerWaalsContact O-N 3.08Å; V333-V370 HydrophobicContact CG1-CG1 4.26Å; V333-N372 HydrophobicContact CG1-CB 3.71Å; V333-N372 PolarHBondContact O-ND2 3.26Å; V333-A378 HydrophobicContact CG2-CB 3.96Å
334	T	92.3	Very high	92.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-90.5	-23.4	-175.6	66.8	0	0	0	0	112.5	V245 L330 A336 G351 T352 K353 A354 V370	V245-T334 HydrophobicContact CB-CG2 4.04Å; V245-T334 HydrophobicContact CG1-CG2 4.04Å; V245-T334 HydrophobicContact CG2-CG2 3.9Å; L330-T334 WeakPolarHBondContact O-CB 3.49Å; L330-T334 WeakPolarHBondContact O-CG2 3.37Å; L330-T334 PolarHBondContact O-N 3.05Å; L330-T334 PolarHBondContact O-OG1 3.34Å; T334-A336 VanDerWaalsContact C-N 3.26Å; T334-A336 WeakPolarHBondContact OG1-CB 3.26Å; T334-A336 PolarHBondContact OG1-N 3.42Å; T334-A336 VanDerWaalsContact OG1-N 3.14Å; T334-G351 CarbonylContact O-C 3.57Å; T334-G351 WeakPolarHBondContact O-CA 3.27Å; T334-T352 PolarHBondContact O-N 3.06Å; T334-K353 VanDerWaalsContact O-CB 3.3Å; T334-K353 WeakPolarHBondContact O-CB 3.39Å; T334-K353 WeakPolarHBondContact O-CG 3.43Å; T334-K353 PolarHBondContact O-N 3.3Å; T334-A354 HydrophobicContact CG2-CB 4.25Å; T334-V370 HydrophobicContact CG2-CG1 4Å
335	G	91.1	Very high	92.8	Very high	32 Å²	32	40.4 Å²	40.4	33%	0.33	23%	0.231	S	C	.	.			trans	78.3	6.4	-170.7	0	0	0	0	0	114.1	A331	A331-G335 CarbonylContact O-C 3.23Å; A331-G335 WeakPolarHBondContact O-CA 3.21Å; A331-G335 PolarHBondContact O-N 3.29Å
336	A	93.9	Very high	92.8	Very high	5 Å²	5	40.1 Å²	40.1	4%	0.041	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-71.6	149.4	175.8	0	0	0	0	0	111.1	L247 A331 T334 D349	L247-A336 HydrophobicContact CD1-CB 3.85Å; L247-A336 HydrophobicContact CG-CB 3.79Å; A331-A336 WeakPolarHBondContact CA-O 2.81Å; A331-A336 VanDerWaalsContact CB-O 3.25Å; A331-A336 WeakPolarHBondContact CB-O 3.38Å; T334-A336 VanDerWaalsContact C-N 3.26Å; T334-A336 WeakPolarHBondContact OG1-CB 3.26Å; T334-A336 PolarHBondContact OG1-N 3.42Å; T334-A336 VanDerWaalsContact OG1-N 3.14Å; A336-D349 VanDerWaalsContact CA-O 3.28Å; A336-D349 WeakPolarHBondContact CA-O 3.18Å; A336-D349 WeakPolarHBondContact CB-O 3.49Å
337	T	94.7	Very high	92.7	Very high	60 Å²	60	47.3 Å²	47.3	37%	0.368	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-90.8	149.5	166.9	57.5	0	0	0	0	108.7	D349	T337-D349 PolarHBondContact N-O 3.14Å; T337-D349 WeakPolarHBondContact OG1-CA 3.42Å; T337-D349 WeakPolarHBondContact OG1-CB 3.37Å; T337-D349 PolarHBondContact OG1-OD1 3.3Å
338	I	95.3	Very high	92.6	Very high	43 Å²	43	58.1 Å²	58.1	22%	0.221	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.2	175.8	-56.2	167.8	0	0	0	107.1	L247 D249 S327 D328 A331	L247-I338 HydrophobicContact CB-CG1 4.19Å; L247-I338 HydrophobicContact CD1-CG1 4.09Å; D249-I338 HydrophobicContact CB-CG2 4.21Å; S327-I338 WeakPolarHBondContact OG-CD1 3.23Å; D328-I338 VanDerWaalsContact OD1-CD1 3.32Å; D328-I338 WeakPolarHBondContact OD1-CD1 3.31Å; A331-I338 HydrophobicContact CB-CD1 4.42Å; A331-I338 HydrophobicContact CB-CG1 4.23Å
339	V	95.3	Very high	92.6	Very high	18 Å²	18	56.2 Å²	56.2	11%	0.109	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	144.4	-179.5	-178.2	0	0	0	0	109.4	L247 L248 D249 D341 D344 L345 D349	L247-V339 PolarHBondContact O-N 3.27Å; L247-V339 VanDerWaalsContact O-N 3.12Å; L248-V339 WeakPolarHBondContact CA-O 3.45Å; L248-V339 HydrophobicContact CD2-CB 4.48Å; D249-V339 PolarHBondContact N-O 2.96Å; V339-D341 WeakPolarHBondContact CG1-O 2.98Å; V339-D344 HydrophobicContact CG1-CB 4.17Å; V339-L345 HydrophobicContact CB-CD2 3.73Å; V339-L345 HydrophobicContact CG1-CD2 4.02Å; V339-L345 HydrophobicContact CG1-CG 4.36Å; V339-L345 HydrophobicContact CG2-CD2 3.85Å; V339-D349 HydrophobicContact CG2-CB 4.04Å
340	H	93.6	Very high	92.6	Very high	125 Å²	125	55.6 Å²	55.6	58%	0.579	29%	0.292	S	S	*	.	S	Bend	trans	-83.1	-64.2	179	-171.1	73.5	0	0	0	111.2	S250	S250-H340 WeakPolarHBondContact CB-O 3.41Å; S250-H340 PolarHBondContact OG-O 3.36Å
341	D	90.7	Very high	92.5	Very high	74 Å²	74	55.6 Å²	55.6	40%	0.396	29%	0.292	S	S	.	.	S	Bend	trans	-88.3	127	-178.8	-165.7	-24.7	0	0	0	110.9	V339 A343 D344	V339-D341 WeakPolarHBondContact CG1-O 2.98Å; D341-A343 PolarHBondContact O-N 2.96Å; D341-A343 VanDerWaalsContact O-N 3.15Å; D341-A343 WeakPolarHBondContact OD1-CB 3.32Å; D341-A343 PolarHBondContact OD1-N 3.26Å; D341-D344 PolarHBondContact O-N 3.11Å; D341-D344 VanDerWaalsContact O-N 3.11Å
342	P	91.2	Very high	92.4	Very high	4 Å²	4	59.2 Å²	59.2	3%	0.026	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-54	-26.1	171.6	-26.9	35.4	0	0	0	114.8	L248 L252 M285 S288 I289 D344 L345	L248-P342 HydrophobicContact CD1-CG 4.17Å; L248-P342 HydrophobicContact CD2-CG 4.36Å; L252-P342 HydrophobicContact CD2-CG 3.94Å; M285-P342 HydrophobicContact CB-CB 4.46Å; M285-P342 HydrophobicContact CB-CG 4.36Å; S288-P342 WeakPolarHBondContact CB-O 3.49Å; I289-P342 HydrophobicContact CD1-CB 4.19Å; I289-P342 HydrophobicContact CD1-CG 4.41Å; I289-P342 HydrophobicContact CG1-CB 4.06Å; P342-D344 VanDerWaalsContact C-N 3.3Å; P342-D344 PolarHBondContact O-N 2.9Å; P342-L345 HydrophobicContact CB-CD1 4.29Å; P342-L345 WeakPolarHBondContact O-CB 3.32Å; P342-L345 WeakPolarHBondContact O-CD1 3.46Å; P342-L345 WeakPolarHBondContact O-CG 3.47Å; P342-L345 PolarHBondContact O-N 3.14Å
343	A	90.4	Very high	92.5	Very high	66 Å²	66	60.7 Å²	60.7	55%	0.545	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-69.9	-25.9	178.3	0	0	0	0	0	113.6	D341 L345	D341-A343 PolarHBondContact O-N 2.96Å; D341-A343 VanDerWaalsContact O-N 3.15Å; D341-A343 WeakPolarHBondContact OD1-CB 3.32Å; D341-A343 PolarHBondContact OD1-N 3.26Å; A343-L345 VanDerWaalsContact C-N 3.29Å
344	D	92.9	Very high	92.4	Very high	116 Å²	116	60.7 Å²	60.7	62%	0.62	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-85.9	-1.4	-179.8	-70.5	-25.3	0	0	0	112.9	V339 D341 P342 T346	V339-D344 HydrophobicContact CG1-CB 4.17Å; D341-D344 PolarHBondContact O-N 3.11Å; D341-D344 VanDerWaalsContact O-N 3.11Å; P342-D344 VanDerWaalsContact C-N 3.3Å; P342-D344 PolarHBondContact O-N 2.9Å; D344-T346 PolarHBondContact O-N 3.38Å
345	L	92.5	Very high	92.3	Very high	21 Å²	21	61.9 Å²	61.9	11%	0.11	33%	0.328	C	S	.	.			trans	-64.9	128.3	-177.5	-71.8	169.3	0	0	0	111.3	I246 L248 I289 L292 V339 P342 A343	I246-L345 HydrophobicContact CD1-CD1 4.33Å; I246-L345 HydrophobicContact CG2-CD1 4.05Å; I246-L345 HydrophobicContact CG2-CD2 3.79Å; L248-L345 HydrophobicContact CD2-CD1 4.21Å; L248-L345 HydrophobicContact CD2-CD2 4.13Å; L248-L345 HydrophobicContact CD2-CG 4.39Å; I289-L345 HydrophobicContact CG1-CD1 3.82Å; L292-L345 HydrophobicContact CD1-CB 3.49Å; L292-L345 VanDerWaalsContact CD1-CB 3.49Å; L292-L345 HydrophobicContact CD1-CD1 4.29Å; L292-L345 HydrophobicContact CD1-CG 4.42Å; V339-L345 HydrophobicContact CB-CD2 3.73Å; V339-L345 HydrophobicContact CG1-CD2 4.02Å; V339-L345 HydrophobicContact CG1-CG 4.36Å; V339-L345 HydrophobicContact CG2-CD2 3.85Å; P342-L345 HydrophobicContact CB-CD1 4.29Å; P342-L345 WeakPolarHBondContact O-CB 3.32Å; P342-L345 WeakPolarHBondContact O-CD1 3.46Å; P342-L345 WeakPolarHBondContact O-CG 3.47Å; P342-L345 PolarHBondContact O-N 3.14Å; A343-L345 VanDerWaalsContact C-N 3.29Å
346	T	91.9	Very high	92.5	Very high	68 Å²	68	62 Å²	62	42%	0.417	32%	0.32	S	S	.	.			trans	-115.3	165.9	173.4	71.7	0	0	0	0	111.6	D344 R348 D349	D344-T346 PolarHBondContact O-N 3.38Å; T346-R348 PolarHBondContact O-N 3.47Å; T346-R348 VanDerWaalsContact O-N 3.09Å; T346-D349 WeakPolarHBondContact CB-OD2 3.15Å; T346-D349 PolarHBondContact N-OD2 3.48Å; T346-D349 WeakPolarHBondContact O-CB 3.46Å; T346-D349 PolarHBondContact O-N 3.29Å; T346-D349 PolarHBondContact OG1-OD2 3.48Å
347	E	91.4	Very high	92.5	Very high	159 Å²	159	61.8 Å²	61.8	74%	0.743	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-60	-22.3	176.4	-69.4	-168.5	159.7	0	0	113.8	L292 D349	L292-E347 HydrophobicContact CD2-CG 3.81Å; E347-D349 VanDerWaalsContact C-N 3.27Å; E347-D349 PolarHBondContact O-N 3.1Å
348	R	92.6	Very high	92.5	Very high	230 Å²	230	60.8 Å²	60.8	87%	0.868	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-73.1	-22.2	178.7	-63.2	-179.2	-178.8	171.3	2	112.8	T346 V350	T346-R348 PolarHBondContact O-N 3.47Å; T346-R348 VanDerWaalsContact O-N 3.09Å; R348-V350 VanDerWaalsContact C-N 3.33Å
349	D	93.2	Very high	92.5	Very high	28 Å²	28	59.8 Å²	59.8	15%	0.15	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-84.1	-15.2	-175.5	-57.5	-44.8	0	0	0	112	A336 T337 V339 T346 E347 G351	A336-D349 VanDerWaalsContact CA-O 3.28Å; A336-D349 WeakPolarHBondContact CA-O 3.18Å; A336-D349 WeakPolarHBondContact CB-O 3.49Å; T337-D349 PolarHBondContact N-O 3.14Å; T337-D349 WeakPolarHBondContact OG1-CA 3.42Å; T337-D349 WeakPolarHBondContact OG1-CB 3.37Å; T337-D349 PolarHBondContact OG1-OD1 3.3Å; V339-D349 HydrophobicContact CG2-CB 4.04Å; T346-D349 WeakPolarHBondContact CB-OD2 3.15Å; T346-D349 PolarHBondContact N-OD2 3.48Å; T346-D349 WeakPolarHBondContact O-CB 3.46Å; T346-D349 PolarHBondContact O-N 3.29Å; T346-D349 PolarHBondContact OG1-OD2 3.48Å; E347-D349 VanDerWaalsContact C-N 3.27Å; E347-D349 PolarHBondContact O-N 3.1Å; D349-G351 PolarHBondContact O-N 3.1Å
350	V	92.7	Very high	92.3	Very high	12 Å²	12	62.8 Å²	62.8	7%	0.073	32%	0.315	C	S	.	.			trans	-77.2	116.8	-178.8	-174.1	0	0	0	0	110.9	R244 I246 L292 R348	R244-V350 HydrophobicContact CB-CG1 3.96Å; I246-V350 HydrophobicContact CD1-CG2 4.27Å; I246-V350 HydrophobicContact CG1-CG1 4.5Å; I246-V350 HydrophobicContact CG1-CG2 4.16Å; L292-V350 HydrophobicContact CB-CG2 4.25Å; L292-V350 HydrophobicContact CD1-CG2 4.19Å; R348-V350 VanDerWaalsContact C-N 3.33Å
351	G	91.5	Very high	92.2	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.01	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-74.9	126.9	175.6	0	0	0	0	0	112.1	R244 V245 T334 D349	R244-G351 WeakPolarHBondContact CA-O 3.39Å; V245-G351 PolarHBondContact N-O 3.43Å; V245-G351 PolarHBondContact O-N 3.15Å; T334-G351 CarbonylContact O-C 3.57Å; T334-G351 WeakPolarHBondContact O-CA 3.27Å; D349-G351 PolarHBondContact O-N 3.1Å
352	T	91.5	Very high	92.1	Very high	94 Å²	94	59.2 Å²	59.2	58%	0.577	30%	0.295	S	S	*	.			trans	-121.3	2.9	-179.3	55	0	0	0	0	113.3	R244 T334	R244-T352 HydrophobicContact CG-CG2 4.45Å; T334-T352 PolarHBondContact O-N 3.06Å
353	K	90.8	Very high	91.7	Very high	118 Å²	118	61.6 Å²	61.6	51%	0.513	32%	0.32	S	S	.	.			trans	-84.7	-15	-172.4	-59.1	-175	177.4	-176.3	0	114.5	T334 N372	T334-K353 VanDerWaalsContact O-CB 3.3Å; T334-K353 WeakPolarHBondContact O-CB 3.39Å; T334-K353 WeakPolarHBondContact O-CG 3.43Å; T334-K353 PolarHBondContact O-N 3.3Å; K353-N372 VanDerWaalsContact O-CG 3.23Å; K353-N372 PolarHBondContact O-ND2 3.27Å; K353-N372 PolarHBondContact O-OD1 3.01Å
354	A	90.8	Very high	91.5	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.008	33%	0.332	C	S	.	.			trans	-69.4	134.1	178.5	0	0	0	0	0	110.7	N242 P243 T334 V370 I371	N242-A354 WeakPolarHBondContact CA-O 3.41Å; P243-A354 HydrophobicContact CG-CB 3.82Å; T334-A354 HydrophobicContact CG2-CB 4.25Å; A354-V370 HydrophobicContact CB-CG1 4.05Å; A354-I371 CarbonylContact C-O 3.53Å; A354-I371 WeakPolarHBondContact CA-O 3.48Å
355	S	91.6	Very high	91.4	Very high	25 Å²	25	65.2 Å²	65.2	18%	0.175	33%	0.327	C	S	.	.			trans	-84.3	-41.4	178.7	54.1	0	0	0	0	111.9	N242 I371 D373	N242-S355 PolarHBondContact N-O 3.22Å; N242-S355 PolarHBondContact OD1-O 2.77Å; S355-I371 PolarHBondContact N-O 2.97Å; S355-I371 PolarHBondContact OG-O 3.17Å; S355-D373 VanDerWaalsContact CB-OD2 3.29Å; S355-D373 WeakPolarHBondContact CB-OD2 3.46Å; S355-D373 PolarHBondContact OG-OD2 2.99Å
356	E	94	Very high	91.4	Very high	35 Å²	35	68.4 Å²	68.4	16%	0.164	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	140.4	-178.2	-165.1	165.8	-134.6	0	0	111.9	R239 Y358 I371	R239-E356 IonicContact CZ-OE1 2.69Å; R239-E356 IonicContact NE-OE1 3.61Å; R239-E356 PolarHBondContact NE-OE1 3.16Å; R239-E356 IonicContact NH2-OE1 2.87Å; R239-E356 PolarHBondContact NH2-OE1 3.26Å; R239-E356 IonicContact NH2-OE2 3.17Å; R239-E356 PolarHBondContact NH2-OE2 2.95Å; E356-Y358 HydrophobicContact CG-CD1 4.12Å; E356-I371 PolarHBondContact N-O 3Å; E356-I371 PolarHBondContact O-N 3.36Å
357	F	94.7	Very high	91.5	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129.4	164.9	164.1	-95.4	0	0	0	108.1	R239 I240 P243 L296 F298 I319 I359 T368 F369 V370	R239-F357 CarbonylContact C-O 3.42Å; R239-F357 VanDerWaalsContact CA-O 3.25Å; R239-F357 WeakPolarHBondContact CA-O 3.31Å; I240-F357 HydrophobicContact CB-CB 4.33Å; I240-F357 HydrophobicContact CB-CD1 4.16Å; I240-F357 HydrophobicContact CD1-CD1 3.85Å; I240-F357 HydrophobicContact CD1-CE1 4.22Å; I240-F357 HydrophobicContact CG1-CD1 3.93Å; I240-F357 PolarHBondContact N-O 2.73Å; I240-F357 PolarHBondContact O-N 2.92Å; P243-F357 HydrophobicContact CB-CB 4.3Å; P243-F357 HydrophobicContact CG-CB 3.9Å; L296-F357 HydrophobicContact CD1-CD1 4.47Å; L296-F357 HydrophobicContact CD1-CD2 4.08Å; L296-F357 HydrophobicContact CD1-CE1 4.1Å; L296-F357 HydrophobicContact CD1-CE2 3.61Å; L296-F357 HydrophobicContact CD1-CG 4.46Å; L296-F357 HydrophobicContact CD1-CZ 3.64Å; L296-F357 HydrophobicContact CD2-CB 4.07Å; L296-F357 HydrophobicContact CD2-CD1 4.4Å; L296-F357 HydrophobicContact CD2-CD2 3.31Å; L296-F357 HydrophobicContact CD2-CE2 3.69Å; L296-F357 HydrophobicContact CD2-CG 3.69Å; L296-F357 HydrophobicContact CD2-CZ 4.41Å; L296-F357 HydrophobicContact CG-CD2 4.36Å; L296-F357 HydrophobicContact CG-CE2 4.32Å; F298-F357 HydrophobicContact CZ-CE2 4.44Å; I319-F357 HydrophobicContact CD1-CE2 3.64Å; I319-F357 HydrophobicContact CD1-CZ 3.95Å; F357-I359 HydrophobicContact CE1-CG1 4.46Å; F357-I359 HydrophobicContact CZ-CD1 4.08Å; F357-I359 HydrophobicContact CZ-CG1 4.06Å; F357-T368 HydrophobicContact CD2-CG2 3.89Å; F357-T368 HydrophobicContact CE2-CG2 3.35Å; F357-T368 HydrophobicContact CZ-CG2 4.28Å; F357-F369 WeakPolarHBondContact CA-O 3.5Å; F357-V370 HydrophobicContact CD2-CG2 4.18Å
358	Y	95.1	Very high	91.7	Very high	39 Å²	39	57.7 Å²	57.7	15%	0.153	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	158	169.7	68.4	-90.8	0	0	0	112.2	R238 E356 E360 F369 I371	R238-Y358 CarbonylContact O-C 3.57Å; R238-Y358 VanDerWaalsContact O-CA 3.23Å; R238-Y358 WeakPolarHBondContact O-CA 3.31Å; E356-Y358 HydrophobicContact CG-CD1 4.12Å; Y358-E360 HydrophobicContact CD2-CB 4.06Å; Y358-E360 HydrophobicContact CE2-CB 3.85Å; Y358-E360 WeakPolarHBondContact CE2-OE2 3.24Å; Y358-F369 HydrophobicContact CD1-CB 4.05Å; Y358-F369 HydrophobicContact CD2-CB 4.24Å; Y358-F369 AromaticContact CD2-CD2 3.94Å; Y358-F369 HydrophobicContact CD2-CD2 3.94Å; Y358-F369 HydrophobicContact CD2-CG 4.34Å; Y358-F369 HydrophobicContact CE1-CB 3.67Å; Y358-F369 HydrophobicContact CE1-CG 4.2Å; Y358-F369 HydrophobicContact CE2-CB 3.86Å; Y358-F369 HydrophobicContact CE2-CD1 4.45Å; Y358-F369 AromaticContact CE2-CD2 3.39Å; Y358-F369 HydrophobicContact CE2-CD2 3.39Å; Y358-F369 HydrophobicContact CE2-CE2 4.11Å; Y358-F369 AromaticContact CE2-CG 3.63Å; Y358-F369 HydrophobicContact CE2-CG 3.63Å; Y358-F369 HydrophobicContact CG-CB 4.32Å; Y358-F369 AromaticContact CZ-CD2 3.84Å; Y358-F369 AromaticContact CZ-CG 3.54Å; Y358-F369 PolarHBondContact N-O 2.98Å; Y358-F369 VanDerWaalsContact N-O 3.08Å; Y358-F369 PolarHBondContact O-N 2.96Å; Y358-I371 HydrophobicContact CE1-CD1 3.63Å; Y358-I371 HydrophobicContact CE1-CG1 4.38Å
359	I	94	Very high	91.8	Very high	22 Å²	22	46.8 Å²	46.8	11%	0.113	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	127.5	174.1	-58.5	175.1	0	0	0	108.5	I231 R238 F357 Y366 F367	I231-I359 HydrophobicContact CB-CD1 4.01Å; I231-I359 HydrophobicContact CD1-CD1 4.45Å; I231-I359 HydrophobicContact CG1-CD1 3.71Å; I231-I359 HydrophobicContact CG2-CD1 3.58Å; R238-I359 PolarHBondContact O-N 3.39Å; F357-I359 HydrophobicContact CE1-CG1 4.46Å; F357-I359 HydrophobicContact CZ-CD1 4.08Å; F357-I359 HydrophobicContact CZ-CG1 4.06Å; I359-Y366 HydrophobicContact CG2-CD1 4.1Å; I359-F367 CarbonylContact C-O 3.52Å; I359-F367 VanDerWaalsContact CA-O 3.32Å; I359-F367 WeakPolarHBondContact CA-O 3.35Å
360	E	92.5	Very high	91.9	Very high	81 Å²	81	45.4 Å²	45.4	38%	0.379	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	138	178.6	-174.8	177.6	-176	0	0	109.2	Y358 I362 F367 F369	Y358-E360 HydrophobicContact CD2-CB 4.06Å; Y358-E360 HydrophobicContact CE2-CB 3.85Å; Y358-E360 WeakPolarHBondContact CE2-OE2 3.24Å; E360-I362 HydrophobicContact CG-CG1 4.26Å; E360-F367 PolarHBondContact N-O 3Å; E360-F367 PolarHBondContact O-N 2.92Å; E360-F369 HydrophobicContact CB-CD2 4.19Å; E360-F369 HydrophobicContact CB-CE2 3.79Å
361	K	91	Very high	91.9	Very high	105 Å²	105	46.2 Å²	46.2	46%	0.457	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	116.8	174.2	-166.8	-174.6	178.9	-162.5	0	108.2	G363 D364 E365 Y366	K361-G363 VanDerWaalsContact CE-O 3.23Å; K361-G363 WeakPolarHBondContact CE-O 3.23Å; K361-D364 IonicContact NZ-OD1 3.16Å; K361-E365 WeakPolarHBondContact CA-O 3.16Å; K361-Y366 HydrophobicContact CB-CD1 3.85Å; K361-Y366 HydrophobicContact CB-CE1 3.78Å; K361-Y366 HydrophobicContact CD-CE1 4.12Å; K361-Y366 HydrophobicContact CG-CD1 4.09Å; K361-Y366 HydrophobicContact CG-CE1 3.97Å
