A0A077Z7Z8_TRITR Loading...

Netrin receptor UNC5

Receptor for netrin required for axon guidance. Mediates axon repulsion of neuronal growth cones in the developing nervous system upon ligand binding.

AlphaFold DB , UniProt , Accession A0A077Z7Z8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 792 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	37.5	Very low	62.6	Low	234 Å²	234	126 Å²	126	100%	1.153	64%	0.639	S	S	*	*				0	82.6	0	-158.3	175.9	-151.9	0	0	106.1	L3	M1-L3 PolarHBondContact O-N 2.72Å
2	T	42.3	Very low	64.6	Low	136 Å²	136	117.3 Å²	117.3	83%	0.834	59%	0.594	S	S	*	*			trans	-74.2	106.1	176.5	-29	0	0	0	0	105.3	L4	T2-L4 VanDerWaalsContact C-N 3.34Å; T2-L4 PolarHBondContact O-N 3.12Å
3	L	46.5	Very low	66.2	Low	144 Å²	144	116.8 Å²	116.8	75%	0.754	59%	0.588	S	S	*	*			trans	-61.3	102.9	168.2	-80.1	155.4	0	0	0	105.7	M1 F5	M1-L3 PolarHBondContact O-N 2.72Å; L3-F5 PolarHBondContact O-N 3.26Å
4	L	54.4	Low	67.8	Low	127 Å²	127	117.6 Å²	117.6	67%	0.665	58%	0.58	S	S	*	*			trans	-61.6	105.6	168.2	-75.7	162.3	0	0	0	105.8	T2 L6	T2-L4 VanDerWaalsContact C-N 3.34Å; T2-L4 PolarHBondContact O-N 3.12Å; L4-L6 VanDerWaalsContact C-N 3.32Å; L4-L6 PolarHBondContact O-N 3.29Å
5	F	62.4	Low	69.3	Low	172 Å²	172	115.8 Å²	115.8	75%	0.754	57%	0.57	S	S	*	*			trans	-72.9	95.1	171.8	-94.4	-91.7	0	0	0	106.8	L3	L3-F5 PolarHBondContact O-N 3.26Å
6	L	68.2	Low	70.9	Confident	81 Å²	81	109.6 Å²	109.6	42%	0.424	54%	0.541	S	S	.	.			trans	-76.7	120.5	171.6	-57.8	171.8	0	0	0	107.9	L4 E37 I87 V88	L4-L6 VanDerWaalsContact C-N 3.32Å; L4-L6 PolarHBondContact O-N 3.29Å; L6-E37 WeakPolarHBondContact CA-O 3.44Å; L6-E37 WeakPolarHBondContact CD2-O 3.23Å; L6-I87 HydrophobicContact CD1-CD1 3.59Å; L6-I87 HydrophobicContact CD1-CG1 4.25Å; L6-I87 HydrophobicContact CD2-CD1 3.9Å; L6-I87 HydrophobicContact CG-CD1 4.35Å; L6-V88 HydrophobicContact CB-CG2 3.45Å; L6-V88 VanDerWaalsContact CB-CG2 3.45Å
7	D	76.6	Confident	72.2	Confident	102 Å²	102	107.3 Å²	107.3	55%	0.545	54%	0.543	S	S	.	.			trans	-142.5	164.1	179.5	-162	7.9	0	0	0	110.9	G36 E37	D7-G36 CarbonylContact O-C 3.56Å; D7-G36 WeakPolarHBondContact O-CA 3.45Å; D7-E37 PolarHBondContact O-N 3.05Å
8	M	74.4	Confident	73.5	Confident	12 Å²	12	106.4 Å²	106.4	6%	0.059	54%	0.544	C	S	.	.	B	Isolated β-bridge	trans	-146.6	119.9	170.9	-173.4	-173	-55	0	0	109.3	P34 E35 N86 N89 R91	M8-P34 HydrophobicContact CG-CB 4.47Å; M8-E35 WeakPolarHBondContact CA-O 3.3Å; M8-N86 HydrophobicContact CE-CB 3.47Å; M8-N86 VanDerWaalsContact CE-CB 3.47Å; M8-N89 HydrophobicContact CE-CB 3.74Å; M8-N89 WeakPolarHBondContact CE-O 3.43Å; M8-N89 HydrophobicContact SD-CB 3.99Å; M8-R91 HydrophobicContact SD-CG 3.91Å
9	L	73.4	Confident	74.6	Confident	80 Å²	80	103.3 Å²	103.3	42%	0.419	53%	0.527	S	S	.	.			trans	-59.8	158.4	176.5	-72.2	176.7	0	0	0	111.9	P34 E35	L9-P34 HydrophobicContact CB-CB 4.12Å; L9-P34 WeakPolarHBondContact O-CB 3.39Å; L9-E35 HydrophobicContact CD1-CB 3.71Å; L9-E35 HydrophobicContact CD1-CG 4Å; L9-E35 HydrophobicContact CG-CB 4.32Å; L9-E35 PolarHBondContact N-O 2.9Å
10	K	72.3	Confident	75.5	Confident	171 Å²	171	105.7 Å²	105.7	74%	0.743	53%	0.529	S	S	*	.	S	Bend	trans	-77.6	-35.6	-172.8	-76.7	-171.8	177.7	-178.4	0	114.7
11	D	81.2	Confident	76.5	Confident	127 Å²	127	104.8 Å²	104.8	68%	0.679	52%	0.52	S	S	*	.	S	Bend	trans	-111.7	137.9	-165.1	-53.8	-39.6	0	0	0	110.6
12	F	86.2	Confident	79.1	Confident	21 Å²	21	95.7 Å²	95.7	9%	0.092	48%	0.478	C	S	.	.			trans	-68.2	140.5	170.1	-78.4	-101.6	0	0	0	109.4	R14 E15 L32 P34 A84 R91 T93	F12-R14 VanDerWaalsContact C-N 3.28Å; F12-R14 PolarHBondContact O-N 3.32Å; F12-E15 HydrophobicContact CB-CG 3.6Å; F12-E15 HydrophobicContact CG-CG 4.29Å; F12-L32 WeakPolarHBondContact CD1-O 3.4Å; F12-P34 HydrophobicContact CD2-CG 4.27Å; F12-P34 HydrophobicContact CE2-CG 4.47Å; F12-P34 HydrophobicContact CG-CG 4.29Å; F12-A84 HydrophobicContact CE1-CB 3.86Å; F12-A84 HydrophobicContact CZ-CB 3.86Å; F12-R91 HydrophobicContact CE2-CB 3.9Å; F12-R91 HydrophobicContact CZ-CB 4.19Å; F12-T93 HydrophobicContact CB-CG2 4.47Å; F12-T93 HydrophobicContact CD1-CG2 3.74Å; F12-T93 HydrophobicContact CD2-CG2 3.66Å; F12-T93 HydrophobicContact CE1-CG2 3.76Å; F12-T93 HydrophobicContact CE2-CG2 3.66Å; F12-T93 HydrophobicContact CG-CG2 3.7Å; F12-T93 HydrophobicContact CZ-CG2 3.73Å
13	H	84.8	Confident	81.3	Confident	112 Å²	112	93.3 Å²	93.3	52%	0.519	46%	0.46	S	S	.	.	S	Bend	trans	-71.3	-28.9	176.4	-69.8	-63.9	0	0	0	112.3	L32 P33 E35	H13-L32 HydrophobicContact CB-CB 3.86Å; H13-L32 HydrophobicContact CB-CD1 4.47Å; H13-L32 PolarHBondContact N-O 3.28Å; H13-L32 VanDerWaalsContact N-O 3.17Å; H13-P33 PolarHBondContact CD2-O 3.38Å; H13-E35 WeakPolarHBondContact NE2-CG 3.43Å
14	R	88.6	Confident	83.3	Confident	128 Å²	128	88.5 Å²	88.5	48%	0.483	45%	0.445	S	S	.	.	B	Isolated β-bridge	trans	-152.5	126.7	176.8	-167.1	171.1	-176.2	-159.3	-1	109.4	F12 P30 C31 L32	F12-R14 VanDerWaalsContact C-N 3.28Å; F12-R14 PolarHBondContact O-N 3.32Å; R14-P30 HydrophobicContact CG-CB 4.21Å; R14-P30 HydrophobicContact CG-CG 4.42Å; R14-P30 VanDerWaalsContact CZ-CB 3.5Å; R14-C31 WeakPolarHBondContact O-CA 3.17Å; R14-L32 HydrophobicContact CB-CB 3.88Å; R14-L32 HydrophobicContact CB-CD1 3.81Å; R14-L32 HydrophobicContact CB-CG 4.04Å; R14-L32 PolarHBondContact O-N 3.27Å
15	E	91.5	Very high	85	Confident	90 Å²	90	83.7 Å²	83.7	42%	0.421	42%	0.422	S	S	.	.			trans	-109.3	153.4	-180	-62.5	-174.1	178.6	0	0	110.4	F12 P30 T93	F12-E15 HydrophobicContact CB-CG 3.6Å; F12-E15 HydrophobicContact CG-CG 4.29Å; E15-P30 CarbonylContact C-O 3.58Å; E15-T93 HydrophobicContact CB-CG2 4.32Å; E15-T93 HydrophobicContact CG-CG2 3.87Å
16	P	94	Very high	86.3	Confident	16 Å²	16	80 Å²	80	10%	0.104	41%	0.41	C	S	.	.			trans	-66.4	147.3	174.9	25.5	-32.3	0	0	0	111.9	M29 W44 C82 A96	P16-M29 HydrophobicContact CB-CB 4.36Å; P16-M29 HydrophobicContact CB-CE 4.01Å; P16-W44 HydrophobicContact CB-CH2 3.86Å; P16-W44 HydrophobicContact CB-CZ3 4.17Å; P16-W44 HydrophobicContact CG-CH2 3.92Å; P16-W44 HydrophobicContact CG-CZ3 4.02Å; P16-C82 HydrophobicContact CG-CB 4.47Å; P16-A96 HydrophobicContact CB-CB 3.73Å; P16-A96 HydrophobicContact CG-CB 4.02Å
17	A	93.5	Very high	87.5	Confident	71 Å²	71	76.2 Å²	76.2	59%	0.587	39%	0.389	S	S	*	.			trans	-113.7	146.7	175.8	0	0	0	0	0	111.1	E19	A17-E19 PolarHBondContact O-N 3.34Å
18	T	95.2	Very high	88.3	Confident	91 Å²	91	76 Å²	76	56%	0.558	39%	0.385	S	S	*	.			trans	-61.8	127.5	174.3	-69.7	0	0	0	0	111	S97	T18-S97 VanDerWaalsContact CA-O 3.31Å; T18-S97 WeakPolarHBondContact CA-O 3.46Å; T18-S97 WeakPolarHBondContact CG2-O 3.47Å; T18-S97 PolarHBondContact OG1-N 2.93Å
19	E	93.8	Very high	89.3	Confident	47 Å²	47	75.5 Å²	75.5	22%	0.22	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	163.7	-177.4	69.1	171.2	158.3	0	0	114.3	A17 R21 V27 S97 L98 H99	A17-E19 PolarHBondContact O-N 3.34Å; E19-R21 HydrophobicContact CG-CG 4.26Å; E19-R21 WeakPolarHBondContact OE2-CD 3.48Å; E19-R21 IonicContact OE2-NE 3.52Å; E19-R21 IonicContact OE2-NH1 3.53Å; E19-V27 WeakPolarHBondContact OE1-CG1 3.44Å; E19-S97 PolarHBondContact N-O 3.33Å; E19-L98 HydrophobicContact CG-CD1 3.76Å; E19-H99 PolarHBondContact O-N 3.44Å
20	R	94	Very high	90.2	Very high	152 Å²	152	72.7 Å²	72.7	57%	0.574	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122	125.9	177.9	-58.7	-178.8	64.8	-177.1	-2.4	109.7	H99 Y101	R20-H99 WeakPolarHBondContact CA-O 3.39Å; R20-H99 HydrophobicContact CG-CB 4.18Å; R20-Y101 HydrophobicContact CB-CD1 4.47Å; R20-Y101 HydrophobicContact CB-CE1 4.46Å
21	R	95	Very high	91.1	Very high	87 Å²	87	64.5 Å²	64.5	33%	0.328	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	142.4	-175.9	-60.5	-65.7	-90.2	-156.9	-5.6	111.3	E19 L26 V27 L98 H99 I100 Y101	E19-R21 HydrophobicContact CG-CG 4.26Å; E19-R21 WeakPolarHBondContact OE2-CD 3.48Å; E19-R21 IonicContact OE2-NE 3.52Å; E19-R21 IonicContact OE2-NH1 3.53Å; R21-L26 PolarHBondContact NE-O 3.18Å; R21-L26 PolarHBondContact NH2-O 3.3Å; R21-V27 HydrophobicContact CB-CG2 4.28Å; R21-V27 HydrophobicContact CG-CG1 4.42Å; R21-V27 HydrophobicContact CG-CG2 4.11Å; R21-L98 HydrophobicContact CG-CD1 4.05Å; R21-H99 PolarHBondContact N-O 3.22Å; R21-I100 HydrophobicContact CB-CD1 3.82Å; R21-I100 VanDerWaalsContact O-CA 3.28Å; R21-I100 WeakPolarHBondContact O-CA 3.44Å; R21-Y101 WeakPolarHBondContact O-CD1 3.44Å; R21-Y101 WeakPolarHBondContact O-CE1 3.11Å; R21-Y101 PolarHBondContact O-N 3.17Å
22	P	91.9	Very high	91.5	Very high	42 Å²	42	61.8 Å²	61.8	27%	0.273	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	153.5	175	28.3	-30.7	0	0	0	110.9	G24 S25 Y101	P22-G24 PolarHBondContact O-N 3.19Å; P22-S25 PolarHBondContact O-N 3.04Å; P22-S25 PolarHBondContact O-OG 2.75Å; P22-Y101 CarbonylContact C-O 3.54Å; P22-Y101 WeakPolarHBondContact CA-O 3.33Å; P22-Y101 HydrophobicContact CB-CE1 4.23Å; P22-Y101 HydrophobicContact CB-CE2 3.88Å
23	L	89.8	Confident	91.6	Very high	87 Å²	87	62.1 Å²	62.1	46%	0.455	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	133	172.3	-171.8	80	0	0	0	110.8	S25 A72 L74 I100 Y101 V102	L23-S25 VanDerWaalsContact C-N 3.34Å; L23-S25 PolarHBondContact O-N 3.21Å; L23-A72 WeakPolarHBondContact CD1-O 3.45Å; L23-L74 HydrophobicContact CD1-CD2 4.47Å; L23-L74 HydrophobicContact CD1-CG 4.06Å; L23-I100 HydrophobicContact CB-CG2 4.38Å; L23-I100 HydrophobicContact CD1-CG2 4.22Å; L23-Y101 PolarHBondContact N-O 2.97Å; L23-V102 HydrophobicContact CB-CG2 4.2Å; L23-V102 HydrophobicContact CD2-CG2 4.2Å
24	G	88	Confident	91.7	Very high	42 Å²	42	56.9 Å²	56.9	43%	0.433	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	-0.4	177.9	0	0	0	0	0	115.7	P22 S71 A72	P22-G24 PolarHBondContact O-N 3.19Å; G24-S71 WeakPolarHBondContact CA-OG 3.25Å; G24-A72 PolarHBondContact N-O 2.93Å
25	S	89.3	Confident	91.5	Very high	26 Å²	26	57 Å²	57	18%	0.182	31%	0.305	C	S	.	.			trans	-80.7	152.3	174.6	67.3	0	0	0	0	112.5	P22 L23 A72	P22-S25 PolarHBondContact O-N 3.04Å; P22-S25 PolarHBondContact O-OG 2.75Å; L23-S25 VanDerWaalsContact C-N 3.34Å; L23-S25 PolarHBondContact O-N 3.21Å; S25-A72 VanDerWaalsContact O-CB 3.29Å; S25-A72 WeakPolarHBondContact O-CB 3.44Å; S25-A72 PolarHBondContact O-N 3.48Å
26	L	91.1	Very high	91.1	Very high	96 Å²	96	53.7 Å²	53.7	50%	0.503	30%	0.295	S	S	.	.			trans	-63.7	133.5	166.7	179.1	67.5	0	0	0	110.2	R21 I69	R21-L26 PolarHBondContact NE-O 3.18Å; R21-L26 PolarHBondContact NH2-O 3.3Å; L26-I69 CarbonylContact C-O 3.54Å; L26-I69 WeakPolarHBondContact CA-O 3.36Å
27	V	93.9	Very high	90.5	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	136.1	172.9	-169	0	0	0	0	108.6	E19 R21 M29 L68 I69 A72 L98	E19-V27 WeakPolarHBondContact OE1-CG1 3.44Å; R21-V27 HydrophobicContact CB-CG2 4.28Å; R21-V27 HydrophobicContact CG-CG1 4.42Å; R21-V27 HydrophobicContact CG-CG2 4.11Å; V27-M29 HydrophobicContact CG1-CG 4.05Å; V27-L68 CarbonylContact O-C 3.57Å; V27-L68 WeakPolarHBondContact O-CA 3.37Å; V27-I69 HydrophobicContact CB-CB 3.9Å; V27-I69 HydrophobicContact CB-CD1 4.4Å; V27-I69 HydrophobicContact CB-CG1 4.26Å; V27-I69 HydrophobicContact CG2-CB 4.13Å; V27-I69 PolarHBondContact N-O 2.9Å; V27-I69 PolarHBondContact O-N 3.1Å; V27-A72 HydrophobicContact CG2-CB 3.92Å; V27-L98 HydrophobicContact CG1-CD1 3.83Å; V27-L98 HydrophobicContact CG1-CD2 3.95Å; V27-L98 HydrophobicContact CG2-CD2 4.42Å
28	E	93.1	Very high	90.1	Very high	98 Å²	98	58 Å²	58	46%	0.458	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	108.7	174.6	175.3	-176.5	162.3	0	0	107.4	P30 L67 L68	E28-P30 VanDerWaalsContact O-CD 3.32Å; E28-P30 WeakPolarHBondContact O-CD 3.2Å; E28-L67 WeakPolarHBondContact CA-O 3.23Å; E28-L68 HydrophobicContact CB-CD2 3.8Å; E28-L68 HydrophobicContact CG-CD2 3.64Å
29	M	93.9	Very high	89.6	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	100.9	173.6	-55.8	-168.3	79.1	0	0	108	P16 V27 W44 S66 L67 Y80 A96 L98	P16-M29 HydrophobicContact CB-CB 4.36Å; P16-M29 HydrophobicContact CB-CE 4.01Å; V27-M29 HydrophobicContact CG1-CG 4.05Å; M29-W44 HydrophobicContact CB-CH2 3.69Å; M29-W44 HydrophobicContact CB-CZ2 4.4Å; M29-W44 HydrophobicContact CB-CZ3 4.22Å; M29-W44 VanDerWaalsContact O-CZ2 3.29Å; M29-W44 WeakPolarHBondContact O-CZ2 3.41Å; M29-S66 WeakPolarHBondContact O-CA 3.3Å; M29-L67 HydrophobicContact CB-CB 4.25Å; M29-L67 PolarHBondContact N-O 3.44Å; M29-L67 PolarHBondContact O-N 3.33Å; M29-Y80 HydrophobicContact CE-CG 4.47Å; M29-Y80 HydrophobicContact SD-CD1 4.34Å; M29-Y80 HydrophobicContact SD-CD2 3.96Å; M29-Y80 HydrophobicContact SD-CG 3.76Å; M29-A96 HydrophobicContact CE-CB 3.71Å; M29-L98 HydrophobicContact SD-CB 4.45Å; M29-L98 HydrophobicContact SD-CD2 4.47Å
30	P	92.3	Very high	89.4	Confident	20 Å²	20	58.3 Å²	58.3	13%	0.13	31%	0.312	C	S	.	.			trans	-69.1	138.3	-175.8	28.6	-35.1	0	0	0	110.8	R14 E15 E28 S66	R14-P30 HydrophobicContact CG-CB 4.21Å; R14-P30 HydrophobicContact CG-CG 4.42Å; R14-P30 VanDerWaalsContact CZ-CB 3.5Å; E15-P30 CarbonylContact C-O 3.58Å; E28-P30 VanDerWaalsContact O-CD 3.32Å; E28-P30 WeakPolarHBondContact O-CD 3.2Å; P30-S66 WeakPolarHBondContact CA-OG 3.5Å
31	C	92.3	Very high	89.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.31	C	S	.	.			trans	-145	118.9	168.4	-178.5	0	0	0	0	110.3	R14 W44 G65 C82	R14-C31 WeakPolarHBondContact O-CA 3.17Å; C31-W44 HydrophobicContact CB-CH2 4.02Å; C31-W44 HydrophobicContact CB-CZ2 3.37Å; C31-G65 CarbonylContact O-C 3.2Å; C31-G65 WeakPolarHBondContact O-CA 3.43Å; C31-C82 HydrophobicContact CB-CB 3.63Å; C31-C82 WeakPolarHBondContact CB-SG 3.17Å; C31-C82 WeakPolarHBondContact SG-CB 3.49Å; C31-C82 CovalentContact SG-SG 2.01Å; C31-C82 PolarHBondContact SG-SG 2.93Å
32	L	89.6	Confident	88.9	Confident	69 Å²	69	53.6 Å²	53.6	36%	0.361	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-109.7	114.9	173.3	-74.3	167.6	0	0	0	108.8	F12 H13 R14	F12-L32 WeakPolarHBondContact CD1-O 3.4Å; H13-L32 HydrophobicContact CB-CB 3.86Å; H13-L32 HydrophobicContact CB-CD1 4.47Å; H13-L32 PolarHBondContact N-O 3.28Å; H13-L32 VanDerWaalsContact N-O 3.17Å; R14-L32 HydrophobicContact CB-CB 3.88Å; R14-L32 HydrophobicContact CB-CD1 3.81Å; R14-L32 HydrophobicContact CB-CG 4.04Å; R14-L32 PolarHBondContact O-N 3.27Å
33	P	87.5	Confident	88.9	Confident	28 Å²	28	52.1 Å²	52.1	18%	0.182	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-66.3	158.8	-177	29.3	-36	0	0	0	111.9	H13 P40 V42 A84	H13-P33 PolarHBondContact CD2-O 3.38Å; P33-P40 HydrophobicContact CB-CG 4.03Å; P33-P40 HydrophobicContact CG-CG 4.49Å; P33-V42 HydrophobicContact CB-CG2 3.75Å; P33-V42 HydrophobicContact CG-CG2 3.52Å; P33-A84 HydrophobicContact CB-CB 3.77Å
34	P	87	Confident	89.1	Confident	3 Å²	3	48 Å²	48	2%	0.019	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-60.9	153.6	171.3	-16.6	29.2	0	0	0	111.8	M8 L9 F12 P40	M8-P34 HydrophobicContact CG-CB 4.47Å; L9-P34 HydrophobicContact CB-CB 4.12Å; L9-P34 WeakPolarHBondContact O-CB 3.39Å; F12-P34 HydrophobicContact CD2-CG 4.27Å; F12-P34 HydrophobicContact CE2-CG 4.47Å; F12-P34 HydrophobicContact CG-CG 4.29Å; P34-P40 WeakPolarHBondContact O-CG 3.29Å
35	E	84	Confident	89.4	Confident	131 Å²	131	47.2 Å²	47.2	61%	0.612	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-64.6	138.8	169.4	-52.9	179.6	164.9	0	0	110.4	M8 L9 H13	M8-E35 WeakPolarHBondContact CA-O 3.3Å; L9-E35 HydrophobicContact CD1-CB 3.71Å; L9-E35 HydrophobicContact CD1-CG 4Å; L9-E35 HydrophobicContact CG-CB 4.32Å; L9-E35 PolarHBondContact N-O 2.9Å; H13-E35 WeakPolarHBondContact NE2-CG 3.43Å
36	G	84.1	Confident	89.6	Confident	20 Å²	20	48.4 Å²	48.4	21%	0.206	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-162.7	156.8	176.3	0	0	0	0	0	112.1	D7 P38 T39	D7-G36 CarbonylContact O-C 3.56Å; D7-G36 WeakPolarHBondContact O-CA 3.45Å; G36-P38 CarbonylContact C-O 3.54Å; G36-P38 VanDerWaalsContact C-O 3.23Å; G36-P38 CarbonylContact O-C 3.58Å; G36-P38 VanDerWaalsContact O-O 3.06Å; G36-T39 WeakPolarHBondContact O-CA 3.03Å; G36-T39 PolarHBondContact O-N 2.9Å
37	E	81.3	Confident	89.7	Confident	117 Å²	117	48.2 Å²	48.2	55%	0.547	26%	0.257	S	S	.	.	S	Bend	trans	-122.4	116.3	-179.9	-162.6	167	-174.3	0	0	110.3	L6 D7 N86	L6-E37 WeakPolarHBondContact CA-O 3.44Å; L6-E37 WeakPolarHBondContact CD2-O 3.23Å; D7-E37 PolarHBondContact O-N 3.05Å; E37-N86 PolarHBondContact O-ND2 3.34Å
38	P	85.7	Confident	89.5	Confident	59 Å²	59	51 Å²	51	38%	0.383	29%	0.286	S	S	.	.	S	Bend	cis	-67.4	167	-4.1	27.4	-32	0	0	0	113.1	G36 N86 I87	G36-P38 CarbonylContact C-O 3.54Å; G36-P38 VanDerWaalsContact C-O 3.23Å; G36-P38 CarbonylContact O-C 3.58Å; G36-P38 VanDerWaalsContact O-O 3.06Å; P38-N86 VanDerWaalsContact CD-ND2 3.34Å; P38-N86 WeakPolarHBondContact CD-ND2 3.45Å; P38-N86 VanDerWaalsContact CD-OD1 3.31Å; P38-N86 WeakPolarHBondContact CD-OD1 3.4Å; P38-N86 WeakPolarHBondContact CG-OD1 3.29Å; P38-N86 VanDerWaalsContact O-CG 3.23Å; P38-N86 PolarHBondContact O-ND2 2.9Å; P38-I87 HydrophobicContact CG-CD1 4.35Å; P38-I87 HydrophobicContact CG-CG1 4.49Å
39	T	83.5	Confident	89.4	Confident	127 Å²	127	51.4 Å²	51.4	78%	0.779	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-53.8	126.3	-178.4	48.7	0	0	0	0	111	G36	G36-T39 WeakPolarHBondContact O-CA 3.03Å; G36-T39 PolarHBondContact O-N 2.9Å
40	P	89	Confident	89.1	Confident	18 Å²	18	55.5 Å²	55.5	12%	0.117	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-67.1	143.4	-178.7	25.8	-32.4	0	0	0	111.9	P33 P34 A84 R85 N86	P33-P40 HydrophobicContact CB-CG 4.03Å; P33-P40 HydrophobicContact CG-CG 4.49Å; P34-P40 WeakPolarHBondContact O-CG 3.29Å; P40-A84 HydrophobicContact CB-CB 4.26Å; P40-R85 CarbonylContact C-O 3.57Å; P40-R85 WeakPolarHBondContact CA-O 3.41Å; P40-N86 HydrophobicContact CB-CB 4.27Å
41	E	87.8	Confident	88.9	Confident	112 Å²	112	56 Å²	56	52%	0.523	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	131	173	-174.9	-172.5	-161.2	0	0	109.7	A84 R85	E41-A84 WeakPolarHBondContact O-CA 3.38Å; E41-R85 HydrophobicContact CB-CG 4.25Å; E41-R85 PolarHBondContact N-O 2.95Å; E41-R85 PolarHBondContact O-N 3.37Å; E41-R85 IonicContact OE1-NH2 3.09Å; E41-R85 IonicContact OE2-CZ 2.73Å; E41-R85 IonicContact OE2-NE 2.75Å; E41-R85 PolarHBondContact OE2-NE 3.23Å; E41-R85 IonicContact OE2-NH2 3.16Å; E41-R85 PolarHBondContact OE2-NH2 3.11Å
42	V	91.8	Very high	88.2	Confident	29 Å²	29	59.9 Å²	59.9	18%	0.176	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	132.7	176.2	-180	0	0	0	0	110.3	P33 G65 G83	P33-V42 HydrophobicContact CB-CG2 3.75Å; P33-V42 HydrophobicContact CG-CG2 3.52Å; V42-G65 WeakPolarHBondContact CG1-O 3.49Å; V42-G83 CarbonylContact C-O 3.23Å; V42-G83 VanDerWaalsContact CA-O 3.31Å; V42-G83 WeakPolarHBondContact CA-O 3.42Å