362	I	88.7	Confident	91.9	Very high	19 Å²	19	46.3 Å²	46.3	10%	0.097	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	112.3	176.7	-58.1	-179.3	0	0	0	107.7	V211 E360 D364 E365 F367 F369 L382	V211-I362 HydrophobicContact CG1-CG2 3.79Å; E360-I362 HydrophobicContact CG-CG1 4.26Å; I362-D364 PolarHBondContact O-N 3.13Å; I362-E365 PolarHBondContact N-O 3.04Å; I362-E365 PolarHBondContact O-N 2.99Å; I362-F367 HydrophobicContact CB-CD2 3.77Å; I362-F367 HydrophobicContact CB-CE2 3.98Å; I362-F367 HydrophobicContact CD1-CD2 4.26Å; I362-F367 HydrophobicContact CG1-CD2 4.13Å; I362-F369 HydrophobicContact CD1-CE2 4.28Å; I362-F369 HydrophobicContact CD1-CZ 3.69Å; I362-L382 HydrophobicContact CD1-CD2 4.3Å
363	G	82	Confident	91.4	Very high	54 Å²	54	46.7 Å²	46.7	56%	0.557	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.5	-123.6	-168.6	0	0	0	0	0	110.6	K361	K361-G363 VanDerWaalsContact CE-O 3.23Å; K361-G363 WeakPolarHBondContact CE-O 3.23Å
364	D	85.9	Confident	90.8	Very high	147 Å²	147	49.8 Å²	49.8	79%	0.786	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-3.5	179.6	-69.6	-39	0	0	0	114.2	K361 I362	K361-D364 IonicContact NZ-OD1 3.16Å; I362-D364 PolarHBondContact O-N 3.13Å
365	E	91	Very high	90.3	Very high	111 Å²	111	55.3 Å²	55.3	52%	0.519	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	148.9	-175.7	-65.2	-174.9	178.5	0	0	112.2	K361 I362 F367	K361-E365 WeakPolarHBondContact CA-O 3.16Å; I362-E365 PolarHBondContact N-O 3.04Å; I362-E365 PolarHBondContact O-N 2.99Å; E365-F367 HydrophobicContact CB-CD2 4.44Å; E365-F367 HydrophobicContact CB-CE2 3.75Å; E365-F367 HydrophobicContact CB-CZ 4.21Å
366	Y	93.1	Very high	89.6	Confident	87 Å²	87	54.2 Å²	54.2	34%	0.341	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	127.4	173.4	-70.1	-75.7	0	0	0	110.3	D230 I359 K361	D230-Y366 HydrophobicContact CB-CD2 4.32Å; D230-Y366 HydrophobicContact CB-CG 4.23Å; D230-Y366 WeakPolarHBondContact OD2-CD2 3.23Å; I359-Y366 HydrophobicContact CG2-CD1 4.1Å; K361-Y366 HydrophobicContact CB-CD1 3.85Å; K361-Y366 HydrophobicContact CB-CE1 3.78Å; K361-Y366 HydrophobicContact CD-CE1 4.12Å; K361-Y366 HydrophobicContact CG-CD1 4.09Å; K361-Y366 HydrophobicContact CG-CE1 3.97Å
367	F	94.6	Very high	89.2	Confident	3 Å²	3	57.3 Å²	57.3	1%	0.013	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	133.1	175.8	-68.9	-88.9	0	0	0	110	E209 V211 V226 L227 N228 I359 E360 I362 E365 F369	E209-F367 HydrophobicContact CG-CE1 4.23Å; V211-F367 HydrophobicContact CB-CZ 4.43Å; V211-F367 HydrophobicContact CG1-CE2 4.01Å; V211-F367 HydrophobicContact CG1-CZ 4.01Å; V211-F367 HydrophobicContact CG2-CE1 3.83Å; V211-F367 HydrophobicContact CG2-CE2 4.11Å; V211-F367 HydrophobicContact CG2-CZ 3.51Å; V226-F367 HydrophobicContact CG1-CB 4.12Å; V226-F367 HydrophobicContact CG1-CD1 3.95Å; V226-F367 HydrophobicContact CG1-CG 4.42Å; L227-F367 CarbonylContact O-C 3.3Å; L227-F367 VanDerWaalsContact O-CA 3.32Å; L227-F367 WeakPolarHBondContact O-CA 3.42Å; N228-F367 HydrophobicContact CB-CD1 4.15Å; N228-F367 HydrophobicContact CB-CE1 3.82Å; I359-F367 CarbonylContact C-O 3.52Å; I359-F367 VanDerWaalsContact CA-O 3.32Å; I359-F367 WeakPolarHBondContact CA-O 3.35Å; E360-F367 PolarHBondContact N-O 3Å; E360-F367 PolarHBondContact O-N 2.92Å; I362-F367 HydrophobicContact CB-CD2 3.77Å; I362-F367 HydrophobicContact CB-CE2 3.98Å; I362-F367 HydrophobicContact CD1-CD2 4.26Å; I362-F367 HydrophobicContact CG1-CD2 4.13Å; E365-F367 HydrophobicContact CB-CD2 4.44Å; E365-F367 HydrophobicContact CB-CE2 3.75Å; E365-F367 HydrophobicContact CB-CZ 4.21Å; F367-F369 HydrophobicContact CB-CD2 4.4Å; F367-F369 HydrophobicContact CB-CE2 3.53Å; F367-F369 HydrophobicContact CB-CZ 3.89Å; F367-F369 WeakPolarHBondContact O-CD2 3.21Å
368	T	94.8	Very high	89	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	132.5	170.1	-71.6	0	0	0	0	109.4	V226 L227 K229 I319 F357 V370	V226-T368 CarbonylContact C-O 3.36Å; V226-T368 VanDerWaalsContact CA-O 3.31Å; V226-T368 WeakPolarHBondContact CA-O 3.44Å; L227-T368 PolarHBondContact N-O 3.28Å; L227-T368 PolarHBondContact O-N 3.25Å; K229-T368 PolarHBondContact O-OG1 3.37Å; I319-T368 HydrophobicContact CD1-CG2 3.57Å; I319-T368 WeakPolarHBondContact CD1-OG1 3.42Å; F357-T368 HydrophobicContact CD2-CG2 3.89Å; F357-T368 HydrophobicContact CE2-CG2 3.35Å; F357-T368 HydrophobicContact CZ-CG2 4.28Å; T368-V370 HydrophobicContact CG2-CG2 4.33Å
369	F	95.3	Very high	88.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.9	175	-63.8	-96.9	0	0	0	109.6	I222 V226 F357 Y358 E360 I362 F367	I222-F369 HydrophobicContact CD1-CD1 3.88Å; I222-F369 HydrophobicContact CD1-CE1 3.55Å; V226-F369 HydrophobicContact CB-CD1 4.43Å; V226-F369 HydrophobicContact CB-CE1 4.28Å; V226-F369 HydrophobicContact CG1-CD1 4.17Å; V226-F369 HydrophobicContact CG1-CE1 3.72Å; V226-F369 HydrophobicContact CG1-CE2 4.45Å; V226-F369 HydrophobicContact CG1-CZ 3.86Å; V226-F369 HydrophobicContact CG2-CD1 3.56Å; V226-F369 HydrophobicContact CG2-CE1 3.52Å; V226-F369 HydrophobicContact CG2-CZ 4.47Å; F357-F369 WeakPolarHBondContact CA-O 3.5Å; Y358-F369 HydrophobicContact CD1-CB 4.05Å; Y358-F369 HydrophobicContact CD2-CB 4.24Å; Y358-F369 AromaticContact CD2-CD2 3.94Å; Y358-F369 HydrophobicContact CD2-CD2 3.94Å; Y358-F369 HydrophobicContact CD2-CG 4.34Å; Y358-F369 HydrophobicContact CE1-CB 3.67Å; Y358-F369 HydrophobicContact CE1-CG 4.2Å; Y358-F369 HydrophobicContact CE2-CB 3.86Å; Y358-F369 HydrophobicContact CE2-CD1 4.45Å; Y358-F369 AromaticContact CE2-CD2 3.39Å; Y358-F369 HydrophobicContact CE2-CD2 3.39Å; Y358-F369 HydrophobicContact CE2-CE2 4.11Å; Y358-F369 AromaticContact CE2-CG 3.63Å; Y358-F369 HydrophobicContact CE2-CG 3.63Å; Y358-F369 HydrophobicContact CG-CB 4.32Å; Y358-F369 AromaticContact CZ-CD2 3.84Å; Y358-F369 AromaticContact CZ-CG 3.54Å; Y358-F369 PolarHBondContact N-O 2.98Å; Y358-F369 VanDerWaalsContact N-O 3.08Å; Y358-F369 PolarHBondContact O-N 2.96Å; E360-F369 HydrophobicContact CB-CD2 4.19Å; E360-F369 HydrophobicContact CB-CE2 3.79Å; I362-F369 HydrophobicContact CD1-CE2 4.28Å; I362-F369 HydrophobicContact CD1-CZ 3.69Å; F367-F369 HydrophobicContact CB-CD2 4.4Å; F367-F369 HydrophobicContact CB-CE2 3.53Å; F367-F369 HydrophobicContact CB-CZ 3.89Å; F367-F369 WeakPolarHBondContact O-CD2 3.21Å
370	V	94.1	Very high	89	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	108	169.8	-177.6	0	0	0	0	107.6	G224 V225 F298 L330 V333 T334 A354 F357 T368	G224-V370 CarbonylContact C-O 3.16Å; G224-V370 WeakPolarHBondContact CA-O 3.46Å; V225-V370 PolarHBondContact N-O 3.25Å; V225-V370 PolarHBondContact O-N 2.92Å; F298-V370 HydrophobicContact CE1-CG2 4.48Å; F298-V370 HydrophobicContact CE2-CG2 4.16Å; F298-V370 HydrophobicContact CZ-CG2 3.53Å; L330-V370 HydrophobicContact CD2-CB 4.05Å; L330-V370 HydrophobicContact CD2-CG1 4.21Å; L330-V370 HydrophobicContact CD2-CG2 3.84Å; V333-V370 HydrophobicContact CG1-CG1 4.26Å; T334-V370 HydrophobicContact CG2-CG1 4Å; A354-V370 HydrophobicContact CB-CG1 4.05Å; F357-V370 HydrophobicContact CD2-CG2 4.18Å; T368-V370 HydrophobicContact CG2-CG2 4.33Å
371	I	93.5	Very high	89	Confident	28 Å²	28	50.6 Å²	50.6	14%	0.144	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	143.9	-174.4	-57.8	-175	0	0	0	110.3	I222 A354 S355 E356 Y358	I222-I371 HydrophobicContact CG2-CG1 4.33Å; A354-I371 CarbonylContact C-O 3.53Å; A354-I371 WeakPolarHBondContact CA-O 3.48Å; S355-I371 PolarHBondContact N-O 2.97Å; S355-I371 PolarHBondContact OG-O 3.17Å; E356-I371 PolarHBondContact N-O 3Å; E356-I371 PolarHBondContact O-N 3.36Å; Y358-I371 HydrophobicContact CE1-CD1 3.63Å; Y358-I371 HydrophobicContact CE1-CG1 4.38Å
372	N	90.4	Very high	89.2	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.021	24%	0.235	C	C	.	.			trans	-134.4	108.8	166.2	177.7	-9.9	0	0	0	109.2	K223 V333 K353 K374 D375 A376	K223-N372 PolarHBondContact O-N 2.98Å; V333-N372 HydrophobicContact CG1-CB 3.71Å; V333-N372 PolarHBondContact O-ND2 3.26Å; K353-N372 VanDerWaalsContact O-CG 3.23Å; K353-N372 PolarHBondContact O-ND2 3.27Å; K353-N372 PolarHBondContact O-OD1 3.01Å; N372-K374 VanDerWaalsContact C-N 3.33Å; N372-K374 PolarHBondContact O-N 3.36Å; N372-K374 PolarHBondContact OD1-N 2.94Å; N372-D375 PolarHBondContact OD1-N 3.02Å; N372-A376 HydrophobicContact CB-CB 4.25Å; N372-A376 WeakPolarHBondContact O-CB 3.33Å
373	D	82.5	Confident	89.4	Confident	101 Å²	101	44.9 Å²	44.9	54%	0.54	23%	0.23	S	C	.	.	S	Bend	trans	-77.4	-17.6	-175.9	-61.2	-56.8	0	0	0	114.2	S355	S355-D373 VanDerWaalsContact CB-OD2 3.29Å; S355-D373 WeakPolarHBondContact CB-OD2 3.46Å; S355-D373 PolarHBondContact OG-OD2 2.99Å
374	K	77.6	Confident	89.8	Confident	184 Å²	184	43.7 Å²	43.7	80%	0.8	21%	0.208	S	C	*	.	S	Bend	trans	-91.9	-65.9	-169.8	-64.3	-179.2	179.9	177.6	0	112	N372	N372-K374 VanDerWaalsContact C-N 3.33Å; N372-K374 PolarHBondContact O-N 3.36Å; N372-K374 PolarHBondContact OD1-N 2.94Å
375	D	80.1	Confident	90	Very high	116 Å²	116	36.7 Å²	36.7	62%	0.62	17%	0.171	S	C	*	.			trans	-133.7	48.6	-167.6	-67.4	-35.7	0	0	0	111.3	N372 K377	N372-D375 PolarHBondContact OD1-N 3.02Å; D375-K377 PolarHBondContact O-N 3.17Å
376	A	77.2	Confident	89.8	Confident	3 Å²	3	34.6 Å²	34.6	3%	0.025	17%	0.167	C	C	.	.			trans	-68.2	100.1	176.1	0	0	0	0	0	110.4	K223 N372 A378	K223-A376 HydrophobicContact CB-CB 4.01Å; N372-A376 HydrophobicContact CB-CB 4.25Å; N372-A376 WeakPolarHBondContact O-CB 3.33Å; A376-A378 PolarHBondContact O-N 3.16Å
377	K	84.8	Confident	89.5	Confident	100 Å²	100	34.9 Å²	34.9	44%	0.435	18%	0.175	S	C	.	.	S	Bend	trans	-77.3	0.1	172.1	-63.8	-170.7	178.2	-170.2	0	113.7	I192 K332 D375	I192-K377 HydrophobicContact CD1-CD 4.42Å; K332-K377 HydrophobicContact CB-CB 4.34Å; D375-K377 PolarHBondContact O-N 3.17Å
378	A	91.1	Very high	89.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	-143.4	147.3	174.5	0	0	0	0	0	109.3	Y205 R329 K332 V333 A376	Y205-A378 HydrophobicContact CD1-CB 4.31Å; Y205-A378 CarbonylContact O-C 3.6Å; Y205-A378 VanDerWaalsContact O-CA 3.28Å; Y205-A378 WeakPolarHBondContact O-CA 3.28Å; Y205-A378 WeakPolarHBondContact O-CB 3.48Å; R329-A378 HydrophobicContact CB-CB 4.34Å; R329-A378 HydrophobicContact CG-CB 4.46Å; K332-A378 HydrophobicContact CB-CB 4.35Å; V333-A378 HydrophobicContact CG2-CB 3.96Å; A376-A378 PolarHBondContact O-N 3.16Å
379	C	93.3	Very high	88.6	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.007	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	160.6	-175.8	64.5	0	0	0	0	111.6	L189 Y205 R207 L221 I222 G224	L189-C379 HydrophobicContact CD1-CB 4.4Å; Y205-C379 PolarHBondContact O-N 2.7Å; R207-C379 PolarHBondContact N-O 2.86Å; L221-C379 HydrophobicContact CD1-CB 3.74Å; I222-C379 WeakPolarHBondContact O-CA 3.39Å; I222-C379 WeakPolarHBondContact O-CB 3.47Å; G224-C379 CarbonylContact O-C 3.54Å; G224-C379 VanDerWaalsContact O-C 3.25Å; G224-C379 WeakPolarHBondContact O-CA 3.33Å
380	T	94.5	Very high	88.1	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	123.4	173.9	-54.8	0	0	0	0	109.5	R207 E209 I222 G224 V225 V226	R207-T380 HydrophobicContact CB-CG2 4.08Å; R207-T380 HydrophobicContact CG-CG2 4.01Å; R207-T380 CarbonylContact O-C 3.54Å; R207-T380 VanDerWaalsContact O-CA 3.27Å; R207-T380 WeakPolarHBondContact O-CA 3.39Å; E209-T380 HydrophobicContact CB-CG2 3.94Å; I222-T380 WeakPolarHBondContact CB-O 3.41Å; I222-T380 PolarHBondContact N-O 3.35Å; I222-T380 PolarHBondContact O-N 3.13Å; G224-T380 WeakPolarHBondContact O-CB 3.4Å; G224-T380 PolarHBondContact O-N 2.88Å; G224-T380 PolarHBondContact O-OG1 2.84Å; V225-T380 WeakPolarHBondContact CA-OG1 3.25Å; V226-T380 HydrophobicContact CB-CG2 3.87Å; V226-T380 HydrophobicContact CG2-CG2 3.81Å; V226-T380 PolarHBondContact N-OG1 3.4Å
381	L	94.1	Very high	87.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	106.2	170.9	-67.3	165.7	0	0	0	107.4	M182 A186 V206 R207 V208 E209 L221 L398 L402	M182-L381 HydrophobicContact CB-CD2 3.95Å; M182-L381 HydrophobicContact CG-CD2 4.47Å; M182-L381 HydrophobicContact SD-CD2 4.41Å; A186-L381 HydrophobicContact CB-CD1 4.37Å; A186-L381 HydrophobicContact CB-CD2 4.35Å; V206-L381 HydrophobicContact CG1-CD1 3.4Å; V206-L381 VanDerWaalsContact CG1-CD1 3.4Å; V206-L381 HydrophobicContact CG1-CG 4.05Å; R207-L381 PolarHBondContact O-N 3.03Å; V208-L381 WeakPolarHBondContact CA-O 3.15Å; V208-L381 HydrophobicContact CG2-CB 4.41Å; V208-L381 HydrophobicContact CG2-CD1 4.43Å; E209-L381 PolarHBondContact N-O 3.28Å; L221-L381 HydrophobicContact CB-CD2 4.11Å; L221-L381 HydrophobicContact CD1-CD2 3.55Å; L221-L381 HydrophobicContact CD1-CG 4.19Å; L221-L381 HydrophobicContact CG-CD2 4.41Å; L381-L398 HydrophobicContact CB-CD2 4.07Å; L381-L398 HydrophobicContact CD1-CD1 4.23Å; L381-L398 HydrophobicContact CD1-CD2 3.7Å; L381-L398 HydrophobicContact CD1-CG 4.12Å; L381-L398 HydrophobicContact CG-CD2 4.37Å; L381-L402 HydrophobicContact CD1-CD1 3.8Å; L381-L402 HydrophobicContact CD1-CD2 4.3Å
382	L	93.8	Very high	87.5	Confident	4 Å²	4	53 Å²	53	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	112.8	175.4	179.5	67.6	0	0	0	108.4	E209 V211 S219 K220 I222 I362	E209-L382 HydrophobicContact CB-CD1 4.16Å; E209-L382 HydrophobicContact CG-CD1 4.24Å; V211-L382 HydrophobicContact CB-CD1 4.34Å; V211-L382 HydrophobicContact CG2-CD1 3.55Å; S219-L382 CarbonylContact C-O 3.58Å; S219-L382 WeakPolarHBondContact CA-O 3.15Å; S219-L382 WeakPolarHBondContact CB-O 3.37Å; K220-L382 HydrophobicContact CG-CB 4.42Å; K220-L382 HydrophobicContact CG-CD2 4.38Å; K220-L382 PolarHBondContact N-O 3.39Å; K220-L382 PolarHBondContact O-N 3.13Å; I222-L382 HydrophobicContact CD1-CB 3.89Å; I222-L382 HydrophobicContact CD1-CD2 4.14Å; I362-L382 HydrophobicContact CD1-CD2 4.3Å
383	L	93.3	Very high	87.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	127.9	176.9	-63.8	-176.4	0	0	0	110.7	M182 V208 E209 V211 L391 M394 D395 L398	M182-L383 HydrophobicContact CE-CD2 4.19Å; V208-L383 HydrophobicContact CG1-CD1 3.54Å; V208-L383 HydrophobicContact CG1-CG 3.95Å; E209-L383 PolarHBondContact O-N 3.33Å; V211-L383 PolarHBondContact N-O 2.82Å; L383-L391 HydrophobicContact CB-CD2 3.94Å; L383-M394 HydrophobicContact CD1-CB 4.35Å; L383-D395 HydrophobicContact CD1-CB 4.24Å; L383-L398 HydrophobicContact CD1-CD2 3.9Å; L383-L398 HydrophobicContact CD2-CD2 3.96Å; L383-L398 HydrophobicContact CG-CD2 4.2Å
384	R	91.1	Very high	87.4	Confident	28 Å²	28	49.5 Å²	49.5	11%	0.106	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	141	177.6	-65.3	-75.9	-75.9	171.8	-5.5	108.7	P212 G213 Q215 E218 S219	P212-R384 PolarHBondContact O-NH1 3.27Å; G213-R384 VanDerWaalsContact O-CZ 3.27Å; G213-R384 PolarHBondContact O-NE 3.06Å; G213-R384 PolarHBondContact O-NH1 3.2Å; Q215-R384 VanDerWaalsContact O-CB 3.32Å; Q215-R384 WeakPolarHBondContact O-CB 3.44Å; E218-R384 HydrophobicContact CB-CB 4.01Å; E218-R384 HydrophobicContact CB-CG 3.93Å; E218-R384 IonicContact OE2-CZ 2.88Å; E218-R384 IonicContact OE2-NE 3.15Å; E218-R384 PolarHBondContact OE2-NE 3.17Å; E218-R384 IonicContact OE2-NH2 2.78Å; E218-R384 PolarHBondContact OE2-NH2 3.27Å; S219-R384 PolarHBondContact OG-N 2.81Å; S219-R384 PolarHBondContact OG-O 3.02Å
385	G	89.1	Confident	87.9	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.8	152.3	-173.8	0	0	0	0	0	111.4	G213 N387	G213-G385 WeakPolarHBondContact CA-O 3.16Å; G213-G385 PolarHBondContact N-O 2.74Å; G213-G385 PolarHBondContact O-N 3.1Å; G385-N387 PolarHBondContact O-N 2.62Å
386	P	88.3	Confident	88.1	Confident	68 Å²	68	38.3 Å²	38.3	44%	0.442	19%	0.188	S	C	.	.	S	Bend	trans	-63.5	-43	-169.7	23.1	-33.2	0	0	0	112.3	I390	P386-I390 HydrophobicContact CG-CD1 3.74Å
387	N	85.9	Confident	88.5	Confident	93 Å²	93	38.3 Å²	38.3	50%	0.497	19%	0.188	S	C	.	.	S	Bend	trans	-128.8	155.4	-175.1	-64.6	-6.9	0	0	0	111	G385 D389 I390 L391	G385-N387 PolarHBondContact O-N 2.62Å; N387-D389 VanDerWaalsContact C-N 3.3Å; N387-D389 PolarHBondContact O-N 3.19Å; N387-I390 HydrophobicContact CB-CD1 4.49Å; N387-I390 PolarHBondContact O-N 3.09Å; N387-L391 PolarHBondContact O-N 2.98Å; N387-L391 VanDerWaalsContact O-N 3.11Å
388	K	87.4	Confident	88.7	Confident	138 Å²	138	33.6 Å²	33.6	60%	0.6	17%	0.167	S	C	*	.	H	α-helix	trans	-61.2	-36.5	178.5	-68.7	-176.8	-179.6	178.7	0	112.8	P212 L391 M392	P212-K388 HydrophobicContact CB-CG 4.48Å; K388-L391 WeakPolarHBondContact O-CB 3.38Å; K388-L391 PolarHBondContact O-N 3.2Å; K388-M392 WeakPolarHBondContact O-CG 3.37Å; K388-M392 PolarHBondContact O-N 2.91Å
389	D	83.6	Confident	88.6	Confident	100 Å²	100	37.4 Å²	37.4	54%	0.535	19%	0.185	S	C	.	.	H	α-helix	trans	-65.5	-42.8	-178.3	-50.2	-40.7	0	0	0	111.4	N387 L391 M392 E393	N387-D389 VanDerWaalsContact C-N 3.3Å; N387-D389 PolarHBondContact O-N 3.19Å; D389-L391 VanDerWaalsContact C-N 3.33Å; D389-L391 PolarHBondContact O-N 3.28Å; D389-M392 PolarHBondContact O-N 3.39Å; D389-E393 PolarHBondContact O-N 3.29Å; D389-E393 VanDerWaalsContact O-N 3.08Å
390	I	85.2	Confident	88.3	Confident	72 Å²	72	38.5 Å²	38.5	37%	0.369	19%	0.191	S	C	.	.	H	α-helix	trans	-63.1	-43	173.9	-67.3	166.1	0	0	0	109.7	P386 N387 M392 E393 M394	P386-I390 HydrophobicContact CG-CD1 3.74Å; N387-I390 HydrophobicContact CB-CD1 4.49Å; N387-I390 PolarHBondContact O-N 3.09Å; I390-M392 VanDerWaalsContact C-N 3.29Å; I390-M392 PolarHBondContact O-N 3.16Å; I390-E393 PolarHBondContact O-N 3.43Å; I390-M394 HydrophobicContact CG2-CG 4.15Å; I390-M394 HydrophobicContact CG2-SD 3.77Å; I390-M394 WeakPolarHBondContact O-CB 3.34Å; I390-M394 WeakPolarHBondContact O-CG 3.16Å; I390-M394 PolarHBondContact O-N 2.97Å
391	L	88.6	Confident	88.1	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-61.7	-33.8	175.8	-74.9	172.2	0	0	0	113.5	K210 P212 L383 N387 K388 D389 M394 D395	K210-L391 HydrophobicContact CB-CD1 4.42Å; K210-L391 HydrophobicContact CD-CB 4.49Å; P212-L391 HydrophobicContact CB-CD1 4.32Å; L383-L391 HydrophobicContact CB-CD2 3.94Å; N387-L391 PolarHBondContact O-N 2.98Å; N387-L391 VanDerWaalsContact O-N 3.11Å; K388-L391 WeakPolarHBondContact O-CB 3.38Å; K388-L391 PolarHBondContact O-N 3.2Å; D389-L391 VanDerWaalsContact C-N 3.33Å; D389-L391 PolarHBondContact O-N 3.28Å; L391-M394 HydrophobicContact CD2-SD 4.17Å; L391-M394 PolarHBondContact O-N 3.36Å; L391-D395 WeakPolarHBondContact O-CB 3.24Å; L391-D395 PolarHBondContact O-N 2.92Å
392	M	86.5	Confident	88	Confident	97 Å²	97	38.6 Å²	38.6	48%	0.478	19%	0.192	S	C	.	.	H	α-helix	trans	-68.7	-44.2	175.6	-70.9	-171.8	-170.7	0	0	111.4	K388 D389 I390 M394 D395 R396	K388-M392 WeakPolarHBondContact O-CG 3.37Å; K388-M392 PolarHBondContact O-N 2.91Å; D389-M392 PolarHBondContact O-N 3.39Å; I390-M392 VanDerWaalsContact C-N 3.29Å; I390-M392 PolarHBondContact O-N 3.16Å; M392-M394 PolarHBondContact O-N 2.93Å; M392-D395 PolarHBondContact O-N 3.26Å; M392-R396 WeakPolarHBondContact O-CG 3.28Å; M392-R396 PolarHBondContact O-N 2.97Å; M392-R396 VanDerWaalsContact O-N 3.15Å
393	E	82.7	Confident	87.9	Confident	30 Å²	30	40.2 Å²	40.2	14%	0.14	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-32.5	174.6	-165	67.4	173.1	0	0	111.3	T63 D389 I390 R396 N397	T63-E393 PolarHBondContact OG1-OE1 3.26Å; T63-E393 PolarHBondContact OG1-OE2 3.36Å; D389-E393 PolarHBondContact O-N 3.29Å; D389-E393 VanDerWaalsContact O-N 3.08Å; I390-E393 PolarHBondContact O-N 3.43Å; E393-R396 IonicContact OE2-NH1 2.72Å; E393-R396 PolarHBondContact OE2-NH1 2.82Å; E393-R396 VanDerWaalsContact OE2-NH1 3.16Å; E393-N397 WeakPolarHBondContact O-CB 3.39Å; E393-N397 PolarHBondContact O-N 3.48Å; E393-N397 PolarHBondContact O-ND2 2.95Å
394	M	86.9	Confident	87.7	Confident	3 Å²	3	40.2 Å²	40.2	2%	0.015	20%	0.199	C	C	.	.	H	α-helix	trans	-67.3	-42.7	175.8	-73	170.7	77.8	0	0	112.8	W175 I216 L383 I390 L391 M392 L398	W175-M394 HydrophobicContact CD2-CE 3.97Å; W175-M394 HydrophobicContact CD2-CG 4.01Å; W175-M394 HydrophobicContact CE3-CG 3.86Å; W175-M394 HydrophobicContact CG-CE 4.31Å; W175-M394 HydrophobicContact CH2-CB 3.47Å; W175-M394 VanDerWaalsContact CH2-CB 3.47Å; W175-M394 HydrophobicContact CH2-CG 3.61Å; W175-M394 WeakPolarHBondContact CH2-O 3.23Å; W175-M394 HydrophobicContact CZ2-CB 3.4Å; W175-M394 VanDerWaalsContact CZ2-CB 3.4Å; W175-M394 HydrophobicContact CZ2-CE 3.83Å; W175-M394 HydrophobicContact CZ2-CG 3.54Å; W175-M394 WeakPolarHBondContact CZ2-O 3.4Å; W175-M394 HydrophobicContact CZ3-CB 4.01Å; W175-M394 HydrophobicContact CZ3-CG 3.66Å; I216-M394 HydrophobicContact CB-CE 4.43Å; I216-M394 HydrophobicContact CG1-CE 4.25Å; I216-M394 HydrophobicContact CG1-SD 4.39Å; I216-M394 HydrophobicContact CG2-CE 3.67Å; L383-M394 HydrophobicContact CD1-CB 4.35Å; I390-M394 HydrophobicContact CG2-CG 4.15Å; I390-M394 HydrophobicContact CG2-SD 3.77Å; I390-M394 WeakPolarHBondContact O-CB 3.34Å; I390-M394 WeakPolarHBondContact O-CG 3.16Å; I390-M394 PolarHBondContact O-N 2.97Å; L391-M394 HydrophobicContact CD2-SD 4.17Å; L391-M394 PolarHBondContact O-N 3.36Å; M392-M394 PolarHBondContact O-N 2.93Å; M394-L398 VanDerWaalsContact O-CB 3.28Å; M394-L398 WeakPolarHBondContact O-CB 3.43Å; M394-L398 PolarHBondContact O-N 3.09Å
395	D	88.7	Confident	87.7	Confident	17 Å²	17	38.9 Å²	38.9	9%	0.091	19%	0.194	C	C	.	.	H	α-helix	trans	-62.3	-43.4	177.3	-178.8	22	0	0	0	111.6	V208 K210 L383 L391 M392 L398 Q399	V208-D395 WeakPolarHBondContact CG1-OD1 3.45Å; K210-D395 HydrophobicContact CD-CB 3.92Å; K210-D395 IonicContact NZ-OD2 3.75Å; K210-D395 PolarHBondContact NZ-OD2 3.33Å; L383-D395 HydrophobicContact CD1-CB 4.24Å; L391-D395 WeakPolarHBondContact O-CB 3.24Å; L391-D395 PolarHBondContact O-N 2.92Å; M392-D395 PolarHBondContact O-N 3.26Å; D395-L398 PolarHBondContact O-N 3.01Å; D395-Q399 VanDerWaalsContact O-CG 3.28Å; D395-Q399 WeakPolarHBondContact O-CG 3.32Å; D395-Q399 PolarHBondContact O-N 2.87Å; D395-Q399 PolarHBondContact OD1-NE2 2.86Å
396	R	84.6	Confident	87.8	Confident	47 Å²	47	41.8 Å²	41.8	18%	0.177	21%	0.205	C	C	.	.	H	α-helix	trans	-58.5	-55.2	176.1	-71.2	172.9	-176.9	168.4	-4.3	112	M392 E393 L398 Q399 D400	M392-R396 WeakPolarHBondContact O-CG 3.28Å; M392-R396 PolarHBondContact O-N 2.97Å; M392-R396 VanDerWaalsContact O-N 3.15Å; E393-R396 IonicContact OE2-NH1 2.72Å; E393-R396 PolarHBondContact OE2-NH1 2.82Å; E393-R396 VanDerWaalsContact OE2-NH1 3.16Å; R396-L398 VanDerWaalsContact C-N 3.26Å; R396-L398 PolarHBondContact O-N 3.46Å; R396-Q399 WeakPolarHBondContact O-CA 3.32Å; R396-Q399 WeakPolarHBondContact O-CB 3.48Å; R396-Q399 PolarHBondContact O-N 3.01Å; R396-D400 PolarHBondContact O-N 2.92Å
397	N	85.3	Confident	88	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-60.8	-33.9	-179.9	-80.8	-36.7	0	0	0	113.3	N170 I171 W175 E393 A401	N170-N397 WeakPolarHBondContact CB-OD1 3.35Å; N170-N397 PolarHBondContact ND2-OD1 2.97Å; I171-N397 HydrophobicContact CD1-CB 3.63Å; I171-N397 HydrophobicContact CG1-CB 3.76Å; W175-N397 HydrophobicContact CH2-CB 3.63Å; W175-N397 HydrophobicContact CZ3-CB 3.85Å; E393-N397 WeakPolarHBondContact O-CB 3.39Å; E393-N397 PolarHBondContact O-N 3.48Å; E393-N397 PolarHBondContact O-ND2 2.95Å; N397-A401 WeakPolarHBondContact O-CB 3.47Å; N397-A401 PolarHBondContact O-N 2.84Å; N397-A401 VanDerWaalsContact O-N 3.1Å
398	L	89.4	Confident	88.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-69.6	-37.6	172.5	179.9	67.3	0	0	0	111.9	V179 M182 V208 L381 L383 M394 D395 R396 A401 L402	V179-L398 HydrophobicContact CG1-CD1 3.86Å; M182-L398 HydrophobicContact CE-CD1 4.47Å; V208-L398 HydrophobicContact CG1-CD2 4.37Å; V208-L398 HydrophobicContact CG2-CD2 4.24Å; L381-L398 HydrophobicContact CB-CD2 4.07Å; L381-L398 HydrophobicContact CD1-CD1 4.23Å; L381-L398 HydrophobicContact CD1-CD2 3.7Å; L381-L398 HydrophobicContact CD1-CG 4.12Å; L381-L398 HydrophobicContact CG-CD2 4.37Å; L383-L398 HydrophobicContact CD1-CD2 3.9Å; L383-L398 HydrophobicContact CD2-CD2 3.96Å; L383-L398 HydrophobicContact CG-CD2 4.2Å; M394-L398 VanDerWaalsContact O-CB 3.28Å; M394-L398 WeakPolarHBondContact O-CB 3.43Å; M394-L398 PolarHBondContact O-N 3.09Å; D395-L398 PolarHBondContact O-N 3.01Å; R396-L398 VanDerWaalsContact C-N 3.26Å; R396-L398 PolarHBondContact O-N 3.46Å; L398-A401 WeakPolarHBondContact O-CB 3.41Å; L398-A401 PolarHBondContact O-N 3.32Å; L398-L402 HydrophobicContact CG-CD1 4.21Å; L398-L402 VanDerWaalsContact O-CG 3.23Å; L398-L402 WeakPolarHBondContact O-CG 3.45Å; L398-L402 PolarHBondContact O-N 3.1Å
399	Q	88.8	Confident	88.3	Confident	81 Å²	81	28.5 Å²	28.5	38%	0.379	14%	0.136	S	C	.	.	H	α-helix	trans	-62.7	-45.5	174.3	-72.2	172.7	25.2	0	0	110.7	D395 R396 A401 L402 H403	D395-Q399 VanDerWaalsContact O-CG 3.28Å; D395-Q399 WeakPolarHBondContact O-CG 3.32Å; D395-Q399 PolarHBondContact O-N 2.87Å; D395-Q399 PolarHBondContact OD1-NE2 2.86Å; R396-Q399 WeakPolarHBondContact O-CA 3.32Å; R396-Q399 WeakPolarHBondContact O-CB 3.48Å; R396-Q399 PolarHBondContact O-N 3.01Å; Q399-A401 VanDerWaalsContact C-N 3.3Å; Q399-A401 PolarHBondContact O-N 2.92Å; Q399-L402 PolarHBondContact O-N 3.28Å; Q399-H403 PolarHBondContact O-N 2.73Å; Q399-H403 PolarHBondContact O-ND1 2.75Å
400	D	87	Confident	88.5	Confident	24 Å²	24	27.8 Å²	27.8	13%	0.128	13%	0.132	C	C	.	.	H	α-helix	trans	-58.5	-45.3	176.3	-59.3	-10.3	0	0	0	110.6	R396 L402 H403 V404	R396-D400 PolarHBondContact O-N 2.92Å; D400-L402 PolarHBondContact O-N 3.38Å; D400-H403 PolarHBondContact O-N 2.82Å; D400-V404 VanDerWaalsContact O-CG2 3.29Å; D400-V404 WeakPolarHBondContact O-CG2 3.42Å; D400-V404 PolarHBondContact O-N 3.15Å
401	A	89.7	Confident	88.6	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-53.9	-50.1	174.3	0	0	0	0	0	112.8	I167 V179 A183 N397 L398 Q399 H403 V404 V405	I167-A401 HydrophobicContact CD1-CB 3.22Å; I167-A401 HydrophobicContact CG1-CB 4.08Å; V179-A401 HydrophobicContact CG1-CB 3.82Å; A183-A401 HydrophobicContact CB-CB 3.82Å; N397-A401 WeakPolarHBondContact O-CB 3.47Å; N397-A401 PolarHBondContact O-N 2.84Å; N397-A401 VanDerWaalsContact O-N 3.1Å; L398-A401 WeakPolarHBondContact O-CB 3.41Å; L398-A401 PolarHBondContact O-N 3.32Å; Q399-A401 VanDerWaalsContact C-N 3.3Å; Q399-A401 PolarHBondContact O-N 2.92Å; A401-H403 VanDerWaalsContact C-N 3.34Å; A401-H403 PolarHBondContact O-N 3.42Å; A401-V404 PolarHBondContact O-N 3.5Å; A401-V405 VanDerWaalsContact O-CG2 3.31Å; A401-V405 WeakPolarHBondContact O-CG2 3.42Å; A401-V405 PolarHBondContact O-N 2.83Å
402	L	92.1	Very high	88.6	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-63.1	-41	-178.7	-72	166.1	0	0	0	111.5	A183 A186 I187 I202 V206 L381 L398 Q399 D400 R406	A183-L402 HydrophobicContact CB-CD2 4.01Å; A183-L402 HydrophobicContact CB-CG 4.33Å; A186-L402 HydrophobicContact CB-CD2 3.89Å; I187-L402 HydrophobicContact CD1-CB 4.43Å; I187-L402 HydrophobicContact CD1-CD2 4.01Å; I187-L402 HydrophobicContact CG1-CD2 3.95Å; I202-L402 HydrophobicContact CD1-CB 4.06Å; I202-L402 HydrophobicContact CG2-CB 4.19Å; I202-L402 HydrophobicContact CG2-CD1 4.03Å; V206-L402 HydrophobicContact CG1-CD1 4.06Å; L381-L402 HydrophobicContact CD1-CD1 3.8Å; L381-L402 HydrophobicContact CD1-CD2 4.3Å; L398-L402 HydrophobicContact CG-CD1 4.21Å; L398-L402 VanDerWaalsContact O-CG 3.23Å; L398-L402 WeakPolarHBondContact O-CG 3.45Å; L398-L402 PolarHBondContact O-N 3.1Å; Q399-L402 PolarHBondContact O-N 3.28Å; D400-L402 PolarHBondContact O-N 3.38Å; L402-R406 WeakPolarHBondContact O-CB 3.41Å; L402-R406 PolarHBondContact O-N 3.03Å
403	H	91	Very high	88.8	Confident	37 Å²	37	27 Å²	27	17%	0.171	13%	0.129	C	C	.	.	H	α-helix	trans	-69.1	-40.7	178.2	-69.4	97.5	0	0	0	112.2	T94 Q399 D400 A401 V405 R406 N407	T94-H403 WeakPolarHBondContact O-CB 3.38Å; Q399-H403 PolarHBondContact O-N 2.73Å; Q399-H403 PolarHBondContact O-ND1 2.75Å; D400-H403 PolarHBondContact O-N 2.82Å; A401-H403 VanDerWaalsContact C-N 3.34Å; A401-H403 PolarHBondContact O-N 3.42Å; H403-V405 PolarHBondContact O-N 2.85Å; H403-R406 WeakPolarHBondContact O-CB 3.28Å; H403-R406 PolarHBondContact O-N 2.96Å; H403-N407 PolarHBondContact O-N 3.36Å; H403-N407 PolarHBondContact O-ND2 3.43Å
404	V	90.2	Very high	89.3	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59	-48.8	174.2	169.5	0	0	0	0	110.7	D96 V162 V163 C166 D400 A401 R406 N407 V408 P505	D96-V404 HydrophobicContact CB-CG2 4Å; V162-V404 HydrophobicContact CG1-CG1 4.37Å; V163-V404 HydrophobicContact CG2-CG1 4.48Å; C166-V404 HydrophobicContact CB-CB 4.48Å; C166-V404 HydrophobicContact CB-CG1 4.1Å; C166-V404 HydrophobicContact CB-CG2 3.73Å; D400-V404 VanDerWaalsContact O-CG2 3.29Å; D400-V404 WeakPolarHBondContact O-CG2 3.42Å; D400-V404 PolarHBondContact O-N 3.15Å; A401-V404 PolarHBondContact O-N 3.5Å; V404-R406 VanDerWaalsContact C-N 3.35Å; V404-R406 PolarHBondContact O-N 3.28Å; V404-N407 PolarHBondContact O-N 3.48Å; V404-V408 WeakPolarHBondContact O-CG2 3.35Å; V404-V408 PolarHBondContact O-N 2.9Å; V404-V408 VanDerWaalsContact O-N 3.07Å; V404-P505 HydrophobicContact CG1-CG 3.93Å
405	V	91.4	Very high	89.5	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.5	-44.8	176.7	177.8	0	0	0	0	110.7	L159 V163 A183 V184 I187 A401 H403 N407 V408 F409	L159-V405 HydrophobicContact CD2-CG1 4.41Å; V163-V405 HydrophobicContact CG1-CG2 4.42Å; V163-V405 HydrophobicContact CG2-CG2 3.34Å; A183-V405 HydrophobicContact CB-CG2 4.36Å; V184-V405 HydrophobicContact CG2-CG2 4.12Å; I187-V405 HydrophobicContact CB-CB 4.49Å; I187-V405 HydrophobicContact CB-CG1 3.69Å; I187-V405 HydrophobicContact CG1-CB 4Å; I187-V405 HydrophobicContact CG1-CG1 3.75Å; I187-V405 HydrophobicContact CG2-CG1 3.82Å; A401-V405 VanDerWaalsContact O-CG2 3.31Å; A401-V405 WeakPolarHBondContact O-CG2 3.42Å; A401-V405 PolarHBondContact O-N 2.83Å; H403-V405 PolarHBondContact O-N 2.85Å; V405-N407 VanDerWaalsContact C-N 3.32Å; V405-N407 PolarHBondContact O-N 3.44Å; V405-V408 PolarHBondContact O-N 3.35Å; V405-F409 HydrophobicContact CG1-CD2 3.78Å; V405-F409 HydrophobicContact CG1-CE2 3.75Å; V405-F409 VanDerWaalsContact O-CD2 3.29Å; V405-F409 WeakPolarHBondContact O-CD2 3.4Å; V405-F409 PolarHBondContact O-N 3.08Å
406	R	91.6	Very high	89.6	Confident	62 Å²	62	25 Å²	25	23%	0.234	12%	0.12	C	C	.	.	H	α-helix	trans	-55.6	-45.6	174.6	167	-178.6	176.9	-110.9	2.3	111.8	E93 I187 I200 I202 L402 H403 V404 V408 F409 L410	E93-R406 PolarHBondContact O-NH1 2.95Å; I187-R406 HydrophobicContact CD1-CB 4.45Å; I200-R406 HydrophobicContact CB-CG 4.23Å; I200-R406 HydrophobicContact CD1-CG 4.42Å; I200-R406 HydrophobicContact CG2-CB 4.31Å; I200-R406 HydrophobicContact CG2-CG 4.14Å; I200-R406 PolarHBondContact O-NE 3.45Å; I202-R406 HydrophobicContact CD1-CB 3.86Å; I202-R406 HydrophobicContact CD1-CG 4.33Å; L402-R406 WeakPolarHBondContact O-CB 3.41Å; L402-R406 PolarHBondContact O-N 3.03Å; H403-R406 WeakPolarHBondContact O-CB 3.28Å; H403-R406 PolarHBondContact O-N 2.96Å; V404-R406 VanDerWaalsContact C-N 3.35Å; V404-R406 PolarHBondContact O-N 3.28Å; R406-V408 VanDerWaalsContact C-N 3.35Å; R406-V408 PolarHBondContact O-N 3.21Å; R406-F409 PolarHBondContact O-N 3.26Å; R406-L410 HydrophobicContact CG-CD1 3.95Å; R406-L410 HydrophobicContact CG-CG 4.46Å; R406-L410 WeakPolarHBondContact O-CG 3.46Å; R406-L410 PolarHBondContact O-N 2.82Å
407	N	91.2	Very high	89.9	Confident	4 Å²	4	22.7 Å²	22.7	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-63.3	-41.2	-178.5	-67.2	-26.2	0	0	0	111.8	T94 H403 V404 V405 L410 N411 P505 V508	T94-N407 PolarHBondContact O-ND2 2.81Å; H403-N407 PolarHBondContact O-N 3.36Å; H403-N407 PolarHBondContact O-ND2 3.43Å; V404-N407 PolarHBondContact O-N 3.48Å; V405-N407 VanDerWaalsContact C-N 3.32Å; V405-N407 PolarHBondContact O-N 3.44Å; N407-L410 PolarHBondContact O-N 3.35Å; N407-N411 PolarHBondContact O-N 2.99Å; N407-P505 HydrophobicContact CB-CB 4.34Å; N407-V508 WeakPolarHBondContact ND2-CG2 3.45Å
408	V	90.3	Very high	90	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-67.3	-37.1	176.1	178.2	0	0	0	0	111.5	L159 V162 V404 V405 R406 N411 P412 P505	L159-V408 HydrophobicContact CD1-CB 4.13Å; L159-V408 HydrophobicContact CD1-CG1 3.75Å; V162-V408 HydrophobicContact CG1-CG2 3.84Å; V404-V408 WeakPolarHBondContact O-CG2 3.35Å; V404-V408 PolarHBondContact O-N 2.9Å; V404-V408 VanDerWaalsContact O-N 3.07Å; V405-V408 PolarHBondContact O-N 3.35Å; R406-V408 VanDerWaalsContact C-N 3.35Å; R406-V408 PolarHBondContact O-N 3.21Å; V408-N411 CarbonylContact O-C 3.25Å; V408-N411 VanDerWaalsContact O-C 3.23Å; V408-P412 WeakPolarHBondContact O-CA 3.27Å; V408-P505 HydrophobicContact CG2-CB 4.25Å; V408-P505 HydrophobicContact CG2-CG 4.03Å
409	F	88.8	Confident	90.1	Very high	16 Å²	16	23.2 Å²	23.2	7%	0.07	12%	0.117	C	C	.	.	H	α-helix	trans	-67.6	-35.7	176.1	-93.9	-112.2	0	0	0	113.2	I153 L159 I187 K188 I200 V405 R406	I153-F409 HydrophobicContact CG2-CD1 3.88Å; I153-F409 HydrophobicContact CG2-CD2 3.89Å; I153-F409 HydrophobicContact CG2-CE1 3.65Å; I153-F409 HydrophobicContact CG2-CE2 3.67Å; I153-F409 HydrophobicContact CG2-CG 3.99Å; I153-F409 HydrophobicContact CG2-CZ 3.55Å; L159-F409 HydrophobicContact CD1-CE2 4.42Å; L159-F409 HydrophobicContact CD2-CE2 3.73Å; L159-F409 HydrophobicContact CD2-CZ 4.48Å; I187-F409 HydrophobicContact CG2-CD1 4.41Å; I187-F409 HydrophobicContact CG2-CD2 4.26Å; I187-F409 HydrophobicContact CG2-CE2 4.46Å; I187-F409 HydrophobicContact CG2-CG 4.23Å; K188-F409 HydrophobicContact CG-CE1 4.45Å; K188-F409 HydrophobicContact CG-CZ 3.91Å; I200-F409 HydrophobicContact CD1-CB 3.65Å; I200-F409 HydrophobicContact CD1-CD1 4.42Å; I200-F409 HydrophobicContact CD1-CG 4.3Å; V405-F409 HydrophobicContact CG1-CD2 3.78Å; V405-F409 HydrophobicContact CG1-CE2 3.75Å; V405-F409 VanDerWaalsContact O-CD2 3.29Å; V405-F409 WeakPolarHBondContact O-CD2 3.4Å; V405-F409 PolarHBondContact O-N 3.08Å; R406-F409 PolarHBondContact O-N 3.26Å
410	L	88	Confident	90.2	Very high	85 Å²	85	19.3 Å²	19.3	45%	0.445	10%	0.099	S	C	.	.	H	α-helix	trans	-75.3	-40.4	177.2	-69.2	174.4	0	0	0	112	K198 R406 N407	K198-L410 WeakPolarHBondContact O-CD2 3.18Å; R406-L410 HydrophobicContact CG-CD1 3.95Å; R406-L410 HydrophobicContact CG-CG 4.46Å; R406-L410 WeakPolarHBondContact O-CG 3.46Å; R406-L410 PolarHBondContact O-N 2.82Å; N407-L410 PolarHBondContact O-N 3.35Å
411	N	88.3	Confident	90.5	Very high	47 Å²	47	18.2 Å²	18.2	25%	0.251	9%	0.093	S	C	.	.			trans	-137.2	102.6	177.8	-174.3	5.8	0	0	0	110	N407 V408 K413 T507	N407-N411 PolarHBondContact O-N 2.99Å; V408-N411 CarbonylContact O-C 3.25Å; V408-N411 VanDerWaalsContact O-C 3.23Å; N411-K413 PolarHBondContact O-N 3.18Å; N411-T507 WeakPolarHBondContact CB-OG1 3.46Å