43	F	92	Very high	87.1	Confident	11 Å²	11	58.5 Å²	58.5	5%	0.048	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	161.5	172.2	65.4	-83.2	0	0	0	109.9	L45 E50 G83 R85 E90 L92	F43-L45 HydrophobicContact CD2-CD2 4.03Å; F43-L45 HydrophobicContact CD2-CG 4.35Å; F43-L45 HydrophobicContact CE2-CD1 4.41Å; F43-L45 HydrophobicContact CE2-CD2 3.95Å; F43-L45 HydrophobicContact CE2-CG 4.11Å; F43-E50 HydrophobicContact CD2-CG 4.34Å; F43-G83 WeakPolarHBondContact CD1-O 3.5Å; F43-G83 PolarHBondContact N-O 3.13Å; F43-G83 PolarHBondContact O-N 3.42Å; F43-R85 HydrophobicContact CD1-CB 4.44Å; F43-R85 HydrophobicContact CD1-CG 4.02Å; F43-R85 HydrophobicContact CE1-CB 3.92Å; F43-R85 HydrophobicContact CE1-CG 3.98Å; F43-E90 HydrophobicContact CE1-CG 4.07Å; F43-E90 HydrophobicContact CZ-CG 3.86Å; F43-E90 VanDerWaalsContact CZ-OE1 3.28Å; F43-E90 WeakPolarHBondContact CZ-OE1 3.42Å; F43-L92 HydrophobicContact CE2-CD2 3.77Å; F43-L92 HydrophobicContact CZ-CD2 3.61Å
44	W	94.6	Very high	85.9	Confident	1 Å²	1	65.9 Å²	65.9	0%	0.004	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	141.7	-178.8	-79	84.8	0	0	0	110.9	P16 M29 C31 E50 I51 V61 G65 L67 Y80 C82	P16-W44 HydrophobicContact CB-CH2 3.86Å; P16-W44 HydrophobicContact CB-CZ3 4.17Å; P16-W44 HydrophobicContact CG-CH2 3.92Å; P16-W44 HydrophobicContact CG-CZ3 4.02Å; M29-W44 HydrophobicContact CB-CH2 3.69Å; M29-W44 HydrophobicContact CB-CZ2 4.4Å; M29-W44 HydrophobicContact CB-CZ3 4.22Å; M29-W44 VanDerWaalsContact O-CZ2 3.29Å; M29-W44 WeakPolarHBondContact O-CZ2 3.41Å; C31-W44 HydrophobicContact CB-CH2 4.02Å; C31-W44 HydrophobicContact CB-CZ2 3.37Å; W44-E50 CarbonylContact O-C 3.58Å; W44-E50 WeakPolarHBondContact O-CA 3.38Å; W44-I51 HydrophobicContact CB-CB 4.39Å; W44-I51 HydrophobicContact CB-CD1 3.89Å; W44-I51 HydrophobicContact CB-CG1 4.32Å; W44-I51 PolarHBondContact O-N 3Å; W44-V61 HydrophobicContact CG-CG2 4.49Å; W44-G65 PolarHBondContact NE1-O 3.28Å; W44-L67 HydrophobicContact CB-CD1 4.28Å; W44-L67 HydrophobicContact CD2-CB 3.74Å; W44-L67 HydrophobicContact CD2-CD1 4.39Å; W44-L67 HydrophobicContact CD2-CD2 4.14Å; W44-L67 HydrophobicContact CD2-CG 4.33Å; W44-L67 VanDerWaalsContact CE2-CB 3.48Å; W44-L67 HydrophobicContact CE3-CB 4.19Å; W44-L67 HydrophobicContact CE3-CD2 4.03Å; W44-L67 HydrophobicContact CG-CB 4.17Å; W44-L67 HydrophobicContact CG-CD1 4.01Å; W44-L67 HydrophobicContact CG-CD2 4.45Å; W44-L67 HydrophobicContact CG-CG 4.46Å; W44-L67 HydrophobicContact CH2-CB 4.09Å; W44-L67 HydrophobicContact CZ2-CB 3.65Å; W44-L67 HydrophobicContact CZ3-CB 4.36Å; W44-L67 HydrophobicContact CZ3-CD2 4.47Å; W44-Y80 HydrophobicContact CE3-CD1 4.45Å; W44-C82 HydrophobicContact CD2-CB 4.2Å; W44-C82 HydrophobicContact CE3-CB 4.15Å; W44-C82 HydrophobicContact CH2-CB 3.91Å; W44-C82 HydrophobicContact CZ2-CB 3.93Å; W44-C82 HydrophobicContact CZ3-CB 4.01Å
45	L	93.7	Very high	85	Confident	25 Å²	25	71.3 Å²	71.3	13%	0.131	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	131.8	172.7	-50.5	174.8	0	0	0	109	F43 V49 E50 Y80 T81 L92	F43-L45 HydrophobicContact CD2-CD2 4.03Å; F43-L45 HydrophobicContact CD2-CG 4.35Å; F43-L45 HydrophobicContact CE2-CD1 4.41Å; F43-L45 HydrophobicContact CE2-CD2 3.95Å; F43-L45 HydrophobicContact CE2-CG 4.11Å; L45-V49 CarbonylContact C-O 3.49Å; L45-V49 VanDerWaalsContact CA-O 3.29Å; L45-V49 WeakPolarHBondContact CA-O 3.41Å; L45-E50 HydrophobicContact CD2-CB 3.77Å; L45-E50 HydrophobicContact CD2-CG 4.26Å; L45-Y80 WeakPolarHBondContact O-CA 3.46Å; L45-T81 PolarHBondContact N-O 3.18Å; L45-T81 PolarHBondContact O-N 3.29Å; L45-L92 HydrophobicContact CD1-CD1 4.22Å; L45-L92 HydrophobicContact CD1-CD2 3.93Å
46	K	94.1	Very high	84.7	Confident	50 Å²	50	67 Å²	67	22%	0.217	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	119.2	166.3	-175.3	-176.7	-173	-66.5	0	108.7	G48 V49 I51 S75 S77 Y80	K46-G48 PolarHBondContact O-N 3.38Å; K46-G48 VanDerWaalsContact O-N 3.1Å; K46-V49 PolarHBondContact N-O 3Å; K46-V49 PolarHBondContact O-N 3.46Å; K46-I51 HydrophobicContact CB-CD1 3.95Å; K46-I51 HydrophobicContact CB-CG1 3.95Å; K46-S75 VanDerWaalsContact CE-O 3.25Å; K46-S75 WeakPolarHBondContact CE-O 3.26Å; K46-S75 PolarHBondContact NZ-O 2.57Å; K46-S77 PolarHBondContact NZ-O 3.29Å; K46-Y80 HydrophobicContact CB-CD1 4.37Å; K46-Y80 HydrophobicContact CB-CE1 4.06Å; K46-Y80 HydrophobicContact CD-CE1 4.2Å; K46-Y80 WeakPolarHBondContact CD-OH 3.38Å; K46-Y80 WeakPolarHBondContact CE-OH 3.25Å; K46-Y80 HydrophobicContact CG-CE1 4.03Å; K46-Y80 HydrophobicContact CG-CE2 4.28Å
47	D	92.7	Very high	84.3	Confident	92 Å²	92	67.7 Å²	67.7	49%	0.492	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	31.8	-179.2	-54.3	-52.4	0	0	0	112.7	G78 N79	D47-G78 WeakPolarHBondContact OD1-CA 3.34Å; D47-N79 PolarHBondContact N-O 2.84Å; D47-N79 PolarHBondContact OD1-N 3.41Å
48	G	88.9	Confident	84.4	Confident	59 Å²	59	63 Å²	63	61%	0.608	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	-1.2	-178.1	0	0	0	0	0	115.9	K46	K46-G48 PolarHBondContact O-N 3.38Å; K46-G48 VanDerWaalsContact O-N 3.1Å
49	V	90.8	Very high	84.6	Confident	106 Å²	106	60.6 Å²	60.6	64%	0.642	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	130.9	179.1	-177.5	0	0	0	0	110.6	L45 K46 I51	L45-V49 CarbonylContact C-O 3.49Å; L45-V49 VanDerWaalsContact CA-O 3.29Å; L45-V49 WeakPolarHBondContact CA-O 3.41Å; K46-V49 PolarHBondContact N-O 3Å; K46-V49 PolarHBondContact O-N 3.46Å; V49-I51 PolarHBondContact O-N 3.4Å
50	E	89.2	Confident	84.7	Confident	88 Å²	88	55.9 Å²	55.9	41%	0.411	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	129.8	-179.4	-168	174.8	172.5	0	0	112.3	F43 W44 L45 V52 R85	F43-E50 HydrophobicContact CD2-CG 4.34Å; W44-E50 CarbonylContact O-C 3.58Å; W44-E50 WeakPolarHBondContact O-CA 3.38Å; L45-E50 HydrophobicContact CD2-CB 3.77Å; L45-E50 HydrophobicContact CD2-CG 4.26Å; E50-V52 PolarHBondContact O-N 3.23Å; E50-R85 IonicContact OE1-NH1 2.97Å; E50-R85 IonicContact OE1-NH2 3.7Å; E50-R85 IonicContact OE2-NH1 2.74Å
51	I	87.4	Confident	84.7	Confident	32 Å²	32	56.5 Å²	56.5	16%	0.164	30%	0.3	C	S	.	.			trans	-82	109.3	179.3	-56.8	179.1	0	0	0	108.6	W44 K46 V49 S53 V59 L67 Y80	W44-I51 HydrophobicContact CB-CB 4.39Å; W44-I51 HydrophobicContact CB-CD1 3.89Å; W44-I51 HydrophobicContact CB-CG1 4.32Å; W44-I51 PolarHBondContact O-N 3Å; K46-I51 HydrophobicContact CB-CD1 3.95Å; K46-I51 HydrophobicContact CB-CG1 3.95Å; V49-I51 PolarHBondContact O-N 3.4Å; I51-S53 PolarHBondContact O-N 3.16Å; I51-V59 HydrophobicContact CG2-CG1 3.76Å; I51-L67 HydrophobicContact CD1-CD1 4.26Å; I51-L67 HydrophobicContact CD1-CD2 4.11Å; I51-Y80 HydrophobicContact CD1-CD1 3.91Å; I51-Y80 HydrophobicContact CD1-CE1 3.65Å
52	V	76.9	Confident	84.5	Confident	80 Å²	80	52.5 Å²	52.5	49%	0.485	29%	0.286	S	S	.	.			trans	-86.5	101.1	171.2	-174.4	0	0	0	0	108.6	E50 R54 K55	E50-V52 PolarHBondContact O-N 3.23Å; V52-R54 HydrophobicContact CG1-CB 4.35Å; V52-R54 PolarHBondContact O-N 3.3Å; V52-K55 HydrophobicContact CB-CG 4.25Å; V52-K55 HydrophobicContact CG1-CG 4.35Å; V52-K55 PolarHBondContact O-N 2.97Å
53	S	68	Low	83.9	Confident	40 Å²	40	59.4 Å²	59.4	28%	0.28	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-51.7	-27.6	-176.7	-62.7	0	0	0	0	113.9	I51 K55	I51-S53 PolarHBondContact O-N 3.16Å; S53-K55 VanDerWaalsContact C-N 3.28Å; S53-K55 PolarHBondContact O-N 3.49Å
54	R	61.2	Low	83.5	Confident	184 Å²	184	62.3 Å²	62.3	69%	0.694	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-68.2	-21.4	177.7	-64.1	-173.7	-174	-125.7	-3.4	114.3	V52 D514	V52-R54 HydrophobicContact CG1-CB 4.35Å; V52-R54 PolarHBondContact O-N 3.3Å; R54-D514 IonicContact NH1-OD2 2.72Å
55	K	67.3	Low	83.2	Confident	117 Å²	117	62.3 Å²	62.3	51%	0.509	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-82.1	-26.1	-178.3	-68.4	-163.5	172	-153.4	0	112.9	V52 S53 D499 T501	V52-K55 HydrophobicContact CB-CG 4.25Å; V52-K55 HydrophobicContact CG1-CG 4.35Å; V52-K55 PolarHBondContact O-N 2.97Å; S53-K55 VanDerWaalsContact C-N 3.28Å; S53-K55 PolarHBondContact O-N 3.49Å; K55-D499 IonicContact NZ-OD1 3.38Å; K55-T501 HydrophobicContact CB-CG2 4.4Å; K55-T501 HydrophobicContact CG-CG2 4.09Å
56	D	77.6	Confident	83	Confident	40 Å²	40	61.2 Å²	61.2	21%	0.214	33%	0.333	C	S	.	.			trans	-136.8	102.2	-174.5	-165.2	-16.6	0	0	0	111	N58 V59 R73	D56-N58 PolarHBondContact O-N 3Å; D56-N58 VanDerWaalsContact O-N 3.11Å; D56-N58 VanDerWaalsContact OD1-CB 3.22Å; D56-N58 WeakPolarHBondContact OD1-CB 3.39Å; D56-N58 PolarHBondContact OD1-N 3.4Å; D56-V59 HydrophobicContact CB-CB 4.43Å; D56-V59 HydrophobicContact CB-CG2 4.3Å; D56-V59 PolarHBondContact O-N 3.3Å; D56-V59 VanDerWaalsContact O-O 3.12Å; D56-R73 IonicContact OD1-CZ 3.42Å; D56-R73 IonicContact OD1-NH1 2.89Å; D56-R73 PolarHBondContact OD1-NH1 2.76Å; D56-R73 VanDerWaalsContact OD1-NH1 3.11Å; D56-R73 IonicContact OD1-NH2 2.96Å; D56-R73 IonicContact OD2-CZ 2.8Å; D56-R73 VanDerWaalsContact OD2-CZ 3.25Å; D56-R73 IonicContact OD2-NH1 2.67Å; D56-R73 PolarHBondContact OD2-NH1 3.2Å; D56-R73 IonicContact OD2-NH2 3.2Å; D56-R73 PolarHBondContact OD2-NH2 3.33Å
57	P	76.5	Confident	83	Confident	34 Å²	34	58.9 Å²	58.9	22%	0.221	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-15	-176.5	32.8	-40.3	0	0	0	112.4	V59 I502 V505	P57-V59 PolarHBondContact O-N 3.5Å; P57-I502 HydrophobicContact CG-CB 3.67Å; P57-I502 HydrophobicContact CG-CD1 3.89Å; P57-I502 HydrophobicContact CG-CG1 4.39Å; P57-I502 HydrophobicContact CG-CG2 3.66Å; P57-V505 HydrophobicContact CG-CG2 4.24Å
58	N	84.4	Confident	83	Confident	20 Å²	20	56.7 Å²	56.7	11%	0.107	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-18.4	174.3	-169.4	49	0	0	0	111.8	D56 I69 S70 S71 R73	D56-N58 PolarHBondContact O-N 3Å; D56-N58 VanDerWaalsContact O-N 3.11Å; D56-N58 VanDerWaalsContact OD1-CB 3.22Å; D56-N58 WeakPolarHBondContact OD1-CB 3.39Å; D56-N58 PolarHBondContact OD1-N 3.4Å; N58-I69 WeakPolarHBondContact ND2-CG2 3.48Å; N58-I69 CarbonylContact O-C 3.47Å; N58-I69 VanDerWaalsContact O-CA 3.24Å; N58-I69 WeakPolarHBondContact O-CA 3.49Å; N58-S70 PolarHBondContact O-N 3.36Å; N58-S70 WeakPolarHBondContact OD1-CB 3.37Å; N58-S70 PolarHBondContact OD1-N 2.95Å; N58-S71 PolarHBondContact ND2-O 3.48Å; N58-S71 PolarHBondContact OD1-N 3.31Å; N58-S71 PolarHBondContact OD1-O 3.25Å; N58-R73 PolarHBondContact ND2-NE 3.46Å
59	V	89.4	Confident	83.2	Confident	7 Å²	7	53.9 Å²	53.9	4%	0.042	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	114.5	-172.9	-174.2	0	0	0	0	109.8	I51 D56 P57 L67 L68 I69	I51-V59 HydrophobicContact CG2-CG1 3.76Å; D56-V59 HydrophobicContact CB-CB 4.43Å; D56-V59 HydrophobicContact CB-CG2 4.3Å; D56-V59 PolarHBondContact O-N 3.3Å; D56-V59 VanDerWaalsContact O-O 3.12Å; P57-V59 PolarHBondContact O-N 3.5Å; V59-L67 HydrophobicContact CG1-CD1 3.49Å; V59-L67 VanDerWaalsContact CG1-CD1 3.49Å; V59-L67 HydrophobicContact CG1-CG 4.25Å; V59-L68 CarbonylContact C-O 3.51Å; V59-L68 WeakPolarHBondContact CA-O 3.46Å; V59-I69 HydrophobicContact CG2-CG1 4.46Å
60	I	85.9	Confident	83.1	Confident	28 Å²	28	51.3 Å²	51.3	14%	0.144	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.1	-174.3	-58	166.4	0	0	0	108.6	L68 T510	I60-L68 HydrophobicContact CB-CB 4.37Å; I60-L68 PolarHBondContact N-O 2.89Å; I60-L68 PolarHBondContact O-N 3.36Å; I60-T510 HydrophobicContact CD1-CG2 3.47Å; I60-T510 VanDerWaalsContact CD1-CG2 3.47Å
61	V	88.5	Confident	83.1	Confident	31 Å²	31	49.5 Å²	49.5	19%	0.188	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	113.8	163.9	-175.4	0	0	0	0	107.7	W44 S66 L67	W44-V61 HydrophobicContact CG-CG2 4.49Å; V61-S66 WeakPolarHBondContact CA-O 3.45Å; V61-L67 HydrophobicContact CG2-CD1 4.01Å
62	A	84.3	Confident	83.2	Confident	28 Å²	28	48 Å²	48	23%	0.231	26%	0.259	C	S	.	.			trans	-72.8	163.3	178.9	0	0	0	0	0	111.5	D64 G65 S66 L68	A62-D64 WeakPolarHBondContact CB-OD1 3.37Å; A62-D64 PolarHBondContact O-N 3.16Å; A62-D64 VanDerWaalsContact O-N 3.14Å; A62-G65 PolarHBondContact O-N 3.37Å; A62-S66 PolarHBondContact N-O 2.69Å; A62-L68 HydrophobicContact CB-CD1 4.06Å; A62-L68 HydrophobicContact CB-CG 4.4Å
63	N	79.2	Confident	83.9	Confident	174 Å²	174	48 Å²	48	93%	0.93	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-22	-177.1	-69.8	-4.9	0	0	0	113.9	G65	N63-G65 VanDerWaalsContact C-N 3.29Å
64	D	83	Confident	84.8	Confident	72 Å²	72	49.9 Å²	49.9	39%	0.385	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-5.7	175.1	68.3	-26.2	0	0	0	113	A62 S66	A62-D64 WeakPolarHBondContact CB-OD1 3.37Å; A62-D64 PolarHBondContact O-N 3.16Å; A62-D64 VanDerWaalsContact O-N 3.14Å; D64-S66 VanDerWaalsContact CG-OG 3.27Å; D64-S66 WeakPolarHBondContact OD1-CB 3.39Å; D64-S66 PolarHBondContact OD1-N 2.93Å; D64-S66 VanDerWaalsContact OD1-N 3.1Å; D64-S66 PolarHBondContact OD1-OG 2.86Å; D64-S66 PolarHBondContact OD2-OG 3.48Å
65	G	87.5	Confident	86.1	Confident	2 Å²	2	44.9 Å²	44.9	2%	0.021	25%	0.249	C	C	.	.	S	Bend	trans	96.7	-6.8	-176.7	0	0	0	0	0	114.5	C31 V42 W44 A62 N63	C31-G65 CarbonylContact O-C 3.2Å; C31-G65 WeakPolarHBondContact O-CA 3.43Å; V42-G65 WeakPolarHBondContact CG1-O 3.49Å; W44-G65 PolarHBondContact NE1-O 3.28Å; A62-G65 PolarHBondContact O-N 3.37Å; N63-G65 VanDerWaalsContact C-N 3.29Å
66	S	90.9	Very high	87.3	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.014	23%	0.227	C	C	.	.			trans	-70.3	140.8	-177.7	-60.5	0	0	0	0	112.1	M29 P30 V61 A62 D64	M29-S66 WeakPolarHBondContact O-CA 3.3Å; P30-S66 WeakPolarHBondContact CA-OG 3.5Å; V61-S66 WeakPolarHBondContact CA-O 3.45Å; A62-S66 PolarHBondContact N-O 2.69Å; D64-S66 VanDerWaalsContact CG-OG 3.27Å; D64-S66 WeakPolarHBondContact OD1-CB 3.39Å; D64-S66 PolarHBondContact OD1-N 2.93Å; D64-S66 VanDerWaalsContact OD1-N 3.1Å; D64-S66 PolarHBondContact OD1-OG 2.86Å; D64-S66 PolarHBondContact OD2-OG 3.48Å
67	L	93.9	Very high	88	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	123.2	172.5	-173.2	74.2	0	0	0	110.1	E28 M29 W44 I51 V59 V61 Y80	E28-L67 WeakPolarHBondContact CA-O 3.23Å; M29-L67 HydrophobicContact CB-CB 4.25Å; M29-L67 PolarHBondContact N-O 3.44Å; M29-L67 PolarHBondContact O-N 3.33Å; W44-L67 HydrophobicContact CB-CD1 4.28Å; W44-L67 HydrophobicContact CD2-CB 3.74Å; W44-L67 HydrophobicContact CD2-CD1 4.39Å; W44-L67 HydrophobicContact CD2-CD2 4.14Å; W44-L67 HydrophobicContact CD2-CG 4.33Å; W44-L67 VanDerWaalsContact CE2-CB 3.48Å; W44-L67 HydrophobicContact CE3-CB 4.19Å; W44-L67 HydrophobicContact CE3-CD2 4.03Å; W44-L67 HydrophobicContact CG-CB 4.17Å; W44-L67 HydrophobicContact CG-CD1 4.01Å; W44-L67 HydrophobicContact CG-CD2 4.45Å; W44-L67 HydrophobicContact CG-CG 4.46Å; W44-L67 HydrophobicContact CH2-CB 4.09Å; W44-L67 HydrophobicContact CZ2-CB 3.65Å; W44-L67 HydrophobicContact CZ3-CB 4.36Å; W44-L67 HydrophobicContact CZ3-CD2 4.47Å; I51-L67 HydrophobicContact CD1-CD1 4.26Å; I51-L67 HydrophobicContact CD1-CD2 4.11Å; V59-L67 HydrophobicContact CG1-CD1 3.49Å; V59-L67 VanDerWaalsContact CG1-CD1 3.49Å; V59-L67 HydrophobicContact CG1-CG 4.25Å; V61-L67 HydrophobicContact CG2-CD1 4.01Å; L67-Y80 HydrophobicContact CD2-CD1 3.33Å; L67-Y80 HydrophobicContact CD2-CE1 3.46Å; L67-Y80 VanDerWaalsContact CD2-CE1 3.46Å; L67-Y80 HydrophobicContact CD2-CG 4.32Å
68	L	92.2	Very high	88.8	Confident	47 Å²	47	38.2 Å²	38.2	25%	0.246	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.1	177.9	-56.2	-179.8	0	0	0	109.7	V27 E28 V59 I60 A62	V27-L68 CarbonylContact O-C 3.57Å; V27-L68 WeakPolarHBondContact O-CA 3.37Å; E28-L68 HydrophobicContact CB-CD2 3.8Å; E28-L68 HydrophobicContact CG-CD2 3.64Å; V59-L68 CarbonylContact C-O 3.51Å; V59-L68 WeakPolarHBondContact CA-O 3.46Å; I60-L68 HydrophobicContact CB-CB 4.37Å; I60-L68 PolarHBondContact N-O 2.89Å; I60-L68 PolarHBondContact O-N 3.36Å; A62-L68 HydrophobicContact CB-CD1 4.06Å; A62-L68 HydrophobicContact CB-CG 4.4Å
69	I	92.9	Very high	89.3	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	106.6	170.2	-50.4	-179.8	0	0	0	108.1	L26 V27 N58 V59 S71 D76 L98	L26-I69 CarbonylContact C-O 3.54Å; L26-I69 WeakPolarHBondContact CA-O 3.36Å; V27-I69 HydrophobicContact CB-CB 3.9Å; V27-I69 HydrophobicContact CB-CD1 4.4Å; V27-I69 HydrophobicContact CB-CG1 4.26Å; V27-I69 HydrophobicContact CG2-CB 4.13Å; V27-I69 PolarHBondContact N-O 2.9Å; V27-I69 PolarHBondContact O-N 3.1Å; N58-I69 WeakPolarHBondContact ND2-CG2 3.48Å; N58-I69 CarbonylContact O-C 3.47Å; N58-I69 VanDerWaalsContact O-CA 3.24Å; N58-I69 WeakPolarHBondContact O-CA 3.49Å; V59-I69 HydrophobicContact CG2-CG1 4.46Å; I69-S71 VanDerWaalsContact C-N 3.32Å; I69-S71 PolarHBondContact O-N 3.14Å; I69-D76 HydrophobicContact CD1-CB 4.09Å; I69-L98 HydrophobicContact CD1-CD2 3.76Å
70	S	88.1	Confident	89.7	Confident	51 Å²	51	40.4 Å²	40.4	36%	0.357	24%	0.235	S	C	.	.	S	Bend	trans	-58.7	-40.4	-172.1	-63.2	0	0	0	0	113	N58	N58-S70 PolarHBondContact O-N 3.36Å; N58-S70 WeakPolarHBondContact OD1-CB 3.37Å; N58-S70 PolarHBondContact OD1-N 2.95Å
71	S	89.3	Confident	90.1	Very high	50 Å²	50	40 Å²	40	35%	0.35	23%	0.234	S	C	.	.	S	Bend	trans	-141.5	109.5	177.6	-178.3	0	0	0	0	110.4	G24 N58 I69 R73	G24-S71 WeakPolarHBondContact CA-OG 3.25Å; N58-S71 PolarHBondContact ND2-O 3.48Å; N58-S71 PolarHBondContact OD1-N 3.31Å; N58-S71 PolarHBondContact OD1-O 3.25Å; I69-S71 VanDerWaalsContact C-N 3.32Å; I69-S71 PolarHBondContact O-N 3.14Å; S71-R73 PolarHBondContact O-N 3.17Å
72	A	91.2	Very high	90.4	Very high	2 Å²	2	38.6 Å²	38.6	2%	0.017	23%	0.225	C	C	.	.			trans	-62.3	124.8	-177.4	0	0	0	0	0	113.2	L23 G24 S25 V27 I100	L23-A72 WeakPolarHBondContact CD1-O 3.45Å; G24-A72 PolarHBondContact N-O 2.93Å; S25-A72 VanDerWaalsContact O-CB 3.29Å; S25-A72 WeakPolarHBondContact O-CB 3.44Å; S25-A72 PolarHBondContact O-N 3.48Å; V27-A72 HydrophobicContact CG2-CB 3.92Å; A72-I100 HydrophobicContact CB-CD1 3.7Å; A72-I100 HydrophobicContact CB-CG1 4.17Å; A72-I100 HydrophobicContact CB-CG2 4.1Å
73	R	90.8	Very high	90.8	Very high	79 Å²	79	37.2 Å²	37.2	30%	0.298	21%	0.214	S	C	.	.			trans	-107	159.8	173.2	-57.8	164.2	-62.4	-168.9	3.6	110.3	D56 N58 S71 S75 D76 I100	D56-R73 IonicContact OD1-CZ 3.42Å; D56-R73 IonicContact OD1-NH1 2.89Å; D56-R73 PolarHBondContact OD1-NH1 2.76Å; D56-R73 VanDerWaalsContact OD1-NH1 3.11Å; D56-R73 IonicContact OD1-NH2 2.96Å; D56-R73 IonicContact OD2-CZ 2.8Å; D56-R73 VanDerWaalsContact OD2-CZ 3.25Å; D56-R73 IonicContact OD2-NH1 2.67Å; D56-R73 PolarHBondContact OD2-NH1 3.2Å; D56-R73 IonicContact OD2-NH2 3.2Å; D56-R73 PolarHBondContact OD2-NH2 3.33Å; N58-R73 PolarHBondContact ND2-NE 3.46Å; S71-R73 PolarHBondContact O-N 3.17Å; R73-S75 PolarHBondContact O-N 3.16Å; R73-D76 VanDerWaalsContact CB-OD2 3.31Å; R73-D76 WeakPolarHBondContact CB-OD2 3.5Å; R73-D76 IonicContact CZ-OD1 3.27Å; R73-D76 IonicContact CZ-OD2 3.59Å; R73-D76 PolarHBondContact N-OD2 2.84Å; R73-D76 IonicContact NE-OD1 2.94Å; R73-D76 PolarHBondContact NE-OD1 3.41Å; R73-D76 IonicContact NE-OD2 3.39Å; R73-D76 PolarHBondContact NE-OD2 2.96Å; R73-D76 VanDerWaalsContact NE-OD2 3.11Å; R73-D76 IonicContact NH2-OD1 2.94Å; R73-D76 PolarHBondContact NH2-OD1 2.9Å; R73-D76 IonicContact NH2-OD2 3.64Å; R73-D76 WeakPolarHBondContact O-CB 3.29Å; R73-D76 PolarHBondContact O-N 2.97Å; R73-I100 WeakPolarHBondContact O-CG1 3.49Å