412	P	88.9	Confident	90.5	Very high	43 Å²	43	18.2 Å²	18.2	28%	0.279	9%	0.093	S	C	.	.			trans	-80.4	51.4	-175.2	34	-36.7	0	0	0	112	S150 I151 I153 V408	S150-P412 CarbonylContact C-O 3.55Å; S150-P412 VanDerWaalsContact CA-O 3.26Å; S150-P412 WeakPolarHBondContact CA-O 3.43Å; I151-P412 PolarHBondContact N-O 3.24Å; I153-P412 HydrophobicContact CD1-CB 3.87Å; I153-P412 HydrophobicContact CD1-CG 4.2Å; I153-P412 HydrophobicContact CG1-CB 3.73Å; V408-P412 WeakPolarHBondContact O-CA 3.27Å
413	K	91.1	Very high	90.5	Very high	65 Å²	65	18.2 Å²	18.2	28%	0.283	9%	0.093	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	137.3	173.9	-72	-174.5	173.4	-173.1	0	109.6	N144 K149 N411 L506	N144-K413 PolarHBondContact O-NZ 3.11Å; K149-K413 CarbonylContact O-C 3.58Å; K149-K413 WeakPolarHBondContact O-CA 3.5Å; N411-K413 PolarHBondContact O-N 3.18Å; K413-L506 HydrophobicContact CB-CB 3.9Å; K413-L506 HydrophobicContact CB-CD2 3.57Å; K413-L506 HydrophobicContact CB-CG 4.38Å; K413-L506 HydrophobicContact CD-CD2 3.57Å; K413-L506 HydrophobicContact CG-CD2 4.22Å; K413-L506 VanDerWaalsContact O-CB 3.25Å; K413-L506 WeakPolarHBondContact O-CB 3.36Å; K413-L506 PolarHBondContact O-N 3.18Å
414	V	91.3	Very high	90.5	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.006	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	160	175.4	-63.1	0	0	0	0	111.5	K149 I151 V162 W503 D504	K149-V414 HydrophobicContact CB-CG2 4.19Å; K149-V414 PolarHBondContact N-O 3.49Å; K149-V414 PolarHBondContact O-N 2.76Å; I151-V414 HydrophobicContact CD1-CB 3.99Å; I151-V414 HydrophobicContact CD1-CG1 3.27Å; I151-V414 HydrophobicContact CD1-CG2 3.51Å; I151-V414 HydrophobicContact CG1-CG1 4.07Å; I151-V414 HydrophobicContact CG1-CG2 3.78Å; V162-V414 HydrophobicContact CG1-CG1 4.31Å; V162-V414 HydrophobicContact CG2-CG1 3.96Å; V414-W503 HydrophobicContact CB-CB 4.18Å; V414-W503 HydrophobicContact CB-CE3 4.3Å; V414-W503 HydrophobicContact CG1-CB 4.49Å; V414-W503 HydrophobicContact CG2-CB 4.22Å; V414-W503 HydrophobicContact CG2-CD2 3.94Å; V414-W503 HydrophobicContact CG2-CE3 3.51Å; V414-W503 HydrophobicContact CG2-CG 4.26Å; V414-W503 HydrophobicContact CG2-CZ3 4.1Å; V414-D504 CarbonylContact C-O 3.59Å; V414-D504 VanDerWaalsContact CA-O 3.3Å; V414-D504 WeakPolarHBondContact CA-O 3.46Å; V414-D504 WeakPolarHBondContact CB-O 3.13Å
415	L	91.6	Very high	90.5	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	151.6	172.8	-67.6	179	0	0	0	110.1	M147 G417 A421 W503 D504 L506 R509	M147-L415 HydrophobicContact CB-CD2 3.42Å; M147-L415 VanDerWaalsContact CB-CD2 3.42Å; L415-G417 PolarHBondContact O-N 3.26Å; L415-A421 HydrophobicContact CB-CB 4.26Å; L415-A421 HydrophobicContact CD1-CB 4.45Å; L415-W503 WeakPolarHBondContact O-CA 3.36Å; L415-D504 PolarHBondContact N-O 3.38Å; L415-D504 PolarHBondContact O-N 2.91Å; L415-L506 HydrophobicContact CD1-CD1 3.61Å; L415-L506 HydrophobicContact CD2-CD1 3.95Å; L415-L506 HydrophobicContact CG-CB 4.48Å; L415-L506 HydrophobicContact CG-CD1 3.72Å; L415-R509 HydrophobicContact CD1-CB 3.84Å; L415-R509 HydrophobicContact CD1-CG 4.25Å
416	P	91.8	Very high	90.5	Very high	6 Å²	6	17 Å²	17	4%	0.039	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	127.6	173.7	29.3	-35.2	0	0	0	109.7	A420 A421 T484 M497 W503	P416-A420 HydrophobicContact CB-CB 3.94Å; P416-A420 HydrophobicContact CG-CB 4.1Å; P416-A421 WeakPolarHBondContact O-CB 3.2Å; P416-A421 PolarHBondContact O-N 3.32Å; P416-T484 HydrophobicContact CB-CG2 4.24Å; P416-T484 HydrophobicContact CG-CG2 4.29Å; P416-M497 HydrophobicContact CB-CB 3.94Å; P416-M497 HydrophobicContact CB-CG 4.38Å; P416-W503 HydrophobicContact CB-CZ3 4.43Å
417	G	90.8	Very high	90.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-155.1	-178.2	0	0	0	0	0	113.5	L415 G419 A420 M497 V502 D504	L415-G417 PolarHBondContact O-N 3.26Å; G417-G419 PolarHBondContact O-N 3.26Å; G417-G419 VanDerWaalsContact O-N 3.1Å; G417-A420 VanDerWaalsContact O-CB 3.29Å; G417-A420 WeakPolarHBondContact O-CB 3.43Å; G417-A420 PolarHBondContact O-N 3.36Å; G417-M497 VanDerWaalsContact O-CG 3.3Å; G417-M497 WeakPolarHBondContact O-CG 3.39Å; G417-V502 PolarHBondContact N-O 3.19Å; G417-D504 WeakPolarHBondContact CA-OD2 3.45Å
418	G	87.8	Confident	90.3	Very high	13 Å²	13	17.6 Å²	17.6	13%	0.134	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	23.1	172.2	0	0	0	0	0	115.6	A420 I487	G418-A420 VanDerWaalsContact C-N 3.3Å; G418-A420 PolarHBondContact O-N 2.97Å; G418-I487 PolarHBondContact O-N 3.05Å
419	G	90	Very high	90.3	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.01	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	3.3	-176.6	0	0	0	0	0	114.8	G417 E422 M423	G417-G419 PolarHBondContact O-N 3.26Å; G417-G419 VanDerWaalsContact O-N 3.1Å; G419-E422 VanDerWaalsContact CA-OE2 3.24Å; G419-E422 WeakPolarHBondContact CA-OE2 3.38Å; G419-M423 WeakPolarHBondContact O-CB 3.49Å; G419-M423 PolarHBondContact O-N 3.27Å; G419-M423 VanDerWaalsContact O-N 3.08Å
420	A	92.5	Very high	90.4	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-66.1	-46.4	178.6	0	0	0	0	0	111	P416 G417 G418 E422 M423 A424 L485 M497	P416-A420 HydrophobicContact CB-CB 3.94Å; P416-A420 HydrophobicContact CG-CB 4.1Å; G417-A420 VanDerWaalsContact O-CB 3.29Å; G417-A420 WeakPolarHBondContact O-CB 3.43Å; G417-A420 PolarHBondContact O-N 3.36Å; G418-A420 VanDerWaalsContact C-N 3.3Å; G418-A420 PolarHBondContact O-N 2.97Å; A420-E422 VanDerWaalsContact C-N 3.32Å; A420-E422 PolarHBondContact O-N 2.9Å; A420-M423 PolarHBondContact O-N 3.36Å; A420-A424 WeakPolarHBondContact O-CB 3.32Å; A420-A424 PolarHBondContact O-N 3.2Å; A420-L485 WeakPolarHBondContact CB-O 3.44Å; A420-M497 HydrophobicContact CB-CG 3.94Å
421	A	91.5	Very high	90.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.8	-43.6	179.4	0	0	0	0	0	112	M147 L415 P416 A424 L425	M147-A421 HydrophobicContact CE-CB 3.86Å; L415-A421 HydrophobicContact CB-CB 4.26Å; L415-A421 HydrophobicContact CD1-CB 4.45Å; P416-A421 WeakPolarHBondContact O-CB 3.2Å; P416-A421 PolarHBondContact O-N 3.32Å; A421-A424 PolarHBondContact O-N 3.41Å; A421-L425 WeakPolarHBondContact O-CB 3.4Å; A421-L425 VanDerWaalsContact O-CG 3.25Å; A421-L425 WeakPolarHBondContact O-CG 3.42Å; A421-L425 PolarHBondContact O-N 3Å
422	E	91	Very high	90.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.6	-40.7	178	-68.9	75.3	-166	0	0	112.3	G419 A420 L425 A426 F451 I454 R509 Y513	G419-E422 VanDerWaalsContact CA-OE2 3.24Å; G419-E422 WeakPolarHBondContact CA-OE2 3.38Å; A420-E422 VanDerWaalsContact C-N 3.32Å; A420-E422 PolarHBondContact O-N 2.9Å; E422-L425 PolarHBondContact O-N 3.2Å; E422-A426 WeakPolarHBondContact O-CB 3.48Å; E422-A426 PolarHBondContact O-N 3.08Å; E422-F451 HydrophobicContact CB-CB 4.38Å; E422-F451 HydrophobicContact CB-CD1 4.43Å; E422-F451 WeakPolarHBondContact CB-O 3.18Å; E422-F451 HydrophobicContact CG-CD1 4.32Å; E422-I454 HydrophobicContact CG-CB 4.06Å; E422-I454 HydrophobicContact CG-CG1 4.1Å; E422-I454 HydrophobicContact CG-CG2 4.35Å; E422-R509 IonicContact OE1-CZ 3.61Å; E422-R509 IonicContact OE1-NE 3.65Å; E422-R509 IonicContact OE1-NH1 3.74Å; E422-R509 PolarHBondContact OE1-NH1 3.12Å; E422-Y513 VanDerWaalsContact CD-OH 3.26Å; E422-Y513 HydrophobicContact CG-CE1 4.26Å; E422-Y513 PolarHBondContact OE1-OH 3.37Å
423	M	91.3	Very high	90.7	Very high	3 Å²	3	21.3 Å²	21.3	2%	0.015	11%	0.105	C	C	.	.	H	α-helix	trans	-69.7	-38.9	178.1	-173.3	61.6	74.1	0	0	112.3	G419 A420 A426 Q427 E452 P455 I470 L473 R474 H477	G419-M423 WeakPolarHBondContact O-CB 3.49Å; G419-M423 PolarHBondContact O-N 3.27Å; G419-M423 VanDerWaalsContact O-N 3.08Å; A420-M423 PolarHBondContact O-N 3.36Å; M423-A426 WeakPolarHBondContact O-CB 3.3Å; M423-A426 PolarHBondContact O-N 3.03Å; M423-Q427 PolarHBondContact O-N 2.74Å; M423-E452 HydrophobicContact CE-CB 4.45Å; M423-E452 HydrophobicContact CE-CG 4.04Å; M423-E452 HydrophobicContact SD-CG 4.15Å; M423-P455 HydrophobicContact CE-CG 4.18Å; M423-I470 HydrophobicContact CE-CG2 4.5Å; M423-L473 HydrophobicContact CE-CB 4.48Å; M423-L473 HydrophobicContact CE-CD2 3.86Å; M423-L473 HydrophobicContact CE-CG 4.19Å; M423-L473 HydrophobicContact CG-CD2 4.39Å; M423-L473 HydrophobicContact CG-CG 4.25Å; M423-R474 HydrophobicContact CE-CG 4.05Å; M423-R474 HydrophobicContact SD-CG 3.92Å; M423-H477 HydrophobicContact CG-CB 4.11Å; M423-H477 VanDerWaalsContact CG-CE1 3.44Å; M423-H477 WeakPolarHBondContact CG-CE1 3.42Å; M423-H477 VanDerWaalsContact CG-CG 3.46Å; M423-H477 WeakPolarHBondContact CG-ND1 3.34Å
424	A	91.1	Very high	90.6	Very high	6 Å²	6	23 Å²	23	5%	0.05	12%	0.117	C	C	.	.	H	α-helix	trans	-62.3	-43.9	173.3	0	0	0	0	0	111.4	M147 A420 A421 Q427 V428 E483	M147-A424 HydrophobicContact CE-CB 3.64Å; M147-A424 HydrophobicContact SD-CB 4.44Å; A420-A424 WeakPolarHBondContact O-CB 3.32Å; A420-A424 PolarHBondContact O-N 3.2Å; A421-A424 PolarHBondContact O-N 3.41Å; A424-Q427 PolarHBondContact O-N 3.39Å; A424-V428 VanDerWaalsContact O-CG2 3.3Å; A424-V428 WeakPolarHBondContact O-CG2 2.84Å; A424-V428 PolarHBondContact O-N 2.8Å; A424-V428 VanDerWaalsContact O-N 3.08Å; A424-E483 HydrophobicContact CB-CB 4.26Å; A424-E483 HydrophobicContact CB-CG 4.47Å
425	L	90.6	Very high	90.5	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-64	-42.1	174.9	-71.6	168.9	0	0	0	112.4	V139 H142 M147 A421 E422 Q427 V428 I429 F451 Y513	V139-L425 HydrophobicContact CG1-CD1 4.14Å; V139-L425 HydrophobicContact CG1-CD2 4.29Å; H142-L425 HydrophobicContact CB-CD2 4.29Å; M147-L425 HydrophobicContact SD-CD2 3.92Å; M147-L425 HydrophobicContact SD-CG 4Å; A421-L425 WeakPolarHBondContact O-CB 3.4Å; A421-L425 VanDerWaalsContact O-CG 3.25Å; A421-L425 WeakPolarHBondContact O-CG 3.42Å; A421-L425 PolarHBondContact O-N 3Å; E422-L425 PolarHBondContact O-N 3.2Å; L425-Q427 VanDerWaalsContact C-N 3.3Å; L425-Q427 PolarHBondContact O-N 2.8Å; L425-V428 PolarHBondContact O-N 3.47Å; L425-I429 WeakPolarHBondContact O-CB 3.4Å; L425-I429 WeakPolarHBondContact O-CD1 3.16Å; L425-I429 WeakPolarHBondContact O-CG1 3.43Å; L425-I429 PolarHBondContact O-N 2.98Å; L425-F451 HydrophobicContact CD1-CE1 4.42Å; L425-Y513 HydrophobicContact CD1-CD2 4.06Å; L425-Y513 HydrophobicContact CD1-CE2 3.38Å
426	A	90.4	Very high	90.4	Very high	3 Å²	3	28.5 Å²	28.5	3%	0.025	15%	0.153	C	C	.	.	H	α-helix	trans	-55.3	-47.4	175.5	0	0	0	0	0	111.1	E422 M423 K430 A448 F451 E452	E422-A426 WeakPolarHBondContact O-CB 3.48Å; E422-A426 PolarHBondContact O-N 3.08Å; M423-A426 WeakPolarHBondContact O-CB 3.3Å; M423-A426 PolarHBondContact O-N 3.03Å; A426-K430 WeakPolarHBondContact O-CB 3.43Å; A426-K430 PolarHBondContact O-N 3.4Å; A426-A448 VanDerWaalsContact CB-O 3.23Å; A426-A448 WeakPolarHBondContact CB-O 3.2Å; A426-A448 WeakPolarHBondContact O-CB 3.21Å; A426-F451 HydrophobicContact CB-CB 4.03Å; A426-E452 HydrophobicContact CB-CG 4.08Å
427	Q	90.7	Very high	90	Very high	36 Å²	36	37.7 Å²	37.7	17%	0.168	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-47.9	178.4	-179.6	61.4	16.7	0	0	112.1	M423 A424 L425 I429 K430 E431	M423-Q427 PolarHBondContact O-N 2.74Å; A424-Q427 PolarHBondContact O-N 3.39Å; L425-Q427 VanDerWaalsContact C-N 3.3Å; L425-Q427 PolarHBondContact O-N 2.8Å; Q427-I429 PolarHBondContact O-N 3.38Å; Q427-K430 WeakPolarHBondContact O-CB 3.33Å; Q427-K430 PolarHBondContact O-N 3.14Å; Q427-E431 PolarHBondContact NE2-OE1 2.9Å; Q427-E431 WeakPolarHBondContact O-CG 3.29Å; Q427-E431 PolarHBondContact O-N 3.44Å
428	V	89.3	Confident	89.6	Confident	43 Å²	43	40 Å²	40	26%	0.261	22%	0.216	S	C	.	.	H	α-helix	trans	-62	-43.7	-179.2	170.8	0	0	0	0	111.6	A424 L425 K430 E431 K432	A424-V428 VanDerWaalsContact O-CG2 3.3Å; A424-V428 WeakPolarHBondContact O-CG2 2.84Å; A424-V428 PolarHBondContact O-N 2.8Å; A424-V428 VanDerWaalsContact O-N 3.08Å; L425-V428 PolarHBondContact O-N 3.47Å; V428-K430 VanDerWaalsContact C-N 3.32Å; V428-E431 PolarHBondContact O-N 3.16Å; V428-K432 WeakPolarHBondContact O-CB 3.44Å; V428-K432 PolarHBondContact O-N 3.25Å
429	I	90.4	Very high	89	Confident	6 Å²	6	44.4 Å²	44.4	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-67.6	-37.5	179	-65	165.7	0	0	0	110.3	V139 L425 Q427 K432 A433 Y444 V447 A448 F451	V139-I429 HydrophobicContact CG2-CD1 3.43Å; V139-I429 VanDerWaalsContact CG2-CD1 3.43Å; V139-I429 HydrophobicContact CG2-CG1 4.25Å; L425-I429 WeakPolarHBondContact O-CB 3.4Å; L425-I429 WeakPolarHBondContact O-CD1 3.16Å; L425-I429 WeakPolarHBondContact O-CG1 3.43Å; L425-I429 PolarHBondContact O-N 2.98Å; Q427-I429 PolarHBondContact O-N 3.38Å; I429-K432 CarbonylContact O-C 3.01Å; I429-K432 PolarHBondContact O-N 2.74Å; I429-A433 WeakPolarHBondContact O-CB 3.49Å; I429-A433 PolarHBondContact O-N 2.72Å; I429-Y444 HydrophobicContact CG2-CD1 3.99Å; I429-Y444 VanDerWaalsContact CG2-O 3.29Å; I429-Y444 WeakPolarHBondContact CG2-O 3.25Å; I429-V447 HydrophobicContact CD1-CG1 4.09Å; I429-V447 HydrophobicContact CG2-CG1 4.38Å; I429-A448 HydrophobicContact CB-CB 4.16Å; I429-A448 HydrophobicContact CG2-CB 4.04Å; I429-F451 HydrophobicContact CD1-CD2 3.7Å; I429-F451 HydrophobicContact CD1-CE2 3.36Å; I429-F451 HydrophobicContact CD1-CZ 4.37Å
430	K	90.3	Very high	88.7	Confident	78 Å²	78	48.4 Å²	48.4	34%	0.339	25%	0.252	S	S	.	.	H	α-helix	trans	-65.6	-40.8	176.6	-169.3	172.4	-171.1	161.4	0	112.4	A426 Q427 V428 A433 N434 A448	A426-K430 WeakPolarHBondContact O-CB 3.43Å; A426-K430 PolarHBondContact O-N 3.4Å; Q427-K430 WeakPolarHBondContact O-CB 3.33Å; Q427-K430 PolarHBondContact O-N 3.14Å; V428-K430 VanDerWaalsContact C-N 3.32Å; K430-A433 WeakPolarHBondContact O-CB 3.39Å; K430-A433 PolarHBondContact O-N 2.93Å; K430-N434 PolarHBondContact O-N 2.93Å; K430-N434 PolarHBondContact O-ND2 3.03Å; K430-A448 HydrophobicContact CB-CB 4.04Å
431	E	90.3	Very high	88.4	Confident	107 Å²	107	50.4 Å²	50.4	50%	0.5	26%	0.261	S	S	.	.	H	α-helix	trans	-63.2	-45	171.7	-73.4	175.7	-171	0	0	111.2	Q427 V428 A433 N434	Q427-E431 PolarHBondContact NE2-OE1 2.9Å; Q427-E431 WeakPolarHBondContact O-CG 3.29Å; Q427-E431 PolarHBondContact O-N 3.44Å; V428-E431 PolarHBondContact O-N 3.16Å; E431-A433 VanDerWaalsContact C-N 3.3Å; E431-A433 PolarHBondContact O-N 2.79Å; E431-N434 WeakPolarHBondContact O-CB 3.4Å; E431-N434 PolarHBondContact O-N 3.44Å; E431-N434 VanDerWaalsContact O-N 3.09Å
432	K	90.2	Very high	87.9	Confident	79 Å²	79	54.7 Å²	54.7	34%	0.343	28%	0.28	S	S	.	.	H	α-helix	trans	-61.9	-38.1	175.7	-169.6	163.4	-170.2	169.5	0	112	D138 V428 I429 N434 S435 I436 Y444	D138-K432 HydrophobicContact CB-CD 4.41Å; D138-K432 IonicContact OD1-NZ 2.67Å; D138-K432 PolarHBondContact OD1-NZ 3.35Å; D138-K432 VanDerWaalsContact OD2-CD 3.29Å; D138-K432 WeakPolarHBondContact OD2-CD 3.14Å; D138-K432 WeakPolarHBondContact OD2-CE 3.35Å; D138-K432 IonicContact OD2-NZ 2.71Å; D138-K432 PolarHBondContact OD2-NZ 2.71Å; V428-K432 WeakPolarHBondContact O-CB 3.44Å; V428-K432 PolarHBondContact O-N 3.25Å; I429-K432 CarbonylContact O-C 3.01Å; I429-K432 PolarHBondContact O-N 2.74Å; K432-N434 PolarHBondContact O-N 3.42Å; K432-S435 WeakPolarHBondContact O-CB 3.37Å; K432-S435 PolarHBondContact O-N 3.37Å; K432-S435 PolarHBondContact O-OG 2.88Å; K432-I436 HydrophobicContact CG-CD1 4.24Å; K432-I436 PolarHBondContact O-N 2.79Å; K432-Y444 HydrophobicContact CD-CE1 4.29Å; K432-Y444 HydrophobicContact CG-CE1 4.37Å
433	A	89.9	Confident	87.6	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.3	-30.2	175.6	0	0	0	0	0	112.5	I429 K430 E431 S435 Q441 R445	I429-A433 WeakPolarHBondContact O-CB 3.49Å; I429-A433 PolarHBondContact O-N 2.72Å; K430-A433 WeakPolarHBondContact O-CB 3.39Å; K430-A433 PolarHBondContact O-N 2.93Å; E431-A433 VanDerWaalsContact C-N 3.3Å; E431-A433 PolarHBondContact O-N 2.79Å; A433-S435 VanDerWaalsContact C-N 3.32Å; A433-Q441 VanDerWaalsContact O-CG 3.29Å; A433-Q441 WeakPolarHBondContact O-CG 3.48Å; A433-Q441 PolarHBondContact O-NE2 2.83Å; A433-R445 HydrophobicContact CB-CG 3.79Å
434	N	90.2	Very high	87.4	Confident	101 Å²	101	55 Å²	55	54%	0.54	28%	0.281	S	S	.	.	H	α-helix	trans	-73.6	-24.2	176	-65.2	-30.6	0	0	0	112.9	K430 E431 K432 R445	K430-N434 PolarHBondContact O-N 2.93Å; K430-N434 PolarHBondContact O-ND2 3.03Å; E431-N434 WeakPolarHBondContact O-CB 3.4Å; E431-N434 PolarHBondContact O-N 3.44Å; E431-N434 VanDerWaalsContact O-N 3.09Å; K432-N434 PolarHBondContact O-N 3.42Å; N434-R445 PolarHBondContact OD1-NH2 3.35Å
435	S	89.7	Confident	87.3	Confident	89 Å²	89	59.3 Å²	59.3	62%	0.622	30%	0.296	S	S	*	.	H	α-helix	trans	-81.9	-23.7	175.3	73.8	0	0	0	0	113.5	K432 A433	K432-S435 WeakPolarHBondContact O-CB 3.37Å; K432-S435 PolarHBondContact O-N 3.37Å; K432-S435 PolarHBondContact O-OG 2.88Å; A433-S435 VanDerWaalsContact C-N 3.32Å
436	I	88.5	Confident	86.9	Confident	26 Å²	26	59.5 Å²	59.5	13%	0.133	30%	0.298	C	S	.	.			trans	-82.4	131.8	179.8	-63.1	168.1	0	0	0	109.4	K432 Q440 Y444	K432-I436 HydrophobicContact CG-CD1 4.24Å; K432-I436 PolarHBondContact O-N 2.79Å; I436-Q440 HydrophobicContact CG2-CB 3.96Å; I436-Y444 HydrophobicContact CD1-CD1 3.57Å; I436-Y444 HydrophobicContact CD1-CD2 3.85Å; I436-Y444 HydrophobicContact CD1-CE1 3.44Å; I436-Y444 VanDerWaalsContact CD1-CE1 3.44Å; I436-Y444 HydrophobicContact CD1-CE2 3.73Å; I436-Y444 HydrophobicContact CD1-CG 3.77Å
437	K	82.6	Confident	86.7	Confident	199 Å²	199	59.4 Å²	59.4	87%	0.865	30%	0.297	S	S	*	.			trans	-101.3	144.2	173.3	-64.8	-175.4	-178.9	-179.2	0	110.5