74	L	85.7	Confident	91.5	Very high	80 Å²	80	29 Å²	29	42%	0.419	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-60.1	-34.5	176.5	-68.4	173.9	0	0	0	112.8	L23 D76 S77 I100 V102	L23-L74 HydrophobicContact CD1-CD2 4.47Å; L23-L74 HydrophobicContact CD1-CG 4.06Å; L74-D76 PolarHBondContact O-N 3Å; L74-S77 WeakPolarHBondContact O-CB 3.43Å; L74-S77 PolarHBondContact O-N 3.41Å; L74-S77 VanDerWaalsContact O-N 3.15Å; L74-S77 PolarHBondContact O-OG 2.94Å; L74-S77 VanDerWaalsContact O-OG 3.08Å; L74-I100 HydrophobicContact CD2-CG2 4.34Å; L74-V102 HydrophobicContact CD1-CG2 4.35Å; L74-V102 HydrophobicContact CD2-CG2 3.92Å; L74-V102 HydrophobicContact CG-CG2 4.46Å
75	S	88.7	Confident	91.8	Very high	78 Å²	78	29.3 Å²	29.3	55%	0.545	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-65.3	-20.4	175.5	52.8	0	0	0	0	114	K46 R73 S77	K46-S75 VanDerWaalsContact CE-O 3.25Å; K46-S75 WeakPolarHBondContact CE-O 3.26Å; K46-S75 PolarHBondContact NZ-O 2.57Å; R73-S75 PolarHBondContact O-N 3.16Å; S75-S77 PolarHBondContact O-N 2.94Å
76	D	93	Very high	91.7	Very high	6 Å²	6	30.5 Å²	30.5	3%	0.032	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-77.9	-5.4	176.7	-56.4	-28.7	0	0	0	111.2	I69 R73 L74 G78 Y80 I100	I69-D76 HydrophobicContact CD1-CB 4.09Å; R73-D76 VanDerWaalsContact CB-OD2 3.31Å; R73-D76 WeakPolarHBondContact CB-OD2 3.5Å; R73-D76 IonicContact CZ-OD1 3.27Å; R73-D76 IonicContact CZ-OD2 3.59Å; R73-D76 PolarHBondContact N-OD2 2.84Å; R73-D76 IonicContact NE-OD1 2.94Å; R73-D76 PolarHBondContact NE-OD1 3.41Å; R73-D76 IonicContact NE-OD2 3.39Å; R73-D76 PolarHBondContact NE-OD2 2.96Å; R73-D76 VanDerWaalsContact NE-OD2 3.11Å; R73-D76 IonicContact NH2-OD1 2.94Å; R73-D76 PolarHBondContact NH2-OD1 2.9Å; R73-D76 IonicContact NH2-OD2 3.64Å; R73-D76 WeakPolarHBondContact O-CB 3.29Å; R73-D76 PolarHBondContact O-N 2.97Å; L74-D76 PolarHBondContact O-N 3Å; D76-G78 PolarHBondContact O-N 2.59Å; D76-Y80 VanDerWaalsContact O-CE2 3.23Å; D76-Y80 WeakPolarHBondContact O-CE2 3.46Å; D76-Y80 PolarHBondContact O-OH 2.87Å; D76-I100 HydrophobicContact CB-CG1 4.49Å
77	S	92.3	Very high	91.3	Very high	30 Å²	30	36.5 Å²	36.5	21%	0.21	20%	0.202	C	C	.	.			trans	-66.8	136.9	169.1	-54.2	0	0	0	0	109.9	K46 L74 S75 L98 I100	K46-S77 PolarHBondContact NZ-O 3.29Å; L74-S77 WeakPolarHBondContact O-CB 3.43Å; L74-S77 PolarHBondContact O-N 3.41Å; L74-S77 VanDerWaalsContact O-N 3.15Å; L74-S77 PolarHBondContact O-OG 2.94Å; L74-S77 VanDerWaalsContact O-OG 3.08Å; S75-S77 PolarHBondContact O-N 2.94Å; S77-L98 VanDerWaalsContact CA-O 3.23Å; S77-L98 WeakPolarHBondContact CA-O 3.25Å; S77-I100 PolarHBondContact OG-N 3.01Å
78	G	94.4	Very high	90.6	Very high	15 Å²	15	39.4 Å²	39.4	16%	0.155	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.7	-175.5	-177.9	0	0	0	0	0	112.5	D47 D76 L98	D47-G78 WeakPolarHBondContact OD1-CA 3.34Å; D76-G78 PolarHBondContact O-N 2.59Å; G78-L98 PolarHBondContact N-O 2.95Å; G78-L98 VanDerWaalsContact N-O 3.09Å; G78-L98 PolarHBondContact O-N 2.97Å
79	N	95.2	Very high	90.2	Very high	70 Å²	70	40.3 Å²	40.3	37%	0.374	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	119.7	175.4	-69.6	-25.6	0	0	0	109.7	D47 P95 S97	D47-N79 PolarHBondContact N-O 2.84Å; D47-N79 PolarHBondContact OD1-N 3.41Å; N79-P95 HydrophobicContact CB-CB 4.22Å; N79-S97 PolarHBondContact OD1-OG 3.21Å
80	Y	96.2	Very high	90	Very high	3 Å²	3	44.9 Å²	44.9	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127.7	179.6	-72.6	-96.6	0	0	0	110.2	M29 W44 L45 K46 I51 L67 D76 A96 L98	M29-Y80 HydrophobicContact CE-CG 4.47Å; M29-Y80 HydrophobicContact SD-CD1 4.34Å; M29-Y80 HydrophobicContact SD-CD2 3.96Å; M29-Y80 HydrophobicContact SD-CG 3.76Å; W44-Y80 HydrophobicContact CE3-CD1 4.45Å; L45-Y80 WeakPolarHBondContact O-CA 3.46Å; K46-Y80 HydrophobicContact CB-CD1 4.37Å; K46-Y80 HydrophobicContact CB-CE1 4.06Å; K46-Y80 HydrophobicContact CD-CE1 4.2Å; K46-Y80 WeakPolarHBondContact CD-OH 3.38Å; K46-Y80 WeakPolarHBondContact CE-OH 3.25Å; K46-Y80 HydrophobicContact CG-CE1 4.03Å; K46-Y80 HydrophobicContact CG-CE2 4.28Å; I51-Y80 HydrophobicContact CD1-CD1 3.91Å; I51-Y80 HydrophobicContact CD1-CE1 3.65Å; L67-Y80 HydrophobicContact CD2-CD1 3.33Å; L67-Y80 HydrophobicContact CD2-CE1 3.46Å; L67-Y80 VanDerWaalsContact CD2-CE1 3.46Å; L67-Y80 HydrophobicContact CD2-CG 4.32Å; D76-Y80 VanDerWaalsContact O-CE2 3.23Å; D76-Y80 WeakPolarHBondContact O-CE2 3.46Å; D76-Y80 PolarHBondContact O-OH 2.87Å; Y80-A96 PolarHBondContact N-O 2.63Å; Y80-A96 PolarHBondContact O-N 3.49Å; Y80-L98 HydrophobicContact CD2-CB 3.88Å; Y80-L98 HydrophobicContact CD2-CD2 4.48Å; Y80-L98 HydrophobicContact CE2-CB 3.85Å; Y80-L98 HydrophobicContact CE2-CD2 3.89Å; Y80-L98 HydrophobicContact CE2-CG 4.49Å
81	T	95.2	Very high	90	Very high	21 Å²	21	46.2 Å²	46.2	13%	0.129	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	127.7	175.9	-59.2	0	0	0	0	108.6	L45 L92 T93	L45-T81 PolarHBondContact N-O 3.18Å; L45-T81 PolarHBondContact O-N 3.29Å; T81-L92 HydrophobicContact CG2-CB 3.89Å; T81-L92 HydrophobicContact CG2-CD2 4.3Å; T81-T93 WeakPolarHBondContact CG2-O 3.44Å
82	C	94.9	Very high	90.2	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	139.2	171.1	-177.1	0	0	0	0	109.5	P16 C31 W44 L92 T93	P16-C82 HydrophobicContact CG-CB 4.47Å; C31-C82 HydrophobicContact CB-CB 3.63Å; C31-C82 WeakPolarHBondContact CB-SG 3.17Å; C31-C82 WeakPolarHBondContact SG-CB 3.49Å; C31-C82 CovalentContact SG-SG 2.01Å; C31-C82 PolarHBondContact SG-SG 2.93Å; W44-C82 HydrophobicContact CD2-CB 4.2Å; W44-C82 HydrophobicContact CE3-CB 4.15Å; W44-C82 HydrophobicContact CH2-CB 3.91Å; W44-C82 HydrophobicContact CZ2-CB 3.93Å; W44-C82 HydrophobicContact CZ3-CB 4.01Å; C82-L92 CarbonylContact O-C 3.54Å; C82-L92 WeakPolarHBondContact O-CA 3.29Å; C82-T93 HydrophobicContact CB-CG2 3.87Å; C82-T93 PolarHBondContact N-OG1 2.99Å; C82-T93 VanDerWaalsContact N-OG1 3.13Å; C82-T93 PolarHBondContact O-N 3.27Å; C82-T93 PolarHBondContact O-OG1 2.94Å
83	G	93.2	Very high	90.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	145.2	176.3	0	0	0	0	0	112.2	V42 F43 R91	V42-G83 CarbonylContact C-O 3.23Å; V42-G83 VanDerWaalsContact CA-O 3.31Å; V42-G83 WeakPolarHBondContact CA-O 3.42Å; F43-G83 WeakPolarHBondContact CD1-O 3.5Å; F43-G83 PolarHBondContact N-O 3.13Å; F43-G83 PolarHBondContact O-N 3.42Å; G83-R91 CarbonylContact C-O 3.59Å; G83-R91 WeakPolarHBondContact CA-O 3.41Å
84	A	92.2	Very high	90.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	122.1	174.2	0	0	0	0	0	108.8	F12 P33 P40 E41 E90 R91	F12-A84 HydrophobicContact CE1-CB 3.86Å; F12-A84 HydrophobicContact CZ-CB 3.86Å; P33-A84 HydrophobicContact CB-CB 3.77Å; P40-A84 HydrophobicContact CB-CB 4.26Å; E41-A84 WeakPolarHBondContact O-CA 3.38Å; A84-E90 WeakPolarHBondContact O-CA 3.24Å; A84-R91 PolarHBondContact N-O 2.94Å; A84-R91 PolarHBondContact O-N 3.43Å
85	R	89.5	Confident	90.7	Very high	80 Å²	80	52.1 Å²	52.1	30%	0.302	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	142.9	-179.5	66.6	-178.1	-177.4	-149.9	-7	112.8	P40 E41 F43 E50 N89 E90	P40-R85 CarbonylContact C-O 3.57Å; P40-R85 WeakPolarHBondContact CA-O 3.41Å; E41-R85 HydrophobicContact CB-CG 4.25Å; E41-R85 PolarHBondContact N-O 2.95Å; E41-R85 PolarHBondContact O-N 3.37Å; E41-R85 IonicContact OE1-NH2 3.09Å; E41-R85 IonicContact OE2-CZ 2.73Å; E41-R85 IonicContact OE2-NE 2.75Å; E41-R85 PolarHBondContact OE2-NE 3.23Å; E41-R85 IonicContact OE2-NH2 3.16Å; E41-R85 PolarHBondContact OE2-NH2 3.11Å; F43-R85 HydrophobicContact CD1-CB 4.44Å; F43-R85 HydrophobicContact CD1-CG 4.02Å; F43-R85 HydrophobicContact CE1-CB 3.92Å; F43-R85 HydrophobicContact CE1-CG 3.98Å; E50-R85 IonicContact OE1-NH1 2.97Å; E50-R85 IonicContact OE1-NH2 3.7Å; E50-R85 IonicContact OE2-NH1 2.74Å; R85-N89 WeakPolarHBondContact CA-O 3.48Å; R85-E90 HydrophobicContact CB-CB 4.19Å; R85-E90 HydrophobicContact CB-CG 4.05Å
86	N	85.4	Confident	91.1	Very high	26 Å²	26	48.5 Å²	48.5	14%	0.139	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	170.4	172.1	-174.1	11.9	0	0	0	108.4	M8 E37 P38 P40 V88 N89	M8-N86 HydrophobicContact CE-CB 3.47Å; M8-N86 VanDerWaalsContact CE-CB 3.47Å; E37-N86 PolarHBondContact O-ND2 3.34Å; P38-N86 VanDerWaalsContact CD-ND2 3.34Å; P38-N86 WeakPolarHBondContact CD-ND2 3.45Å; P38-N86 VanDerWaalsContact CD-OD1 3.31Å; P38-N86 WeakPolarHBondContact CD-OD1 3.4Å; P38-N86 WeakPolarHBondContact CG-OD1 3.29Å; P38-N86 VanDerWaalsContact O-CG 3.23Å; P38-N86 PolarHBondContact O-ND2 2.9Å; P40-N86 HydrophobicContact CB-CB 4.27Å; N86-V88 PolarHBondContact O-N 2.88Å; N86-N89 PolarHBondContact N-O 3.05Å; N86-N89 PolarHBondContact O-N 3.27Å; N86-N89 VanDerWaalsContact O-N 3.09Å
87	I	82.5	Confident	91.2	Very high	129 Å²	129	49.5 Å²	49.5	66%	0.662	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-22.5	175.5	66.2	178.7	0	0	0	113.8	L6 P38	L6-I87 HydrophobicContact CD1-CD1 3.59Å; L6-I87 HydrophobicContact CD1-CG1 4.25Å; L6-I87 HydrophobicContact CD2-CD1 3.9Å; L6-I87 HydrophobicContact CG-CD1 4.35Å; P38-I87 HydrophobicContact CG-CD1 4.35Å; P38-I87 HydrophobicContact CG-CG1 4.49Å
88	V	79.1	Confident	91.4	Very high	60 Å²	60	48.1 Å²	48.1	36%	0.364	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-41.4	178.6	-174.6	0	0	0	0	112.4	L6 N86	L6-V88 HydrophobicContact CB-CG2 3.45Å; L6-V88 VanDerWaalsContact CB-CG2 3.45Å; N86-V88 PolarHBondContact O-N 2.88Å
89	N	83.8	Confident	91.3	Very high	66 Å²	66	51.9 Å²	51.9	35%	0.353	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	169.1	-169.4	-137.8	-36.7	0	0	0	113.3	M8 R85 N86 R91	M8-N89 HydrophobicContact CE-CB 3.74Å; M8-N89 WeakPolarHBondContact CE-O 3.43Å; M8-N89 HydrophobicContact SD-CB 3.99Å; R85-N89 WeakPolarHBondContact CA-O 3.48Å; N86-N89 PolarHBondContact N-O 3.05Å; N86-N89 PolarHBondContact O-N 3.27Å; N86-N89 VanDerWaalsContact O-N 3.09Å; N89-R91 PolarHBondContact ND2-NH1 3.46Å; N89-R91 VanDerWaalsContact ND2-NH1 3.13Å; N89-R91 PolarHBondContact ND2-NH2 2.93Å; N89-R91 PolarHBondContact OD1-NH1 3.01Å
90	E	89.1	Confident	91.3	Very high	97 Å²	97	48.6 Å²	48.6	45%	0.453	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	139.9	167.9	-177.5	177.4	146.3	0	0	109.3	F43 A84 R85	F43-E90 HydrophobicContact CE1-CG 4.07Å; F43-E90 HydrophobicContact CZ-CG 3.86Å; F43-E90 VanDerWaalsContact CZ-OE1 3.28Å; F43-E90 WeakPolarHBondContact CZ-OE1 3.42Å; A84-E90 WeakPolarHBondContact O-CA 3.24Å; R85-E90 HydrophobicContact CB-CB 4.19Å; R85-E90 HydrophobicContact CB-CG 4.05Å
91	R	88.9	Confident	91.1	Very high	79 Å²	79	51.1 Å²	51.1	30%	0.298	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	144.2	179	-71.2	-71.2	-179.5	-83.6	-11	109.9	M8 F12 G83 A84 N89	M8-R91 HydrophobicContact SD-CG 3.91Å; F12-R91 HydrophobicContact CE2-CB 3.9Å; F12-R91 HydrophobicContact CZ-CB 4.19Å; G83-R91 CarbonylContact C-O 3.59Å; G83-R91 WeakPolarHBondContact CA-O 3.41Å; A84-R91 PolarHBondContact N-O 2.94Å; A84-R91 PolarHBondContact O-N 3.43Å; N89-R91 PolarHBondContact ND2-NH1 3.46Å; N89-R91 VanDerWaalsContact ND2-NH1 3.13Å; N89-R91 PolarHBondContact ND2-NH2 2.93Å; N89-R91 PolarHBondContact OD1-NH1 3.01Å
92	L	92.4	Very high	90.9	Very high	88 Å²	88	50.6 Å²	50.6	46%	0.461	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	142.1	177.1	-60.7	176.7	0	0	0	108.9	F43 L45 T81 C82	F43-L92 HydrophobicContact CE2-CD2 3.77Å; F43-L92 HydrophobicContact CZ-CD2 3.61Å; L45-L92 HydrophobicContact CD1-CD1 4.22Å; L45-L92 HydrophobicContact CD1-CD2 3.93Å; T81-L92 HydrophobicContact CG2-CB 3.89Å; T81-L92 HydrophobicContact CG2-CD2 4.3Å; C82-L92 CarbonylContact O-C 3.54Å; C82-L92 WeakPolarHBondContact O-CA 3.29Å
93	T	92.9	Very high	90.7	Very high	11 Å²	11	53.8 Å²	53.8	7%	0.067	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-75.3	171.1	171.5	66.5	0	0	0	0	111.2	F12 E15 T81 C82	F12-T93 HydrophobicContact CB-CG2 4.47Å; F12-T93 HydrophobicContact CD1-CG2 3.74Å; F12-T93 HydrophobicContact CD2-CG2 3.66Å; F12-T93 HydrophobicContact CE1-CG2 3.76Å; F12-T93 HydrophobicContact CE2-CG2 3.66Å; F12-T93 HydrophobicContact CG-CG2 3.7Å; F12-T93 HydrophobicContact CZ-CG2 3.73Å; E15-T93 HydrophobicContact CB-CG2 4.32Å; E15-T93 HydrophobicContact CG-CG2 3.87Å; T81-T93 WeakPolarHBondContact CG2-O 3.44Å; C82-T93 HydrophobicContact CB-CG2 3.87Å; C82-T93 PolarHBondContact N-OG1 2.99Å; C82-T93 VanDerWaalsContact N-OG1 3.13Å; C82-T93 PolarHBondContact O-N 3.27Å; C82-T93 PolarHBondContact O-OG1 2.94Å
94	E	91.9	Very high	90.5	Very high	155 Å²	155	54.2 Å²	54.2	72%	0.724	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-62.8	147.3	161.2	-66.3	-166.2	165.5	0	0	110.4	A96	E94-A96 PolarHBondContact O-N 3.36Å
95	P	94	Very high	90.3	Very high	80 Å²	80	59.9 Å²	59.9	52%	0.519	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-71.4	128.3	179.1	27.4	-33	0	0	0	111.6	N79	N79-P95 HydrophobicContact CB-CB 4.22Å
96	A	96.5	Very high	90.5	Very high	2 Å²	2	58.6 Å²	58.6	2%	0.017	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	130	172.9	0	0	0	0	0	110.8	P16 M29 Y80 E94	P16-A96 HydrophobicContact CB-CB 3.73Å; P16-A96 HydrophobicContact CG-CB 4.02Å; M29-A96 HydrophobicContact CE-CB 3.71Å; Y80-A96 PolarHBondContact N-O 2.63Å; Y80-A96 PolarHBondContact O-N 3.49Å; E94-A96 PolarHBondContact O-N 3.36Å
97	S	95.2	Very high	90.4	Very high	28 Å²	28	58.7 Å²	58.7	20%	0.196	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	124.2	180	-56.6	0	0	0	0	111.2	T18 E19 N79	T18-S97 VanDerWaalsContact CA-O 3.31Å; T18-S97 WeakPolarHBondContact CA-O 3.46Å; T18-S97 WeakPolarHBondContact CG2-O 3.47Å; T18-S97 PolarHBondContact OG1-N 2.93Å; E19-S97 PolarHBondContact N-O 3.33Å; N79-S97 PolarHBondContact OD1-OG 3.21Å
98	L	96.2	Very high	90.7	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	124.1	169.9	179.1	61.9	0	0	0	109.1	E19 R21 V27 M29 I69 S77 G78 Y80 I100	E19-L98 HydrophobicContact CG-CD1 3.76Å; R21-L98 HydrophobicContact CG-CD1 4.05Å; V27-L98 HydrophobicContact CG1-CD1 3.83Å; V27-L98 HydrophobicContact CG1-CD2 3.95Å; V27-L98 HydrophobicContact CG2-CD2 4.42Å; M29-L98 HydrophobicContact SD-CB 4.45Å; M29-L98 HydrophobicContact SD-CD2 4.47Å; I69-L98 HydrophobicContact CD1-CD2 3.76Å; S77-L98 VanDerWaalsContact CA-O 3.23Å; S77-L98 WeakPolarHBondContact CA-O 3.25Å; G78-L98 PolarHBondContact N-O 2.95Å; G78-L98 VanDerWaalsContact N-O 3.09Å; G78-L98 PolarHBondContact O-N 2.97Å; Y80-L98 HydrophobicContact CD2-CB 3.88Å; Y80-L98 HydrophobicContact CD2-CD2 4.48Å; Y80-L98 HydrophobicContact CE2-CB 3.85Å; Y80-L98 HydrophobicContact CE2-CD2 3.89Å; Y80-L98 HydrophobicContact CE2-CG 4.49Å; L98-I100 HydrophobicContact CD1-CD1 3.85Å; L98-I100 HydrophobicContact CD2-CD1 4.13Å; L98-I100 HydrophobicContact CG-CD1 3.82Å; L98-I100 HydrophobicContact CG-CG1 4.46Å
99	H	93.5	Very high	91.3	Very high	95 Å²	95	60.8 Å²	60.8	44%	0.44	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	114.7	178.2	-65.9	-68	0	0	0	111.8	E19 R20 R21	E19-H99 PolarHBondContact O-N 3.44Å; R20-H99 WeakPolarHBondContact CA-O 3.39Å; R20-H99 HydrophobicContact CG-CB 4.18Å; R21-H99 PolarHBondContact N-O 3.22Å
100	I	95.1	Very high	91.3	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	128.7	178.8	-51.5	-50.6	0	0	0	111	R21 L23 A72 R73 L74 D76 S77 L98 N146	R21-I100 HydrophobicContact CB-CD1 3.82Å; R21-I100 VanDerWaalsContact O-CA 3.28Å; R21-I100 WeakPolarHBondContact O-CA 3.44Å; L23-I100 HydrophobicContact CB-CG2 4.38Å; L23-I100 HydrophobicContact CD1-CG2 4.22Å; A72-I100 HydrophobicContact CB-CD1 3.7Å; A72-I100 HydrophobicContact CB-CG1 4.17Å; A72-I100 HydrophobicContact CB-CG2 4.1Å; R73-I100 WeakPolarHBondContact O-CG1 3.49Å; L74-I100 HydrophobicContact CD2-CG2 4.34Å; D76-I100 HydrophobicContact CB-CG1 4.49Å; S77-I100 PolarHBondContact OG-N 3.01Å; L98-I100 HydrophobicContact CD1-CD1 3.85Å; L98-I100 HydrophobicContact CD2-CD1 4.13Å; L98-I100 HydrophobicContact CG-CD1 3.82Å; L98-I100 HydrophobicContact CG-CG1 4.46Å; I100-N146 WeakPolarHBondContact O-CB 3.22Å; I100-N146 PolarHBondContact O-ND2 3.21Å
101	Y	92.3	Very high	91.3	Very high	56 Å²	56	63 Å²	63	22%	0.22	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	156.2	-178.2	69.6	-90.8	0	0	0	113.8	R20 R21 P22 L23 N103	R20-Y101 HydrophobicContact CB-CD1 4.47Å; R20-Y101 HydrophobicContact CB-CE1 4.46Å; R21-Y101 WeakPolarHBondContact O-CD1 3.44Å; R21-Y101 WeakPolarHBondContact O-CE1 3.11Å; R21-Y101 PolarHBondContact O-N 3.17Å; P22-Y101 CarbonylContact C-O 3.54Å; P22-Y101 WeakPolarHBondContact CA-O 3.33Å; P22-Y101 HydrophobicContact CB-CE1 4.23Å; P22-Y101 HydrophobicContact CB-CE2 3.88Å; L23-Y101 PolarHBondContact N-O 2.97Å; Y101-N103 WeakPolarHBondContact CE2-OD1 3.24Å
102	V	91.3	Very high	91.3	Very high	10 Å²	10	63.2 Å²	63.2	6%	0.061	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-117	122	178.9	-173.4	0	0	0	0	109.3	L23 L74 P142 P144 A145 G148	L23-V102 HydrophobicContact CB-CG2 4.2Å; L23-V102 HydrophobicContact CD2-CG2 4.2Å; L74-V102 HydrophobicContact CD1-CG2 4.35Å; L74-V102 HydrophobicContact CD2-CG2 3.92Å; L74-V102 HydrophobicContact CG-CG2 4.46Å; V102-P142 HydrophobicContact CG1-CB 3.86Å; V102-P142 HydrophobicContact CG1-CG 3.59Å; V102-P144 CarbonylContact O-C 3.6Å; V102-P144 VanDerWaalsContact O-CA 3.24Å; V102-P144 WeakPolarHBondContact O-CA 3.45Å; V102-A145 HydrophobicContact CB-CB 3.96Å; V102-A145 HydrophobicContact CG2-CB 3.99Å; V102-A145 PolarHBondContact N-O 3.24Å; V102-A145 PolarHBondContact O-N 2.99Å; V102-G148 WeakPolarHBondContact O-CA 3.5Å
103	N	89.1	Confident	90.9	Very high	67 Å²	67	64.7 Å²	64.7	36%	0.358	32%	0.321	S	S	.	.			trans	-78.6	140.4	170	-69.8	-35.7	0	0	0	110.1	Y101 S149	Y101-N103 WeakPolarHBondContact CE2-OD1 3.24Å; N103-S149 PolarHBondContact OD1-N 3.4Å
104	G	89.2	Confident	90.3	Very high	8 Å²	8	66.7 Å²	66.7	8%	0.082	34%	0.343	C	S	.	.			trans	-68	141	176.6	0	0	0	0	0	112.8	P142 S149	G104-P142 WeakPolarHBondContact CA-O 3.47Å; G104-S149 PolarHBondContact N-O 2.72Å