438	G	82.5	Confident	86.6	Confident	48 Å²	48	57.8 Å²	57.8	50%	0.495	29%	0.289	S	S	.	.	S	Bend	trans	98	-171.1	174.7	0	0	0	0	0	113.6	Q440 Q441	G438-Q440 PolarHBondContact O-N 3.4Å; G438-Q440 VanDerWaalsContact O-N 3.11Å; G438-Q441 VanDerWaalsContact O-CB 3.24Å; G438-Q441 WeakPolarHBondContact O-CB 3.48Å; G438-Q441 PolarHBondContact O-N 3.26Å
439	E	76.5	Confident	86.5	Confident	107 Å²	107	59.2 Å²	59.2	50%	0.5	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-28.8	-173.1	-70.6	175.2	-168.5	0	0	114	M123 Q441 F442	M123-E439 HydrophobicContact CE-CB 3.62Å; M123-E439 HydrophobicContact CE-CG 3.84Å; M123-E439 HydrophobicContact SD-CB 4.35Å; E439-Q441 PolarHBondContact O-N 2.85Å; E439-F442 PolarHBondContact O-N 2.84Å
440	Q	82.6	Confident	86.3	Confident	85 Å²	85	59.1 Å²	59.1	40%	0.397	30%	0.296	S	S	.	.	H	α-helix	trans	-61.8	-28.7	177.9	-61.6	-172.3	-22.4	0	0	113	A131 I436 G438 F442 V443 Y444	A131-Q440 HydrophobicContact CB-CB 4.14Å; A131-Q440 HydrophobicContact CB-CG 4.07Å; I436-Q440 HydrophobicContact CG2-CB 3.96Å; G438-Q440 PolarHBondContact O-N 3.4Å; G438-Q440 VanDerWaalsContact O-N 3.11Å; Q440-F442 PolarHBondContact O-N 3.25Å; Q440-V443 PolarHBondContact O-N 3.14Å; Q440-Y444 WeakPolarHBondContact O-CD2 3.35Å; Q440-Y444 PolarHBondContact O-N 3.22Å
441	Q	86.9	Confident	86.2	Confident	42 Å²	42	55.9 Å²	55.9	20%	0.196	28%	0.282	C	S	.	.	H	α-helix	trans	-55.2	-41	177.8	171.1	168.4	48.5	0	0	111.7	A433 G438 E439 Y444 R445	A433-Q441 VanDerWaalsContact O-CG 3.29Å; A433-Q441 WeakPolarHBondContact O-CG 3.48Å; A433-Q441 PolarHBondContact O-NE2 2.83Å; G438-Q441 VanDerWaalsContact O-CB 3.24Å; G438-Q441 WeakPolarHBondContact O-CB 3.48Å; G438-Q441 PolarHBondContact O-N 3.26Å; E439-Q441 PolarHBondContact O-N 2.85Å; Q441-Y444 PolarHBondContact O-N 2.94Å; Q441-R445 WeakPolarHBondContact O-CG 3.47Å; Q441-R445 PolarHBondContact O-N 3.38Å; Q441-R445 VanDerWaalsContact O-N 3.11Å
442	F	81.9	Confident	86.1	Confident	90 Å²	90	51.1 Å²	51.1	40%	0.395	26%	0.26	S	S	.	.	H	α-helix	trans	-67.6	-39.7	-178.3	-66.2	-74.5	0	0	0	112	F118 E439 Q440 R445 A446	F118-F442 HydrophobicContact CD2-CB 4.38Å; F118-F442 HydrophobicContact CE1-CB 3.77Å; F118-F442 AromaticContact CE1-CD1 3.94Å; F118-F442 HydrophobicContact CE1-CD1 3.94Å; F118-F442 AromaticContact CE1-CG 3.83Å; F118-F442 HydrophobicContact CE1-CG 3.83Å; F118-F442 HydrophobicContact CE2-CB 3.68Å; F118-F442 HydrophobicContact CZ-CB 3.39Å; F118-F442 AromaticContact CZ-CD1 3.91Å; F118-F442 HydrophobicContact CZ-CD1 3.91Å; F118-F442 AromaticContact CZ-CG 3.86Å; F118-F442 HydrophobicContact CZ-CG 3.86Å; E439-F442 PolarHBondContact O-N 2.84Å; Q440-F442 PolarHBondContact O-N 3.25Å; F442-R445 PolarHBondContact O-N 3.23Å; F442-A446 PolarHBondContact O-N 2.97Å
443	V	83.6	Confident	86	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-66.3	-41	177.1	-174.6	0	0	0	0	110.8	I128 A131 L132 Q440 R445 A446 V447	I128-V443 HydrophobicContact CG1-CG2 4.34Å; I128-V443 HydrophobicContact CG2-CG1 4.2Å; I128-V443 HydrophobicContact CG2-CG2 4.35Å; A131-V443 HydrophobicContact CB-CB 3.68Å; A131-V443 HydrophobicContact CB-CG1 3.73Å; A131-V443 HydrophobicContact CB-CG2 3.98Å; L132-V443 HydrophobicContact CD2-CG1 3.8Å; L132-V443 HydrophobicContact CG-CG1 3.92Å; Q440-V443 PolarHBondContact O-N 3.14Å; V443-R445 VanDerWaalsContact C-N 3.33Å; V443-R445 PolarHBondContact O-N 2.85Å; V443-A446 WeakPolarHBondContact O-CB 3.38Å; V443-A446 PolarHBondContact O-N 2.88Å; V443-V447 VanDerWaalsContact O-CG2 3.27Å; V443-V447 WeakPolarHBondContact O-CG2 3.37Å; V443-V447 PolarHBondContact O-N 2.88Å
444	Y	88.2	Confident	85.9	Confident	9 Å²	9	47.9 Å²	47.9	4%	0.035	25%	0.246	C	C	.	.	H	α-helix	trans	-62.3	-39.4	175.3	-88.9	-114.9	0	0	0	112.3	A134 A135 D138 I429 K432 I436 Q440 Q441 V447 A448	A134-Y444 VanDerWaalsContact C-OH 3.25Å; A134-Y444 HydrophobicContact CB-CE2 4.42Å; A134-Y444 WeakPolarHBondContact CB-OH 3.33Å; A135-Y444 HydrophobicContact CB-CD1 4.36Å; A135-Y444 HydrophobicContact CB-CD2 4.39Å; A135-Y444 HydrophobicContact CB-CE1 4.04Å; A135-Y444 HydrophobicContact CB-CE2 4.09Å; A135-Y444 PolarHBondContact N-OH 3.35Å; D138-Y444 PolarHBondContact OD2-OH 3.36Å; I429-Y444 HydrophobicContact CG2-CD1 3.99Å; I429-Y444 VanDerWaalsContact CG2-O 3.29Å; I429-Y444 WeakPolarHBondContact CG2-O 3.25Å; K432-Y444 HydrophobicContact CD-CE1 4.29Å; K432-Y444 HydrophobicContact CG-CE1 4.37Å; I436-Y444 HydrophobicContact CD1-CD1 3.57Å; I436-Y444 HydrophobicContact CD1-CD2 3.85Å; I436-Y444 HydrophobicContact CD1-CE1 3.44Å; I436-Y444 VanDerWaalsContact CD1-CE1 3.44Å; I436-Y444 HydrophobicContact CD1-CE2 3.73Å; I436-Y444 HydrophobicContact CD1-CG 3.77Å; Q440-Y444 WeakPolarHBondContact O-CD2 3.35Å; Q440-Y444 PolarHBondContact O-N 3.22Å; Q441-Y444 PolarHBondContact O-N 2.94Å; Y444-V447 PolarHBondContact O-N 2.84Å; Y444-A448 PolarHBondContact O-N 3.22Å
445	R	87.3	Confident	86	Confident	96 Å²	96	43 Å²	43	36%	0.362	22%	0.22	S	C	.	.	H	α-helix	trans	-64.7	-42.6	174.9	-72.8	-179.2	177.6	169.3	-0	111.9	A433 N434 Q441 F442 V443 V447 A448 D449	A433-R445 HydrophobicContact CB-CG 3.79Å; N434-R445 PolarHBondContact OD1-NH2 3.35Å; Q441-R445 WeakPolarHBondContact O-CG 3.47Å; Q441-R445 PolarHBondContact O-N 3.38Å; Q441-R445 VanDerWaalsContact O-N 3.11Å; F442-R445 PolarHBondContact O-N 3.23Å; V443-R445 VanDerWaalsContact C-N 3.33Å; V443-R445 PolarHBondContact O-N 2.85Å; R445-V447 VanDerWaalsContact C-N 3.3Å; R445-V447 PolarHBondContact O-N 3.22Å; R445-A448 WeakPolarHBondContact O-CB 3.28Å; R445-A448 PolarHBondContact O-N 2.81Å; R445-A448 VanDerWaalsContact O-N 3.16Å; R445-D449 PolarHBondContact O-N 3.4Å
446	A	83.9	Confident	86.1	Confident	5 Å²	5	42.4 Å²	42.4	4%	0.041	20%	0.204	C	C	.	.	H	α-helix	trans	-59.3	-41.8	174.6	0	0	0	0	0	112.1	I111 A114 F442 V443 D449 A450	I111-A446 HydrophobicContact CG1-CB 4.4Å; A114-A446 HydrophobicContact CB-CB 3.51Å; F442-A446 PolarHBondContact O-N 2.97Å; V443-A446 WeakPolarHBondContact O-CB 3.38Å; V443-A446 PolarHBondContact O-N 2.88Å; A446-D449 PolarHBondContact O-N 3.08Å; A446-A450 WeakPolarHBondContact O-CB 3.4Å; A446-A450 PolarHBondContact O-N 3.03Å
447	V	86	Confident	86.1	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-62.4	-43.7	174.6	173.1	0	0	0	0	111.2	I111 L132 A135 I429 V443 Y444 R445 A450 F451	I111-V447 HydrophobicContact CD1-CB 4.19Å; I111-V447 HydrophobicContact CD1-CG2 3.61Å; I111-V447 HydrophobicContact CG1-CB 4.46Å; I111-V447 HydrophobicContact CG1-CG2 3.97Å; L132-V447 HydrophobicContact CD2-CG2 3.45Å; L132-V447 VanDerWaalsContact CD2-CG2 3.45Å; A135-V447 HydrophobicContact CB-CG1 4.37Å; A135-V447 HydrophobicContact CB-CG2 4.28Å; I429-V447 HydrophobicContact CD1-CG1 4.09Å; I429-V447 HydrophobicContact CG2-CG1 4.38Å; V443-V447 VanDerWaalsContact O-CG2 3.27Å; V443-V447 WeakPolarHBondContact O-CG2 3.37Å; V443-V447 PolarHBondContact O-N 2.88Å; Y444-V447 PolarHBondContact O-N 2.84Å; R445-V447 VanDerWaalsContact C-N 3.3Å; R445-V447 PolarHBondContact O-N 3.22Å; V447-A450 PolarHBondContact O-N 2.93Å; V447-F451 HydrophobicContact CG1-CD2 4.04Å; V447-F451 HydrophobicContact CG1-CE2 3.56Å; V447-F451 WeakPolarHBondContact O-CD2 3.45Å; V447-F451 PolarHBondContact O-N 3.33Å
448	A	88.1	Confident	86.5	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.008	16%	0.16	C	C	.	.	H	α-helix	trans	-61.2	-44.9	177	0	0	0	0	0	112.1	A426 I429 K430 Y444 R445 A450 F451	A426-A448 VanDerWaalsContact CB-O 3.23Å; A426-A448 WeakPolarHBondContact CB-O 3.2Å; A426-A448 WeakPolarHBondContact O-CB 3.21Å; I429-A448 HydrophobicContact CB-CB 4.16Å; I429-A448 HydrophobicContact CG2-CB 4.04Å; K430-A448 HydrophobicContact CB-CB 4.04Å; Y444-A448 PolarHBondContact O-N 3.22Å; R445-A448 WeakPolarHBondContact O-CB 3.28Å; R445-A448 PolarHBondContact O-N 2.81Å; R445-A448 VanDerWaalsContact O-N 3.16Å; A448-A450 VanDerWaalsContact C-N 3.33Å; A448-A450 PolarHBondContact O-N 2.88Å; A448-F451 PolarHBondContact O-N 2.78Å
449	D	86.4	Confident	87	Confident	73 Å²	73	30.1 Å²	30.1	39%	0.39	14%	0.137	S	C	.	.	H	α-helix	trans	-65.4	-37.9	178.8	-67.9	-29.6	0	0	0	111.4	R445 A446 F451 E452	R445-D449 PolarHBondContact O-N 3.4Å; A446-D449 PolarHBondContact O-N 3.08Å; D449-F451 VanDerWaalsContact C-N 3.34Å; D449-F451 PolarHBondContact O-N 3.04Å; D449-E452 WeakPolarHBondContact O-CB 3.5Å; D449-E452 PolarHBondContact O-N 2.82Å; D449-E452 VanDerWaalsContact O-N 3.13Å
450	A	85.9	Confident	87.6	Confident	5 Å²	5	29.8 Å²	29.8	4%	0.041	14%	0.135	C	C	.	.	H	α-helix	trans	-62	-35.6	176.9	0	0	0	0	0	113.2	D107 I111 A446 V447 A448 E452 I453	D107-A450 HydrophobicContact CB-CB 3.81Å; D107-A450 VanDerWaalsContact O-CB 3.27Å; D107-A450 WeakPolarHBondContact O-CB 3.32Å; I111-A450 HydrophobicContact CD1-CB 4.11Å; I111-A450 HydrophobicContact CG1-CB 3.87Å; A446-A450 WeakPolarHBondContact O-CB 3.4Å; A446-A450 PolarHBondContact O-N 3.03Å; V447-A450 PolarHBondContact O-N 2.93Å; A448-A450 VanDerWaalsContact C-N 3.33Å; A448-A450 PolarHBondContact O-N 2.88Å; A450-E452 PolarHBondContact O-N 2.88Å; A450-I453 WeakPolarHBondContact O-CB 3.48Å; A450-I453 WeakPolarHBondContact O-CG2 3.38Å; A450-I453 PolarHBondContact O-N 2.76Å
451	F	88.3	Confident	88	Confident	9 Å²	9	27.1 Å²	27.1	4%	0.039	12%	0.124	C	C	.	.	H	α-helix	trans	-61.3	-26.6	176.1	-82.7	-68.7	0	0	0	112.9	L104 V139 E422 L425 A426 I429 V447 A448 D449 I453 Y513	L104-F451 HydrophobicContact CD2-CD1 4.39Å; V139-F451 HydrophobicContact CG1-CZ 4Å; V139-F451 HydrophobicContact CG2-CE2 3.93Å; V139-F451 HydrophobicContact CG2-CZ 3.91Å; E422-F451 HydrophobicContact CB-CB 4.38Å; E422-F451 HydrophobicContact CB-CD1 4.43Å; E422-F451 WeakPolarHBondContact CB-O 3.18Å; E422-F451 HydrophobicContact CG-CD1 4.32Å; L425-F451 HydrophobicContact CD1-CE1 4.42Å; A426-F451 HydrophobicContact CB-CB 4.03Å; I429-F451 HydrophobicContact CD1-CD2 3.7Å; I429-F451 HydrophobicContact CD1-CE2 3.36Å; I429-F451 HydrophobicContact CD1-CZ 4.37Å; V447-F451 HydrophobicContact CG1-CD2 4.04Å; V447-F451 HydrophobicContact CG1-CE2 3.56Å; V447-F451 WeakPolarHBondContact O-CD2 3.45Å; V447-F451 PolarHBondContact O-N 3.33Å; A448-F451 PolarHBondContact O-N 2.78Å; D449-F451 VanDerWaalsContact C-N 3.34Å; D449-F451 PolarHBondContact O-N 3.04Å; F451-I453 PolarHBondContact O-N 3.08Å; F451-Y513 HydrophobicContact CD1-CD1 4.49Å; F451-Y513 HydrophobicContact CD1-CE1 4.28Å; F451-Y513 AromaticContact CE1-CD1 3.59Å; F451-Y513 HydrophobicContact CE1-CD1 3.59Å; F451-Y513 HydrophobicContact CE1-CD2 4.43Å; F451-Y513 AromaticContact CE1-CE1 3.75Å; F451-Y513 HydrophobicContact CE1-CE1 3.75Å; F451-Y513 AromaticContact CE1-CG 3.96Å; F451-Y513 HydrophobicContact CE1-CG 3.96Å; F451-Y513 HydrophobicContact CZ-CD1 4.42Å; F451-Y513 HydrophobicContact CZ-CG 4.42Å
452	E	88.9	Confident	88.1	Confident	8 Å²	8	25.6 Å²	25.6	4%	0.037	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-8.5	-177.8	-58.7	-168.3	-169.2	0	0	114.9	M423 A426 D449 A450 I454 P455 R456 R474	M423-E452 HydrophobicContact CE-CB 4.45Å; M423-E452 HydrophobicContact CE-CG 4.04Å; M423-E452 HydrophobicContact SD-CG 4.15Å; A426-E452 HydrophobicContact CB-CG 4.08Å; D449-E452 WeakPolarHBondContact O-CB 3.5Å; D449-E452 PolarHBondContact O-N 2.82Å; D449-E452 VanDerWaalsContact O-N 3.13Å; A450-E452 PolarHBondContact O-N 2.88Å; E452-I454 VanDerWaalsContact C-N 3.27Å; E452-I454 PolarHBondContact O-N 2.95Å; E452-P455 VanDerWaalsContact O-CD 3.32Å; E452-P455 WeakPolarHBondContact O-CD 3.32Å; E452-P455 VanDerWaalsContact O-CG 3.27Å; E452-P455 WeakPolarHBondContact O-CG 3.31Å; E452-R456 VanDerWaalsContact O-CB 3.31Å; E452-R456 WeakPolarHBondContact O-CB 3.49Å; E452-R456 PolarHBondContact O-N 2.81Å; E452-R474 VanDerWaalsContact CD-NH2 3.28Å; E452-R474 IonicContact OE1-CZ 3.35Å; E452-R474 IonicContact OE1-NE 2.83Å; E452-R474 PolarHBondContact OE1-NE 2.66Å; E452-R474 IonicContact OE1-NH2 2.74Å; E452-R474 PolarHBondContact OE1-NH2 2.86Å; E452-R474 IonicContact OE2-CZ 3.01Å; E452-R474 IonicContact OE2-NE 2.69Å; E452-R474 PolarHBondContact OE2-NE 3.27Å; E452-R474 IonicContact OE2-NH2 3.1Å; E452-R474 PolarHBondContact OE2-NH2 2.8Å
453	I	87.4	Confident	88.4	Confident	7 Å²	7	24.7 Å²	24.7	4%	0.036	13%	0.134	C	C	.	.	H	α-helix	trans	-64.4	-29.9	179.2	-166.5	62	0	0	0	113.4	I103 L104 D107 A450 F451 R456 T457	I103-I453 HydrophobicContact CG2-CG1 4.1Å; I103-I453 HydrophobicContact CG2-CG2 4.15Å; L104-I453 HydrophobicContact CD2-CG2 3.87Å; D107-I453 HydrophobicContact CB-CB 4.4Å; D107-I453 HydrophobicContact CB-CG2 3.97Å; D107-I453 WeakPolarHBondContact OD1-CG1 3.47Å; D107-I453 WeakPolarHBondContact OD2-CB 3.46Å; D107-I453 VanDerWaalsContact OD2-CG1 3.26Å; D107-I453 WeakPolarHBondContact OD2-CG1 3.26Å; D107-I453 WeakPolarHBondContact OD2-CG2 3.25Å; A450-I453 WeakPolarHBondContact O-CB 3.48Å; A450-I453 WeakPolarHBondContact O-CG2 3.38Å; A450-I453 PolarHBondContact O-N 2.76Å; F451-I453 PolarHBondContact O-N 3.08Å; I453-R456 HydrophobicContact CD1-CB 4.43Å; I453-R456 WeakPolarHBondContact O-CB 3.5Å; I453-R456 PolarHBondContact O-N 2.98Å; I453-T457 VanDerWaalsContact O-CB 3.25Å; I453-T457 WeakPolarHBondContact O-CB 3.31Å; I453-T457 PolarHBondContact O-N 3.31Å; I453-T457 PolarHBondContact O-OG1 3.24Å
454	I	89.2	Confident	88.6	Confident	3 Å²	3	26 Å²	26	2%	0.015	14%	0.144	C	C	.	.	H	α-helix	trans	-66.6	-56.6	-179.4	-66	-61	0	0	0	109.5	L44 I103 L104 E422 E452 R456 T457 L458	L44-I454 HydrophobicContact CD2-CD1 3.78Å; L44-I454 HydrophobicContact CD2-CG2 4.4Å; I103-I454 HydrophobicContact CB-CD1 4.46Å; I103-I454 HydrophobicContact CG2-CD1 4.03Å; L104-I454 HydrophobicContact CD1-CD1 4.3Å; L104-I454 HydrophobicContact CD1-CG1 4.11Å; L104-I454 HydrophobicContact CD2-CD1 4.4Å; L104-I454 HydrophobicContact CD2-CG1 3.88Å; L104-I454 HydrophobicContact CG-CD1 3.98Å; L104-I454 HydrophobicContact CG-CG1 3.93Å; E422-I454 HydrophobicContact CG-CB 4.06Å; E422-I454 HydrophobicContact CG-CG1 4.1Å; E422-I454 HydrophobicContact CG-CG2 4.35Å; E452-I454 VanDerWaalsContact C-N 3.27Å; E452-I454 PolarHBondContact O-N 2.95Å; I454-R456 PolarHBondContact O-N 3.15Å; I454-T457 PolarHBondContact O-N 2.69Å; I454-L458 HydrophobicContact CG2-CD1 4.37Å; I454-L458 WeakPolarHBondContact O-CG 3.47Å; I454-L458 PolarHBondContact O-N 3.37Å
455	P	91.5	Very high	88.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58.7	-36.4	172.2	16.2	-25.8	0	0	0	112.4	M423 E452 T457 L458 L459 L473 I487	M423-P455 HydrophobicContact CE-CG 4.18Å; E452-P455 VanDerWaalsContact O-CD 3.32Å; E452-P455 WeakPolarHBondContact O-CD 3.32Å; E452-P455 VanDerWaalsContact O-CG 3.27Å; E452-P455 WeakPolarHBondContact O-CG 3.31Å; P455-T457 PolarHBondContact O-N 2.87Å; P455-L458 PolarHBondContact O-N 2.9Å; P455-L459 WeakPolarHBondContact O-CG 3.34Å; P455-L459 PolarHBondContact O-N 2.99Å; P455-L473 HydrophobicContact CB-CD2 4.32Å; P455-I487 HydrophobicContact CB-CD1 3.43Å; P455-I487 VanDerWaalsContact CB-CD1 3.43Å; P455-I487 HydrophobicContact CB-CG1 4.15Å; P455-I487 WeakPolarHBondContact O-CD1 3.26Å
456	R	91.2	Very high	88.9	Confident	75 Å²	75	27 Å²	27	28%	0.283	16%	0.157	S	C	.	.	H	α-helix	trans	-60.4	-44.6	175.7	-172.8	178.7	-62.7	-88.2	-0.7	113	E452 I453 I454 L459 Q460 I466 I470	E452-R456 VanDerWaalsContact O-CB 3.31Å; E452-R456 WeakPolarHBondContact O-CB 3.49Å; E452-R456 PolarHBondContact O-N 2.81Å; I453-R456 HydrophobicContact CD1-CB 4.43Å; I453-R456 WeakPolarHBondContact O-CB 3.5Å; I453-R456 PolarHBondContact O-N 2.98Å; I454-R456 PolarHBondContact O-N 3.15Å; R456-L459 PolarHBondContact O-N 2.87Å; R456-Q460 WeakPolarHBondContact O-CB 3.48Å; R456-Q460 PolarHBondContact O-N 2.93Å; R456-I466 HydrophobicContact CG-CG2 3.62Å; R456-I470 HydrophobicContact CB-CD1 3.57Å; R456-I470 HydrophobicContact CG-CD1 3.73Å
457	T	89.6	Confident	89.2	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-69.4	-40.4	-179.8	-60.4	0	0	0	0	110.7	R41 L44 I103 I453 I454 P455 L459 Q460 N461	R41-T457 HydrophobicContact CG-CG2 3.48Å; R41-T457 VanDerWaalsContact CG-CG2 3.48Å; R41-T457 VanDerWaalsContact O-CG2 3.25Å; R41-T457 WeakPolarHBondContact O-CG2 3.49Å; L44-T457 HydrophobicContact CB-CG2 3.99Å; L44-T457 HydrophobicContact CD2-CG2 3.83Å; L44-T457 HydrophobicContact CG-CG2 4.48Å; I103-T457 HydrophobicContact CD1-CG2 4.44Å; I453-T457 VanDerWaalsContact O-CB 3.25Å; I453-T457 WeakPolarHBondContact O-CB 3.31Å; I453-T457 PolarHBondContact O-N 3.31Å; I453-T457 PolarHBondContact O-OG1 3.24Å; I454-T457 PolarHBondContact O-N 2.69Å; P455-T457 PolarHBondContact O-N 2.87Å; T457-L459 VanDerWaalsContact C-N 3.31Å; T457-L459 PolarHBondContact O-N 3.09Å; T457-Q460 WeakPolarHBondContact O-CB 3.23Å; T457-Q460 PolarHBondContact O-N 3.38Å; T457-N461 PolarHBondContact O-N 3.09Å
458	L	90.8	Very high	89.5	Confident	16 Å²	16	41.1 Å²	41.1	8%	0.084	22%	0.217	C	C	.	.	H	α-helix	trans	-59.2	-42.5	173.3	-68.6	175.5	0	0	0	111.7	L44 G45 I454 P455 S462	L44-L458 HydrophobicContact CG-CD2 4.29Å; G45-L458 VanDerWaalsContact CA-CD2 3.44Å; I454-L458 HydrophobicContact CG2-CD1 4.37Å; I454-L458 WeakPolarHBondContact O-CG 3.47Å; I454-L458 PolarHBondContact O-N 3.37Å; P455-L458 PolarHBondContact O-N 2.9Å; L458-S462 WeakPolarHBondContact O-CB 3.32Å; L458-S462 PolarHBondContact O-N 3.35Å; L458-S462 PolarHBondContact O-OG 3.12Å