105	Q	88.9	Confident	89.5	Confident	120 Å²	120	65.4 Å²	65.4	56%	0.561	35%	0.346	S	S	*	.			trans	-126.6	152.3	165.2	-57.6	171.2	-34.5	0	0	110.9	N140 N141 P142 C151	Q105-N140 PolarHBondContact O-N 3.35Å; Q105-N141 VanDerWaalsContact CB-O 3.28Å; Q105-N141 WeakPolarHBondContact CB-O 3.48Å; Q105-N141 PolarHBondContact O-N 2.99Å; Q105-N141 PolarHBondContact OE1-O 3.35Å; Q105-P142 PolarHBondContact N-O 3.29Å; Q105-C151 VanDerWaalsContact CA-SG 3.53Å; Q105-C151 PolarHBondContact N-SG 3.32Å; Q105-C151 VanDerWaalsContact N-SG 3.35Å; Q105-C151 PolarHBondContact O-SG 3.02Å
106	W	92.2	Very high	88.6	Confident	53 Å²	53	63.7 Å²	63.7	20%	0.201	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-72	142.7	-179.7	-70.8	113.6	0	0	0	111.7	R137 H138 C139 C151 P152 G153 P155	W106-R137 HydrophobicContact CD2-CG 3.96Å; W106-R137 HydrophobicContact CE3-CB 4.19Å; W106-R137 HydrophobicContact CE3-CG 3.52Å; W106-R137 HydrophobicContact CG-CG 4.46Å; W106-R137 HydrophobicContact CZ3-CG 3.97Å; W106-H138 VanDerWaalsContact CE3-C 3.47Å; W106-C139 HydrophobicContact CE3-CB 4.08Å; W106-C139 HydrophobicContact CH2-CB 4.29Å; W106-C139 HydrophobicContact CZ3-CB 3.86Å; W106-C151 HydrophobicContact CD2-CB 3.7Å; W106-C151 HydrophobicContact CE3-CB 4.29Å; W106-C151 HydrophobicContact CG-CB 4.08Å; W106-C151 HydrophobicContact CH2-CB 4.2Å; W106-C151 HydrophobicContact CZ2-CB 3.58Å; W106-P152 PolarHBondContact NE1-O 3.04Å; W106-G153 WeakPolarHBondContact CZ2-O 3.35Å; W106-P155 HydrophobicContact CH2-CB 3.83Å; W106-P155 HydrophobicContact CZ3-CB 3.81Å
107	S	85.1	Confident	87.5	Confident	28 Å²	28	64.6 Å²	64.6	20%	0.196	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-59.6	164.8	159.7	72.6	0	0	0	0	110.7	H138 N140	S107-H138 PolarHBondContact N-O 3.32Å; S107-H138 PolarHBondContact OG-N 3.37Å; S107-N140 WeakPolarHBondContact CB-OD1 3.4Å
108	Q	88.6	Confident	86.2	Confident	163 Å²	163	69.8 Å²	69.8	76%	0.762	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-55.3	150.6	159.5	-64.8	-174.4	2.7	0	0	109.3	G110	Q108-G110 PolarHBondContact O-N 2.99Å
109	W	91.9	Very high	84.9	Confident	70 Å²	70	71.6 Å²	71.6	27%	0.265	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-62.2	135.3	169.8	-73.3	107.5	0	0	0	109.2	R135 Y136 R137 P155 E157	W109-R135 HydrophobicContact CB-CG 4.42Å; W109-R135 HydrophobicContact CD2-CG 4.1Å; W109-R135 HydrophobicContact CE3-CB 4.32Å; W109-R135 HydrophobicContact CE3-CG 3.64Å; W109-R135 HydrophobicContact CG-CG 4.47Å; W109-R135 HydrophobicContact CZ3-CG 4.2Å; W109-R135 WeakPolarHBondContact CZ3-O 3.49Å; W109-Y136 VanDerWaalsContact CE3-C 3.43Å; W109-R137 HydrophobicContact CD2-CB 3.97Å; W109-R137 HydrophobicContact CD2-CG 4.03Å; W109-R137 HydrophobicContact CE3-CB 3.7Å; W109-R137 HydrophobicContact CE3-CG 3.73Å; W109-R137 HydrophobicContact CH2-CG 3.67Å; W109-R137 VanDerWaalsContact CZ2-CD 3.42Å; W109-R137 HydrophobicContact CZ2-CG 3.98Å; W109-R137 VanDerWaalsContact CZ2-NE 3.29Å; W109-R137 HydrophobicContact CZ3-CB 4.02Å; W109-R137 HydrophobicContact CZ3-CG 3.55Å; W109-P155 WeakPolarHBondContact CZ3-O 3.24Å; W109-E157 HydrophobicContact CE3-CB 4.45Å; W109-E157 HydrophobicContact CH2-CB 3.58Å; W109-E157 HydrophobicContact CZ2-CB 4.02Å; W109-E157 WeakPolarHBondContact CZ2-OE2 3.18Å; W109-E157 HydrophobicContact CZ3-CB 3.81Å
110	G	83.3	Confident	83.7	Confident	38 Å²	38	69 Å²	69	39%	0.392	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-64.9	171	167.9	0	0	0	0	0	111.7	Q108 R135 Y136	Q108-G110 PolarHBondContact O-N 2.99Å; G110-R135 WeakPolarHBondContact O-CB 3.46Å; G110-Y136 PolarHBondContact N-O 3.2Å
111	E	88.1	Confident	82.3	Confident	170 Å²	170	74.9 Å²	74.9	79%	0.794	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-58.2	153.5	174.5	-66.2	-58.1	148.1	0	0	111.6	E113	E111-E113 PolarHBondContact O-N 2.95Å; E111-E113 VanDerWaalsContact O-N 3.16Å
112	W	88.5	Confident	81	Confident	85 Å²	85	76.5 Å²	76.5	32%	0.322	42%	0.423	S	S	.	.			trans	-66.7	113.7	172.5	-72.6	106.4	0	0	0	109.8	L133 R135 E157 V159	W112-L133 HydrophobicContact CB-CB 4.19Å; W112-L133 HydrophobicContact CB-CD1 4.34Å; W112-L133 HydrophobicContact CD2-CB 4.05Å; W112-L133 HydrophobicContact CE3-CB 3.56Å; W112-L133 HydrophobicContact CG-CB 4.36Å; W112-L133 HydrophobicContact CG-CD1 4.49Å; W112-L133 HydrophobicContact CZ3-CB 4.26Å; W112-L133 WeakPolarHBondContact CZ3-O 3.5Å; W112-R135 HydrophobicContact CD2-CB 4.15Å; W112-R135 HydrophobicContact CD2-CG 4.14Å; W112-R135 HydrophobicContact CE3-CB 3.87Å; W112-R135 HydrophobicContact CE3-CG 3.83Å; W112-R135 HydrophobicContact CH2-CG 3.77Å; W112-R135 VanDerWaalsContact CZ2-CD 3.47Å; W112-R135 HydrophobicContact CZ2-CG 4.09Å; W112-R135 HydrophobicContact CZ3-CB 4.17Å; W112-R135 HydrophobicContact CZ3-CG 3.65Å; W112-E157 HydrophobicContact CH2-CG 4.09Å; W112-V159 HydrophobicContact CH2-CB 3.95Å; W112-V159 HydrophobicContact CH2-CG2 3.39Å; W112-V159 HydrophobicContact CZ2-CG2 3.89Å; W112-V159 HydrophobicContact CZ3-CB 4.16Å; W112-V159 HydrophobicContact CZ3-CG2 4.08Å
113	E	85.1	Confident	79.6	Confident	119 Å²	119	77.8 Å²	77.8	56%	0.556	43%	0.428	S	S	*	.	B	Isolated β-bridge	trans	-81.8	138.3	170.5	-64.1	-178.2	-179.9	0	0	110.6	E111 L133 T134 Y136	E111-E113 PolarHBondContact O-N 2.95Å; E111-E113 VanDerWaalsContact O-N 3.16Å; E113-L133 WeakPolarHBondContact O-CA 3.44Å; E113-T134 WeakPolarHBondContact CA-O 3.49Å; E113-T134 WeakPolarHBondContact CB-O 3.37Å; E113-T134 PolarHBondContact N-O 3.29Å; E113-T134 PolarHBondContact O-N 3.18Å; E113-Y136 WeakPolarHBondContact OE2-CE2 3.39Å
114	G	79.6	Confident	78.5	Confident	52 Å²	52	78.5 Å²	78.5	54%	0.536	44%	0.443	S	S	.	.	S	Bend	trans	108.5	164.2	-174.6	0	0	0	0	0	111.8	L133	G114-L133 WeakPolarHBondContact O-CD2 3.4Å
115	V	76.4	Confident	77.1	Confident	128 Å²	128	85.1 Å²	85.1	78%	0.776	48%	0.477	S	S	*	.			trans	-126.5	123.6	178.8	-173.4	0	0	0	0	106.9
116	C	75	Confident	75.7	Confident	45 Å²	45	81.4 Å²	81.4	30%	0.304	46%	0.464	S	S	.	.			trans	-68.9	132.3	167.5	-67.3	0	0	0	0	108.5	T118 C161	C116-T118 PolarHBondContact O-N 3.07Å; C116-C161 WeakPolarHBondContact CA-SG 3.36Å; C116-C161 HydrophobicContact CB-CB 3.79Å; C116-C161 WeakPolarHBondContact CB-SG 3.42Å; C116-C161 WeakPolarHBondContact SG-CB 3.4Å; C116-C161 CovalentContact SG-SG 2.04Å; C116-C161 PolarHBondContact SG-SG 3.24Å
117	P	72.8	Confident	74.2	Confident	21 Å²	21	90.4 Å²	90.4	14%	0.136	50%	0.498	C	S	.	.			trans	-57.1	128.3	176.2	-25.9	36.9	0	0	0	110.1	F123 A131 L163	P117-F123 HydrophobicContact CB-CB 4.09Å; P117-F123 HydrophobicContact CB-CD2 3.96Å; P117-F123 HydrophobicContact CG-CD2 3.76Å; P117-A131 HydrophobicContact CG-CB 4.15Å; P117-L163 WeakPolarHBondContact O-CD2 3.47Å
118	T	67.3	Low	72.6	Confident	137 Å²	137	94.4 Å²	94.4	84%	0.84	51%	0.513	S	S	*	.	S	Bend	trans	-88.7	-12.7	178.9	49.1	0	0	0	0	112.9	C116	C116-T118 PolarHBondContact O-N 3.07Å
119	S	68.6	Low	71.1	Confident	38 Å²	38	90.6 Å²	90.6	27%	0.266	50%	0.503	S	S	.	.	S	Bend	trans	-126	136.7	-177	151.1	0	0	0	0	110.6	D121 V122 F123	S119-D121 VanDerWaalsContact C-N 3.31Å; S119-D121 PolarHBondContact O-N 3.43Å; S119-D121 PolarHBondContact OG-N 3.44Å; S119-V122 PolarHBondContact O-N 3.42Å; S119-F123 PolarHBondContact O-N 2.86Å
120	C	68.4	Low	69.6	Low	40 Å²	40	93.8 Å²	93.8	27%	0.27	52%	0.516	S	S	.	.	H	α-helix	trans	-64	-33.6	178	-66.1	0	0	0	0	113.3	V122 F123 A124 C165	C120-V122 VanDerWaalsContact C-N 3.27Å; C120-V122 PolarHBondContact O-N 2.96Å; C120-F123 PolarHBondContact O-N 3.37Å; C120-A124 WeakPolarHBondContact O-CB 3.46Å; C120-A124 PolarHBondContact O-N 2.9Å; C120-C165 WeakPolarHBondContact CA-SG 3.39Å; C120-C165 HydrophobicContact CB-CB 3.74Å; C120-C165 WeakPolarHBondContact CB-SG 3.38Å; C120-C165 WeakPolarHBondContact SG-CA 3.49Å; C120-C165 WeakPolarHBondContact SG-CB 3.19Å; C120-C165 CovalentContact SG-SG 2.03Å; C120-C165 PolarHBondContact SG-SG 2.97Å
121	D	66.4	Low	69	Low	125 Å²	125	93 Å²	93	67%	0.668	51%	0.506	S	S	*	.	H	α-helix	trans	-65.7	-35.8	177.7	-55.9	-37.8	0	0	0	111	S119 N125	S119-D121 VanDerWaalsContact C-N 3.31Å; S119-D121 PolarHBondContact O-N 3.43Å; S119-D121 PolarHBondContact OG-N 3.44Å; D121-N125 WeakPolarHBondContact O-CB 3.28Å; D121-N125 PolarHBondContact O-N 3.36Å; D121-N125 PolarHBondContact O-ND2 3.18Å
122	V	64.9	Low	68.7	Low	89 Å²	89	89.5 Å²	89.5	54%	0.539	49%	0.488	S	S	.	.	H	α-helix	trans	-74	-38	175.8	-177.7	0	0	0	0	110.7	S119 C120 S126	S119-V122 PolarHBondContact O-N 3.42Å; C120-V122 VanDerWaalsContact C-N 3.27Å; C120-V122 PolarHBondContact O-N 2.96Å; V122-S126 WeakPolarHBondContact O-CB 3.48Å; V122-S126 PolarHBondContact O-N 3.32Å; V122-S126 PolarHBondContact O-OG 3.05Å
123	F	63.1	Low	68.5	Low	38 Å²	38	87.1 Å²	87.1	17%	0.167	48%	0.481	C	S	.	.	H	α-helix	trans	-68.2	-41.6	177.7	-168	-91.2	0	0	0	112.7	P117 S119 C120 S126 P129 L163	P117-F123 HydrophobicContact CB-CB 4.09Å; P117-F123 HydrophobicContact CB-CD2 3.96Å; P117-F123 HydrophobicContact CG-CD2 3.76Å; S119-F123 PolarHBondContact O-N 2.86Å; C120-F123 PolarHBondContact O-N 3.37Å; F123-S126 WeakPolarHBondContact CA-OG 3.47Å; F123-S126 PolarHBondContact O-OG 3.37Å; F123-P129 HydrophobicContact CE1-CB 4.34Å; F123-P129 WeakPolarHBondContact CZ-O 3.42Å; F123-L163 HydrophobicContact CB-CD2 3.79Å; F123-L163 HydrophobicContact CD2-CB 4.4Å; F123-L163 HydrophobicContact CD2-CD2 3.95Å; F123-L163 HydrophobicContact CE2-CB 4.44Å; F123-L163 HydrophobicContact CG-CD2 3.93Å
124	A	64.5	Low	68.8	Low	82 Å²	82	82.3 Å²	82.3	68%	0.678	46%	0.46	S	S	*	.	H	α-helix	trans	-70.6	-33.7	178.7	0	0	0	0	0	112.9	C120	C120-A124 WeakPolarHBondContact O-CB 3.46Å; C120-A124 PolarHBondContact O-N 2.9Å
125	N	61	Low	69.4	Low	147 Å²	147	82.6 Å²	82.6	79%	0.786	45%	0.445	S	S	*	.	H	α-helix	trans	-88.2	-9.6	178.6	-80.4	-29.8	0	0	0	114.3	D121 R127	D121-N125 WeakPolarHBondContact O-CB 3.28Å; D121-N125 PolarHBondContact O-N 3.36Å; D121-N125 PolarHBondContact O-ND2 3.18Å; N125-R127 PolarHBondContact O-N 2.9Å
126	S	59.1	Low	70.1	Confident	41 Å²	41	80.8 Å²	80.8	29%	0.287	42%	0.424	S	S	.	.	S	Bend	trans	-74.6	130.4	174.2	22.9	0	0	0	0	109.2	V122 F123 H128	V122-S126 WeakPolarHBondContact O-CB 3.48Å; V122-S126 PolarHBondContact O-N 3.32Å; V122-S126 PolarHBondContact O-OG 3.05Å; F123-S126 WeakPolarHBondContact CA-OG 3.47Å; F123-S126 PolarHBondContact O-OG 3.37Å; S126-H128 PolarHBondContact O-N 3.37Å
127	R	61.3	Low	71	Confident	242 Å²	242	80.8 Å²	80.8	91%	0.913	42%	0.418	S	S	*	.	S	Bend	trans	-57.4	-8.5	178.3	-114.1	179.2	-78.8	-151.5	-2.9	114.1	N125	N125-R127 PolarHBondContact O-N 2.9Å
128	H	51.2	Low	71.7	Confident	112 Å²	112	85.3 Å²	85.3	52%	0.519	44%	0.437	S	S	.	.			trans	-131	97.5	-178.7	-65.5	-60.9	0	0	0	110.3	S126 Y130	S126-H128 PolarHBondContact O-N 3.37Å; H128-Y130 HydrophobicContact CB-CE2 4.22Å; H128-Y130 AromaticContact ND1-CE2 3.83Å; H128-Y130 AromaticContact ND1-CZ 3.48Å; H128-Y130 PolarHBondContact ND1-OH 3.19Å; H128-Y130 PolarHBondContact O-N 3.17Å
129	P	56.4	Low	72.8	Confident	83 Å²	83	80.7 Å²	80.7	54%	0.539	41%	0.41	S	S	.	.	S	Bend	trans	-70.5	10.3	176.3	27.9	-33.9	0	0	0	113.9	F123	F123-P129 HydrophobicContact CE1-CB 4.34Å; F123-P129 WeakPolarHBondContact CZ-O 3.42Å
130	Y	60.1	Low	73.4	Confident	137 Å²	137	82.8 Å²	82.8	54%	0.537	42%	0.418	S	S	.	.			trans	-124.9	70	177.6	43	-89.8	0	0	0	108.2	H128 K132	H128-Y130 HydrophobicContact CB-CE2 4.22Å; H128-Y130 AromaticContact ND1-CE2 3.83Å; H128-Y130 AromaticContact ND1-CZ 3.48Å; H128-Y130 PolarHBondContact ND1-OH 3.19Å; H128-Y130 PolarHBondContact O-N 3.17Å; Y130-K132 PolarHBondContact O-N 3.32Å
131	A	71.8	Confident	73.9	Confident	22 Å²	22	84.3 Å²	84.3	18%	0.182	42%	0.424	C	S	.	.			trans	-61.6	128	167.6	0	0	0	0	0	108.3	P117 C161	P117-A131 HydrophobicContact CG-CB 4.15Å; A131-C161 HydrophobicContact CB-CB 4.15Å; A131-C161 WeakPolarHBondContact O-CB 3.27Å; A131-C161 PolarHBondContact O-N 3.49Å; A131-C161 PolarHBondContact O-SG 2.86Å; A131-C161 VanDerWaalsContact O-SG 3.32Å
132	K	81.4	Confident	74.6	Confident	96 Å²	96	80.7 Å²	80.7	42%	0.417	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	133.6	179	-63.6	-170.6	-177.2	-159.3	0	109.9	Y130 V159 D160	Y130-K132 PolarHBondContact O-N 3.32Å; K132-V159 CarbonylContact C-O 3.59Å; K132-V159 VanDerWaalsContact CA-O 3.25Å; K132-V159 WeakPolarHBondContact CA-O 3.36Å; K132-D160 WeakPolarHBondContact CD-OD1 3.5Å; K132-D160 WeakPolarHBondContact CE-OD1 3.3Å; K132-D160 WeakPolarHBondContact CG-OD1 3.36Å; K132-D160 IonicContact NZ-OD1 2.62Å
133	L	85.3	Confident	75.5	Confident	35 Å²	35	80.7 Å²	80.7	18%	0.183	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	138.1	165.6	-61.2	-180	0	0	0	108.6	W112 E113 G114 Q158 V159	W112-L133 HydrophobicContact CB-CB 4.19Å; W112-L133 HydrophobicContact CB-CD1 4.34Å; W112-L133 HydrophobicContact CD2-CB 4.05Å; W112-L133 HydrophobicContact CE3-CB 3.56Å; W112-L133 HydrophobicContact CG-CB 4.36Å; W112-L133 HydrophobicContact CG-CD1 4.49Å; W112-L133 HydrophobicContact CZ3-CB 4.26Å; W112-L133 WeakPolarHBondContact CZ3-O 3.5Å; E113-L133 WeakPolarHBondContact O-CA 3.44Å; G114-L133 WeakPolarHBondContact O-CD2 3.4Å; L133-Q158 CarbonylContact O-C 3.54Å; L133-Q158 VanDerWaalsContact O-CA 3.25Å; L133-Q158 WeakPolarHBondContact O-CA 3.46Å; L133-V159 PolarHBondContact N-O 3.25Å; L133-V159 PolarHBondContact O-N 3.13Å
134	T	90.6	Very high	76.8	Confident	18 Å²	18	80.9 Å²	80.9	11%	0.11	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	137.2	179	-61	0	0	0	0	110.2	E113 Y136 K156 E157 Q158	E113-T134 WeakPolarHBondContact CA-O 3.49Å; E113-T134 WeakPolarHBondContact CB-O 3.37Å; E113-T134 PolarHBondContact N-O 3.29Å; E113-T134 PolarHBondContact O-N 3.18Å; T134-Y136 HydrophobicContact CG2-CD2 4.45Å; T134-Y136 HydrophobicContact CG2-CE1 4.33Å; T134-Y136 HydrophobicContact CG2-CE2 3.75Å; T134-K156 HydrophobicContact CG2-CD 4.34Å; T134-K156 HydrophobicContact CG2-CG 3.96Å; T134-E157 CarbonylContact C-O 3.51Å; T134-E157 WeakPolarHBondContact CA-O 3.5Å; T134-Q158 HydrophobicContact CG2-CG 4.11Å; T134-Q158 PolarHBondContact OG1-NE2 3.13Å
135	R	92.2	Very high	77.9	Confident	59 Å²	59	78.6 Å²	78.6	22%	0.223	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	154.5	170.4	64	-177.7	-172.4	-173.2	-6.8	111.5	W109 G110 W112 E157	W109-R135 HydrophobicContact CB-CG 4.42Å; W109-R135 HydrophobicContact CD2-CG 4.1Å; W109-R135 HydrophobicContact CE3-CB 4.32Å; W109-R135 HydrophobicContact CE3-CG 3.64Å; W109-R135 HydrophobicContact CG-CG 4.47Å; W109-R135 HydrophobicContact CZ3-CG 4.2Å; W109-R135 WeakPolarHBondContact CZ3-O 3.49Å; G110-R135 WeakPolarHBondContact O-CB 3.46Å; W112-R135 HydrophobicContact CD2-CB 4.15Å; W112-R135 HydrophobicContact CD2-CG 4.14Å; W112-R135 HydrophobicContact CE3-CB 3.87Å; W112-R135 HydrophobicContact CE3-CG 3.83Å; W112-R135 HydrophobicContact CH2-CG 3.77Å; W112-R135 VanDerWaalsContact CZ2-CD 3.47Å; W112-R135 HydrophobicContact CZ2-CG 4.09Å; W112-R135 HydrophobicContact CZ3-CB 4.17Å; W112-R135 HydrophobicContact CZ3-CG 3.65Å; R135-E157 HydrophobicContact CG-CB 4Å; R135-E157 IonicContact CZ-OE2 2.95Å; R135-E157 PolarHBondContact N-O 3.26Å; R135-E157 IonicContact NE-OE2 3.42Å; R135-E157 PolarHBondContact NE-OE2 2.85Å; R135-E157 VanDerWaalsContact NH2-CD 3.29Å; R135-E157 IonicContact NH2-OE1 2.78Å; R135-E157 PolarHBondContact NH2-OE1 3.45Å; R135-E157 IonicContact NH2-OE2 3.43Å; R135-E157 PolarHBondContact NH2-OE2 3.16Å; R135-E157 PolarHBondContact O-N 2.93Å
136	Y	90.3	Very high	79.1	Confident	89 Å²	89	76.4 Å²	76.4	35%	0.349	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	149.2	-177.1	-61.6	-85.8	0	0	0	111.7	W109 G110 E113 T134 P155 K156	W109-Y136 VanDerWaalsContact CE3-C 3.43Å; G110-Y136 PolarHBondContact N-O 3.2Å; E113-Y136 WeakPolarHBondContact OE2-CE2 3.39Å; T134-Y136 HydrophobicContact CG2-CD2 4.45Å; T134-Y136 HydrophobicContact CG2-CE1 4.33Å; T134-Y136 HydrophobicContact CG2-CE2 3.75Å; Y136-P155 CarbonylContact C-O 3.5Å; Y136-P155 VanDerWaalsContact CA-O 3.3Å; Y136-P155 WeakPolarHBondContact CA-O 3.34Å; Y136-K156 HydrophobicContact CD1-CB 4.12Å; Y136-K156 HydrophobicContact CD1-CG 4.15Å; Y136-K156 HydrophobicContact CE1-CB 4.12Å; Y136-K156 HydrophobicContact CE1-CD 3.82Å; Y136-K156 HydrophobicContact CE1-CG 3.76Å
137	R	94.1	Very high	80.4	Confident	46 Å²	46	77.6 Å²	77.6	17%	0.174	40%	0.4	C	S	.	.			trans	-133.2	150.1	167.6	62.1	178.6	179	176.9	1.8	109.3	W106 W109 V154 P155	W106-R137 HydrophobicContact CD2-CG 3.96Å; W106-R137 HydrophobicContact CE3-CB 4.19Å; W106-R137 HydrophobicContact CE3-CG 3.52Å; W106-R137 HydrophobicContact CG-CG 4.46Å; W106-R137 HydrophobicContact CZ3-CG 3.97Å; W109-R137 HydrophobicContact CD2-CB 3.97Å; W109-R137 HydrophobicContact CD2-CG 4.03Å; W109-R137 HydrophobicContact CE3-CB 3.7Å; W109-R137 HydrophobicContact CE3-CG 3.73Å; W109-R137 HydrophobicContact CH2-CG 3.67Å; W109-R137 VanDerWaalsContact CZ2-CD 3.42Å; W109-R137 HydrophobicContact CZ2-CG 3.98Å; W109-R137 VanDerWaalsContact CZ2-NE 3.29Å; W109-R137 HydrophobicContact CZ3-CB 4.02Å; W109-R137 HydrophobicContact CZ3-CG 3.55Å; R137-V154 VanDerWaalsContact CZ-O 3.27Å; R137-V154 PolarHBondContact NE-O 3.19Å; R137-V154 PolarHBondContact NH2-O 3.38Å; R137-P155 PolarHBondContact N-O 2.87Å; R137-P155 VanDerWaalsContact O-CB 3.31Å; R137-P155 WeakPolarHBondContact O-CB 3.31Å
138	H	87	Confident	81.8	Confident	115 Å²	115	66.7 Å²	66.7	53%	0.532	36%	0.363	S	S	.	.			trans	-114.9	143.5	-177.2	-63.5	87.3	0	0	0	110.2	W106 S107 N140	W106-H138 VanDerWaalsContact CE3-C 3.47Å; S107-H138 PolarHBondContact N-O 3.32Å; S107-H138 PolarHBondContact OG-N 3.37Å; H138-N140 HydrophobicContact CB-CB 4.47Å; H138-N140 WeakPolarHBondContact CB-OD1 3.47Å; H138-N140 PolarHBondContact O-N 3.07Å; H138-N140 PolarHBondContact O-OD1 3.3Å; H138-N140 VanDerWaalsContact O-OD1 3.12Å
139	C	90.6	Very high	83.6	Confident	40 Å²	40	64.8 Å²	64.8	27%	0.27	36%	0.363	S	S	.	.	S	Bend	trans	-82.6	66.5	178	-176.4	0	0	0	0	109.9	W106 C151	W106-C139 HydrophobicContact CE3-CB 4.08Å; W106-C139 HydrophobicContact CH2-CB 4.29Å; W106-C139 HydrophobicContact CZ3-CB 3.86Å; C139-C151 WeakPolarHBondContact CA-SG 3.35Å; C139-C151 HydrophobicContact CB-CB 3.77Å; C139-C151 WeakPolarHBondContact CB-SG 3.15Å; C139-C151 WeakPolarHBondContact SG-CB 3.48Å; C139-C151 PolarHBondContact SG-N 3.39Å; C139-C151 CovalentContact SG-SG 2.03Å; C139-C151 PolarHBondContact SG-SG 3.36Å
140	N	82.4	Confident	85.3	Confident	83 Å²	83	65.8 Å²	65.8	44%	0.444	37%	0.369	S	S	.	.			trans	-139.5	19.7	-170.1	66.4	-12.7	0	0	0	114.5	Q105 S107 H138 P142 V143	Q105-N140 PolarHBondContact O-N 3.35Å; S107-N140 WeakPolarHBondContact CB-OD1 3.4Å; H138-N140 HydrophobicContact CB-CB 4.47Å; H138-N140 WeakPolarHBondContact CB-OD1 3.47Å; H138-N140 PolarHBondContact O-N 3.07Å; H138-N140 PolarHBondContact O-OD1 3.3Å; H138-N140 VanDerWaalsContact O-OD1 3.12Å; N140-P142 VanDerWaalsContact C-C 3.46Å; N140-V143 HydrophobicContact CB-CG2 3.78Å