459	L	92.2	Very high	89.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-45.4	174.8	-73.8	166.7	0	0	0	112.1	P455 R456 T457 N461 S462 G463 A464 I466 V469 I470 I487 G492	P455-L459 WeakPolarHBondContact O-CG 3.34Å; P455-L459 PolarHBondContact O-N 2.99Å; R456-L459 PolarHBondContact O-N 2.87Å; T457-L459 VanDerWaalsContact C-N 3.31Å; T457-L459 PolarHBondContact O-N 3.09Å; L459-N461 VanDerWaalsContact C-N 3.33Å; L459-N461 PolarHBondContact O-N 3.47Å; L459-S462 WeakPolarHBondContact CA-OG 3.41Å; L459-S462 PolarHBondContact O-N 2.67Å; L459-S462 VanDerWaalsContact O-N 3.15Å; L459-S462 PolarHBondContact O-OG 2.84Å; L459-G463 PolarHBondContact O-N 2.86Å; L459-G463 VanDerWaalsContact O-N 3.1Å; L459-A464 HydrophobicContact CD2-CB 3.91Å; L459-A464 PolarHBondContact O-N 3.06Å; L459-I466 HydrophobicContact CB-CG1 4.1Å; L459-V469 HydrophobicContact CD1-CB 3.88Å; L459-V469 HydrophobicContact CD1-CG1 3.97Å; L459-V469 HydrophobicContact CD2-CB 3.91Å; L459-V469 HydrophobicContact CD2-CG1 3.72Å; L459-V469 HydrophobicContact CD2-CG2 4.26Å; L459-V469 HydrophobicContact CG-CG1 4.47Å; L459-I470 HydrophobicContact CD1-CD1 4.22Å; L459-I470 HydrophobicContact CD1-CG1 3.56Å; L459-I487 HydrophobicContact CD1-CD1 3.48Å; L459-I487 VanDerWaalsContact CD1-CD1 3.48Å; L459-I487 HydrophobicContact CD2-CD1 3.93Å; L459-I487 HydrophobicContact CD2-CG2 3.6Å; L459-I487 HydrophobicContact CG-CD1 3.45Å; L459-I487 VanDerWaalsContact CG-CD1 3.45Å; L459-I487 HydrophobicContact CG-CG2 3.97Å; L459-G492 WeakPolarHBondContact CD2-O 3.39Å
460	Q	90.8	Very high	89.9	Confident	99 Å²	99	38.3 Å²	38.3	46%	0.463	20%	0.203	S	C	.	.	H	α-helix	trans	-57.3	-47.2	178.2	-174.5	175.6	-3.9	0	0	111.3	R456 T457 S462 G463 I466	R456-Q460 WeakPolarHBondContact O-CB 3.48Å; R456-Q460 PolarHBondContact O-N 2.93Å; T457-Q460 WeakPolarHBondContact O-CB 3.23Å; T457-Q460 PolarHBondContact O-N 3.38Å; Q460-S462 VanDerWaalsContact C-N 3.31Å; Q460-S462 PolarHBondContact O-N 3.02Å; Q460-G463 PolarHBondContact O-N 2.59Å; Q460-I466 HydrophobicContact CB-CD1 3.82Å; Q460-I466 HydrophobicContact CG-CD1 4.19Å
461	N	90.1	Very high	90.2	Very high	29 Å²	29	42 Å²	42	16%	0.155	23%	0.225	C	C	.	.	H	α-helix	trans	-72.3	-25.3	179.6	-65.3	-17	0	0	0	112.3	R41 L44 T457 L459 G463	R41-N461 PolarHBondContact O-ND2 2.94Å; L44-N461 PolarHBondContact O-ND2 3.03Å; T457-N461 PolarHBondContact O-N 3.09Å; L459-N461 VanDerWaalsContact C-N 3.33Å; L459-N461 PolarHBondContact O-N 3.47Å; N461-G463 VanDerWaalsContact C-N 3.33Å
462	S	88.4	Confident	90.3	Very high	11 Å²	11	43.1 Å²	43.1	8%	0.077	24%	0.236	C	C	.	.	H	α-helix	trans	-75.1	-20	173.7	75.3	0	0	0	0	114.1	R47 L458 L459 Q460 A464 G489 G492	R47-S462 PolarHBondContact NH1-O 3.06Å; R47-S462 VanDerWaalsContact NH1-O 3.11Å; L458-S462 WeakPolarHBondContact O-CB 3.32Å; L458-S462 PolarHBondContact O-N 3.35Å; L458-S462 PolarHBondContact O-OG 3.12Å; L459-S462 WeakPolarHBondContact CA-OG 3.41Å; L459-S462 PolarHBondContact O-N 2.67Å; L459-S462 VanDerWaalsContact O-N 3.15Å; L459-S462 PolarHBondContact O-OG 2.84Å; Q460-S462 VanDerWaalsContact C-N 3.31Å; Q460-S462 PolarHBondContact O-N 3.02Å; S462-A464 PolarHBondContact OG-N 2.81Å; S462-G489 WeakPolarHBondContact CB-O 3.49Å; S462-G492 WeakPolarHBondContact OG-CA 3.46Å
463	G	88.6	Confident	90.5	Very high	71 Å²	71	42.8 Å²	42.8	73%	0.732	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.3	13.3	-175.5	0	0	0	0	0	114.9	L459 Q460 N461	L459-G463 PolarHBondContact O-N 2.86Å; L459-G463 VanDerWaalsContact O-N 3.1Å; Q460-G463 PolarHBondContact O-N 2.59Å; N461-G463 VanDerWaalsContact C-N 3.33Å
464	A	88.8	Confident	90.6	Very high	27 Å²	27	46.4 Å²	46.4	22%	0.223	25%	0.247	C	C	.	.			trans	-84.5	164.9	-178.7	0	0	0	0	0	113.4	L459 S462 I466 G492	L459-A464 HydrophobicContact CD2-CB 3.91Å; L459-A464 PolarHBondContact O-N 3.06Å; S462-A464 PolarHBondContact OG-N 2.81Å; A464-I466 PolarHBondContact O-N 3.05Å; A464-G492 WeakPolarHBondContact CB-O 3.38Å
465	D	89.9	Confident	90.7	Very high	86 Å²	86	49.1 Å²	49.1	46%	0.46	27%	0.27	S	S	.	.			trans	-70.9	101.2	173.3	-176.6	-14.5	0	0	0	110.8	I467 R468 V469	D465-I467 PolarHBondContact O-N 2.82Å; D465-I467 PolarHBondContact OD1-N 3Å; D465-I467 VanDerWaalsContact OD1-N 3.17Å; D465-R468 HydrophobicContact CB-CB 4.26Å; D465-R468 PolarHBondContact OD1-N 3.08Å; D465-V469 WeakPolarHBondContact O-CG2 3.45Å; D465-V469 PolarHBondContact O-N 2.91Å
466	I	90.1	Very high	90.7	Very high	41 Å²	41	53.1 Å²	53.1	21%	0.21	29%	0.287	C	S	.	.	H	α-helix	trans	-56.8	-47.7	-176.1	-60.6	173.7	0	0	0	111.7	R456 L459 Q460 A464 I470	R456-I466 HydrophobicContact CG-CG2 3.62Å; L459-I466 HydrophobicContact CB-CG1 4.1Å; Q460-I466 HydrophobicContact CB-CD1 3.82Å; Q460-I466 HydrophobicContact CG-CD1 4.19Å; A464-I466 PolarHBondContact O-N 3.05Å; I466-I470 HydrophobicContact CG2-CD1 3.6Å; I466-I470 HydrophobicContact CG2-CG1 4.4Å; I466-I470 WeakPolarHBondContact O-CB 3.03Å; I466-I470 VanDerWaalsContact O-CG1 3.29Å; I466-I470 WeakPolarHBondContact O-CG1 3.2Å; I466-I470 PolarHBondContact O-N 3.44Å
467	I	90.7	Very high	90.6	Very high	125 Å²	125	50.3 Å²	50.3	64%	0.641	28%	0.277	S	S	*	.	H	α-helix	trans	-69.1	-46.4	-169.8	-62.2	173.9	0	0	0	109.5	D465 T471	D465-I467 PolarHBondContact O-N 2.82Å; D465-I467 PolarHBondContact OD1-N 3Å; D465-I467 VanDerWaalsContact OD1-N 3.17Å; I467-T471 WeakPolarHBondContact O-CB 3.42Å; I467-T471 PolarHBondContact O-N 2.78Å; I467-T471 VanDerWaalsContact O-N 3.15Å; I467-T471 PolarHBondContact O-OG1 2.68Å
468	R	92.5	Very high	90.5	Very high	178 Å²	178	54.4 Å²	54.4	67%	0.672	30%	0.302	S	S	*	.	H	α-helix	trans	-64	-46.5	-178.4	-170.4	-178.3	73.5	173.2	2.7	111.7	D465 A472	D465-R468 HydrophobicContact CB-CB 4.26Å; D465-R468 PolarHBondContact OD1-N 3.08Å; R468-A472 WeakPolarHBondContact O-CB 3.01Å; R468-A472 PolarHBondContact O-N 3.18Å
469	V	91.5	Very high	90.3	Very high	12 Å²	12	59.5 Å²	59.5	7%	0.073	33%	0.326	C	S	.	.	H	α-helix	trans	-72.9	-43.2	-174.6	-179.1	0	0	0	0	111.7	L459 D465 T471 A472 L473 M494	L459-V469 HydrophobicContact CD1-CB 3.88Å; L459-V469 HydrophobicContact CD1-CG1 3.97Å; L459-V469 HydrophobicContact CD2-CB 3.91Å; L459-V469 HydrophobicContact CD2-CG1 3.72Å; L459-V469 HydrophobicContact CD2-CG2 4.26Å; L459-V469 HydrophobicContact CG-CG1 4.47Å; D465-V469 WeakPolarHBondContact O-CG2 3.45Å; D465-V469 PolarHBondContact O-N 2.91Å; V469-T471 VanDerWaalsContact C-N 3.35Å; V469-T471 PolarHBondContact O-N 2.92Å; V469-A472 PolarHBondContact O-N 2.87Å; V469-L473 VanDerWaalsContact O-CB 3.3Å; V469-L473 WeakPolarHBondContact O-CB 3.33Å; V469-L473 PolarHBondContact O-N 3.44Å; V469-M494 HydrophobicContact CG1-CG 3.83Å
470	I	91.2	Very high	89.5	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.015	37%	0.368	C	S	.	.	H	α-helix	trans	-61.9	-43.7	176.5	-70.2	177.6	0	0	0	111.2	M423 R456 L459 I466 A472 L473 R474	M423-I470 HydrophobicContact CE-CG2 4.5Å; R456-I470 HydrophobicContact CB-CD1 3.57Å; R456-I470 HydrophobicContact CG-CD1 3.73Å; L459-I470 HydrophobicContact CD1-CD1 4.22Å; L459-I470 HydrophobicContact CD1-CG1 3.56Å; I466-I470 HydrophobicContact CG2-CD1 3.6Å; I466-I470 HydrophobicContact CG2-CG1 4.4Å; I466-I470 WeakPolarHBondContact O-CB 3.03Å; I466-I470 VanDerWaalsContact O-CG1 3.29Å; I466-I470 WeakPolarHBondContact O-CG1 3.2Å; I466-I470 PolarHBondContact O-N 3.44Å; I470-A472 VanDerWaalsContact C-N 3.31Å; I470-A472 PolarHBondContact O-N 3.36Å; I470-L473 PolarHBondContact O-N 2.95Å; I470-L473 VanDerWaalsContact O-N 3.16Å; I470-R474 HydrophobicContact CG2-CG 4.24Å; I470-R474 WeakPolarHBondContact O-CG 3.21Å; I470-R474 PolarHBondContact O-N 3.28Å
471	T	92	Very high	88.9	Confident	82 Å²	82	63 Å²	63	50%	0.503	38%	0.378	S	S	.	.	H	α-helix	trans	-61.5	-42.5	-179.9	-56	0	0	0	0	111.1	I467 V469 A475	I467-T471 WeakPolarHBondContact O-CB 3.42Å; I467-T471 PolarHBondContact O-N 2.78Å; I467-T471 VanDerWaalsContact O-N 3.15Å; I467-T471 PolarHBondContact O-OG1 2.68Å; V469-T471 VanDerWaalsContact C-N 3.35Å; V469-T471 PolarHBondContact O-N 2.92Å; T471-A475 PolarHBondContact O-N 3.37Å
472	A	92	Very high	88.5	Confident	33 Å²	33	64 Å²	64	27%	0.273	38%	0.383	S	S	.	.	H	α-helix	trans	-67.2	-37.6	175	0	0	0	0	0	112.6	R468 V469 I470 A475 K476 M494	R468-A472 WeakPolarHBondContact O-CB 3.01Å; R468-A472 PolarHBondContact O-N 3.18Å; V469-A472 PolarHBondContact O-N 2.87Å; I470-A472 VanDerWaalsContact C-N 3.31Å; I470-A472 PolarHBondContact O-N 3.36Å; A472-A475 PolarHBondContact O-N 2.99Å; A472-K476 WeakPolarHBondContact O-CG 3.39Å; A472-K476 PolarHBondContact O-N 2.88Å; A472-K476 VanDerWaalsContact O-N 3.16Å; A472-M494 HydrophobicContact CB-CE 3.57Å; A472-M494 HydrophobicContact CB-SD 3.91Å
473	L	91.4	Very high	88.2	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-65.7	-44.8	178.7	-169.2	64.7	0	0	0	111.5	M423 P455 V469 I470 A475 K476 H477 L485 I487 M494	M423-L473 HydrophobicContact CE-CB 4.48Å; M423-L473 HydrophobicContact CE-CD2 3.86Å; M423-L473 HydrophobicContact CE-CG 4.19Å; M423-L473 HydrophobicContact CG-CD2 4.39Å; M423-L473 HydrophobicContact CG-CG 4.25Å; P455-L473 HydrophobicContact CB-CD2 4.32Å; V469-L473 VanDerWaalsContact O-CB 3.3Å; V469-L473 WeakPolarHBondContact O-CB 3.33Å; V469-L473 PolarHBondContact O-N 3.44Å; I470-L473 PolarHBondContact O-N 2.95Å; I470-L473 VanDerWaalsContact O-N 3.16Å; L473-A475 PolarHBondContact O-N 2.9Å; L473-K476 PolarHBondContact O-N 2.86Å; L473-H477 VanDerWaalsContact CD1-CE1 3.46Å; L473-H477 WeakPolarHBondContact CD1-CE1 3.23Å; L473-H477 PolarHBondContact O-N 3.46Å; L473-H477 PolarHBondContact O-ND1 2.99Å; L473-L485 HydrophobicContact CD1-CB 4.45Å; L473-L485 HydrophobicContact CD1-CD2 3.78Å; L473-L485 HydrophobicContact CD1-CG 3.84Å; L473-I487 HydrophobicContact CD2-CD1 3.85Å; L473-I487 HydrophobicContact CD2-CG1 3.77Å; L473-M494 HydrophobicContact CB-SD 4.14Å; L473-M494 HydrophobicContact CD1-CG 4.07Å; L473-M494 HydrophobicContact CD1-SD 4.11Å
474	R	89.9	Confident	88.2	Confident	84 Å²	84	66 Å²	66	32%	0.317	37%	0.374	S	S	.	.	H	α-helix	trans	-57.6	-46.9	174.4	-73.2	172.6	178.1	-176.1	-5.3	111.8	M423 E452 I470 K476 H477 T478	M423-R474 HydrophobicContact CE-CG 4.05Å; M423-R474 HydrophobicContact SD-CG 3.92Å; E452-R474 VanDerWaalsContact CD-NH2 3.28Å; E452-R474 IonicContact OE1-CZ 3.35Å; E452-R474 IonicContact OE1-NE 2.83Å; E452-R474 PolarHBondContact OE1-NE 2.66Å; E452-R474 IonicContact OE1-NH2 2.74Å; E452-R474 PolarHBondContact OE1-NH2 2.86Å; E452-R474 IonicContact OE2-CZ 3.01Å; E452-R474 IonicContact OE2-NE 2.69Å; E452-R474 PolarHBondContact OE2-NE 3.27Å; E452-R474 IonicContact OE2-NH2 3.1Å; E452-R474 PolarHBondContact OE2-NH2 2.8Å; I470-R474 HydrophobicContact CG2-CG 4.24Å; I470-R474 WeakPolarHBondContact O-CG 3.21Å; I470-R474 PolarHBondContact O-N 3.28Å; R474-K476 VanDerWaalsContact C-N 3.31Å; R474-K476 PolarHBondContact O-N 2.84Å; R474-H477 PolarHBondContact O-N 3.41Å; R474-T478 PolarHBondContact O-N 2.87Å; R474-T478 PolarHBondContact O-OG1 3.29Å; R474-T478 VanDerWaalsContact O-OG1 3.06Å
475	A	90.9	Very high	88.3	Confident	59 Å²	59	65.6 Å²	65.6	49%	0.488	37%	0.369	S	S	.	.	H	α-helix	trans	-59.3	-43.6	179.7	0	0	0	0	0	111.5	T471 A472 L473 T478	T471-A475 PolarHBondContact O-N 3.37Å; A472-A475 PolarHBondContact O-N 2.99Å; L473-A475 PolarHBondContact O-N 2.9Å; A475-T478 WeakPolarHBondContact O-CB 3.43Å; A475-T478 PolarHBondContact O-N 2.95Å
476	K	91.2	Very high	88.4	Confident	84 Å²	84	61.5 Å²	61.5	37%	0.365	35%	0.347	S	S	.	.	H	α-helix	trans	-68.9	-36.2	178.5	-71.7	-178.1	177.4	-175.4	0	113.8	A472 L473 R474 T478 E479 N482 L485 M494	A472-K476 WeakPolarHBondContact O-CG 3.39Å; A472-K476 PolarHBondContact O-N 2.88Å; A472-K476 VanDerWaalsContact O-N 3.16Å; L473-K476 PolarHBondContact O-N 2.86Å; R474-K476 VanDerWaalsContact C-N 3.31Å; R474-K476 PolarHBondContact O-N 2.84Å; K476-T478 PolarHBondContact O-N 2.94Å; K476-E479 WeakPolarHBondContact O-CB 3.32Å; K476-E479 PolarHBondContact O-N 3.02Å; K476-E479 VanDerWaalsContact O-N 3.12Å; K476-N482 VanDerWaalsContact O-CB 3.31Å; K476-N482 WeakPolarHBondContact O-CB 3.35Å; K476-N482 PolarHBondContact O-ND2 3.46Å; K476-L485 HydrophobicContact CB-CD2 3.64Å; K476-L485 HydrophobicContact CD-CD2 3.34Å; K476-L485 HydrophobicContact CG-CD2 4.16Å; K476-M494 HydrophobicContact CD-SD 4.07Å
477	H	89.5	Confident	88.5	Confident	16 Å²	16	59.7 Å²	59.7	7%	0.074	34%	0.338	C	S	.	.	H	α-helix	trans	-70	-18.2	176.9	-79.8	80.9	0	0	0	113.8	M423 L473 R474 L485	M423-H477 HydrophobicContact CG-CB 4.11Å; M423-H477 VanDerWaalsContact CG-CE1 3.44Å; M423-H477 WeakPolarHBondContact CG-CE1 3.42Å; M423-H477 VanDerWaalsContact CG-CG 3.46Å; M423-H477 WeakPolarHBondContact CG-ND1 3.34Å; L473-H477 VanDerWaalsContact CD1-CE1 3.46Å; L473-H477 WeakPolarHBondContact CD1-CE1 3.23Å; L473-H477 PolarHBondContact O-N 3.46Å; L473-H477 PolarHBondContact O-ND1 2.99Å; R474-H477 PolarHBondContact O-N 3.41Å; H477-L485 PolarHBondContact CE1-O 3.15Å; H477-L485 PolarHBondContact NE2-O 2.89Å; H477-L485 VanDerWaalsContact NE2-O 3.09Å
478	T	87.7	Confident	88.5	Confident	86 Å²	86	55.3 Å²	55.3	53%	0.528	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-23.2	172.2	-51.3	0	0	0	0	111.3	R474 A475 K476	R474-T478 PolarHBondContact O-N 2.87Å; R474-T478 PolarHBondContact O-OG1 3.29Å; R474-T478 VanDerWaalsContact O-OG1 3.06Å; A475-T478 WeakPolarHBondContact O-CB 3.43Å; A475-T478 PolarHBondContact O-N 2.95Å; K476-T478 PolarHBondContact O-N 2.94Å
479	E	86.7	Confident	88.1	Confident	123 Å²	123	47.2 Å²	47.2	58%	0.575	29%	0.287	S	S	*	.	S	Bend	trans	-82.3	133.9	174.9	-59.7	173.8	-179.6	0	0	110.5	K476 G481 N482	K476-E479 WeakPolarHBondContact O-CB 3.32Å; K476-E479 PolarHBondContact O-N 3.02Å; K476-E479 VanDerWaalsContact O-N 3.12Å; E479-G481 PolarHBondContact O-N 2.87Å; E479-N482 PolarHBondContact OE2-ND2 3.32Å
480	A	76.4	Confident	87.9	Confident	108 Å²	108	51.2 Å²	51.2	89%	0.893	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	134.3	-178.6	0	0	0	0	0	112.1
481	G	77.5	Confident	87.7	Confident	64 Å²	64	54.7 Å²	54.7	66%	0.66	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.7	-3	176	0	0	0	0	0	115.7	E479	E479-G481 PolarHBondContact O-N 2.87Å
482	N	82	Confident	87.5	Confident	51 Å²	51	50.9 Å²	50.9	27%	0.273	31%	0.306	S	S	.	.			trans	-96.9	18.8	179.3	-69.5	-34.6	0	0	0	114	K476 E479 T484 L485	K476-N482 VanDerWaalsContact O-CB 3.31Å; K476-N482 WeakPolarHBondContact O-CB 3.35Å; K476-N482 PolarHBondContact O-ND2 3.46Å; E479-N482 PolarHBondContact OE2-ND2 3.32Å; N482-T484 PolarHBondContact O-N 3.5Å; N482-T484 VanDerWaalsContact O-N 3.14Å; N482-L485 VanDerWaalsContact O-CB 3.25Å; N482-L485 WeakPolarHBondContact O-CB 3.45Å; N482-L485 PolarHBondContact O-N 3.31Å
483	E	82.7	Confident	87.4	Confident	92 Å²	92	55.6 Å²	55.6	43%	0.43	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-19.7	-177.5	-62.6	176.4	-172.6	0	0	113.8	A424	A424-E483 HydrophobicContact CB-CB 4.26Å; A424-E483 HydrophobicContact CB-CG 4.47Å
484	T	88	Confident	87.4	Confident	31 Å²	31	58.3 Å²	58.3	19%	0.19	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	1.6	178.4	63.3	0	0	0	0	113.2	P416 N482 G486 D496 M497 N498	P416-T484 HydrophobicContact CB-CG2 4.24Å; P416-T484 HydrophobicContact CG-CG2 4.29Å; N482-T484 PolarHBondContact O-N 3.5Å; N482-T484 VanDerWaalsContact O-N 3.14Å; T484-G486 PolarHBondContact O-N 2.9Å; T484-D496 WeakPolarHBondContact CB-OD1 3.33Å; T484-D496 PolarHBondContact OG1-OD1 3.11Å; T484-M497 WeakPolarHBondContact O-CB 3.29Å; T484-M497 VanDerWaalsContact O-CG 3.32Å; T484-M497 WeakPolarHBondContact O-CG 2.93Å; T484-M497 PolarHBondContact O-N 3.49Å; T484-N498 WeakPolarHBondContact CB-ND2 3.48Å; T484-N498 WeakPolarHBondContact CG2-ND2 3.42Å; T484-N498 PolarHBondContact OG1-ND2 2.96Å; T484-N498 VanDerWaalsContact OG1-ND2 3.09Å
485	L	91.3	Very high	87.4	Confident	20 Å²	20	55.4 Å²	55.4	11%	0.105	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	117.3	177.9	-169.4	72.5	0	0	0	109.2	A420 L473 K476 H477 N482 M494	A420-L485 WeakPolarHBondContact CB-O 3.44Å; L473-L485 HydrophobicContact CD1-CB 4.45Å; L473-L485 HydrophobicContact CD1-CD2 3.78Å; L473-L485 HydrophobicContact CD1-CG 3.84Å; K476-L485 HydrophobicContact CB-CD2 3.64Å; K476-L485 HydrophobicContact CD-CD2 3.34Å; K476-L485 HydrophobicContact CG-CD2 4.16Å; H477-L485 PolarHBondContact CE1-O 3.15Å; H477-L485 PolarHBondContact NE2-O 2.89Å; H477-L485 VanDerWaalsContact NE2-O 3.09Å; N482-L485 VanDerWaalsContact O-CB 3.25Å; N482-L485 WeakPolarHBondContact O-CB 3.45Å; N482-L485 PolarHBondContact O-N 3.31Å; L485-M494 HydrophobicContact CD1-CB 4.47Å; L485-M494 HydrophobicContact CD2-SD 4.49Å
486	G	91.6	Very high	87.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	-159.6	178.6	0	0	0	0	0	111.5	T484 M494 A495	T484-G486 PolarHBondContact O-N 2.9Å; G486-M494 WeakPolarHBondContact O-CA 3.41Å; G486-A495 PolarHBondContact N-O 2.91Å; G486-A495 PolarHBondContact O-N 3.47Å