141	N	79.3	Confident	86.9	Confident	71 Å²	71	60 Å²	60	38%	0.38	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.4	64.3	-177.5	-164.5	31.3	0	0	0	115.8	Q105	Q105-N141 VanDerWaalsContact CB-O 3.28Å; Q105-N141 WeakPolarHBondContact CB-O 3.48Å; Q105-N141 PolarHBondContact O-N 2.99Å; Q105-N141 PolarHBondContact OE1-O 3.35Å
142	P	80	Confident	87.9	Confident	50 Å²	50	64.1 Å²	64.1	33%	0.325	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.1	166.4	8.8	34.3	-35.1	0	0	0	113.4	V102 G104 Q105 N140	V102-P142 HydrophobicContact CG1-CB 3.86Å; V102-P142 HydrophobicContact CG1-CG 3.59Å; G104-P142 WeakPolarHBondContact CA-O 3.47Å; Q105-P142 PolarHBondContact N-O 3.29Å; N140-P142 VanDerWaalsContact C-C 3.46Å
143	V	84	Confident	88.4	Confident	89 Å²	89	62.4 Å²	62.4	54%	0.539	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-73.2	135.6	170.6	-177.9	0	0	0	0	108.8	N140 A145	N140-V143 HydrophobicContact CB-CG2 3.78Å; V143-A145 PolarHBondContact O-N 3.31Å
144	P	90.1	Very high	88.7	Confident	42 Å²	42	65.2 Å²	65.2	27%	0.273	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-56.7	133.5	171.6	-10.9	16.1	0	0	0	111.9	V102	V102-P144 CarbonylContact O-C 3.6Å; V102-P144 VanDerWaalsContact O-CA 3.24Å; V102-P144 WeakPolarHBondContact O-CA 3.45Å
145	A	86.8	Confident	88.8	Confident	33 Å²	33	67.5 Å²	67.5	27%	0.273	42%	0.416	S	S	.	.	B	Isolated β-bridge	trans	-138.6	156.4	-179.7	0	0	0	0	0	111.7	V102 V143 G147 G148	V102-A145 HydrophobicContact CB-CB 3.96Å; V102-A145 HydrophobicContact CG2-CB 3.99Å; V102-A145 PolarHBondContact N-O 3.24Å; V102-A145 PolarHBondContact O-N 2.99Å; V143-A145 PolarHBondContact O-N 3.31Å; A145-G147 PolarHBondContact O-N 3.5Å; A145-G148 PolarHBondContact O-N 2.94Å
146	N	88.2	Confident	88.9	Confident	102 Å²	102	69 Å²	69	55%	0.545	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	39.1	178.9	-62.3	-12.3	0	0	0	114.2	I100	I100-N146 WeakPolarHBondContact O-CB 3.22Å; I100-N146 PolarHBondContact O-ND2 3.21Å
147	G	85.5	Confident	89.1	Confident	65 Å²	65	68 Å²	68	67%	0.67	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	21.7	179.7	0	0	0	0	0	114.8	A145	A145-G147 PolarHBondContact O-N 3.5Å
148	G	90.5	Very high	89	Confident	14 Å²	14	70.2 Å²	70.2	14%	0.144	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-69.7	164.8	169	0	0	0	0	0	113.4	V102 A145	V102-G148 WeakPolarHBondContact O-CA 3.5Å; A145-G148 PolarHBondContact O-N 2.94Å
149	S	89.8	Confident	89.1	Confident	72 Å²	72	67.9 Å²	67.9	50%	0.503	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-72.9	144.3	-171.6	-61.3	0	0	0	0	112.6	N103 G104	N103-S149 PolarHBondContact OD1-N 3.4Å; G104-S149 PolarHBondContact N-O 2.72Å
150	P	92.2	Very high	88.7	Confident	104 Å²	104	71 Å²	71	68%	0.675	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-70.1	160.4	171.5	31.1	-35	0	0	0	111.7
151	C	93.4	Very high	88.6	Confident	15 Å²	15	68.1 Å²	68.1	10%	0.101	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-66.2	133.8	-177.4	-57.2	0	0	0	0	112.5	Q105 W106 C139	Q105-C151 VanDerWaalsContact CA-SG 3.53Å; Q105-C151 PolarHBondContact N-SG 3.32Å; Q105-C151 VanDerWaalsContact N-SG 3.35Å; Q105-C151 PolarHBondContact O-SG 3.02Å; W106-C151 HydrophobicContact CD2-CB 3.7Å; W106-C151 HydrophobicContact CE3-CB 4.29Å; W106-C151 HydrophobicContact CG-CB 4.08Å; W106-C151 HydrophobicContact CH2-CB 4.2Å; W106-C151 HydrophobicContact CZ2-CB 3.58Å; C139-C151 WeakPolarHBondContact CA-SG 3.35Å; C139-C151 HydrophobicContact CB-CB 3.77Å; C139-C151 WeakPolarHBondContact CB-SG 3.15Å; C139-C151 WeakPolarHBondContact SG-CB 3.48Å; C139-C151 PolarHBondContact SG-N 3.39Å; C139-C151 CovalentContact SG-SG 2.03Å; C139-C151 PolarHBondContact SG-SG 3.36Å
152	P	92	Very high	88.1	Confident	108 Å²	108	72 Å²	72	70%	0.701	45%	0.45	S	S	*	.	S	Bend	trans	-76.4	133.5	179.7	28.9	-33.7	0	0	0	112.4	W106	W106-P152 PolarHBondContact NE1-O 3.04Å
153	G	92.5	Very high	87.4	Confident	60 Å²	60	72.1 Å²	72.1	62%	0.619	45%	0.447	S	S	*	.	S	Bend	trans	103	-169.9	176.7	0	0	0	0	0	114.3	W106	W106-G153 WeakPolarHBondContact CZ2-O 3.35Å
154	V	91.8	Very high	86.6	Confident	95 Å²	95	71.4 Å²	71.4	58%	0.576	45%	0.446	S	S	*	.			trans	-97.8	147.3	-174.7	-64.3	0	0	0	0	112.8	R137 K156	R137-V154 VanDerWaalsContact CZ-O 3.27Å; R137-V154 PolarHBondContact NE-O 3.19Å; R137-V154 PolarHBondContact NH2-O 3.38Å; V154-K156 VanDerWaalsContact C-N 3.34Å; V154-K156 WeakPolarHBondContact CG2-O 3.17Å
155	P	92.4	Very high	85.8	Confident	66 Å²	66	70.5 Å²	70.5	43%	0.429	44%	0.441	S	S	.	.	S	Bend	trans	-83	-4.8	178.6	32.6	-36.2	0	0	0	114.3	W106 W109 Y136 R137	W106-P155 HydrophobicContact CH2-CB 3.83Å; W106-P155 HydrophobicContact CZ3-CB 3.81Å; W109-P155 WeakPolarHBondContact CZ3-O 3.24Å; Y136-P155 CarbonylContact C-O 3.5Å; Y136-P155 VanDerWaalsContact CA-O 3.3Å; Y136-P155 WeakPolarHBondContact CA-O 3.34Å; R137-P155 PolarHBondContact N-O 2.87Å; R137-P155 VanDerWaalsContact O-CB 3.31Å; R137-P155 WeakPolarHBondContact O-CB 3.31Å
156	K	94.6	Very high	85.4	Confident	91 Å²	91	72.5 Å²	72.5	40%	0.396	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	133.9	-172.4	-179.4	-178.7	-179.9	173.1	0	110.5	T134 Y136 V154	T134-K156 HydrophobicContact CG2-CD 4.34Å; T134-K156 HydrophobicContact CG2-CG 3.96Å; Y136-K156 HydrophobicContact CD1-CB 4.12Å; Y136-K156 HydrophobicContact CD1-CG 4.15Å; Y136-K156 HydrophobicContact CE1-CB 4.12Å; Y136-K156 HydrophobicContact CE1-CD 3.82Å; Y136-K156 HydrophobicContact CE1-CG 3.76Å; V154-K156 VanDerWaalsContact C-N 3.34Å; V154-K156 WeakPolarHBondContact CG2-O 3.17Å
157	E	94.5	Very high	84.9	Confident	66 Å²	66	70.3 Å²	70.3	31%	0.308	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	146.2	176.4	-172.9	177.5	-175.1	0	0	110.6	W109 W112 T134 R135	W109-E157 HydrophobicContact CE3-CB 4.45Å; W109-E157 HydrophobicContact CH2-CB 3.58Å; W109-E157 HydrophobicContact CZ2-CB 4.02Å; W109-E157 WeakPolarHBondContact CZ2-OE2 3.18Å; W109-E157 HydrophobicContact CZ3-CB 3.81Å; W112-E157 HydrophobicContact CH2-CG 4.09Å; T134-E157 CarbonylContact C-O 3.51Å; T134-E157 WeakPolarHBondContact CA-O 3.5Å; R135-E157 HydrophobicContact CG-CB 4Å; R135-E157 IonicContact CZ-OE2 2.95Å; R135-E157 PolarHBondContact N-O 3.26Å; R135-E157 IonicContact NE-OE2 3.42Å; R135-E157 PolarHBondContact NE-OE2 2.85Å; R135-E157 VanDerWaalsContact NH2-CD 3.29Å; R135-E157 IonicContact NH2-OE1 2.78Å; R135-E157 PolarHBondContact NH2-OE1 3.45Å; R135-E157 IonicContact NH2-OE2 3.43Å; R135-E157 PolarHBondContact NH2-OE2 3.16Å; R135-E157 PolarHBondContact O-N 2.93Å
158	Q	91.6	Very high	84.8	Confident	94 Å²	94	71.3 Å²	71.3	44%	0.439	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	139.9	-177.5	-59.9	-166.9	-42.9	0	0	111.7	L133 T134	L133-Q158 CarbonylContact O-C 3.54Å; L133-Q158 VanDerWaalsContact O-CA 3.25Å; L133-Q158 WeakPolarHBondContact O-CA 3.46Å; T134-Q158 HydrophobicContact CG2-CG 4.11Å; T134-Q158 PolarHBondContact OG1-NE2 3.13Å
159	V	88.1	Confident	84.7	Confident	66 Å²	66	71.2 Å²	71.2	40%	0.4	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	138.3	177.3	167	0	0	0	0	109.9	W112 K132 L133	W112-V159 HydrophobicContact CH2-CB 3.95Å; W112-V159 HydrophobicContact CH2-CG2 3.39Å; W112-V159 HydrophobicContact CZ2-CG2 3.89Å; W112-V159 HydrophobicContact CZ3-CB 4.16Å; W112-V159 HydrophobicContact CZ3-CG2 4.08Å; K132-V159 CarbonylContact C-O 3.59Å; K132-V159 VanDerWaalsContact CA-O 3.25Å; K132-V159 WeakPolarHBondContact CA-O 3.36Å; L133-V159 PolarHBondContact N-O 3.25Å; L133-V159 PolarHBondContact O-N 3.13Å
160	D	82.9	Confident	84.7	Confident	105 Å²	105	72.3 Å²	72.3	56%	0.561	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	137.3	176.5	-59.9	-40.3	0	0	0	110.9	K132	K132-D160 WeakPolarHBondContact CD-OD1 3.5Å; K132-D160 WeakPolarHBondContact CE-OD1 3.3Å; K132-D160 WeakPolarHBondContact CG-OD1 3.36Å; K132-D160 IonicContact NZ-OD1 2.62Å
161	C	79.6	Confident	84.7	Confident	22 Å²	22	69.5 Å²	69.5	15%	0.149	40%	0.404	C	S	.	.			trans	-76.4	126.5	174.7	-64.7	0	0	0	0	111.1	C116 A131	C116-C161 WeakPolarHBondContact CA-SG 3.36Å; C116-C161 HydrophobicContact CB-CB 3.79Å; C116-C161 WeakPolarHBondContact CB-SG 3.42Å; C116-C161 WeakPolarHBondContact SG-CB 3.4Å; C116-C161 CovalentContact SG-SG 2.04Å; C116-C161 PolarHBondContact SG-SG 3.24Å; A131-C161 HydrophobicContact CB-CB 4.15Å; A131-C161 WeakPolarHBondContact O-CB 3.27Å; A131-C161 PolarHBondContact O-N 3.49Å; A131-C161 PolarHBondContact O-SG 2.86Å; A131-C161 VanDerWaalsContact O-SG 3.32Å
162	D	68.6	Low	84.7	Confident	153 Å²	153	70 Å²	70	82%	0.818	41%	0.408	S	S	*	.			trans	-99.5	103.4	174	-168.3	11.2	0	0	0	110.4
163	L	66.7	Low	84.7	Confident	52 Å²	52	69.1 Å²	69.1	27%	0.272	41%	0.41	S	S	.	.			trans	-114.5	107.9	176.9	-171.6	72.7	0	0	0	110	P117 F123 C165	P117-L163 WeakPolarHBondContact O-CD2 3.47Å; F123-L163 HydrophobicContact CB-CD2 3.79Å; F123-L163 HydrophobicContact CD2-CB 4.4Å; F123-L163 HydrophobicContact CD2-CD2 3.95Å; F123-L163 HydrophobicContact CE2-CB 4.44Å; F123-L163 HydrophobicContact CG-CD2 3.93Å; L163-C165 VanDerWaalsContact CD2-SG 3.5Å; L163-C165 PolarHBondContact O-N 2.99Å; L163-C165 VanDerWaalsContact O-N 3.09Å
164	S	66.2	Low	84.8	Confident	74 Å²	74	69.8 Å²	69.8	52%	0.517	39%	0.394	S	S	.	.			trans	-80.1	83.5	178.1	-69.3	0	0	0	0	111.9
165	C	73.2	Confident	84.8	Confident	24 Å²	24	68 Å²	68	16%	0.162	39%	0.385	C	S	.	.			trans	-79.5	141.4	-179.7	-75.5	0	0	0	0	114.2	C120 L163 I167 H199	C120-C165 WeakPolarHBondContact CA-SG 3.39Å; C120-C165 HydrophobicContact CB-CB 3.74Å; C120-C165 WeakPolarHBondContact CB-SG 3.38Å; C120-C165 WeakPolarHBondContact SG-CA 3.49Å; C120-C165 WeakPolarHBondContact SG-CB 3.19Å; C120-C165 CovalentContact SG-SG 2.03Å; C120-C165 PolarHBondContact SG-SG 2.97Å; L163-C165 VanDerWaalsContact CD2-SG 3.5Å; L163-C165 PolarHBondContact O-N 2.99Å; L163-C165 VanDerWaalsContact O-N 3.09Å; C165-I167 PolarHBondContact O-N 2.89Å; C165-H199 WeakPolarHBondContact O-CB 3.42Å; C165-H199 PolarHBondContact O-ND1 2.99Å
166	P	78.5	Confident	84.9	Confident	75 Å²	75	76.1 Å²	76.1	49%	0.487	41%	0.407	S	S	.	.			trans	-56.3	124.9	171.2	-21.7	32.5	0	0	0	110.8
167	I	77.8	Confident	84.7	Confident	55 Å²	55	75.2 Å²	75.2	28%	0.282	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-105.7	113.5	172.4	-60.5	174.6	0	0	0	106.3	C165 P195 P197 R198 G201	C165-I167 PolarHBondContact O-N 2.89Å; I167-P195 HydrophobicContact CG2-CB 3.85Å; I167-P195 HydrophobicContact CG2-CG 3.62Å; I167-P197 CarbonylContact O-C 3.46Å; I167-P197 WeakPolarHBondContact O-CA 3.32Å; I167-R198 HydrophobicContact CB-CB 4.31Å; I167-R198 HydrophobicContact CD1-CB 4.34Å; I167-R198 PolarHBondContact N-O 3.06Å; I167-R198 PolarHBondContact O-N 2.91Å; I167-G201 WeakPolarHBondContact O-CA 3.2Å
168	D	84.8	Confident	84.5	Confident	86 Å²	86	74 Å²	74	46%	0.46	40%	0.4	S	S	.	.			trans	-68.1	141.3	172.6	-68	-27.2	0	0	0	110.3	G201 Q202	D168-G201 WeakPolarHBondContact OD1-CA 3.26Å; D168-Q202 WeakPolarHBondContact OD1-CB 3.46Å; D168-Q202 PolarHBondContact OD1-N 2.77Å
169	G	88.6	Confident	84.3	Confident	13 Å²	13	78 Å²	78	13%	0.134	42%	0.418	C	S	.	.			trans	-71.9	134.5	177.8	0	0	0	0	0	111.6	P195 Q202 C204	G169-P195 CarbonylContact C-O 3.54Å; G169-P195 VanDerWaalsContact CA-O 3.25Å; G169-P195 WeakPolarHBondContact CA-O 3.34Å; G169-Q202 PolarHBondContact N-O 2.93Å; G169-C204 PolarHBondContact O-SG 3.48Å
170	D	89.4	Confident	84.3	Confident	95 Å²	95	77 Å²	77	51%	0.508	41%	0.414	S	S	.	.			trans	-119.9	153.3	169.1	-162.5	11.6	0	0	0	111.7	D193 N194 P195 C204	D170-D193 PolarHBondContact O-N 2.92Å; D170-N194 WeakPolarHBondContact CB-O 3.48Å; D170-N194 PolarHBondContact O-N 2.99Å; D170-P195 PolarHBondContact N-O 3.49Å; D170-C204 VanDerWaalsContact CA-SG 3.59Å; D170-C204 PolarHBondContact N-SG 3.17Å; D170-C204 VanDerWaalsContact N-SG 3.44Å
171	W	92	Very high	84.3	Confident	45 Å²	45	75.5 Å²	75.5	17%	0.17	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-76	137.4	-173.7	-73.9	109	0	0	0	111.9	R190 C192 C204 H205 G206 D208	W171-R190 VanDerWaalsContact CD1-CZ 3.48Å; W171-R190 HydrophobicContact CD2-CG 3.87Å; W171-R190 HydrophobicContact CE3-CB 3.95Å; W171-R190 VanDerWaalsContact CE3-CD 3.48Å; W171-R190 HydrophobicContact CE3-CG 3.38Å; W171-R190 HydrophobicContact CG-CG 4.47Å; W171-R190 HydrophobicContact CH2-CG 4.48Å; W171-R190 HydrophobicContact CZ3-CB 4.49Å; W171-R190 HydrophobicContact CZ3-CG 3.73Å; W171-R190 VanDerWaalsContact NE1-CZ 3.25Å; W171-C192 HydrophobicContact CE3-CB 4.24Å; W171-C192 HydrophobicContact CZ3-CB 4.12Å; W171-C204 HydrophobicContact CD2-CB 3.7Å; W171-C204 HydrophobicContact CE3-CB 4.3Å; W171-C204 HydrophobicContact CG-CB 4.09Å; W171-C204 HydrophobicContact CH2-CB 4.2Å; W171-C204 HydrophobicContact CZ2-CB 3.56Å; W171-H205 PolarHBondContact NE1-O 2.76Å; W171-G206 WeakPolarHBondContact CZ2-O 3.35Å; W171-D208 HydrophobicContact CH2-CB 4.03Å; W171-D208 HydrophobicContact CZ3-CB 4.2Å
172	S	92.1	Very high	84.4	Confident	25 Å²	25	81.8 Å²	81.8	18%	0.175	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-54.3	157.5	161	83.7	0	0	0	0	110.7	W174 V191 D193	S172-W174 PolarHBondContact O-N 2.75Å; S172-V191 WeakPolarHBondContact CB-O 3.3Å; S172-V191 PolarHBondContact N-O 3.4Å; S172-V191 PolarHBondContact OG-N 2.74Å; S172-V191 PolarHBondContact OG-O 3.4Å; S172-D193 VanDerWaalsContact CB-OD1 3.23Å; S172-D193 WeakPolarHBondContact CB-OD1 3.34Å
173	A	93.1	Very high	85.1	Confident	90 Å²	90	77.7 Å²	77.7	74%	0.744	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-53.2	142.5	161.7	0	0	0	0	0	109.7
174	W	94.5	Very high	86	Confident	74 Å²	74	76.2 Å²	76.2	28%	0.28	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-59.8	141.7	174.7	-76.2	99.5	0	0	0	110.8	S172 R188 R189 R190 D208 Q210	S172-W174 PolarHBondContact O-N 2.75Å; W174-R188 HydrophobicContact CD2-CG 4.08Å; W174-R188 HydrophobicContact CE3-CB 4.11Å; W174-R188 HydrophobicContact CE3-CG 3.54Å; W174-R188 HydrophobicContact CZ3-CG 3.98Å; W174-R188 WeakPolarHBondContact CZ3-O 3.15Å; W174-R189 VanDerWaalsContact CE3-C 3.42Å; W174-R190 HydrophobicContact CD2-CB 4.04Å; W174-R190 HydrophobicContact CD2-CG 4.05Å; W174-R190 HydrophobicContact CE3-CB 3.84Å; W174-R190 HydrophobicContact CE3-CG 3.8Å; W174-R190 HydrophobicContact CH2-CG 3.66Å; W174-R190 HydrophobicContact CZ2-CG 3.91Å; W174-R190 HydrophobicContact CZ3-CB 4.14Å; W174-R190 HydrophobicContact CZ3-CG 3.6Å; W174-D208 WeakPolarHBondContact CZ3-O 3.37Å; W174-Q210 HydrophobicContact CH2-CB 3.95Å; W174-Q210 HydrophobicContact CZ2-CB 4.48Å; W174-Q210 HydrophobicContact CZ3-CB 4.21Å
175	S	92.7	Very high	87	Confident	56 Å²	56	78.8 Å²	78.8	39%	0.392	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-56.5	160.7	167	78.3	0	0	0	0	110.7	R189	S175-R189 WeakPolarHBondContact CB-O 3.47Å; S175-R189 PolarHBondContact N-O 2.87Å; S175-R189 PolarHBondContact OG-N 3.3Å; S175-R189 PolarHBondContact OG-O 3.35Å
176	R	93.4	Very high	87.9	Confident	238 Å²	238	79.8 Å²	79.8	90%	0.898	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-55.7	148.1	162.8	-64.6	-171.3	179.9	113.9	0.6	109.2
177	W	91.3	Very high	88.7	Confident	72 Å²	72	78.6 Å²	78.6	27%	0.273	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-61.3	139.9	170.8	-73.4	100.1	0	0	0	109.4	R186 Q187 R188 Q210 R212	W177-R186 HydrophobicContact CD2-CG 4.34Å; W177-R186 HydrophobicContact CE3-CB 4.28Å; W177-R186 HydrophobicContact CE3-CG 3.82Å; W177-R186 HydrophobicContact CZ3-CG 4.38Å; W177-R186 VanDerWaalsContact CZ3-O 3.26Å; W177-R186 WeakPolarHBondContact CZ3-O 3.3Å; W177-Q187 CarbonylContact C-O 3.53Å; W177-Q187 WeakPolarHBondContact CA-O 3.05Å; W177-R188 HydrophobicContact CD2-CB 4Å; W177-R188 HydrophobicContact CD2-CG 4.02Å; W177-R188 VanDerWaalsContact CE2-CD 3.48Å; W177-R188 HydrophobicContact CE3-CB 3.9Å; W177-R188 HydrophobicContact CE3-CG 3.9Å; W177-R188 HydrophobicContact CG-CB 4.5Å; W177-R188 HydrophobicContact CH2-CG 3.67Å; W177-R188 VanDerWaalsContact CZ2-CD 3.41Å; W177-R188 HydrophobicContact CZ2-CG 3.79Å; W177-R188 VanDerWaalsContact CZ2-NE 3.31Å; W177-R188 HydrophobicContact CZ3-CB 4.19Å; W177-R188 HydrophobicContact CZ3-CG 3.72Å; W177-Q210 HydrophobicContact CH2-CB 4.32Å; W177-Q210 HydrophobicContact CH2-CG 4.2Å; W177-Q210 WeakPolarHBondContact CZ3-O 3.4Å; W177-R212 HydrophobicContact CH2-CB 3.75Å; W177-R212 HydrophobicContact CZ2-CB 4.28Å; W177-R212 HydrophobicContact CZ3-CB 3.95Å
178	S	90	Very high	89.5	Confident	39 Å²	39	79 Å²	79	27%	0.273	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-59.3	162.6	168.1	73.4	0	0	0	0	110.7	Q187	S178-Q187 PolarHBondContact N-O 2.79Å; S178-Q187 PolarHBondContact OG-N 3.23Å
179	E	87.8	Confident	90	Very high	178 Å²	178	81.4 Å²	81.4	83%	0.832	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-58.7	157	162.7	-62.8	-176.7	176.1	0	0	110.6	Q181	E179-Q181 PolarHBondContact O-N 3.3Å
180	C	86.6	Confident	90.4	Very high	45 Å²	45	82.9 Å²	82.9	30%	0.304	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-69	123.4	-179.7	-171.2	0	0	0	0	109.8	C214	C180-C214 HydrophobicContact CB-CB 3.92Å; C180-C214 WeakPolarHBondContact CB-SG 3.23Å; C180-C214 WeakPolarHBondContact SG-CB 3.3Å; C180-C214 CovalentContact SG-SG 2.03Å; C180-C214 PolarHBondContact SG-SG 2.9Å
181	Q	84.4	Confident	90.5	Very high	75 Å²	75	81.6 Å²	81.6	35%	0.35	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-77.7	167.6	178.4	-63	-177.7	-47.6	0	0	111.2	E179 D183 C184 R185	E179-Q181 PolarHBondContact O-N 3.3Å; Q181-D183 VanDerWaalsContact CB-OD1 3.26Å; Q181-D183 WeakPolarHBondContact CB-OD1 3.47Å; Q181-D183 PolarHBondContact O-N 2.89Å; Q181-D183 VanDerWaalsContact O-N 3.15Å; Q181-C184 PolarHBondContact O-N 3.42Å; Q181-R185 WeakPolarHBondContact CB-O 3.16Å; Q181-R185 PolarHBondContact N-O 3.08Å
182	T	80.4	Confident	90.5	Very high	153 Å²	153	80.2 Å²	80.2	94%	0.939	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-21.6	-178.4	49.6	0	0	0	0	113.9	C184	T182-C184 VanDerWaalsContact C-N 3.27Å
183	D	83.7	Confident	90.4	Very high	67 Å²	67	83.3 Å²	83.3	36%	0.358	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	12.5	175.7	71.8	-19.7	0	0	0	113.3	Q181 R185	Q181-D183 VanDerWaalsContact CB-OD1 3.26Å; Q181-D183 WeakPolarHBondContact CB-OD1 3.47Å; Q181-D183 PolarHBondContact O-N 2.89Å; Q181-D183 VanDerWaalsContact O-N 3.15Å; D183-R185 VanDerWaalsContact C-N 3.29Å; D183-R185 PolarHBondContact O-N 2.94Å; D183-R185 PolarHBondContact OD1-N 3.16Å; D183-R185 IonicContact OD2-CZ 3.09Å; D183-R185 IonicContact OD2-NE 3.91Å; D183-R185 PolarHBondContact OD2-NE 3.06Å; D183-R185 IonicContact OD2-NH2 2.87Å; D183-R185 PolarHBondContact OD2-NH2 2.72Å