487	I	92.1	Very high	87.4	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.015	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	126.3	178.1	-54	-169.1	0	0	0	108.5	G418 P455 L459 L473 G489	G418-I487 PolarHBondContact O-N 3.05Å; P455-I487 HydrophobicContact CB-CD1 3.43Å; P455-I487 VanDerWaalsContact CB-CD1 3.43Å; P455-I487 HydrophobicContact CB-CG1 4.15Å; P455-I487 WeakPolarHBondContact O-CD1 3.26Å; L459-I487 HydrophobicContact CD1-CD1 3.48Å; L459-I487 VanDerWaalsContact CD1-CD1 3.48Å; L459-I487 HydrophobicContact CD2-CD1 3.93Å; L459-I487 HydrophobicContact CD2-CG2 3.6Å; L459-I487 HydrophobicContact CG-CD1 3.45Å; L459-I487 VanDerWaalsContact CG-CD1 3.45Å; L459-I487 HydrophobicContact CG-CG2 3.97Å; L473-I487 HydrophobicContact CD2-CD1 3.85Å; L473-I487 HydrophobicContact CD2-CG1 3.77Å; I487-G489 PolarHBondContact O-N 3.28Å
488	N	90.5	Very high	87.2	Confident	33 Å²	33	52.8 Å²	52.8	18%	0.176	31%	0.312	C	S	.	.			trans	-74.6	106.9	168.8	-177.5	-16.6	0	0	0	108.8	I490 T491 G492 E493 A495 L500	N488-I490 PolarHBondContact O-N 2.6Å; N488-I490 VanDerWaalsContact O-N 3.08Å; N488-I490 WeakPolarHBondContact OD1-CB 3.48Å; N488-I490 PolarHBondContact OD1-N 3.16Å; N488-T491 WeakPolarHBondContact CB-OG1 3.46Å; N488-T491 PolarHBondContact ND2-OG1 3.2Å; N488-T491 PolarHBondContact O-N 3.44Å; N488-G492 WeakPolarHBondContact O-CA 3.36Å; N488-G492 PolarHBondContact O-N 3.18Å; N488-E493 PolarHBondContact N-O 3.07Å; N488-A495 HydrophobicContact CB-CB 4.16Å; N488-L500 HydrophobicContact CB-CD1 3.99Å
489	G	84.8	Confident	87.3	Confident	8 Å²	8	56.8 Å²	56.8	8%	0.082	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-13.2	-177.8	0	0	0	0	0	115.1	S462 I487	S462-G489 WeakPolarHBondContact CB-O 3.49Å; I487-G489 PolarHBondContact O-N 3.28Å
490	I	86	Confident	87.3	Confident	95 Å²	95	54.6 Å²	54.6	49%	0.487	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-48.5	176.1	-57	173.7	0	0	0	110.8	P46 R47 N488	P46-I490 HydrophobicContact CB-CG1 4.27Å; P46-I490 HydrophobicContact CG-CG1 4.19Å; R47-I490 PolarHBondContact NE-O 2.86Å; R47-I490 PolarHBondContact NH1-O 2.98Å; R47-I490 VanDerWaalsContact NH1-O 3.08Å; R47-I490 PolarHBondContact NH2-O 3.29Å; N488-I490 PolarHBondContact O-N 2.6Å; N488-I490 VanDerWaalsContact O-N 3.08Å; N488-I490 WeakPolarHBondContact OD1-CB 3.48Å; N488-I490 PolarHBondContact OD1-N 3.16Å
491	T	87.6	Confident	87.8	Confident	77 Å²	77	52.5 Å²	52.5	47%	0.472	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-22.7	-176.8	61.2	0	0	0	0	113	N488 E493	N488-T491 WeakPolarHBondContact CB-OG1 3.46Å; N488-T491 PolarHBondContact ND2-OG1 3.2Å; N488-T491 PolarHBondContact O-N 3.44Å; T491-E493 VanDerWaalsContact C-N 3.27Å; T491-E493 PolarHBondContact OG1-N 3.17Å
492	G	87	Confident	88.4	Confident	2 Å²	2	51.4 Å²	51.4	2%	0.021	27%	0.268	C	S	.	.			trans	74.4	16.8	-173.4	0	0	0	0	0	113.7	L459 S462 A464 N488	L459-G492 WeakPolarHBondContact CD2-O 3.39Å; S462-G492 WeakPolarHBondContact OG-CA 3.46Å; A464-G492 WeakPolarHBondContact CB-O 3.38Å; N488-G492 WeakPolarHBondContact O-CA 3.36Å; N488-G492 PolarHBondContact O-N 3.18Å
493	E	90.3	Very high	88.8	Confident	131 Å²	131	49.7 Å²	49.7	61%	0.612	26%	0.257	S	S	*	.	S	Bend	trans	-105.9	158.5	-179.5	-62.2	-175.7	159	0	0	112	N488 T491 A495	N488-E493 PolarHBondContact N-O 3.07Å; T491-E493 VanDerWaalsContact C-N 3.27Å; T491-E493 PolarHBondContact OG1-N 3.17Å; E493-A495 PolarHBondContact O-N 3.29Å
494	M	91.5	Very high	89.1	Confident	58 Å²	58	45.9 Å²	45.9	29%	0.286	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	127.7	173.1	-62.1	179.8	-80.4	0	0	109.9	V469 A472 L473 K476 L485 G486	V469-M494 HydrophobicContact CG1-CG 3.83Å; A472-M494 HydrophobicContact CB-CE 3.57Å; A472-M494 HydrophobicContact CB-SD 3.91Å; L473-M494 HydrophobicContact CB-SD 4.14Å; L473-M494 HydrophobicContact CD1-CG 4.07Å; L473-M494 HydrophobicContact CD1-SD 4.11Å; K476-M494 HydrophobicContact CD-SD 4.07Å; L485-M494 HydrophobicContact CD1-CB 4.47Å; L485-M494 HydrophobicContact CD2-SD 4.49Å; G486-M494 WeakPolarHBondContact O-CA 3.41Å
495	A	90.7	Very high	89.3	Confident	22 Å²	22	44.4 Å²	44.4	18%	0.182	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151.9	178.3	0	0	0	0	0	110.6	G486 N488 E493 M497 L500	G486-A495 PolarHBondContact N-O 2.91Å; G486-A495 PolarHBondContact O-N 3.47Å; N488-A495 HydrophobicContact CB-CB 4.16Å; E493-A495 PolarHBondContact O-N 3.29Å; A495-M497 HydrophobicContact CB-CE 4.06Å; A495-M497 WeakPolarHBondContact O-CE 3.32Å; A495-M497 PolarHBondContact O-N 3.4Å; A495-L500 HydrophobicContact CB-CD1 3.45Å; A495-L500 VanDerWaalsContact CB-CD1 3.45Å; A495-L500 HydrophobicContact CB-CG 4.2Å
496	D	91.9	Very high	89.4	Confident	42 Å²	42	43.5 Å²	43.5	23%	0.225	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	119.4	174.2	-178.5	4.7	0	0	0	109.3	T484 N498 K499 L500	T484-D496 WeakPolarHBondContact CB-OD1 3.33Å; T484-D496 PolarHBondContact OG1-OD1 3.11Å; D496-N498 PolarHBondContact O-N 2.94Å; D496-N498 WeakPolarHBondContact OD1-CB 3.43Å; D496-N498 PolarHBondContact OD1-N 3.45Å; D496-N498 VanDerWaalsContact OD1-N 3.15Å; D496-K499 HydrophobicContact CB-CB 4.43Å; D496-K499 HydrophobicContact CB-CD 4.11Å; D496-K499 HydrophobicContact CB-CG 4.1Å; D496-K499 PolarHBondContact O-N 3.19Å; D496-L500 PolarHBondContact O-N 3.11Å
497	M	89.2	Confident	89.4	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-65.4	-26	-176.5	-62.9	-62.2	102.6	0	0	112	P416 G417 A420 T484 A495 K499 L500 N501 V502	P416-M497 HydrophobicContact CB-CB 3.94Å; P416-M497 HydrophobicContact CB-CG 4.38Å; G417-M497 VanDerWaalsContact O-CG 3.3Å; G417-M497 WeakPolarHBondContact O-CG 3.39Å; A420-M497 HydrophobicContact CB-CG 3.94Å; T484-M497 WeakPolarHBondContact O-CB 3.29Å; T484-M497 VanDerWaalsContact O-CG 3.32Å; T484-M497 WeakPolarHBondContact O-CG 2.93Å; T484-M497 PolarHBondContact O-N 3.49Å; A495-M497 HydrophobicContact CB-CE 4.06Å; A495-M497 WeakPolarHBondContact O-CE 3.32Å; A495-M497 PolarHBondContact O-N 3.4Å; M497-K499 VanDerWaalsContact C-N 3.28Å; M497-K499 PolarHBondContact O-N 3.15Å; M497-L500 HydrophobicContact CE-CD1 3.91Å; M497-L500 PolarHBondContact O-N 2.77Å; M497-N501 PolarHBondContact O-N 2.87Å; M497-V502 PolarHBondContact O-N 3.48Å; M497-V502 HydrophobicContact SD-CB 3.93Å; M497-V502 HydrophobicContact SD-CG1 4.16Å
498	N	87.1	Confident	89.4	Confident	61 Å²	61	45.8 Å²	45.8	33%	0.326	24%	0.24	S	C	.	.	H	α-helix	trans	-61.4	-38	171.8	-70.1	-30.4	0	0	0	112.1	T484 D496 N501 W503	T484-N498 WeakPolarHBondContact CB-ND2 3.48Å; T484-N498 WeakPolarHBondContact CG2-ND2 3.42Å; T484-N498 PolarHBondContact OG1-ND2 2.96Å; T484-N498 VanDerWaalsContact OG1-ND2 3.09Å; D496-N498 PolarHBondContact O-N 2.94Å; D496-N498 WeakPolarHBondContact OD1-CB 3.43Å; D496-N498 PolarHBondContact OD1-N 3.45Å; D496-N498 VanDerWaalsContact OD1-N 3.15Å; N498-N501 PolarHBondContact O-OD1 3.22Å; N498-W503 WeakPolarHBondContact OD1-CH2 3.4Å; N498-W503 VanDerWaalsContact OD1-CZ2 3.27Å; N498-W503 WeakPolarHBondContact OD1-CZ2 3.38Å
499	K	88.6	Confident	89.4	Confident	171 Å²	171	45.6 Å²	45.6	74%	0.743	24%	0.237	S	C	*	.	H	α-helix	trans	-79.6	-33.1	-178.2	-63.5	-178.2	-173.6	176	0	111.9	D496 M497 N501	D496-K499 HydrophobicContact CB-CB 4.43Å; D496-K499 HydrophobicContact CB-CD 4.11Å; D496-K499 HydrophobicContact CB-CG 4.1Å; D496-K499 PolarHBondContact O-N 3.19Å; M497-K499 VanDerWaalsContact C-N 3.28Å; M497-K499 PolarHBondContact O-N 3.15Å; K499-N501 VanDerWaalsContact C-N 3.32Å
500	L	87.3	Confident	89.8	Confident	76 Å²	76	45.8 Å²	45.8	40%	0.398	24%	0.237	S	C	.	.	H	α-helix	trans	-83	-7.9	176.7	-66.9	-177.9	0	0	0	113.4	N488 A495 D496 M497 V502	N488-L500 HydrophobicContact CB-CD1 3.99Å; A495-L500 HydrophobicContact CB-CD1 3.45Å; A495-L500 VanDerWaalsContact CB-CD1 3.45Å; A495-L500 HydrophobicContact CB-CG 4.2Å; D496-L500 PolarHBondContact O-N 3.11Å; M497-L500 HydrophobicContact CE-CD1 3.91Å; M497-L500 PolarHBondContact O-N 2.77Å; L500-V502 VanDerWaalsContact C-N 3.25Å; L500-V502 HydrophobicContact CB-CG2 3.89Å; L500-V502 PolarHBondContact O-N 3.45Å
501	N	86.5	Confident	90.1	Very high	65 Å²	65	44 Å²	44	35%	0.348	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	39.1	-174.9	-68.2	-40.2	0	0	0	113.4	H161 M497 N498 K499 W503	H161-N501 HydrophobicContact CB-CB 4.27Å; M497-N501 PolarHBondContact O-N 2.87Å; N498-N501 PolarHBondContact O-OD1 3.22Å; K499-N501 VanDerWaalsContact C-N 3.32Å; N501-W503 VanDerWaalsContact C-CD1 3.43Å
502	V	89.5	Confident	90.3	Very high	41 Å²	41	40.4 Å²	40.4	25%	0.248	20%	0.204	C	C	.	.			trans	-98.1	108.3	177.7	179	0	0	0	0	108.2	S165 G417 M497 L500	S165-V502 VanDerWaalsContact OG-CG1 3.26Å; S165-V502 WeakPolarHBondContact OG-CG1 3.37Å; G417-V502 PolarHBondContact N-O 3.19Å; M497-V502 PolarHBondContact O-N 3.48Å; M497-V502 HydrophobicContact SD-CB 3.93Å; M497-V502 HydrophobicContact SD-CG1 4.16Å; L500-V502 VanDerWaalsContact C-N 3.25Å; L500-V502 HydrophobicContact CB-CG2 3.89Å; L500-V502 PolarHBondContact O-N 3.45Å
503	W	90.3	Very high	90.5	Very high	14 Å²	14	40.4 Å²	40.4	5%	0.053	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	136.6	-170.8	-62	104.8	0	0	0	110.1	K149 V162 S165 V414 L415 P416 N498 N501	K149-W503 HydrophobicContact CB-CZ3 4.36Å; K149-W503 HydrophobicContact CD-CH2 3.43Å; K149-W503 VanDerWaalsContact CD-CH2 3.43Å; K149-W503 HydrophobicContact CD-CZ2 4.02Å; K149-W503 HydrophobicContact CD-CZ3 3.92Å; V162-W503 HydrophobicContact CG2-CB 4.11Å; S165-W503 VanDerWaalsContact CB-O 3.27Å; S165-W503 WeakPolarHBondContact CB-O 3.49Å; S165-W503 PolarHBondContact OG-N 3.34Å; S165-W503 VanDerWaalsContact OG-N 3.09Å; S165-W503 PolarHBondContact OG-O 3.31Å; S165-W503 VanDerWaalsContact OG-O 3.12Å; V414-W503 HydrophobicContact CB-CB 4.18Å; V414-W503 HydrophobicContact CB-CE3 4.3Å; V414-W503 HydrophobicContact CG1-CB 4.49Å; V414-W503 HydrophobicContact CG2-CB 4.22Å; V414-W503 HydrophobicContact CG2-CD2 3.94Å; V414-W503 HydrophobicContact CG2-CE3 3.51Å; V414-W503 HydrophobicContact CG2-CG 4.26Å; V414-W503 HydrophobicContact CG2-CZ3 4.1Å; L415-W503 WeakPolarHBondContact O-CA 3.36Å; P416-W503 HydrophobicContact CB-CZ3 4.43Å; N498-W503 WeakPolarHBondContact OD1-CH2 3.4Å; N498-W503 VanDerWaalsContact OD1-CZ2 3.27Å; N498-W503 WeakPolarHBondContact OD1-CZ2 3.38Å; N501-W503 VanDerWaalsContact C-CD1 3.43Å
504	D	90.4	Very high	90.5	Very high	12 Å²	12	37.6 Å²	37.6	6%	0.064	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	141	174.4	-64.3	-35.2	0	0	0	110.4	V414 L415 G417 L506 R509	V414-D504 CarbonylContact C-O 3.59Å; V414-D504 VanDerWaalsContact CA-O 3.3Å; V414-D504 WeakPolarHBondContact CA-O 3.46Å; V414-D504 WeakPolarHBondContact CB-O 3.13Å; L415-D504 PolarHBondContact N-O 3.38Å; L415-D504 PolarHBondContact O-N 2.91Å; G417-D504 WeakPolarHBondContact CA-OD2 3.45Å; D504-L506 PolarHBondContact O-N 3.01Å; D504-R509 HydrophobicContact CB-CG 3.92Å; D504-R509 IonicContact OD1-NH2 2.74Å; D504-R509 IonicContact OD2-CZ 3.94Å; D504-R509 IonicContact OD2-NE 2.59Å; D504-R509 PolarHBondContact OD2-NE 3.43Å; D504-R509 IonicContact OD2-NH2 2.91Å; D504-R509 PolarHBondContact OD2-NH2 3.47Å
505	P	91.7	Very high	90.5	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	132.1	175.7	-20.4	30.8	0	0	0	111.5	V162 V404 N407 V408 T507 V508 R509	V162-P505 HydrophobicContact CG1-CG 4.2Å; V404-P505 HydrophobicContact CG1-CG 3.93Å; N407-P505 HydrophobicContact CB-CB 4.34Å; V408-P505 HydrophobicContact CG2-CB 4.25Å; V408-P505 HydrophobicContact CG2-CG 4.03Å; P505-T507 PolarHBondContact O-N 3.04Å; P505-V508 HydrophobicContact CB-CB 4.43Å; P505-V508 HydrophobicContact CB-CG2 3.9Å; P505-V508 HydrophobicContact CG-CG2 4.08Å; P505-V508 PolarHBondContact O-N 2.77Å; P505-V508 VanDerWaalsContact O-N 3.12Å; P505-R509 PolarHBondContact O-N 3.4Å
506	L	92.3	Very high	90.5	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-55.8	-42.3	179.4	175.3	67.6	0	0	0	111.5	C143 K413 L415 D504 V508 R509 V510	C143-L506 HydrophobicContact CB-CD1 4.01Å; K413-L506 HydrophobicContact CB-CB 3.9Å; K413-L506 HydrophobicContact CB-CD2 3.57Å; K413-L506 HydrophobicContact CB-CG 4.38Å; K413-L506 HydrophobicContact CD-CD2 3.57Å; K413-L506 HydrophobicContact CG-CD2 4.22Å; K413-L506 VanDerWaalsContact O-CB 3.25Å; K413-L506 WeakPolarHBondContact O-CB 3.36Å; K413-L506 PolarHBondContact O-N 3.18Å; L415-L506 HydrophobicContact CD1-CD1 3.61Å; L415-L506 HydrophobicContact CD2-CD1 3.95Å; L415-L506 HydrophobicContact CG-CB 4.48Å; L415-L506 HydrophobicContact CG-CD1 3.72Å; D504-L506 PolarHBondContact O-N 3.01Å; L506-V508 VanDerWaalsContact C-N 3.29Å; L506-V508 PolarHBondContact O-N 2.86Å; L506-R509 PolarHBondContact O-N 2.79Å; L506-V510 HydrophobicContact CD1-CG2 3.65Å; L506-V510 HydrophobicContact CG-CG2 4.05Å; L506-V510 WeakPolarHBondContact O-CB 3.07Å; L506-V510 VanDerWaalsContact O-CG2 3.3Å; L506-V510 WeakPolarHBondContact O-CG2 3.25Å; L506-V510 PolarHBondContact O-N 3.36Å
507	T	91.7	Very high	90.3	Very high	46 Å²	46	33.2 Å²	33.2	28%	0.282	17%	0.165	S	C	.	.	H	α-helix	trans	-57.1	-42.1	-179.9	-54.5	0	0	0	0	112.1	N411 P505 Q511	N411-T507 WeakPolarHBondContact CB-OG1 3.46Å; P505-T507 PolarHBondContact O-N 3.04Å; T507-Q511 VanDerWaalsContact O-CB 3.3Å; T507-Q511 WeakPolarHBondContact O-CB 3.41Å; T507-Q511 PolarHBondContact O-N 3.12Å; T507-Q511 VanDerWaalsContact O-N 3.12Å
508	V	92.4	Very high	90.3	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.024	19%	0.191	C	C	.	.	H	α-helix	trans	-65.5	-55.2	-180	178.3	0	0	0	0	109.3	D96 N407 P505 L506 V510 Q511 V512	D96-V508 HydrophobicContact CB-CG1 4.17Å; D96-V508 HydrophobicContact CB-CG2 4.46Å; N407-V508 WeakPolarHBondContact ND2-CG2 3.45Å; P505-V508 HydrophobicContact CB-CB 4.43Å; P505-V508 HydrophobicContact CB-CG2 3.9Å; P505-V508 HydrophobicContact CG-CG2 4.08Å; P505-V508 PolarHBondContact O-N 2.77Å; P505-V508 VanDerWaalsContact O-N 3.12Å; L506-V508 VanDerWaalsContact C-N 3.29Å; L506-V508 PolarHBondContact O-N 2.86Å; V508-V510 PolarHBondContact O-N 3.41Å; V508-Q511 PolarHBondContact O-N 3.44Å; V508-Q511 VanDerWaalsContact O-N 3.13Å; V508-V512 HydrophobicContact CG1-CG2 4.29Å; V508-V512 VanDerWaalsContact O-CG2 3.25Å; V508-V512 WeakPolarHBondContact O-CG2 3.15Å; V508-V512 PolarHBondContact O-N 3.34Å
509	R	91	Very high	90.3	Very high	29 Å²	29	36 Å²	36	11%	0.109	18%	0.177	C	C	.	.	H	α-helix	trans	-61	-44.5	-176.8	-70.7	-74.4	175.5	-160.7	-12.1	112.9	L415 E422 D504 P505 L506 Q511 V512 Y513	L415-R509 HydrophobicContact CD1-CB 3.84Å; L415-R509 HydrophobicContact CD1-CG 4.25Å; E422-R509 IonicContact OE1-CZ 3.61Å; E422-R509 IonicContact OE1-NE 3.65Å; E422-R509 IonicContact OE1-NH1 3.74Å; E422-R509 PolarHBondContact OE1-NH1 3.12Å; D504-R509 HydrophobicContact CB-CG 3.92Å; D504-R509 IonicContact OD1-NH2 2.74Å; D504-R509 IonicContact OD2-CZ 3.94Å; D504-R509 IonicContact OD2-NE 2.59Å; D504-R509 PolarHBondContact OD2-NE 3.43Å; D504-R509 IonicContact OD2-NH2 2.91Å; D504-R509 PolarHBondContact OD2-NH2 3.47Å; P505-R509 PolarHBondContact O-N 3.4Å; L506-R509 PolarHBondContact O-N 2.79Å; R509-Q511 VanDerWaalsContact C-N 3.29Å; R509-Q511 PolarHBondContact O-N 3.14Å; R509-V512 WeakPolarHBondContact O-CB 3.44Å; R509-V512 PolarHBondContact O-N 3.24Å; R509-Y513 HydrophobicContact CB-CE2 4.21Å; R509-Y513 VanDerWaalsContact O-CD2 3.25Å; R509-Y513 WeakPolarHBondContact O-CD2 3.45Å; R509-Y513 PolarHBondContact O-N 3.46Å
510	V	92.1	Very high	90.2	Very high	12 Å²	12	27.9 Å²	27.9	7%	0.073	14%	0.142	C	C	.	.	H	α-helix	trans	-61.1	-41.6	176.2	169.4	0	0	0	0	111	V140 C143 L506 V508 Y513 K514	V140-V510 HydrophobicContact CG1-CG1 4.07Å; V140-V510 HydrophobicContact CG2-CG1 4.29Å; C143-V510 HydrophobicContact CB-CG2 3.88Å; L506-V510 HydrophobicContact CD1-CG2 3.65Å; L506-V510 HydrophobicContact CG-CG2 4.05Å; L506-V510 WeakPolarHBondContact O-CB 3.07Å; L506-V510 VanDerWaalsContact O-CG2 3.3Å; L506-V510 WeakPolarHBondContact O-CG2 3.25Å; L506-V510 PolarHBondContact O-N 3.36Å; V508-V510 PolarHBondContact O-N 3.41Å; V510-Y513 PolarHBondContact O-N 3.44Å; V510-K514 HydrophobicContact CG1-CD 4.2Å; V510-K514 WeakPolarHBondContact O-CG 3.42Å; V510-K514 PolarHBondContact O-N 3.17Å; V510-K514 VanDerWaalsContact O-N 3.13Å
511	Q	92.7	Very high	90.2	Very high	58 Å²	58	24.8 Å²	24.8	27%	0.271	13%	0.125	S	C	.	.	H	α-helix	trans	-65.9	-41.7	176.8	-171.1	62.2	11.7	0	0	111.1	T94 T507 V508 R509 Y513 K514 T515	T94-Q511 HydrophobicContact CG2-CB 3.97Å; T94-Q511 HydrophobicContact CG2-CG 4.01Å; T507-Q511 VanDerWaalsContact O-CB 3.3Å; T507-Q511 WeakPolarHBondContact O-CB 3.41Å; T507-Q511 PolarHBondContact O-N 3.12Å; T507-Q511 VanDerWaalsContact O-N 3.12Å; V508-Q511 PolarHBondContact O-N 3.44Å; V508-Q511 VanDerWaalsContact O-N 3.13Å; R509-Q511 VanDerWaalsContact C-N 3.29Å; R509-Q511 PolarHBondContact O-N 3.14Å; Q511-Y513 VanDerWaalsContact C-N 3.33Å; Q511-Y513 PolarHBondContact O-N 3.37Å; Q511-K514 PolarHBondContact O-N 3.01Å; Q511-T515 HydrophobicContact CG-CG2 4.25Å; Q511-T515 PolarHBondContact O-N 3.38Å; Q511-T515 PolarHBondContact O-OG1 3.05Å
512	V	92	Very high	90.3	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.006	13%	0.131	C	C	.	.	H	α-helix	trans	-56.6	-45.9	176.7	169.4	0	0	0	0	111.8	V101 L104 V508 R509 T515 A516	V101-V512 HydrophobicContact CG2-CB 3.79Å; V101-V512 HydrophobicContact CG2-CG1 3.7Å; V101-V512 HydrophobicContact CG2-CG2 3.62Å; L104-V512 HydrophobicContact CD1-CG1 3.55Å; V508-V512 HydrophobicContact CG1-CG2 4.29Å; V508-V512 VanDerWaalsContact O-CG2 3.25Å; V508-V512 WeakPolarHBondContact O-CG2 3.15Å; V508-V512 PolarHBondContact O-N 3.34Å; R509-V512 WeakPolarHBondContact O-CB 3.44Å; R509-V512 PolarHBondContact O-N 3.24Å; V512-T515 PolarHBondContact O-OG1 3.29Å; V512-A516 WeakPolarHBondContact O-CB 3.33Å; V512-A516 PolarHBondContact O-N 3.32Å
513	Y	90.9	Very high	90.1	Very high	3 Å²	3	24.1 Å²	24.1	1%	0.012	12%	0.12	C	C	.	.	H	α-helix	trans	-68	-38.1	-179.7	-54.1	-29	0	0	0	112.4	L104 V139 E422 L425 F451 R509 V510 Q511 I517	L104-Y513 HydrophobicContact CD1-CD1 3.94Å; L104-Y513 HydrophobicContact CD1-CE1 3.88Å; V139-Y513 HydrophobicContact CG1-CD2 3.72Å; V139-Y513 HydrophobicContact CG1-CG 4.19Å; E422-Y513 VanDerWaalsContact CD-OH 3.26Å; E422-Y513 HydrophobicContact CG-CE1 4.26Å; E422-Y513 PolarHBondContact OE1-OH 3.37Å; L425-Y513 HydrophobicContact CD1-CD2 4.06Å; L425-Y513 HydrophobicContact CD1-CE2 3.38Å; F451-Y513 HydrophobicContact CD1-CD1 4.49Å; F451-Y513 HydrophobicContact CD1-CE1 4.28Å; F451-Y513 AromaticContact CE1-CD1 3.59Å; F451-Y513 HydrophobicContact CE1-CD1 3.59Å; F451-Y513 HydrophobicContact CE1-CD2 4.43Å; F451-Y513 AromaticContact CE1-CE1 3.75Å; F451-Y513 HydrophobicContact CE1-CE1 3.75Å; F451-Y513 AromaticContact CE1-CG 3.96Å; F451-Y513 HydrophobicContact CE1-CG 3.96Å; F451-Y513 HydrophobicContact CZ-CD1 4.42Å; F451-Y513 HydrophobicContact CZ-CG 4.42Å; R509-Y513 HydrophobicContact CB-CE2 4.21Å; R509-Y513 VanDerWaalsContact O-CD2 3.25Å; R509-Y513 WeakPolarHBondContact O-CD2 3.45Å; R509-Y513 PolarHBondContact O-N 3.46Å; V510-Y513 PolarHBondContact O-N 3.44Å; Q511-Y513 VanDerWaalsContact C-N 3.33Å; Q511-Y513 PolarHBondContact O-N 3.37Å; Y513-I517 WeakPolarHBondContact O-CG1 3.29Å; Y513-I517 PolarHBondContact O-N 2.9Å; Y513-I517 VanDerWaalsContact O-N 3.16Å
514	K	91.6	Very high	89.8	Confident	71 Å²	71	23.6 Å²	23.6	31%	0.309	12%	0.118	S	C	.	.	H	α-helix	trans	-62.3	-54.9	174.8	-74.4	173.8	179.2	-178.4	0	111.4	L136 V140 V510 Q511 A516 I517 E518	L136-K514 HydrophobicContact CD1-CB 4.32Å; L136-K514 HydrophobicContact CD1-CG 3.86Å; L136-K514 HydrophobicContact CD2-CG 4.43Å; V140-K514 HydrophobicContact CG2-CD 4.44Å; V140-K514 HydrophobicContact CG2-CG 3.92Å; V510-K514 HydrophobicContact CG1-CD 4.2Å; V510-K514 WeakPolarHBondContact O-CG 3.42Å; V510-K514 PolarHBondContact O-N 3.17Å; V510-K514 VanDerWaalsContact O-N 3.13Å; Q511-K514 PolarHBondContact O-N 3.01Å; K514-A516 PolarHBondContact O-N 2.84Å; K514-I517 PolarHBondContact O-N 3.22Å; K514-E518 WeakPolarHBondContact O-CB 3.12Å; K514-E518 VanDerWaalsContact O-CG 3.32Å; K514-E518 WeakPolarHBondContact O-CG 3.36Å; K514-E518 PolarHBondContact O-N 2.84Å
515	T	91.7	Very high	89.6	Confident	18 Å²	18	30 Å²	30	11%	0.11	14%	0.141	C	C	.	.	H	α-helix	trans	-64.7	-40.4	-176.1	51.1	0	0	0	0	111.5	Q90 V101 Q511 V512 T519	Q90-T515 PolarHBondContact OE1-OG1 2.88Å; V101-T515 VanDerWaalsContact CG2-OG1 3.32Å; V101-T515 WeakPolarHBondContact CG2-OG1 3.49Å; Q511-T515 HydrophobicContact CG-CG2 4.25Å; Q511-T515 PolarHBondContact O-N 3.38Å; Q511-T515 PolarHBondContact O-OG1 3.05Å; V512-T515 PolarHBondContact O-OG1 3.29Å; T515-T519 VanDerWaalsContact O-CB 3.24Å; T515-T519 WeakPolarHBondContact O-CB 3.39Å; T515-T519 PolarHBondContact O-N 2.86Å; T515-T519 PolarHBondContact O-OG1 3.47Å
516	A	89.2	Confident	89.4	Confident	4 Å²	4	32.3 Å²	32.3	3%	0.033	15%	0.153	C	C	.	.	H	α-helix	trans	-60.1	-49.6	175.7	0	0	0	0	0	112.6	L104 V512 K514 T519 A520	L104-A516 HydrophobicContact CB-CB 3.82Å; V512-A516 WeakPolarHBondContact O-CB 3.33Å; V512-A516 PolarHBondContact O-N 3.32Å; K514-A516 PolarHBondContact O-N 2.84Å; A516-T519 WeakPolarHBondContact O-CB 3.11Å; A516-T519 PolarHBondContact O-N 3.48Å; A516-A520 PolarHBondContact O-N 3.46Å; A516-A520 VanDerWaalsContact O-N 3.1Å
517	I	88.2	Confident	89.2	Confident	8 Å²	8	37 Å²	37	4%	0.041	18%	0.178	C	C	.	.	H	α-helix	trans	-69.8	-39.8	-178.3	-66.2	174.1	0	0	0	111.5	L132 L136 Y513 K514 T519 A520 I521	L132-I517 HydrophobicContact CB-CG2 3.99Å; L136-I517 HydrophobicContact CB-CB 4.44Å; L136-I517 HydrophobicContact CB-CD1 3.91Å; L136-I517 HydrophobicContact CB-CG2 4.07Å; L136-I517 HydrophobicContact CD1-CB 4.41Å; L136-I517 HydrophobicContact CD1-CD1 3.87Å; L136-I517 HydrophobicContact CD2-CB 4.39Å; L136-I517 HydrophobicContact CD2-CG2 4.36Å; L136-I517 HydrophobicContact CG-CD1 4.44Å; Y513-I517 WeakPolarHBondContact O-CG1 3.29Å; Y513-I517 PolarHBondContact O-N 2.9Å; Y513-I517 VanDerWaalsContact O-N 3.16Å; K514-I517 PolarHBondContact O-N 3.22Å; I517-T519 VanDerWaalsContact C-N 3.29Å; I517-T519 PolarHBondContact O-N 3.31Å; I517-A520 VanDerWaalsContact O-CB 3.28Å; I517-A520 WeakPolarHBondContact O-CB 3.47Å; I517-A520 PolarHBondContact O-N 3.46Å; I517-I521 HydrophobicContact CG2-CD1 3.97Å; I517-I521 WeakPolarHBondContact O-CD1 3.43Å; I517-I521 WeakPolarHBondContact O-CG1 3.11Å; I517-I521 PolarHBondContact O-N 3.19Å; I517-I521 VanDerWaalsContact O-N 3.09Å
518	E	89	Confident	89	Confident	115 Å²	115	37.4 Å²	37.4	54%	0.537	18%	0.177	S	C	.	.	H	α-helix	trans	-63	-36.9	175.4	-74.2	179.5	171.4	0	0	112.2	L136 K514 I521 L522	L136-E518 HydrophobicContact CD2-CG 4.37Å; K514-E518 WeakPolarHBondContact O-CB 3.12Å; K514-E518 VanDerWaalsContact O-CG 3.32Å; K514-E518 WeakPolarHBondContact O-CG 3.36Å; K514-E518 PolarHBondContact O-N 2.84Å; E518-I521 WeakPolarHBondContact O-CB 3.35Å; E518-I521 PolarHBondContact O-N 3.02Å; E518-L522 PolarHBondContact O-N 2.82Å
519	T	87.9	Confident	88.7	Confident	7 Å²	7	38.4 Å²	38.4	4%	0.043	18%	0.182	C	C	.	.	H	α-helix	trans	-63.5	-44.4	174.5	-60.6	0	0	0	0	111.7	M83 I86 T515 A516 I517 I521 L522 L523	M83-T519 HydrophobicContact CE-CG2 4.47Å; M83-T519 HydrophobicContact SD-CG2 3.37Å; M83-T519 WeakPolarHBondContact SD-CG2 3.46Å; I86-T519 HydrophobicContact CD1-CG2 3.35Å; I86-T519 WeakPolarHBondContact CD1-OG1 3.38Å; T515-T519 VanDerWaalsContact O-CB 3.24Å; T515-T519 WeakPolarHBondContact O-CB 3.39Å; T515-T519 PolarHBondContact O-N 2.86Å; T515-T519 PolarHBondContact O-OG1 3.47Å; A516-T519 WeakPolarHBondContact O-CB 3.11Å; A516-T519 PolarHBondContact O-N 3.48Å; I517-T519 VanDerWaalsContact C-N 3.29Å; I517-T519 PolarHBondContact O-N 3.31Å; T519-I521 VanDerWaalsContact C-N 3.28Å; T519-I521 PolarHBondContact O-N 3.48Å; T519-L522 WeakPolarHBondContact O-CB 3.39Å; T519-L522 PolarHBondContact O-N 3.38Å; T519-L523 HydrophobicContact CG2-CD1 4.37Å; T519-L523 WeakPolarHBondContact O-CG 3.38Å; T519-L523 PolarHBondContact O-N 3.09Å
520	A	85.1	Confident	88.3	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-53.3	-48.7	172.3	0	0	0	0	0	111.8	A108 L132 A516 I517 L522 L523 L524	A108-A520 HydrophobicContact CB-CB 3.11Å; L132-A520 HydrophobicContact CD1-CB 4.29Å; A516-A520 PolarHBondContact O-N 3.46Å; A516-A520 VanDerWaalsContact O-N 3.1Å; I517-A520 VanDerWaalsContact O-CB 3.28Å; I517-A520 WeakPolarHBondContact O-CB 3.47Å; I517-A520 PolarHBondContact O-N 3.46Å; A520-L522 VanDerWaalsContact C-N 3.29Å; A520-L522 PolarHBondContact O-N 2.99Å; A520-L523 PolarHBondContact O-N 3.42Å; A520-L524 WeakPolarHBondContact O-CB 3.15Å; A520-L524 WeakPolarHBondContact O-CG 3.31Å; A520-L524 PolarHBondContact O-N 2.96Å
521	I	87.9	Confident	87.7	Confident	11 Å²	11	44.3 Å²	44.3	6%	0.056	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-40.7	-178.5	-70.6	162.8	0	0	0	110.1	I129 L132 Q133 I517 E518 T519 R525	I129-I521 HydrophobicContact CB-CG2 4.44Å; I129-I521 HydrophobicContact CG1-CG2 4.17Å; I129-I521 HydrophobicContact CG2-CB 4.46Å; I129-I521 HydrophobicContact CG2-CG1 4.21Å; I129-I521 HydrophobicContact CG2-CG2 3.57Å; L132-I521 HydrophobicContact CB-CD1 4.07Å; L132-I521 HydrophobicContact CB-CG1 4.05Å; L132-I521 HydrophobicContact CD1-CG1 4.08Å; Q133-I521 HydrophobicContact CG-CD1 3.55Å; I517-I521 HydrophobicContact CG2-CD1 3.97Å; I517-I521 WeakPolarHBondContact O-CD1 3.43Å; I517-I521 WeakPolarHBondContact O-CG1 3.11Å; I517-I521 PolarHBondContact O-N 3.19Å; I517-I521 VanDerWaalsContact O-N 3.09Å; E518-I521 WeakPolarHBondContact O-CB 3.35Å; E518-I521 PolarHBondContact O-N 3.02Å; T519-I521 VanDerWaalsContact C-N 3.28Å; T519-I521 PolarHBondContact O-N 3.48Å; I521-R525 VanDerWaalsContact O-CG 3.24Å; I521-R525 WeakPolarHBondContact O-CG 3.44Å; I521-R525 PolarHBondContact O-N 2.74Å
522	L	88.5	Confident	86.8	Confident	88 Å²	88	44.2 Å²	44.2	46%	0.461	24%	0.235	S	C	.	.	H	α-helix	trans	-62.5	-50.2	177.3	-178.4	66.4	0	0	0	111.2	E518 T519 A520 L524 R525	E518-L522 PolarHBondContact O-N 2.82Å; T519-L522 WeakPolarHBondContact O-CB 3.39Å; T519-L522 PolarHBondContact O-N 3.38Å; A520-L522 VanDerWaalsContact C-N 3.29Å; A520-L522 PolarHBondContact O-N 2.99Å; L522-L524 VanDerWaalsContact C-N 3.32Å; L522-L524 PolarHBondContact O-N 3.36Å; L522-R525 PolarHBondContact O-N 3.36Å; L522-R525 VanDerWaalsContact O-N 3.15Å
523	L	85.5	Confident	85.8	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-36.7	-179.4	-66.5	-179.3	0	0	0	112.5	A33 A79 M83 T519 A520 R525 I526	A33-L523 HydrophobicContact CB-CD1 3.87Å; A79-L523 HydrophobicContact CB-CD2 3.66Å; M83-L523 HydrophobicContact SD-CD1 4.18Å; T519-L523 HydrophobicContact CG2-CD1 4.37Å; T519-L523 WeakPolarHBondContact O-CG 3.38Å; T519-L523 PolarHBondContact O-N 3.09Å; A520-L523 PolarHBondContact O-N 3.42Å; L523-R525 VanDerWaalsContact C-N 3.29Å; L523-R525 PolarHBondContact O-N 3.46Å; L523-I526 HydrophobicContact CD2-CD1 4.38Å; L523-I526 PolarHBondContact O-N 2.88Å
524	L	83.7	Confident	84.2	Confident	3 Å²	3	59.2 Å²	59.2	2%	0.016	31%	0.314	C	S	.	.	H	α-helix	trans	-64.6	-30.3	174.6	-86.9	172	0	0	0	114.4	Q26 L112 L119 I128 I129 L132 A520 L522 I526	Q26-L524 PolarHBondContact NE2-O 2.9Å; Q26-L524 VanDerWaalsContact NE2-O 3.1Å; L112-L524 HydrophobicContact CD2-CD1 3.69Å; L112-L524 HydrophobicContact CD2-CD2 3.08Å; L112-L524 HydrophobicContact CD2-CG 3.24Å; L112-L524 HydrophobicContact CG-CG 4.44Å; L119-L524 HydrophobicContact CD1-CD2 4.47Å; I128-L524 HydrophobicContact CB-CD1 4.41Å; I128-L524 HydrophobicContact CG2-CD1 3.77Å; I129-L524 HydrophobicContact CD1-CB 4.23Å; I129-L524 HydrophobicContact CG1-CB 4.17Å; I129-L524 HydrophobicContact CG1-CD1 4.21Å; L132-L524 HydrophobicContact CD1-CD1 3.98Å; A520-L524 WeakPolarHBondContact O-CB 3.15Å; A520-L524 WeakPolarHBondContact O-CG 3.31Å; A520-L524 PolarHBondContact O-N 2.96Å; L522-L524 VanDerWaalsContact C-N 3.32Å; L522-L524 PolarHBondContact O-N 3.36Å; L524-I526 VanDerWaalsContact C-N 3.26Å; L524-I526 PolarHBondContact O-N 3.02Å
525	R	87.8	Confident	82.5	Confident	146 Å²	146	64.8 Å²	64.8	55%	0.551	34%	0.338	S	S	*	.	H	α-helix	trans	-75.7	-16	-179	-77.1	174.8	-179.7	-166	2.6	112.9	I129 I521 L522 L523 D527	I129-R525 HydrophobicContact CD1-CG 3.5Å; I521-R525 VanDerWaalsContact O-CG 3.24Å; I521-R525 WeakPolarHBondContact O-CG 3.44Å; I521-R525 PolarHBondContact O-N 2.74Å; L522-R525 PolarHBondContact O-N 3.36Å; L522-R525 VanDerWaalsContact O-N 3.15Å; L523-R525 VanDerWaalsContact C-N 3.29Å; L523-R525 PolarHBondContact O-N 3.46Å; R525-D527 PolarHBondContact O-N 2.97Å
526	I	87.4	Confident	80.5	Confident	50 Å²	50	72.9 Å²	72.9	26%	0.256	37%	0.372	S	S	.	.			trans	-84.8	106.7	-179.8	-58.4	167.4	0	0	0	108.4	V25 Q26 N29 L523 L524 I529	V25-I526 HydrophobicContact CG1-CG2 4.1Å; Q26-I526 WeakPolarHBondContact CG-O 3.47Å; N29-I526 WeakPolarHBondContact ND2-CB 3.44Å; L523-I526 HydrophobicContact CD2-CD1 4.38Å; L523-I526 PolarHBondContact O-N 2.88Å; L524-I526 VanDerWaalsContact C-N 3.26Å; L524-I526 PolarHBondContact O-N 3.02Å; I526-I529 HydrophobicContact CG2-CG1 4.3Å
527	D	87.1	Confident	78.4	Confident	99 Å²	99	77.1 Å²	77.1	53%	0.529	40%	0.397	S	S	.	.			trans	-104.5	-14	178.7	65.9	-28	0	0	0	113.5	R21 G22 R525	R21-D527 CarbonylContact C-O 3.41Å; G22-D527 PolarHBondContact N-O 3.24Å; R525-D527 PolarHBondContact O-N 2.97Å
528	E	87	Confident	76.8	Confident	55 Å²	55	82.6 Å²	82.6	26%	0.257	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	132.2	-178.1	-171.1	177.1	142	0	0	111.1	Q19 E20 R21 L530	Q19-E528 HydrophobicContact CG-CG 4.23Å; Q19-E528 VanDerWaalsContact NE2-CD 3.32Å; Q19-E528 PolarHBondContact NE2-OE1 3.12Å; E20-E528 WeakPolarHBondContact O-CA 3.49Å; E20-E528 WeakPolarHBondContact O-CG 3.36Å; R21-E528 HydrophobicContact CG-CB 4.34Å; R21-E528 HydrophobicContact CG-CG 3.7Å; R21-E528 IonicContact CZ-OE2 3.42Å; R21-E528 IonicContact NE-OE1 2.76Å; R21-E528 IonicContact NE-OE2 3.6Å; R21-E528 PolarHBondContact NE-OE2 3.33Å; R21-E528 IonicContact NH2-OE1 2.88Å; R21-E528 IonicContact NH2-OE2 3.03Å; R21-E528 PolarHBondContact NH2-OE2 3.26Å; R21-E528 VanDerWaalsContact NH2-OE2 3.1Å; E528-L530 HydrophobicContact CG-CD2 4.45Å; E528-L530 HydrophobicContact CG-CG 4.29Å; E528-L530 WeakPolarHBondContact OE1-CD2 3.37Å; E528-L530 WeakPolarHBondContact OE1-CG 3.47Å
529	I	85.8	Confident	75	Confident	25 Å²	25	84.1 Å²	84.1	13%	0.128	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	119.5	170.1	-64.9	168.9	0	0	0	108.2	E20 V25 P78 I526	E20-I529 PolarHBondContact N-O 3.46Å; E20-I529 PolarHBondContact O-N 3.01Å; E20-I529 VanDerWaalsContact O-N 3.09Å; V25-I529 HydrophobicContact CG1-CD1 3.79Å; V25-I529 HydrophobicContact CG1-CG1 3.68Å; P78-I529 HydrophobicContact CG-CD1 4.09Å; P78-I529 HydrophobicContact CG-CG2 4.43Å; I526-I529 HydrophobicContact CG2-CG1 4.3Å
530	L	83.7	Confident	73.2	Confident	96 Å²	96	90 Å²	90	50%	0.503	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	115.3	175.5	-70.4	173.7	0	0	0	109.6	L13 T17 Q19 E528	L13-L530 HydrophobicContact CD1-CD2 4.23Å; L13-L530 HydrophobicContact CD2-CD2 4.09Å; T17-L530 HydrophobicContact CG2-CD2 4.2Å; Q19-L530 HydrophobicContact CB-CD2 4.06Å; Q19-L530 HydrophobicContact CG-CD2 3.99Å; E528-L530 HydrophobicContact CG-CD2 4.45Å; E528-L530 HydrophobicContact CG-CG 4.29Å; E528-L530 WeakPolarHBondContact OE1-CD2 3.37Å; E528-L530 WeakPolarHBondContact OE1-CG 3.47Å
531	S	79.3	Confident	71.3	Confident	70 Å²	70	96.9 Å²	96.9	49%	0.49	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	105.4	174	-66.6	0	0	0	0	109.8	T17 K18	T17-S531 WeakPolarHBondContact CA-O 3.47Å; T17-S531 WeakPolarHBondContact CG2-O 3.31Å; K18-S531 PolarHBondContact N-O 2.83Å; K18-S531 PolarHBondContact O-N 2.7Å
532	G	74	Confident	69.2	Low	56 Å²	56	101.6 Å²	101.6	58%	0.577	53%	0.531	S	S	*	.			trans	-144.1	136.3	175.9	0	0	0	0	0	111.3
533	V	70	Confident	67	Low	134 Å²	134	106.2 Å²	106.2	81%	0.812	55%	0.55	S	S	*	*			trans	-97.9	127.1	167.1	-176.2	0	0	0	0	106.8	K535	V533-K535 PolarHBondContact O-N 3.25Å; V533-K535 VanDerWaalsContact O-N 3.09Å
534	Q	58.9	Low	64.8	Low	184 Å²	184	115 Å²	115	86%	0.86	59%	0.591	S	S	*	*			trans	-63.4	113.8	170	-158.8	167.2	14.7	0	0	107.1	K536	Q534-K536 PolarHBondContact O-N 3.01Å
535	K	55.1	Low	62.6	Low	188 Å²	188	125.7 Å²	125.7	82%	0.817	65%	0.648	S	S	*	*			trans	-56.9	116.5	166.9	-91	-177.3	175.8	179	0	105.8	V533 T537	V533-K535 PolarHBondContact O-N 3.25Å; V533-K535 VanDerWaalsContact O-N 3.09Å; K535-T537 PolarHBondContact O-N 3.37Å
536	K	49.9	Very low	61.4	Low	189 Å²	189	124.7 Å²	124.7	82%	0.822	65%	0.653	S	S	*	*			trans	-55.6	108.7	162.2	-73.3	-174.2	175.3	-173.8	0	105.9	Q534	Q534-K536 PolarHBondContact O-N 3.01Å
537	T	45.1	Very low	60	Low	92 Å²	92	128.6 Å²	128.6	56%	0.564	67%	0.674	S	S	*	*			trans	-60.6	141	166.5	33.2	0	0	0	0	107.4	K535 D539 D540	K535-T537 PolarHBondContact O-N 3.37Å; T537-D539 PolarHBondContact O-N 3.46Å; T537-D540 PolarHBondContact O-N 3.41Å
538	D	54	Low	58.5	Low	124 Å²	124	130.2 Å²	130.2	66%	0.663	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-60.1	-4.8	-178.3	-90.4	-53.6	0	0	0	113.9	D540 K541	D538-D540 VanDerWaalsContact C-N 3.33Å; D538-D540 PolarHBondContact O-N 3.07Å; D538-K541 IonicContact OD1-NZ 3.02Å; D538-K541 PolarHBondContact OD1-NZ 3.23Å
539	D	52.3	Low	56.8	Low	146 Å²	146	134.6 Å²	134.6	78%	0.781	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-74.8	-10.4	177.2	-64.5	-28.3	0	0	0	114.9	T537	T537-D539 PolarHBondContact O-N 3.46Å
540	D	49.9	Very low	55	Low	131 Å²	131	141.5 Å²	141.5	70%	0.701	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-92.5	10.7	177.7	-84.9	-22.8	0	0	0	113.8	T537 D538	T537-D540 PolarHBondContact O-N 3.41Å; D538-D540 VanDerWaalsContact C-N 3.33Å; D538-D540 PolarHBondContact O-N 3.07Å
541	K	44.3	Very low	53.1	Low	145 Å²	145	144.5 Å²	144.5	63%	0.63	76%	0.759	S	S	*	*	S	Bend	trans	-77.9	125.4	168.7	-75.6	175	-179.5	144.4	0	108.3	D538 E543	D538-K541 IonicContact OD1-NZ 3.02Å; D538-K541 PolarHBondContact OD1-NZ 3.23Å; K541-E543 PolarHBondContact O-N 3.38Å; K541-E543 VanDerWaalsContact O-N 3.11Å
542	P	43.4	Very low	51.2	Low	110 Å²	110	149.9 Å²	149.9	71%	0.714	78%	0.778	S	S	*	*			trans	-59.6	122.7	168.4	25.6	-29.5	0	0	0	107.2	Q544	P542-Q544 PolarHBondContact O-N 3.25Å
543	E	42	Very low	49.5	Very low	185 Å²	185	157.1 Å²	157.1	86%	0.864	79%	0.794	S	S	*	*			trans	-54.1	103.6	169.9	-73.2	-174.5	157.7	0	0	107.7	K541 N545	K541-E543 PolarHBondContact O-N 3.38Å; K541-E543 VanDerWaalsContact O-N 3.11Å; E543-N545 PolarHBondContact O-N 3.28Å
544	Q	39.4	Very low	47.8	Very low	187 Å²	187	159 Å²	159	87%	0.874	79%	0.792	S	S	*	*			trans	-77.2	98.3	164.2	-76.1	-175.7	-12.6	0	0	106.7	P542	P542-Q544 PolarHBondContact O-N 3.25Å
545	N	39.1	Very low	46.8	Very low	227 Å²	227	156.7 Å²	156.7	100%	1.214	79%	0.786	S	S	*	*			trans	-113.3	0	151.8	-89.4	-26.2	0	0	0	108.9	E543	E543-N545 PolarHBondContact O-N 3.28Å

Retrieved 545 of 545 residues in 736.8 ms (Link to these results)

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