184	C	84.7	Confident	89.9	Confident	22 Å²	22	84.2 Å²	84.2	15%	0.149	40%	0.402	C	S	.	.	S	Bend	trans	62.7	29.7	-180	-61.1	0	0	0	0	114.6	Q181 T182 T213 C214 C219	Q181-C184 PolarHBondContact O-N 3.42Å; T182-C184 VanDerWaalsContact C-N 3.27Å; C184-T213 WeakPolarHBondContact O-CA 3.48Å; C184-T213 WeakPolarHBondContact O-CG2 3.39Å; C184-C214 PolarHBondContact O-N 3.14Å; C184-C214 PolarHBondContact O-SG 2.82Å; C184-C214 VanDerWaalsContact O-SG 3.35Å; C184-C219 WeakPolarHBondContact CA-SG 3.32Å; C184-C219 HydrophobicContact CB-CB 3.89Å; C184-C219 WeakPolarHBondContact CB-SG 3.48Å; C184-C219 VanDerWaalsContact SG-CA 3.59Å; C184-C219 WeakPolarHBondContact SG-CB 3.4Å; C184-C219 CovalentContact SG-SG 2.03Å; C184-C219 PolarHBondContact SG-SG 2.89Å
185	R	88.9	Confident	89.3	Confident	127 Å²	127	83.4 Å²	83.4	48%	0.479	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	149.6	172.5	-67.1	-175.6	-78.3	-160.2	-6.5	111.9	Q181 D183 W211 R212	Q181-R185 WeakPolarHBondContact CB-O 3.16Å; Q181-R185 PolarHBondContact N-O 3.08Å; D183-R185 VanDerWaalsContact C-N 3.29Å; D183-R185 PolarHBondContact O-N 2.94Å; D183-R185 PolarHBondContact OD1-N 3.16Å; D183-R185 IonicContact OD2-CZ 3.09Å; D183-R185 IonicContact OD2-NE 3.91Å; D183-R185 PolarHBondContact OD2-NE 3.06Å; D183-R185 IonicContact OD2-NH2 2.87Å; D183-R185 PolarHBondContact OD2-NH2 2.72Å; R185-W211 HydrophobicContact CB-CE3 4.21Å; R185-R212 CarbonylContact C-O 3.58Å; R185-R212 WeakPolarHBondContact CA-O 3.27Å
186	R	92	Very high	89	Confident	46 Å²	46	82.8 Å²	82.8	17%	0.174	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	149.4	170.7	59.2	179.3	84.7	172.4	-0.9	109.9	W177 W211 R212 D216	W177-R186 HydrophobicContact CD2-CG 4.34Å; W177-R186 HydrophobicContact CE3-CB 4.28Å; W177-R186 HydrophobicContact CE3-CG 3.82Å; W177-R186 HydrophobicContact CZ3-CG 4.38Å; W177-R186 VanDerWaalsContact CZ3-O 3.26Å; W177-R186 WeakPolarHBondContact CZ3-O 3.3Å; R186-W211 WeakPolarHBondContact O-CA 3.49Å; R186-R212 HydrophobicContact CG-CB 4.25Å; R186-R212 WeakPolarHBondContact CG-O 3.27Å; R186-R212 PolarHBondContact N-O 3.08Å; R186-R212 PolarHBondContact O-N 2.99Å; R186-D216 IonicContact NH2-OD1 3.93Å; R186-D216 IonicContact NH2-OD2 3.36Å; R186-D216 PolarHBondContact NH2-OD2 2.76Å
187	Q	93.7	Very high	88.6	Confident	50 Å²	50	73.3 Å²	73.3	23%	0.234	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	153.4	-176.3	62.5	179.1	-54.7	0	0	113.3	W177 S178 Q210 W211	W177-Q187 CarbonylContact C-O 3.53Å; W177-Q187 WeakPolarHBondContact CA-O 3.05Å; S178-Q187 PolarHBondContact N-O 2.79Å; S178-Q187 PolarHBondContact OG-N 3.23Å; Q187-Q210 VanDerWaalsContact CA-O 3.26Å; Q187-Q210 WeakPolarHBondContact CA-O 3.16Å; Q187-W211 HydrophobicContact CB-CD2 4.11Å; Q187-W211 HydrophobicContact CB-CE3 3.7Å; Q187-W211 HydrophobicContact CB-CH2 3.94Å; Q187-W211 HydrophobicContact CB-CZ2 4.32Å; Q187-W211 HydrophobicContact CB-CZ3 3.62Å; Q187-W211 HydrophobicContact CG-CH2 4.23Å; Q187-W211 HydrophobicContact CG-CZ3 4.11Å
188	R	95.2	Very high	88.2	Confident	63 Å²	63	77.1 Å²	77.1	24%	0.238	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	153.5	168.7	61.5	175.8	-178	178.1	2.2	110.4	W174 W177 R209 Q210	W174-R188 HydrophobicContact CD2-CG 4.08Å; W174-R188 HydrophobicContact CE3-CB 4.11Å; W174-R188 HydrophobicContact CE3-CG 3.54Å; W174-R188 HydrophobicContact CZ3-CG 3.98Å; W174-R188 WeakPolarHBondContact CZ3-O 3.15Å; W177-R188 HydrophobicContact CD2-CB 4Å; W177-R188 HydrophobicContact CD2-CG 4.02Å; W177-R188 VanDerWaalsContact CE2-CD 3.48Å; W177-R188 HydrophobicContact CE3-CB 3.9Å; W177-R188 HydrophobicContact CE3-CG 3.9Å; W177-R188 HydrophobicContact CG-CB 4.5Å; W177-R188 HydrophobicContact CH2-CG 3.67Å; W177-R188 VanDerWaalsContact CZ2-CD 3.41Å; W177-R188 HydrophobicContact CZ2-CG 3.79Å; W177-R188 VanDerWaalsContact CZ2-NE 3.31Å; W177-R188 HydrophobicContact CZ3-CB 4.19Å; W177-R188 HydrophobicContact CZ3-CG 3.72Å; R188-R209 WeakPolarHBondContact O-CA 3.43Å; R188-Q210 HydrophobicContact CG-CB 4.1Å; R188-Q210 PolarHBondContact N-O 3.3Å; R188-Q210 PolarHBondContact O-N 2.82Å
189	R	95.6	Very high	87.6	Confident	137 Å²	137	80.4 Å²	80.4	52%	0.517	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.7	-177.3	-172.6	178.1	-179.5	-159.9	-3.9	111.8	W174 S175 D208 R209	W174-R189 VanDerWaalsContact CE3-C 3.42Å; S175-R189 WeakPolarHBondContact CB-O 3.47Å; S175-R189 PolarHBondContact N-O 2.87Å; S175-R189 PolarHBondContact OG-N 3.3Å; S175-R189 PolarHBondContact OG-O 3.35Å; R189-D208 CarbonylContact C-O 3.58Å; R189-D208 VanDerWaalsContact CA-O 3.23Å; R189-D208 WeakPolarHBondContact CA-O 3.42Å; R189-D208 WeakPolarHBondContact CG-O 3.09Å; R189-D208 IonicContact NE-OD2 3.33Å; R189-R209 HydrophobicContact CG-CG 4.33Å
190	R	95.8	Very high	87.1	Confident	43 Å²	43	75.6 Å²	75.6	16%	0.162	40%	0.397	C	S	.	.			trans	-131.4	159.1	169.3	56	177.8	-180	171.5	6.9	110.4	W171 W174 H205 A207 D208	W171-R190 VanDerWaalsContact CD1-CZ 3.48Å; W171-R190 HydrophobicContact CD2-CG 3.87Å; W171-R190 HydrophobicContact CE3-CB 3.95Å; W171-R190 VanDerWaalsContact CE3-CD 3.48Å; W171-R190 HydrophobicContact CE3-CG 3.38Å; W171-R190 HydrophobicContact CG-CG 4.47Å; W171-R190 HydrophobicContact CH2-CG 4.48Å; W171-R190 HydrophobicContact CZ3-CB 4.49Å; W171-R190 HydrophobicContact CZ3-CG 3.73Å; W171-R190 VanDerWaalsContact NE1-CZ 3.25Å; W174-R190 HydrophobicContact CD2-CB 4.04Å; W174-R190 HydrophobicContact CD2-CG 4.05Å; W174-R190 HydrophobicContact CE3-CB 3.84Å; W174-R190 HydrophobicContact CE3-CG 3.8Å; W174-R190 HydrophobicContact CH2-CG 3.66Å; W174-R190 HydrophobicContact CZ2-CG 3.91Å; W174-R190 HydrophobicContact CZ3-CB 4.14Å; W174-R190 HydrophobicContact CZ3-CG 3.6Å; R190-H205 PolarHBondContact NH2-O 3.45Å; R190-A207 PolarHBondContact NE-O 3.31Å; R190-A207 PolarHBondContact NH2-O 3.1Å; R190-D208 PolarHBondContact N-O 2.9Å
191	V	92.3	Very high	86.9	Confident	68 Å²	68	74.2 Å²	74.2	41%	0.412	39%	0.39	S	S	.	.			trans	-123.6	147.6	179.6	-172.3	0	0	0	0	109	S172 D193	S172-V191 WeakPolarHBondContact CB-O 3.3Å; S172-V191 PolarHBondContact N-O 3.4Å; S172-V191 PolarHBondContact OG-N 2.74Å; S172-V191 PolarHBondContact OG-O 3.4Å; V191-D193 VanDerWaalsContact C-N 3.31Å; V191-D193 HydrophobicContact CG1-CB 4.24Å; V191-D193 PolarHBondContact O-N 3.12Å; V191-D193 VanDerWaalsContact O-N 3.17Å
192	C	92.4	Very high	86.9	Confident	17 Å²	17	76.5 Å²	76.5	12%	0.115	40%	0.401	C	S	.	.	S	Bend	trans	-87.7	68.1	-178.4	-174.9	0	0	0	0	110.2	W171 Q203 C204	W171-C192 HydrophobicContact CE3-CB 4.24Å; W171-C192 HydrophobicContact CZ3-CB 4.12Å; C192-Q203 PolarHBondContact SG-NE2 2.84Å; C192-C204 WeakPolarHBondContact CA-SG 3.47Å; C192-C204 HydrophobicContact CB-CB 3.77Å; C192-C204 WeakPolarHBondContact CB-SG 3.32Å; C192-C204 WeakPolarHBondContact SG-CB 3.29Å; C192-C204 PolarHBondContact SG-N 3.07Å; C192-C204 CovalentContact SG-SG 2.02Å; C192-C204 PolarHBondContact SG-SG 3.15Å
193	D	89.5	Confident	87.4	Confident	89 Å²	89	75.3 Å²	75.3	48%	0.476	39%	0.385	S	S	.	.			trans	-132.3	10	-170.5	65.8	-4.1	0	0	0	115.2	D170 S172 V191	D170-D193 PolarHBondContact O-N 2.92Å; S172-D193 VanDerWaalsContact CB-OD1 3.23Å; S172-D193 WeakPolarHBondContact CB-OD1 3.34Å; V191-D193 VanDerWaalsContact C-N 3.31Å; V191-D193 HydrophobicContact CG1-CB 4.24Å; V191-D193 PolarHBondContact O-N 3.12Å; V191-D193 VanDerWaalsContact O-N 3.17Å
194	N	82.7	Confident	87.7	Confident	110 Å²	110	72.9 Å²	72.9	59%	0.588	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.1	67.8	-174.9	-162.3	36.7	0	0	0	115.8	D170	D170-N194 WeakPolarHBondContact CB-O 3.48Å; D170-N194 PolarHBondContact O-N 2.99Å
195	P	83.2	Confident	88.1	Confident	57 Å²	57	79.4 Å²	79.4	37%	0.37	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	cis	-86	160.8	5	32.1	-34.4	0	0	0	113.6	I167 G169 D170	I167-P195 HydrophobicContact CG2-CB 3.85Å; I167-P195 HydrophobicContact CG2-CG 3.62Å; G169-P195 CarbonylContact C-O 3.54Å; G169-P195 VanDerWaalsContact CA-O 3.25Å; G169-P195 WeakPolarHBondContact CA-O 3.34Å; D170-P195 PolarHBondContact N-O 3.49Å
196	A	85.4	Confident	88.1	Confident	43 Å²	43	76 Å²	76	36%	0.355	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-74.8	143	168.3	0	0	0	0	0	110.4	R198	A196-R198 PolarHBondContact O-N 3.32Å
197	P	85.9	Confident	88	Confident	38 Å²	38	76.8 Å²	76.8	25%	0.247	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-62.9	128.7	179.5	22.1	-28.5	0	0	0	111.2	I167	I167-P197 CarbonylContact O-C 3.46Å; I167-P197 WeakPolarHBondContact O-CA 3.32Å
198	R	81.6	Confident	88	Confident	153 Å²	153	77.2 Å²	77.2	58%	0.577	43%	0.426	S	S	*	.	B	Isolated β-bridge	trans	-136.2	160.7	179.3	-73.3	-166.3	-73.5	-156.8	-1.3	111.3	I167 A196 G200 G201	I167-R198 HydrophobicContact CB-CB 4.31Å; I167-R198 HydrophobicContact CD1-CB 4.34Å; I167-R198 PolarHBondContact N-O 3.06Å; I167-R198 PolarHBondContact O-N 2.91Å; A196-R198 PolarHBondContact O-N 3.32Å; R198-G200 PolarHBondContact O-N 3.32Å; R198-G200 VanDerWaalsContact O-N 3.09Å; R198-G201 PolarHBondContact O-N 3.33Å
199	H	78.7	Confident	87.9	Confident	107 Å²	107	80.1 Å²	80.1	50%	0.495	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	33.9	-179.5	-47.6	141	0	0	0	114	C165	C165-H199 WeakPolarHBondContact O-CB 3.42Å; C165-H199 PolarHBondContact O-ND1 2.99Å
200	G	76.5	Confident	87.8	Confident	78 Å²	78	77.5 Å²	77.5	80%	0.804	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	13.4	179.3	0	0	0	0	0	116	R198	R198-G200 PolarHBondContact O-N 3.32Å; R198-G200 VanDerWaalsContact O-N 3.09Å
201	G	82.7	Confident	87.7	Confident	15 Å²	15	81.5 Å²	81.5	16%	0.155	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-65.1	162.3	174.4	0	0	0	0	0	114.3	I167 D168 R198	I167-G201 WeakPolarHBondContact O-CA 3.2Å; D168-G201 WeakPolarHBondContact OD1-CA 3.26Å; R198-G201 PolarHBondContact O-N 3.33Å
202	Q	83.7	Confident	87.6	Confident	124 Å²	124	84.2 Å²	84.2	58%	0.579	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-70.1	143.2	-173.8	-61.7	-179	24.4	0	0	112.5	D168 G169	D168-Q202 WeakPolarHBondContact OD1-CB 3.46Å; D168-Q202 PolarHBondContact OD1-N 2.77Å; G169-Q202 PolarHBondContact N-O 2.93Å
203	Q	90.7	Very high	87.3	Confident	127 Å²	127	87.7 Å²	87.7	59%	0.593	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-72.9	142.7	172.6	-169.2	66.2	32.2	0	0	110.5	C192 H205	C192-Q203 PolarHBondContact SG-NE2 2.84Å; Q203-H205 PolarHBondContact O-N 2.9Å
204	C	91.5	Very high	87.1	Confident	16 Å²	16	83.9 Å²	83.9	11%	0.108	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-53.6	132.5	-179.4	-56.4	0	0	0	0	113.6	G169 D170 W171 C192	G169-C204 PolarHBondContact O-SG 3.48Å; D170-C204 VanDerWaalsContact CA-SG 3.59Å; D170-C204 PolarHBondContact N-SG 3.17Å; D170-C204 VanDerWaalsContact N-SG 3.44Å; W171-C204 HydrophobicContact CD2-CB 3.7Å; W171-C204 HydrophobicContact CE3-CB 4.3Å; W171-C204 HydrophobicContact CG-CB 4.09Å; W171-C204 HydrophobicContact CH2-CB 4.2Å; W171-C204 HydrophobicContact CZ2-CB 3.56Å; C192-C204 WeakPolarHBondContact CA-SG 3.47Å; C192-C204 HydrophobicContact CB-CB 3.77Å; C192-C204 WeakPolarHBondContact CB-SG 3.32Å; C192-C204 WeakPolarHBondContact SG-CB 3.29Å; C192-C204 PolarHBondContact SG-N 3.07Å; C192-C204 CovalentContact SG-SG 2.02Å; C192-C204 PolarHBondContact SG-SG 3.15Å
205	H	91.1	Very high	86.6	Confident	159 Å²	159	84 Å²	84	74%	0.736	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-83.4	139.4	179.5	-90.2	-88.6	0	0	0	113.8	W171 R190 Q203	W171-H205 PolarHBondContact NE1-O 2.76Å; R190-H205 PolarHBondContact NH2-O 3.45Å; Q203-H205 PolarHBondContact O-N 2.9Å
206	G	90.9	Very high	85.8	Confident	57 Å²	57	84.9 Å²	84.9	59%	0.588	46%	0.46	S	S	*	.	S	Bend	trans	102.5	175.5	176.2	0	0	0	0	0	114.3	W171	W171-G206 WeakPolarHBondContact CZ2-O 3.35Å
207	A	89.8	Confident	84.8	Confident	62 Å²	62	90.4 Å²	90.4	51%	0.512	48%	0.483	S	S	.	.			trans	-70.9	144.3	-177.8	0	0	0	0	0	112.1	R190 R209	R190-A207 PolarHBondContact NE-O 3.31Å; R190-A207 PolarHBondContact NH2-O 3.1Å; A207-R209 WeakPolarHBondContact CB-O 3.49Å
208	D	92.5	Very high	83.5	Confident	59 Å²	59	95.6 Å²	95.6	32%	0.316	51%	0.508	S	S	.	.	S	Bend	trans	-76.8	-14.1	171.4	70.1	-44.5	0	0	0	111.9	W171 W174 R189 R190	W171-D208 HydrophobicContact CH2-CB 4.03Å; W171-D208 HydrophobicContact CZ3-CB 4.2Å; W174-D208 WeakPolarHBondContact CZ3-O 3.37Å; R189-D208 CarbonylContact C-O 3.58Å; R189-D208 VanDerWaalsContact CA-O 3.23Å; R189-D208 WeakPolarHBondContact CA-O 3.42Å; R189-D208 WeakPolarHBondContact CG-O 3.09Å; R189-D208 IonicContact NE-OD2 3.33Å; R190-D208 PolarHBondContact N-O 2.9Å
209	R	94.1	Very high	82.7	Confident	124 Å²	124	89.2 Å²	89.2	47%	0.468	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	145.1	-178.3	-61.3	-178.4	-145.5	-167.2	7.4	112.5	R188 R189 A207	R188-R209 WeakPolarHBondContact O-CA 3.43Å; R189-R209 HydrophobicContact CG-CG 4.33Å; A207-R209 WeakPolarHBondContact CB-O 3.49Å
210	Q	93.9	Very high	81.9	Confident	81 Å²	81	87 Å²	87	38%	0.379	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	146.7	174.6	-167.1	178.7	22.1	0	0	111.5	W174 W177 Q187 R188	W174-Q210 HydrophobicContact CH2-CB 3.95Å; W174-Q210 HydrophobicContact CZ2-CB 4.48Å; W174-Q210 HydrophobicContact CZ3-CB 4.21Å; W177-Q210 HydrophobicContact CH2-CB 4.32Å; W177-Q210 HydrophobicContact CH2-CG 4.2Å; W177-Q210 WeakPolarHBondContact CZ3-O 3.4Å; Q187-Q210 VanDerWaalsContact CA-O 3.26Å; Q187-Q210 WeakPolarHBondContact CA-O 3.16Å; R188-Q210 HydrophobicContact CG-CB 4.1Å; R188-Q210 PolarHBondContact N-O 3.3Å; R188-Q210 PolarHBondContact O-N 2.82Å
211	W	91.9	Very high	80.8	Confident	127 Å²	127	86 Å²	86	48%	0.481	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	147.2	-178.9	-60.1	93.1	0	0	0	111.7	R185 R186 Q187	R185-W211 HydrophobicContact CB-CE3 4.21Å; R186-W211 WeakPolarHBondContact O-CA 3.49Å; Q187-W211 HydrophobicContact CB-CD2 4.11Å; Q187-W211 HydrophobicContact CB-CE3 3.7Å; Q187-W211 HydrophobicContact CB-CH2 3.94Å; Q187-W211 HydrophobicContact CB-CZ2 4.32Å; Q187-W211 HydrophobicContact CB-CZ3 3.62Å; Q187-W211 HydrophobicContact CG-CH2 4.23Å; Q187-W211 HydrophobicContact CG-CZ3 4.11Å
212	R	90.2	Very high	79.4	Confident	125 Å²	125	90.3 Å²	90.3	47%	0.472	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	144.4	171.5	-167.5	179.7	77.5	176.9	3	110.8	W177 R185 R186	W177-R212 HydrophobicContact CH2-CB 3.75Å; W177-R212 HydrophobicContact CZ2-CB 4.28Å; W177-R212 HydrophobicContact CZ3-CB 3.95Å; R185-R212 CarbonylContact C-O 3.58Å; R185-R212 WeakPolarHBondContact CA-O 3.27Å; R186-R212 HydrophobicContact CG-CB 4.25Å; R186-R212 WeakPolarHBondContact CG-O 3.27Å; R186-R212 PolarHBondContact N-O 3.08Å; R186-R212 PolarHBondContact O-N 2.99Å
213	T	87.2	Confident	77.6	Confident	91 Å²	91	95 Å²	95	56%	0.558	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	138.1	173	-12.6	0	0	0	0	111.1	C184	C184-T213 WeakPolarHBondContact O-CA 3.48Å; C184-T213 WeakPolarHBondContact O-CG2 3.39Å
214	C	84.7	Confident	75.4	Confident	9 Å²	9	99 Å²	99	6%	0.061	51%	0.512	C	S	.	.			trans	-91.7	152	173.3	-16.3	0	0	0	0	111	C180 C184	C180-C214 HydrophobicContact CB-CB 3.92Å; C180-C214 WeakPolarHBondContact CB-SG 3.23Å; C180-C214 WeakPolarHBondContact SG-CB 3.3Å; C180-C214 CovalentContact SG-SG 2.03Å; C180-C214 PolarHBondContact SG-SG 2.9Å; C184-C214 PolarHBondContact O-N 3.14Å; C184-C214 PolarHBondContact O-SG 2.82Å; C184-C214 VanDerWaalsContact O-SG 3.35Å
215	S	73.5	Confident	73.1	Confident	111 Å²	111	105.5 Å²	105.5	78%	0.776	54%	0.544	S	S	*	.			trans	-119.5	32.4	171.9	-51.6	0	0	0	0	111.5
216	D	65.8	Low	70.5	Confident	76 Å²	76	101.6 Å²	101.6	41%	0.406	55%	0.548	S	S	.	.			trans	-73.4	156.5	179.5	-57.7	-43	0	0	0	110.3	R186 L218 C219 S220	R186-D216 IonicContact NH2-OD1 3.93Å; R186-D216 IonicContact NH2-OD2 3.36Å; R186-D216 PolarHBondContact NH2-OD2 2.76Å; D216-L218 PolarHBondContact O-N 3.02Å; D216-L218 VanDerWaalsContact O-N 3.08Å; D216-C219 PolarHBondContact O-N 2.77Å; D216-S220 PolarHBondContact O-N 3.4Å
217	L	63.4	Low	67.9	Low	160 Å²	160	104.4 Å²	104.4	84%	0.838	56%	0.558	S	S	*	*	H	α-helix	trans	-51.6	-36.3	-170.5	-76	151	0	0	0	114.1	C219 S220	L217-C219 VanDerWaalsContact C-N 3.35Å; L217-C219 PolarHBondContact O-N 3.34Å; L217-S220 PolarHBondContact O-N 3.13Å
218	L	59.9	Low	65.3	Low	147 Å²	147	106.7 Å²	106.7	77%	0.77	57%	0.571	S	S	*	*	H	α-helix	trans	-66.8	-31.3	177.8	-77.8	88.4	0	0	0	113.3	D216	D216-L218 PolarHBondContact O-N 3.02Å; D216-L218 VanDerWaalsContact O-N 3.08Å
219	C	64.9	Low	63.1	Low	18 Å²	18	109.4 Å²	109.4	12%	0.122	59%	0.591	C	S	.	*	H	α-helix	trans	-82	-21.7	-179.3	-77.5	0	0	0	0	113.4	C184 D216 L217 A221	C184-C219 WeakPolarHBondContact CA-SG 3.32Å; C184-C219 HydrophobicContact CB-CB 3.89Å; C184-C219 WeakPolarHBondContact CB-SG 3.48Å; C184-C219 VanDerWaalsContact SG-CA 3.59Å; C184-C219 WeakPolarHBondContact SG-CB 3.4Å; C184-C219 CovalentContact SG-SG 2.03Å; C184-C219 PolarHBondContact SG-SG 2.89Å; D216-C219 PolarHBondContact O-N 2.77Å; L217-C219 VanDerWaalsContact C-N 3.35Å; L217-C219 PolarHBondContact O-N 3.34Å; C219-A221 VanDerWaalsContact C-N 3.31Å
220	S	61.3	Low	60.3	Low	61 Å²	61	110.6 Å²	110.6	43%	0.427	61%	0.607	S	S	.	*	H	α-helix	trans	-72	-26.8	171.5	-68.8	0	0	0	0	112.4	D216 L217	D216-S220 PolarHBondContact O-N 3.4Å; L217-S220 PolarHBondContact O-N 3.13Å
221	A	54.2	Low	57.3	Low	56 Å²	56	115.4 Å²	115.4	46%	0.463	63%	0.629	S	S	.	*	H	α-helix	trans	-71.6	-36.9	176.5	0	0	0	0	0	112.2	C219 R223 R224	C219-A221 VanDerWaalsContact C-N 3.31Å; A221-R223 VanDerWaalsContact C-N 3.28Å; A221-R223 PolarHBondContact O-N 3.22Å; A221-R224 PolarHBondContact O-N 3.02Å
222	V	51.9	Low	54.5	Low	107 Å²	107	118.2 Å²	118.2	65%	0.648	65%	0.648	S	S	*	*	H	α-helix	trans	-67.2	-27.9	177.6	-179.1	0	0	0	0	112.1	R224	V222-R224 VanDerWaalsContact C-N 3.33Å; V222-R224 PolarHBondContact O-N 3.12Å
223	R	46.8	Very low	52	Low	221 Å²	221	120.5 Å²	120.5	83%	0.834	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-6.8	174.8	-79	-170.5	178.1	-177.4	-0.7	114.9	A221	A221-R223 VanDerWaalsContact C-N 3.28Å; A221-R223 PolarHBondContact O-N 3.22Å
224	R	43.8	Very low	49.5	Very low	212 Å²	212	121 Å²	121	80%	0.8	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-8.2	-178.5	-69.5	-160.2	-158.2	166.7	6.1	115.5	A221 V222	A221-R224 PolarHBondContact O-N 3.02Å; V222-R224 VanDerWaalsContact C-N 3.33Å; V222-R224 PolarHBondContact O-N 3.12Å
225	I	44.4	Very low	46.9	Very low	152 Å²	152	125.1 Å²	125.1	78%	0.779	72%	0.717	S	S	*	*	S	Bend	trans	-122.9	79.6	-178.4	-50.8	176.5	0	0	0	107.9
226	G	34.7	Very low	44.8	Very low	78 Å²	78	128 Å²	128	80%	0.804	72%	0.723	S	S	*	*			trans	169.8	35.9	-179.6	0	0	0	0	0	114
227	S	36.4	Very low	43.1	Very low	116 Å²	116	133.3 Å²	133.3	81%	0.811	74%	0.743	S	S	*	*			trans	-119.1	78.1	167.5	61.2	0	0	0	0	109
228	S	37	Very low	41.5	Very low	110 Å²	110	136.3 Å²	136.3	77%	0.769	75%	0.749	S	S	*	*			trans	-152.9	142.7	152.3	64.6	0	0	0	0	109.7
229	P	46	Very low	40.1	Very low	115 Å²	115	133.9 Å²	133.9	75%	0.747	75%	0.75	S	S	*	*			trans	-90.2	133.8	-162	35.2	-30.2	0	0	0	111.1
230	D	34.3	Very low	38.5	Very low	149 Å²	149	138.8 Å²	138.8	80%	0.797	79%	0.785	S	S	*	*			trans	177.4	140.9	134.9	-89	-30.5	0	0	0	108.9
231	Q	31.7	Very low	37.1	Very low	183 Å²	183	144.9 Å²	144.9	86%	0.855	80%	0.804	S	S	*	*			trans	64.7	89.2	166.8	-72.2	160.6	-13.5	0	0	115.3
232	Q	31.7	Very low	36.2	Very low	185 Å²	185	145.2 Å²	145.2	86%	0.864	81%	0.812	S	S	*	*				22.1	116.2	73.2	-129.7	89.9	-1.9	0	0	113.1
233	L	38.9	Very low	35.7	Very low	174 Å²	174	143.2 Å²	143.2	91%	0.911	80%	0.803	S	S	*	*			trans	98.5	67.8	165.7	-154.5	75.3	0	0	0	117.2
234	A	33.4	Very low	35.8	Very low	100 Å²	100	138.9 Å²	138.9	83%	0.826	80%	0.797	S	S	*	*	S	Bend		-171.2	133	128	0	0	0	0	0	111.1
235	A	30.8	Very low	36.2	Very low	97 Å²	97	133.5 Å²	133.5	80%	0.802	78%	0.784	S	S	*	*			trans	89.2	40.5	160.6	0	0	0	0	0	120	K237	A235-K237 VanDerWaalsContact C-N 3.33Å; A235-K237 PolarHBondContact O-N 2.7Å
236	D	30.3	Very low	37.1	Very low	170 Å²	170	131.4 Å²	131.4	91%	0.909	78%	0.778	S	S	*	*				-76.8	91.2	129.5	-96.8	-27.4	0	0	0	107.7
237	K	29.1	Very low	38.5	Very low	188 Å²	188	131.5 Å²	131.5	82%	0.817	77%	0.771	S	S	*	*			trans	-167.1	47.3	160.6	-111.3	174.2	-165.9	-177.8	0	112.8	A235	A235-K237 VanDerWaalsContact C-N 3.33Å; A235-K237 PolarHBondContact O-N 2.7Å
238	F	30	Very low	40.1	Very low	224 Å²	224	131 Å²	131	98%	0.982	76%	0.757	S	S	*	*	S	Bend	trans	-138.8	47.8	160.1	-95	-79.6	0	0	0	111
239	A	30.6	Very low	42.1	Very low	95 Å²	95	133.2 Å²	133.2	79%	0.785	75%	0.75	S	S	*	*	S	Bend	trans	-151.2	134.6	159.2	0	0	0	0	0	108.1
240	S	32.1	Very low	43.6	Very low	121 Å²	121	130.6 Å²	130.6	85%	0.846	74%	0.738	S	S	*	*			trans	74.7	78.5	-173.6	-162.5	0	0	0	0	115.9
241	K	30.6	Very low	45.7	Very low	189 Å²	189	125.5 Å²	125.5	82%	0.822	72%	0.721	S	S	*	*			trans	-101.2	73.7	136.1	-136.4	-167.9	-178.9	173.9	0	107.6	S243	K241-S243 PolarHBondContact O-N 3.42Å
242	G	36.8	Very low	48	Very low	63 Å²	63	122 Å²	122	65%	0.649	71%	0.707	S	S	*	*			trans	-60	94.4	144.2	0	0	0	0	0	106.4
243	S	40.1	Very low	50.4	Low	65 Å²	65	114.4 Å²	114.4	46%	0.455	68%	0.678	S	S	.	*			trans	-112.8	83.2	179	-166.1	0	0	0	0	108.6	K241 N245	K241-S243 PolarHBondContact O-N 3.42Å; S243-N245 PolarHBondContact O-N 3.38Å; S243-N245 VanDerWaalsContact O-N 3.09Å
244	N	48.6	Very low	52.7	Low	130 Å²	130	109 Å²	109	70%	0.695	66%	0.659	S	S	*	*			trans	43	57.7	135.4	-55	-10.9	0	0	0	117.2	V246	N244-V246 PolarHBondContact O-N 2.92Å
245	N	53.7	Low	55.4	Low	100 Å²	100	106.7 Å²	106.7	54%	0.535	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77	6.3	159.9	-72.1	-14.8	0	0	0	112.3	S243 A247 M248 Y249	S243-N245 PolarHBondContact O-N 3.38Å; S243-N245 VanDerWaalsContact O-N 3.09Å; N245-A247 PolarHBondContact O-N 3.46Å; N245-M248 PolarHBondContact O-N 2.97Å; N245-Y249 HydrophobicContact CB-CD2 4.01Å; N245-Y249 HydrophobicContact CB-CE2 3.77Å; N245-Y249 WeakPolarHBondContact O-CD2 3.46Å; N245-Y249 PolarHBondContact O-N 3.42Å
246	V	62.6	Low	58.1	Low	108 Å²	108	108.6 Å²	108.6	66%	0.655	63%	0.63	S	S	*	*	H	α-helix	trans	-54.8	-35.7	175.7	-176.9	0	0	0	0	111	N244 A250	N244-V246 PolarHBondContact O-N 2.92Å; V246-A250 WeakPolarHBondContact O-CB 3.29Å; V246-A250 PolarHBondContact O-N 2.96Å
247	A	63.5	Low	60.9	Low	79 Å²	79	106.6 Å²	106.6	65%	0.653	61%	0.614	S	S	*	*	H	α-helix	trans	-66.7	-37.5	176.5	0	0	0	0	0	113	N245 G251	N245-A247 PolarHBondContact O-N 3.46Å; A247-G251 PolarHBondContact O-N 3.2Å
248	M	71	Confident	63.9	Low	107 Å²	107	100.5 Å²	100.5	53%	0.527	60%	0.599	S	S	.	*	H	α-helix	trans	-70.5	-44.2	177.1	-167.4	-173.1	92.6	0	0	111.1	N245 G251 L252	N245-M248 PolarHBondContact O-N 2.97Å; M248-G251 PolarHBondContact O-N 3.43Å; M248-L252 HydrophobicContact CE-CD1 4.4Å; M248-L252 PolarHBondContact O-N 2.8Å
249	Y	77.9	Confident	66.9	Low	155 Å²	155	97.6 Å²	97.6	61%	0.608	59%	0.586	S	S	*	*	H	α-helix	trans	-68.3	-34.3	176.3	-68.2	-67.2	0	0	0	112.4	N245 L252 G253	N245-Y249 HydrophobicContact CB-CD2 4.01Å; N245-Y249 HydrophobicContact CB-CE2 3.77Å; N245-Y249 WeakPolarHBondContact O-CD2 3.46Å; N245-Y249 PolarHBondContact O-N 3.42Å; Y249-L252 PolarHBondContact O-N 2.92Å; Y249-G253 PolarHBondContact O-N 2.8Å
250	A	77.3	Confident	69.8	Low	61 Å²	61	97.4 Å²	97.4	50%	0.504	57%	0.571	S	S	.	*	H	α-helix	trans	-65.7	-39.6	172.1	0	0	0	0	0	111.9	V246 G253 A254	V246-A250 WeakPolarHBondContact O-CB 3.29Å; V246-A250 PolarHBondContact O-N 2.96Å; A250-G253 PolarHBondContact O-N 3.1Å; A250-A254 WeakPolarHBondContact O-CB 2.98Å; A250-A254 PolarHBondContact O-N 3.42Å
251	G	78.1	Confident	72.6	Confident	42 Å²	42	99 Å²	99	43%	0.433	56%	0.563	S	S	.	*	H	α-helix	trans	-65	-42.1	174.4	0	0	0	0	0	113.1	A247 M248 A254 A255	A247-G251 PolarHBondContact O-N 3.2Å; M248-G251 PolarHBondContact O-N 3.43Å; G251-A254 PolarHBondContact O-N 2.91Å; G251-A255 WeakPolarHBondContact O-CB 3.44Å; G251-A255 PolarHBondContact O-N 2.67Å
252	L	80	Confident	75.5	Confident	109 Å²	109	92.6 Å²	92.6	57%	0.571	55%	0.545	S	S	*	.	H	α-helix	trans	-63.6	-41.9	174.3	-106.7	144.5	0	0	0	112	M248 Y249 A255 F256	M248-L252 HydrophobicContact CE-CD1 4.4Å; M248-L252 PolarHBondContact O-N 2.8Å; Y249-L252 PolarHBondContact O-N 2.92Å; L252-A255 PolarHBondContact O-N 2.64Å; L252-F256 WeakPolarHBondContact O-CB 3.38Å; L252-F256 PolarHBondContact O-N 3.48Å
253	G	83.9	Confident	78.1	Confident	25 Å²	25	97.1 Å²	97.1	26%	0.258	55%	0.547	S	S	.	.	H	α-helix	trans	-60.9	-48.6	173.2	0	0	0	0	0	112	Y249 A250 A255 F256 F257	Y249-G253 PolarHBondContact O-N 2.8Å; A250-G253 PolarHBondContact O-N 3.1Å; G253-A255 VanDerWaalsContact C-N 3.35Å; G253-A255 PolarHBondContact O-N 3.17Å; G253-F256 PolarHBondContact O-N 2.96Å; G253-F257 WeakPolarHBondContact O-CD2 2.99Å; G253-F257 PolarHBondContact O-N 3.41Å
254	A	87	Confident	80.5	Confident	62 Å²	62	96.7 Å²	96.7	51%	0.512	55%	0.548	S	S	.	.	H	α-helix	trans	-61.1	-40.3	178.6	0	0	0	0	0	112.7	A250 G251 F257 A258	A250-A254 WeakPolarHBondContact O-CB 2.98Å; A250-A254 PolarHBondContact O-N 3.42Å; G251-A254 PolarHBondContact O-N 2.91Å; A254-F257 PolarHBondContact O-N 3.12Å; A254-A258 WeakPolarHBondContact O-CB 3.39Å; A254-A258 PolarHBondContact O-N 2.89Å
255	A	88.5	Confident	82.5	Confident	51 Å²	51	97.5 Å²	97.5	42%	0.421	55%	0.545	S	S	.	.	H	α-helix	trans	-64.8	-41.9	175.1	0	0	0	0	0	112	G251 L252 G253 A258 F259	G251-A255 WeakPolarHBondContact O-CB 3.44Å; G251-A255 PolarHBondContact O-N 2.67Å; L252-A255 PolarHBondContact O-N 2.64Å; G253-A255 VanDerWaalsContact C-N 3.35Å; G253-A255 PolarHBondContact O-N 3.17Å; A255-A258 PolarHBondContact O-N 3.16Å; A255-F259 WeakPolarHBondContact O-CD2 3.49Å; A255-F259 PolarHBondContact O-N 3.4Å
256	F	89.1	Confident	84.1	Confident	137 Å²	137	96.9 Å²	96.9	60%	0.601	55%	0.545	S	S	*	.	H	α-helix	trans	-63.5	-43.1	177	-161.6	-98	0	0	0	111.7	L252 G253 F259 L260	L252-F256 WeakPolarHBondContact O-CB 3.38Å; L252-F256 PolarHBondContact O-N 3.48Å; G253-F256 PolarHBondContact O-N 2.96Å; F256-F259 PolarHBondContact O-N 3.49Å; F256-L260 HydrophobicContact CD1-CD1 3.73Å; F256-L260 HydrophobicContact CD1-CG 4.31Å; F256-L260 HydrophobicContact CE1-CD1 3.7Å; F256-L260 HydrophobicContact CE1-CG 4.25Å; F256-L260 WeakPolarHBondContact O-CG 3.08Å; F256-L260 PolarHBondContact O-N 3.46Å
257	F	89	Confident	85.3	Confident	127 Å²	127	97.3 Å²	97.3	56%	0.557	54%	0.538	S	S	*	.	H	α-helix	trans	-66.2	-40	174.8	-74.6	-63.9	0	0	0	112.5	G253 A254 F259 L260 F261	G253-F257 WeakPolarHBondContact O-CD2 2.99Å; G253-F257 PolarHBondContact O-N 3.41Å; A254-F257 PolarHBondContact O-N 3.12Å; F257-F259 VanDerWaalsContact C-N 3.33Å; F257-F259 PolarHBondContact O-N 2.81Å; F257-L260 HydrophobicContact CD1-CD1 4.38Å; F257-L260 PolarHBondContact O-N 3.45Å; F257-F261 VanDerWaalsContact O-CD2 3.3Å; F257-F261 WeakPolarHBondContact O-CD2 3.46Å; F257-F261 PolarHBondContact O-N 3.34Å
258	A	91.5	Very high	86.3	Confident	61 Å²	61	96 Å²	96	50%	0.504	53%	0.527	S	S	.	.	H	α-helix	trans	-61.5	-40.7	175.1	0	0	0	0	0	112.1	A254 A255 F261 A262	A254-A258 WeakPolarHBondContact O-CB 3.39Å; A254-A258 PolarHBondContact O-N 2.89Å; A255-A258 PolarHBondContact O-N 3.16Å; A258-F261 PolarHBondContact O-N 2.89Å; A258-A262 WeakPolarHBondContact O-CB 3.36Å; A258-A262 PolarHBondContact O-N 3.44Å
259	F	92.2	Very high	86.9	Confident	163 Å²	163	93.3 Å²	93.3	72%	0.715	52%	0.517	S	S	*	.	H	α-helix	trans	-64.2	-43.5	173.8	-98.9	-80.2	0	0	0	112.3	A255 F256 F257 A262 F263	A255-F259 WeakPolarHBondContact O-CD2 3.49Å; A255-F259 PolarHBondContact O-N 3.4Å; F256-F259 PolarHBondContact O-N 3.49Å; F257-F259 VanDerWaalsContact C-N 3.33Å; F257-F259 PolarHBondContact O-N 2.81Å; F259-A262 PolarHBondContact O-N 2.75Å; F259-F263 VanDerWaalsContact O-CB 3.32Å; F259-F263 WeakPolarHBondContact O-CB 3.48Å; F259-F263 PolarHBondContact O-N 2.93Å
260	L	91.5	Very high	87	Confident	90 Å²	90	90.6 Å²	90.6	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-62.4	-41.9	175.7	-75.1	172.6	0	0	0	112	F256 F257 F263 A264	F256-L260 HydrophobicContact CD1-CD1 3.73Å; F256-L260 HydrophobicContact CD1-CG 4.31Å; F256-L260 HydrophobicContact CE1-CD1 3.7Å; F256-L260 HydrophobicContact CE1-CG 4.25Å; F256-L260 WeakPolarHBondContact O-CG 3.08Å; F256-L260 PolarHBondContact O-N 3.46Å; F257-L260 HydrophobicContact CD1-CD1 4.38Å; F257-L260 PolarHBondContact O-N 3.45Å; L260-F263 PolarHBondContact O-N 3.33Å; L260-A264 WeakPolarHBondContact O-CB 3.31Å; L260-A264 PolarHBondContact O-N 3.28Å
261	F	90.8	Very high	86.9	Confident	156 Å²	156	91.3 Å²	91.3	68%	0.684	51%	0.506	S	S	*	.	H	α-helix	trans	-66.1	-42	175.8	-90.7	-72.8	0	0	0	112.4	F257 A258 A264 F265	F257-F261 VanDerWaalsContact O-CD2 3.3Å; F257-F261 WeakPolarHBondContact O-CD2 3.46Å; F257-F261 PolarHBondContact O-N 3.34Å; A258-F261 PolarHBondContact O-N 2.89Å; F261-A264 PolarHBondContact O-N 2.81Å; F261-F265 VanDerWaalsContact O-CB 3.27Å; F261-F265 WeakPolarHBondContact O-CB 3.12Å; F261-F265 PolarHBondContact O-N 3.29Å
262	A	91.8	Very high	86.7	Confident	53 Å²	53	98.2 Å²	98.2	44%	0.438	52%	0.519	S	S	.	.	H	α-helix	trans	-63.3	-43.5	175.4	0	0	0	0	0	111.3	A258 F259 F265 V266	A258-A262 WeakPolarHBondContact O-CB 3.36Å; A258-A262 PolarHBondContact O-N 3.44Å; F259-A262 PolarHBondContact O-N 2.75Å; A262-F265 PolarHBondContact O-N 3.21Å; A262-V266 WeakPolarHBondContact O-CB 3.42Å; A262-V266 VanDerWaalsContact O-CG2 3.3Å; A262-V266 WeakPolarHBondContact O-CG2 3.48Å; A262-V266 PolarHBondContact O-N 2.83Å
263	F	92.3	Very high	86.1	Confident	158 Å²	158	101.7 Å²	101.7	69%	0.693	52%	0.524	S	S	*	.	H	α-helix	trans	-65.4	-43.6	177.6	-153.2	-88.1	0	0	0	111.4	F259 L260 V266 F267	F259-F263 VanDerWaalsContact O-CB 3.32Å; F259-F263 WeakPolarHBondContact O-CB 3.48Å; F259-F263 PolarHBondContact O-N 2.93Å; L260-F263 PolarHBondContact O-N 3.33Å; F263-V266 PolarHBondContact O-N 3.42Å; F263-F267 WeakPolarHBondContact O-CB 3.5Å; F263-F267 PolarHBondContact O-N 3.37Å
264	A	89.7	Confident	84.8	Confident	56 Å²	56	109 Å²	109	46%	0.463	54%	0.544	S	S	.	.	H	α-helix	trans	-64.4	-38.4	174.9	0	0	0	0	0	112.2	L260 F261 F267 A268	L260-A264 WeakPolarHBondContact O-CB 3.31Å; L260-A264 PolarHBondContact O-N 3.28Å; F261-A264 PolarHBondContact O-N 2.81Å; A264-F267 PolarHBondContact O-N 2.75Å; A264-A268 WeakPolarHBondContact O-CB 3.38Å; A264-A268 PolarHBondContact O-N 2.8Å
265	F	90.1	Very high	83.3	Confident	147 Å²	147	110 Å²	110	65%	0.645	54%	0.544	S	S	*	.	H	α-helix	trans	-67.2	-45.5	175.7	-177.9	-98.5	0	0	0	111.7	F261 A262 F267 A268 V269	F261-F265 VanDerWaalsContact O-CB 3.27Å; F261-F265 WeakPolarHBondContact O-CB 3.12Å; F261-F265 PolarHBondContact O-N 3.29Å; A262-F265 PolarHBondContact O-N 3.21Å; F265-F267 VanDerWaalsContact C-N 3.33Å; F265-F267 PolarHBondContact O-N 2.85Å; F265-A268 PolarHBondContact O-N 2.84Å; F265-V269 HydrophobicContact CD1-CG2 4.22Å; F265-V269 HydrophobicContact CE1-CG2 3.87Å; F265-V269 HydrophobicContact CE2-CG2 4.43Å; F265-V269 HydrophobicContact CZ-CG2 3.99Å; F265-V269 WeakPolarHBondContact O-CB 3.03Å; F265-V269 VanDerWaalsContact O-CG2 3.3Å; F265-V269 WeakPolarHBondContact O-CG2 3.29Å; F265-V269 PolarHBondContact O-N 3.17Å
266	V	88.2	Confident	81.5	Confident	88 Å²	88	111.5 Å²	111.5	53%	0.533	55%	0.551	S	S	.	*	H	α-helix	trans	-62.7	-42.2	174.5	172.3	0	0	0	0	110.5	A262 F263 V269 M270	A262-V266 WeakPolarHBondContact O-CB 3.42Å; A262-V266 VanDerWaalsContact O-CG2 3.3Å; A262-V266 WeakPolarHBondContact O-CG2 3.48Å; A262-V266 PolarHBondContact O-N 2.83Å; F263-V266 PolarHBondContact O-N 3.42Å; V266-V269 PolarHBondContact O-N 3.29Å; V266-M270 HydrophobicContact CG1-CG 4.34Å; V266-M270 VanDerWaalsContact O-CB 3.32Å; V266-M270 WeakPolarHBondContact O-CB 3.11Å; V266-M270 WeakPolarHBondContact O-CG 3.05Å; V266-M270 PolarHBondContact O-N 3.28Å
267	F	87.1	Confident	79.4	Confident	116 Å²	116	115.8 Å²	115.8	51%	0.509	56%	0.563	S	S	.	*	H	α-helix	trans	-64.3	-41.6	175.7	-168.8	-107.4	0	0	0	111.6	F263 A264 F265 M270 L271	F263-F267 WeakPolarHBondContact O-CB 3.5Å; F263-F267 PolarHBondContact O-N 3.37Å; A264-F267 PolarHBondContact O-N 2.75Å; F265-F267 VanDerWaalsContact C-N 3.33Å; F265-F267 PolarHBondContact O-N 2.85Å; F267-M270 WeakPolarHBondContact O-CB 3.33Å; F267-M270 PolarHBondContact O-N 3.16Å; F267-L271 HydrophobicContact CD1-CD1 3.53Å; F267-L271 HydrophobicContact CD1-CG 4.11Å; F267-L271 HydrophobicContact CE1-CD1 3.36Å; F267-L271 HydrophobicContact CE1-CD2 4.4Å; F267-L271 HydrophobicContact CE1-CG 3.97Å; F267-L271 HydrophobicContact CG-CD1 4.43Å; F267-L271 HydrophobicContact CZ-CD1 4.13Å; F267-L271 HydrophobicContact CZ-CD2 4.38Å; F267-L271 HydrophobicContact CZ-CG 4.32Å; F267-L271 WeakPolarHBondContact O-CB 3.41Å; F267-L271 VanDerWaalsContact O-CG 3.23Å; F267-L271 WeakPolarHBondContact O-CG 3.44Å; F267-L271 PolarHBondContact O-N 3.44Å
268	A	84.4	Confident	77.1	Confident	51 Å²	51	120.1 Å²	120.1	42%	0.421	58%	0.576	S	S	.	*	H	α-helix	trans	-65.7	-38.6	174.5	0	0	0	0	0	112.1	A264 F265 L271 R272	A264-A268 WeakPolarHBondContact O-CB 3.38Å; A264-A268 PolarHBondContact O-N 2.8Å; F265-A268 PolarHBondContact O-N 2.84Å; A268-L271 PolarHBondContact O-N 3.17Å; A268-R272 WeakPolarHBondContact O-CB 3.36Å; A268-R272 PolarHBondContact O-N 3.05Å
269	V	84.2	Confident	74.6	Confident	51 Å²	51	122.3 Å²	122.3	31%	0.309	59%	0.586	S	S	.	*	H	α-helix	trans	-67.7	-38.9	172.9	170.5	0	0	0	0	111	F265 V266 R272 R273	F265-V269 HydrophobicContact CD1-CG2 4.22Å; F265-V269 HydrophobicContact CE1-CG2 3.87Å; F265-V269 HydrophobicContact CE2-CG2 4.43Å; F265-V269 HydrophobicContact CZ-CG2 3.99Å; F265-V269 WeakPolarHBondContact O-CB 3.03Å; F265-V269 VanDerWaalsContact O-CG2 3.3Å; F265-V269 WeakPolarHBondContact O-CG2 3.29Å; F265-V269 PolarHBondContact O-N 3.17Å; V266-V269 PolarHBondContact O-N 3.29Å; V269-R272 PolarHBondContact O-N 2.84Å; V269-R273 HydrophobicContact CG1-CG 4.5Å; V269-R273 VanDerWaalsContact O-CB 3.32Å; V269-R273 WeakPolarHBondContact O-CB 3.44Å; V269-R273 WeakPolarHBondContact O-CG 3.3Å; V269-R273 PolarHBondContact O-N 3.49Å
270	M	80.3	Confident	71.9	Confident	98 Å²	98	118.5 Å²	118.5	48%	0.483	58%	0.584	S	S	.	*	H	α-helix	trans	-65	-42.5	174	-75.4	-99.3	-86.8	0	0	111.3	V266 F267 R273 R274	V266-M270 HydrophobicContact CG1-CG 4.34Å; V266-M270 VanDerWaalsContact O-CB 3.32Å; V266-M270 WeakPolarHBondContact O-CB 3.11Å; V266-M270 WeakPolarHBondContact O-CG 3.05Å; V266-M270 PolarHBondContact O-N 3.28Å; F267-M270 WeakPolarHBondContact O-CB 3.33Å; F267-M270 PolarHBondContact O-N 3.16Å; M270-R273 PolarHBondContact O-N 2.75Å; M270-R274 WeakPolarHBondContact O-CB 3.47Å; M270-R274 VanDerWaalsContact O-CG 3.29Å; M270-R274 WeakPolarHBondContact O-CG 3.41Å; M270-R274 PolarHBondContact O-N 3.29Å
271	L	74.9	Confident	69	Low	77 Å²	77	123.2 Å²	123.2	40%	0.403	60%	0.601	S	S	.	*	H	α-helix	trans	-65.7	-41.1	173.5	-73.7	174.7	0	0	0	111	F267 A268 R274 T275	F267-L271 HydrophobicContact CD1-CD1 3.53Å; F267-L271 HydrophobicContact CD1-CG 4.11Å; F267-L271 HydrophobicContact CE1-CD1 3.36Å; F267-L271 HydrophobicContact CE1-CD2 4.4Å; F267-L271 HydrophobicContact CE1-CG 3.97Å; F267-L271 HydrophobicContact CG-CD1 4.43Å; F267-L271 HydrophobicContact CZ-CD1 4.13Å; F267-L271 HydrophobicContact CZ-CD2 4.38Å; F267-L271 HydrophobicContact CZ-CG 4.32Å; F267-L271 WeakPolarHBondContact O-CB 3.41Å; F267-L271 VanDerWaalsContact O-CG 3.23Å; F267-L271 WeakPolarHBondContact O-CG 3.44Å; F267-L271 PolarHBondContact O-N 3.44Å; A268-L271 PolarHBondContact O-N 3.17Å; L271-R274 CarbonylContact O-C 3.59Å; L271-R274 PolarHBondContact O-N 3.13Å; L271-R274 VanDerWaalsContact O-N 3.17Å; L271-T275 WeakPolarHBondContact O-CB 3.4Å; L271-T275 WeakPolarHBondContact O-CG2 3.34Å; L271-T275 PolarHBondContact O-N 3.49Å; L271-T275 PolarHBondContact O-OG1 3.3Å
272	R	74.8	Confident	66	Low	187 Å²	187	122.9 Å²	122.9	71%	0.706	61%	0.606	S	S	*	*	H	α-helix	trans	-66.5	-37.8	175	-168.4	174.8	-178.8	175.5	0.8	112.1	A268 V269 R274 T275 C276	A268-R272 WeakPolarHBondContact O-CB 3.36Å; A268-R272 PolarHBondContact O-N 3.05Å; V269-R272 PolarHBondContact O-N 2.84Å; R272-R274 VanDerWaalsContact C-N 3.33Å; R272-T275 WeakPolarHBondContact CA-OG1 3.29Å; R272-T275 PolarHBondContact O-N 2.91Å; R272-T275 PolarHBondContact O-OG1 2.89Å; R272-C276 VanDerWaalsContact O-CB 3.27Å; R272-C276 WeakPolarHBondContact O-CB 3.42Å; R272-C276 PolarHBondContact O-N 2.71Å
273	R	67.7	Low	63.2	Low	182 Å²	182	131.8 Å²	131.8	69%	0.687	63%	0.63	S	S	*	*	H	α-helix	trans	-66.9	-35.4	171.2	-79.3	-178.5	174.4	-173.1	-0.6	111.4	V269 M270 R277	V269-R273 HydrophobicContact CG1-CG 4.5Å; V269-R273 VanDerWaalsContact O-CB 3.32Å; V269-R273 WeakPolarHBondContact O-CB 3.44Å; V269-R273 WeakPolarHBondContact O-CG 3.3Å; V269-R273 PolarHBondContact O-N 3.49Å; M270-R273 PolarHBondContact O-N 2.75Å; R273-R277 WeakPolarHBondContact O-CG 3.2Å; R273-R277 PolarHBondContact O-N 2.92Å; R273-R277 VanDerWaalsContact O-N 3.16Å
274	R	56.2	Low	60	Low	178 Å²	178	132.9 Å²	132.9	67%	0.672	64%	0.638	S	S	*	*	H	α-helix	trans	-74.2	-34.9	175.3	-77.7	179.3	177.9	-172.5	-0.3	112.6	M270 L271 R272 R278	M270-R274 WeakPolarHBondContact O-CB 3.47Å; M270-R274 VanDerWaalsContact O-CG 3.29Å; M270-R274 WeakPolarHBondContact O-CG 3.41Å; M270-R274 PolarHBondContact O-N 3.29Å; L271-R274 CarbonylContact O-C 3.59Å; L271-R274 PolarHBondContact O-N 3.13Å; L271-R274 VanDerWaalsContact O-N 3.17Å; R272-R274 VanDerWaalsContact C-N 3.33Å; R274-R278 PolarHBondContact O-N 2.73Å
275	T	54.2	Low	57.1	Low	82 Å²	82	135.3 Å²	135.3	50%	0.503	66%	0.658	S	S	.	*	H	α-helix	trans	-79.2	-36	176.4	51.5	0	0	0	0	112	L271 R272 R277 R278 C279	L271-T275 WeakPolarHBondContact O-CB 3.4Å; L271-T275 WeakPolarHBondContact O-CG2 3.34Å; L271-T275 PolarHBondContact O-N 3.49Å; L271-T275 PolarHBondContact O-OG1 3.3Å; R272-T275 WeakPolarHBondContact CA-OG1 3.29Å; R272-T275 PolarHBondContact O-N 2.91Å; R272-T275 PolarHBondContact O-OG1 2.89Å; T275-R277 VanDerWaalsContact C-N 3.34Å; T275-R277 PolarHBondContact O-N 2.83Å; T275-R278 PolarHBondContact O-N 2.01Å; T275-C279 PolarHBondContact O-N 2.86Å; T275-C279 PolarHBondContact O-SG 2.83Å
276	C	51.6	Low	54	Low	84 Å²	84	132.6 Å²	132.6	57%	0.568	66%	0.663	S	S	*	*	H	α-helix	trans	-68.9	-26.9	171.1	-76.9	0	0	0	0	113.6	R272 R278	R272-C276 VanDerWaalsContact O-CB 3.27Å; R272-C276 WeakPolarHBondContact O-CB 3.42Å; R272-C276 PolarHBondContact O-N 2.71Å; C276-R278 PolarHBondContact O-N 2.91Å
277	R	45	Very low	51.3	Low	227 Å²	227	133.9 Å²	133.9	86%	0.857	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-15.9	168.8	-81	-173.6	179.6	-173.1	0.2	113.4	R273 T275	R273-R277 WeakPolarHBondContact O-CG 3.2Å; R273-R277 PolarHBondContact O-N 2.92Å; R273-R277 VanDerWaalsContact O-N 3.16Å; T275-R277 VanDerWaalsContact C-N 3.34Å; T275-R277 PolarHBondContact O-N 2.83Å
278	R	41.2	Very low	48.7	Very low	218 Å²	218	136 Å²	136	82%	0.823	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-14.5	176.4	-126.2	170.3	-173.1	167.4	0.8	113.6	R274 T275 C276	R274-R278 PolarHBondContact O-N 2.73Å; T275-R278 PolarHBondContact O-N 2.01Å; C276-R278 PolarHBondContact O-N 2.91Å
279	C	39.3	Very low	45.7	Very low	106 Å²	106	140 Å²	140	72%	0.716	71%	0.713	S	S	*	*	S	Bend	trans	-95.9	17.8	177.7	-63.2	0	0	0	0	114.8	T275	T275-C279 PolarHBondContact O-N 2.86Å; T275-C279 PolarHBondContact O-SG 2.83Å
280	A	34.9	Very low	43	Very low	83 Å²	83	142.8 Å²	142.8	69%	0.686	73%	0.732	S	S	*	*	S	Bend	trans	-101.5	12	175.8	0	0	0	0	0	113.9
281	K	30.6	Very low	40.3	Very low	189 Å²	189	143.1 Å²	143.1	82%	0.822	74%	0.744	S	S	*	*	S	Bend	trans	-142.6	53.9	177.5	-80.3	-166.7	174	-177.8	0	112.4
282	D	27.4	Very low	38.4	Very low	149 Å²	149	145.3 Å²	145.3	80%	0.797	76%	0.763	S	S	*	*			trans	-131	91.2	153.3	-69.3	-45	0	0	0	106
283	Y	32.3	Very low	36.3	Very low	240 Å²	240	141.7 Å²	141.7	94%	0.941	76%	0.764	S	S	*	*			trans	-114.2	102.7	164.3	-125.3	-87.1	0	0	0	106.7
284	E	25.9	Very low	34.4	Very low	181 Å²	181	141.5 Å²	141.5	85%	0.846	77%	0.773	S	S	*	*			trans	-51.9	142.7	163.7	-84.8	167.6	133.5	0	0	111.6
285	A	29.2	Very low	33.2	Very low	107 Å²	107	141.2 Å²	141.2	88%	0.884	78%	0.779	S	S	*	*			trans	-156.2	82.9	144.8	0	0	0	0	0	109.3
286	A	24.2	Very low	31.7	Very low	91 Å²	91	141.7 Å²	141.7	75%	0.752	79%	0.785	S	S	*	*			trans	-142.2	112.9	153.3	0	0	0	0	0	106.5
287	P	31.3	Very low	30.3	Very low	114 Å²	114	143.1 Å²	143.1	74%	0.74	80%	0.795	S	S	*	*				-144	139.5	101.4	35.1	-19.9	0	0	0	112.2
288	N	32.2	Very low	29.4	Very low	161 Å²	161	138.7 Å²	138.7	86%	0.861	79%	0.793	S	S	*	*			trans	-169	91.2	146.6	-92.3	-22.1	0	0	0	109
289	C	22.1	Very low	29.1	Very low	136 Å²	136	133.8 Å²	133.8	92%	0.919	79%	0.789	S	S	*	*			trans	-122.9	121.4	151.9	-85.7	0	0	0	0	107.5
290	P	26.6	Very low	28.7	Very low	108 Å²	108	134.6 Å²	134.6	70%	0.701	79%	0.793	S	S	*	*			trans	-129.6	130.7	135.7	31.6	-18.1	0	0	0	111.3
291	S	25.3	Very low	28.6	Very low	106 Å²	106	136.1 Å²	136.1	74%	0.741	80%	0.796	S	S	*	*			trans	34.5	147.7	134.6	64.1	0	0	0	0	120.5
292	P	34	Very low	28.4	Very low	122 Å²	122	135.1 Å²	135.1	79%	0.792	79%	0.794	S	S	*	*			cis	-147.2	178	48.4	36.1	-12.3	0	0	0	116.8
293	P	31.1	Very low	28.5	Very low	112 Å²	112	136 Å²	136	73%	0.727	80%	0.797	S	S	*	*			trans	-103.4	159	-165.2	38.4	-29	0	0	0	112.3
294	M	28.6	Very low	28	Very low	178 Å²	178	131.3 Å²	131.3	88%	0.877	79%	0.787	S	S	*	*			trans	-154.2	122.3	148.7	-81.4	-150.1	157	0	0	111.8
295	H	28.9	Very low	28.1	Very low	172 Å²	172	127.1 Å²	127.1	80%	0.796	78%	0.778	S	S	*	*			trans	41.6	114.3	137.3	-79	-77.6	0	0	0	119.6
296	S	23.7	Very low	28.1	Very low	91 Å²	91	131 Å²	131	64%	0.636	78%	0.775	S	S	*	*				82.5	102	76.4	-178.6	0	0	0	0	113.4
297	C	22.3	Very low	28.1	Very low	115 Å²	115	135 Å²	135	78%	0.777	78%	0.782	S	S	*	*				50.8	124.1	125.5	-66.6	0	0	0	0	121.4
298	V	26.7	Very low	28	Very low	134 Å²	134	134.1 Å²	134.1	81%	0.812	78%	0.779	S	S	*	*			trans	108.3	122.9	137.7	179.7	0	0	0	0	116.7
299	P	33.4	Very low	27.7	Very low	115 Å²	115	132.6 Å²	132.6	75%	0.747	77%	0.771	S	S	*	*			trans	-97.6	162.8	178.9	38.6	-32.9	0	0	0	113.4
300	P	32.9	Very low	28.2	Very low	122 Å²	122	134.7 Å²	134.7	79%	0.792	77%	0.767	S	S	*	*			trans	-103.9	168.3	164.8	29.9	-13.8	0	0	0	113
301	P	31	Very low	28	Very low	116 Å²	116	141 Å²	141	75%	0.753	78%	0.776	S	S	*	*			trans	-111.4	167	-135.5	40.6	-35.5	0	0	0	116.6
302	E	26.2	Very low	28.5	Very low	167 Å²	167	141.3 Å²	141.3	78%	0.78	78%	0.776	S	S	*	*			trans	11.2	122.4	145.2	-59.5	-177.5	168.1	0	0	119.9
303	I	30.2	Very low	28.2	Very low	168 Å²	168	140.5 Å²	140.5	86%	0.862	77%	0.771	S	S	*	*				-136.8	105	129.9	-61.5	-175.7	0	0	0	108.6
304	I	23.1	Very low	27.7	Very low	142 Å²	142	140.7 Å²	140.7	73%	0.728	77%	0.773	S	S	*	*			trans	-80	136	158	-69	167.3	0	0	0	107
305	S	28.1	Very low	27.6	Very low	93 Å²	93	138.5 Å²	138.5	65%	0.65	77%	0.77	S	S	*	*				168.6	147	120	62.2	0	0	0	0	114.6
306	K	29	Very low	27.5	Very low	189 Å²	189	139.8 Å²	139.8	82%	0.822	77%	0.774	S	S	*	*			trans	92.5	87	155.4	-57.2	-172.4	-177.4	176.4	0	118.4
307	L	23.8	Very low	27.6	Very low	173 Å²	173	142.7 Å²	142.7	91%	0.906	78%	0.783	S	S	*	*				19.9	121.5	107.7	-113.7	80.3	0	0	0	116.3
308	S	27.8	Very low	28	Very low	96 Å²	96	142.4 Å²	142.4	67%	0.671	78%	0.779	S	S	*	*				152.3	117.3	118.4	175.6	0	0	0	0	110.8
309	N	26.7	Very low	28.1	Very low	130 Å²	130	141.8 Å²	141.8	70%	0.695	78%	0.778	S	S	*	*			trans	30.6	113.1	141.9	-58.1	-20.1	0	0	0	117.3
310	H	33.1	Very low	27.9	Very low	180 Å²	180	142.4 Å²	142.4	83%	0.833	78%	0.782	S	S	*	*				179.4	124.2	104.1	-89.3	-66.1	0	0	0	110	P312	H310-P312 WeakPolarHBondContact O-CD 3.47Å
311	R	21.2	Very low	27.5	Very low	239 Å²	239	142.6 Å²	142.6	90%	0.902	78%	0.781	S	S	*	*			trans	-60.3	136.1	164.1	-153.9	-173.8	-130.1	-159.2	2.4	109.1
312	P	36.2	Very low	27.3	Very low	113 Å²	113	144.3 Å²	144.3	73%	0.734	78%	0.783	S	S	*	*				-129.1	163.3	126.7	32.6	-19.7	0	0	0	111.5	H310	H310-P312 WeakPolarHBondContact O-CD 3.47Å
313	P	28	Very low	27.2	Very low	106 Å²	106	143 Å²	143	69%	0.688	78%	0.782	S	S	*	*			trans	-92.5	147.1	-156.5	36	-33.1	0	0	0	113.6
314	C	21.2	Very low	27.1	Very low	115 Å²	115	140 Å²	140	78%	0.777	78%	0.775	S	S	*	*			trans	14.1	104.8	141.9	-48.6	0	0	0	0	117.4
315	T	27.1	Very low	27.2	Very low	133 Å²	133	141.7 Å²	141.7	82%	0.816	78%	0.78	S	S	*	*			trans	-121.8	119.7	140.2	42.8	0	0	0	0	107.4	D317	T315-D317 PolarHBondContact O-N 2.87Å
316	F	25.8	Very low	27.1	Very low	198 Å²	198	149 Å²	149	87%	0.868	79%	0.794	S	S	*	*			trans	-63.3	113	175.1	-81.9	-102.8	0	0	0	109.4
317	D	26.1	Very low	27.2	Very low	153 Å²	153	145.4 Å²	145.4	82%	0.818	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-87.5	125.8	153.5	-80.7	-34.8	0	0	0	107.9	T315	T315-D317 PolarHBondContact O-N 2.87Å
318	P	29.8	Very low	27.2	Very low	108 Å²	108	148.9 Å²	148.9	70%	0.701	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-71.8	145.4	-177.8	29.7	-32.4	0	0	0	110.3
319	P	29.6	Very low	27.2	Very low	122 Å²	122	154 Å²	154	79%	0.792	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-68.9	146.9	176.1	29.1	-31.4	0	0	0	110.2
320	P	29.4	Very low	27.1	Very low	127 Å²	127	151.2 Å²	151.2	83%	0.825	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-76.2	141	-161.6	29.8	-35.3	0	0	0	113
321	T	25.3	Very low	26.7	Very low	127 Å²	127	150.2 Å²	150.2	78%	0.779	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-80.1	122.1	157.6	47.7	0	0	0	0	108.7
322	L	26	Very low	26.8	Very low	151 Å²	151	145.4 Å²	145.4	79%	0.791	80%	0.796	S	S	*	*			trans	174	120.1	137.7	-109.1	116.1	0	0	0	110.8
323	N	24.5	Very low	26.2	Very low	141 Å²	141	145.4 Å²	145.4	75%	0.754	79%	0.794	S	S	*	*			trans	36.1	137.2	132.3	-64.5	-13.3	0	0	0	122.2
324	S	26.9	Very low	25.9	Very low	104 Å²	104	151 Å²	151	73%	0.727	80%	0.801	S	S	*	*			trans	100.1	118.1	136.5	79.2	0	0	0	0	118.4
325	E	25.6	Very low	26.2	Very low	178 Å²	178	150.2 Å²	150.2	83%	0.832	80%	0.797	S	S	*	*			trans	60	94.1	134.8	-63.6	-175.3	168.1	0	0	118.8
326	R	25.7	Very low	26.1	Very low	247 Å²	247	152.2 Å²	152.2	93%	0.932	80%	0.797	S	S	*	*				164	113.9	115.4	-91.9	168.6	175.2	-167.9	-0.3	109.9
327	S	32.4	Very low	25.9	Very low	113 Å²	113	152 Å²	152	79%	0.79	80%	0.796	S	S	*	*				179	97.1	116.7	-170.1	0	0	0	0	109.6	K329	S327-K329 PolarHBondContact O-N 3.09Å
328	R	23.9	Very low	26	Very low	245 Å²	245	148.9 Å²	148.9	93%	0.925	79%	0.786	S	S	*	*			trans	-61.8	113.7	153.8	-71.2	-179.5	-174.3	-169.1	1.3	107.2
329	K	26.2	Very low	25.7	Very low	204 Å²	204	150.3 Å²	150.3	89%	0.887	79%	0.788	S	S	*	*			trans	165.2	105.1	143.5	-93.7	165.5	-177.1	-174	0	109	S327	S327-K329 PolarHBondContact O-N 3.09Å
330	G	25.9	Very low	25.6	Very low	71 Å²	71	148 Å²	148	73%	0.732	78%	0.775	S	S	*	*			trans	147.4	36.2	172.2	0	0	0	0	0	114.1	I332	G330-I332 PolarHBondContact O-N 2.88Å
331	L	23.4	Very low	25.5	Very low	160 Å²	160	146.8 Å²	146.8	84%	0.838	77%	0.769	S	S	*	*			trans	-74.4	83	172.4	-153.3	94.8	0	0	0	108.1	T333	L331-T333 HydrophobicContact CD2-CG2 3.95Å; L331-T333 HydrophobicContact CG-CG2 4.06Å
332	I	24.4	Very low	25.3	Very low	137 Å²	137	144.7 Å²	144.7	70%	0.703	77%	0.765	S	S	*	*			trans	-94.6	87.1	158.5	-56.7	179	0	0	0	105	G330 W334	G330-I332 PolarHBondContact O-N 2.88Å; I332-W334 VanDerWaalsContact C-N 3.35Å; I332-W334 PolarHBondContact O-N 2.77Å
333	T	23.5	Very low	25.3	Very low	114 Å²	114	141.7 Å²	141.7	70%	0.699	75%	0.753	S	S	*	*			trans	-66.1	95.6	167.8	33.9	0	0	0	0	108.4	L331 S335	L331-T333 HydrophobicContact CD2-CG2 3.95Å; L331-T333 HydrophobicContact CG-CG2 4.06Å; T333-S335 VanDerWaalsContact C-N 3.34Å; T333-S335 PolarHBondContact O-N 2.89Å
334	W	21.2	Very low	25.1	Very low	223 Å²	223	145.6 Å²	145.6	85%	0.845	76%	0.758	S	S	*	*			trans	-74.4	95.9	155.3	-74.3	91.2	0	0	0	106.8	I332 Q336	I332-W334 VanDerWaalsContact C-N 3.35Å; I332-W334 PolarHBondContact O-N 2.77Å; W334-Q336 PolarHBondContact O-N 2.85Å
335	S	27	Very low	25	Very low	98 Å²	98	147.6 Å²	147.6	69%	0.685	75%	0.751	S	S	*	*			trans	-58.5	110.1	165.3	67.1	0	0	0	0	107.2	T333 K337	T333-S335 VanDerWaalsContact C-N 3.34Å; T333-S335 PolarHBondContact O-N 2.89Å; S335-K337 PolarHBondContact O-N 2.82Å
336	Q	26.1	Very low	24.9	Very low	175 Å²	175	144.5 Å²	144.5	82%	0.818	75%	0.746	S	S	*	*			trans	-61.8	103	172.1	-72	178.3	-12.2	0	0	107.8	W334 S338	W334-Q336 PolarHBondContact O-N 2.85Å; Q336-S338 PolarHBondContact O-N 2.88Å
337	K	22.1	Very low	24.8	Very low	193 Å²	193	141.1 Å²	141.1	84%	0.839	75%	0.747	S	S	*	*			trans	-68.1	78.9	156.1	-75.5	-179.3	176.7	179.1	0	106.9	S335 D339	S335-K337 PolarHBondContact O-N 2.82Å; K337-D339 PolarHBondContact O-N 2.91Å
338	S	26.6	Very low	24.4	Very low	88 Å²	88	140.8 Å²	140.8	62%	0.615	75%	0.745	S	S	*	*			trans	-74	114.7	154.8	43.8	0	0	0	0	106.3	Q336 S340	Q336-S338 PolarHBondContact O-N 2.88Å; S338-S340 PolarHBondContact O-N 2.97Å
339	D	23.7	Very low	24.6	Very low	138 Å²	138	134.5 Å²	134.5	74%	0.738	74%	0.738	S	S	*	*			trans	-61.3	78.9	171.8	-76.7	-37.1	0	0	0	110.2	K337	K337-D339 PolarHBondContact O-N 2.91Å
340	S	27.2	Very low	25	Very low	75 Å²	75	134.3 Å²	134.3	52%	0.524	74%	0.74	S	S	.	*			trans	-108.3	84	159.2	-75	0	0	0	0	107.5	S338 A342	S338-S340 PolarHBondContact O-N 2.97Å; S340-A342 PolarHBondContact O-N 2.86Å
341	S	27	Very low	25.2	Very low	100 Å²	100	137.6 Å²	137.6	70%	0.699	74%	0.741	S	S	*	*			trans	41.5	45.1	149.9	38.3	0	0	0	0	115.8	V343	S341-V343 PolarHBondContact O-N 2.94Å
342	A	22.8	Very low	25.4	Very low	84 Å²	84	136.5 Å²	136.5	69%	0.694	74%	0.736	S	S	*	*			trans	-81.9	76.5	165.5	0	0	0	0	0	107.9	S340 Y344	S340-A342 PolarHBondContact O-N 2.86Å; A342-Y344 PolarHBondContact O-N 2.91Å; A342-Y344 VanDerWaalsContact O-N 3.08Å
343	V	24.4	Very low	25.4	Very low	87 Å²	87	138.5 Å²	138.5	53%	0.527	75%	0.748	S	S	.	*			trans	-61	109.8	162.9	177.7	0	0	0	0	106.3	S341 Y345	S341-V343 PolarHBondContact O-N 2.94Å; V343-Y345 HydrophobicContact CB-CE2 4.39Å; V343-Y345 HydrophobicContact CG1-CE1 4.34Å; V343-Y345 HydrophobicContact CG1-CE2 4.47Å; V343-Y345 WeakPolarHBondContact O-CD2 3.3Å; V343-Y345 PolarHBondContact O-N 3.29Å
344	Y	21.3	Very low	25.6	Very low	223 Å²	223	140.9 Å²	140.9	88%	0.875	75%	0.746	S	S	*	*			trans	-61.4	106.8	170.6	-94.4	-95.7	0	0	0	108.3	A342 P346	A342-Y344 PolarHBondContact O-N 2.91Å; A342-Y344 VanDerWaalsContact O-N 3.08Å; Y344-P346 WeakPolarHBondContact O-CD 3.21Å
345	Y	25.1	Very low	25.8	Very low	147 Å²	147	134.3 Å²	134.3	58%	0.576	74%	0.739	S	S	*	*			trans	-81.2	121.1	166.4	-66.4	-77.8	0	0	0	108.2	V343 N347	V343-Y345 HydrophobicContact CB-CE2 4.39Å; V343-Y345 HydrophobicContact CG1-CE1 4.34Å; V343-Y345 HydrophobicContact CG1-CE2 4.47Å; V343-Y345 WeakPolarHBondContact O-CD2 3.3Å; V343-Y345 PolarHBondContact O-N 3.29Å; Y345-N347 PolarHBondContact O-N 3.32Å
346	P	23.1	Very low	25.8	Very low	113 Å²	113	136 Å²	136	73%	0.734	75%	0.745	S	S	*	*			trans	-65.9	124.9	173.1	9.6	-4.5	0	0	0	109.3	Y344 S348	Y344-P346 WeakPolarHBondContact O-CD 3.21Å; P346-S348 PolarHBondContact O-N 3.03Å
347	N	23.5	Very low	25.8	Very low	176 Å²	176	133.5 Å²	133.5	94%	0.941	74%	0.742	S	S	*	*			trans	-49.9	107	172.4	-86.7	-10.3	0	0	0	109.7	Y345	Y345-N347 PolarHBondContact O-N 3.32Å
348	S	24.6	Very low	26	Very low	106 Å²	106	129.7 Å²	129.7	74%	0.741	73%	0.73	S	S	*	*			trans	-123.7	128	163.4	51.5	0	0	0	0	107.6	P346	P346-S348 PolarHBondContact O-N 3.03Å
349	S	28.6	Very low	26	Very low	113 Å²	113	133.6 Å²	133.6	79%	0.79	75%	0.745	S	S	*	*			trans	94.7	125.1	-177.7	76.7	0	0	0	0	116.9	D351	S349-D351 VanDerWaalsContact C-N 3.25Å; S349-D351 PolarHBondContact O-N 3.02Å
350	E	34.3	Very low	26.1	Very low	199 Å²	199	131.2 Å²	131.2	93%	0.93	74%	0.738	S	S	*	*	S	Bend	trans	-76.7	7.3	-172.6	-71.2	-176.7	136.4	0	0	114.8
351	D	28.7	Very low	26.1	Very low	140 Å²	140	137.9 Å²	137.9	75%	0.749	75%	0.752	S	S	*	*			trans	-116.8	78	-177.2	-72.7	-34.7	0	0	0	110.8	S349	S349-D351 VanDerWaalsContact C-N 3.25Å; S349-D351 PolarHBondContact O-N 3.02Å
352	N	29.3	Very low	26.1	Very low	137 Å²	137	138.9 Å²	138.9	73%	0.733	75%	0.748	S	S	*	*			trans	-170	85.3	149.5	-90.9	-41.4	0	0	0	110.4	Y354	N352-Y354 PolarHBondContact O-N 3.21Å
353	N	24.4	Very low	26.1	Very low	180 Å²	180	144.5 Å²	144.5	96%	0.963	76%	0.76	S	S	*	*			trans	-72.8	69.9	163	-150	11.7	0	0	0	108.3
354	Y	26.5	Very low	26.3	Very low	163 Å²	163	148.5 Å²	148.5	64%	0.639	77%	0.767	S	S	*	*			trans	-99.5	127.8	172.7	-109.6	-83	0	0	0	109.5	N352 T356	N352-Y354 PolarHBondContact O-N 3.21Å; Y354-T356 PolarHBondContact O-N 3Å; Y354-T356 VanDerWaalsContact O-N 3.14Å
355	A	26.2	Very low	26.3	Very low	85 Å²	85	147 Å²	147	70%	0.702	77%	0.768	S	S	*	*			trans	-41.7	117.4	-179	0	0	0	0	0	111.4	V357	A355-V357 VanDerWaalsContact C-N 3.32Å; A355-V357 PolarHBondContact O-N 2.85Å
356	T	26.4	Very low	26.7	Very low	133 Å²	133	147.1 Å²	147.1	82%	0.816	77%	0.769	S	S	*	*			trans	-52.3	105.2	153.1	46.3	0	0	0	0	105.9	Y354 D358	Y354-T356 PolarHBondContact O-N 3Å; Y354-T356 VanDerWaalsContact O-N 3.14Å; T356-D358 VanDerWaalsContact C-N 3.35Å; T356-D358 PolarHBondContact O-N 3.04Å
357	V	26.1	Very low	26.8	Very low	123 Å²	123	146.7 Å²	146.7	75%	0.745	77%	0.768	S	S	*	*			trans	-61.2	108.7	167.9	179	0	0	0	0	104.6	A355 D359	A355-V357 VanDerWaalsContact C-N 3.32Å; A355-V357 PolarHBondContact O-N 2.85Å; V357-D359 PolarHBondContact O-N 3.47Å
358	D	25.4	Very low	27	Very low	113 Å²	113	142.1 Å²	142.1	60%	0.604	76%	0.755	S	S	*	*			trans	-59.9	115.4	-177.9	-168.4	-18.8	0	0	0	108.9	T356 S360 R361	T356-D358 VanDerWaalsContact C-N 3.35Å; T356-D358 PolarHBondContact O-N 3.04Å; D358-S360 PolarHBondContact O-N 2.91Å; D358-S360 WeakPolarHBondContact OD1-CB 3.32Å; D358-S360 PolarHBondContact OD1-N 3.27Å; D358-S360 PolarHBondContact OD1-OG 2.98Å; D358-S360 PolarHBondContact OD2-OG 3.04Å; D358-R361 PolarHBondContact O-N 3.24Å
359	D	28.3	Very low	27	Very low	171 Å²	171	144.7 Å²	144.7	91%	0.914	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-1.9	-176.1	-157.1	20.9	0	0	0	113.3	V357	V357-D359 PolarHBondContact O-N 3.47Å
360	S	25.6	Very low	27.1	Very low	87 Å²	87	144.9 Å²	144.9	61%	0.608	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-10.5	-175.5	65.3	0	0	0	0	115.7	D358	D358-S360 PolarHBondContact O-N 2.91Å; D358-S360 WeakPolarHBondContact OD1-CB 3.32Å; D358-S360 PolarHBondContact OD1-N 3.27Å; D358-S360 PolarHBondContact OD1-OG 2.98Å; D358-S360 PolarHBondContact OD2-OG 3.04Å
361	R	25.8	Very low	26.9	Very low	215 Å²	215	140.3 Å²	140.3	81%	0.811	73%	0.729	S	S	*	*	S	Bend	trans	-132.1	95.4	174.8	-77.6	177	81.6	123	-2.5	109.9	D358	D358-R361 PolarHBondContact O-N 3.24Å
362	I	27	Very low	27.1	Very low	121 Å²	121	135.1 Å²	135.1	62%	0.621	70%	0.704	S	S	*	*			trans	-174.8	75.2	142.4	-83.7	142	0	0	0	106.7	Y364	I362-Y364 HydrophobicContact CB-CD2 4.05Å; I362-Y364 HydrophobicContact CB-CE2 4.46Å; I362-Y364 HydrophobicContact CD1-CE2 4.38Å; I362-Y364 HydrophobicContact CG1-CD2 3.56Å; I362-Y364 HydrophobicContact CG1-CE2 3.51Å; I362-Y364 HydrophobicContact CG2-CD2 3.42Å; I362-Y364 VanDerWaalsContact CG2-CD2 3.42Å; I362-Y364 HydrophobicContact CG2-CE2 4.26Å; I362-Y364 HydrophobicContact CG2-CG 4.1Å; I362-Y364 PolarHBondContact O-N 2.8Å
363	E	23.5	Very low	27.3	Very low	202 Å²	202	131.5 Å²	131.5	94%	0.944	68%	0.684	S	S	*	*			trans	-80.5	71.9	143.4	-77.5	-179.3	169.2	0	0	105.8	E365	E363-E365 PolarHBondContact O-N 3.31Å
364	Y	27.5	Very low	27.7	Very low	171 Å²	171	128.4 Å²	128.4	67%	0.671	67%	0.672	S	S	*	*			trans	-81.8	99.4	158.1	-77.5	-61	0	0	0	105.3	I362 Y366	I362-Y364 HydrophobicContact CB-CD2 4.05Å; I362-Y364 HydrophobicContact CB-CE2 4.46Å; I362-Y364 HydrophobicContact CD1-CE2 4.38Å; I362-Y364 HydrophobicContact CG1-CD2 3.56Å; I362-Y364 HydrophobicContact CG1-CE2 3.51Å; I362-Y364 HydrophobicContact CG2-CD2 3.42Å; I362-Y364 VanDerWaalsContact CG2-CD2 3.42Å; I362-Y364 HydrophobicContact CG2-CE2 4.26Å; I362-Y364 HydrophobicContact CG2-CG 4.1Å; I362-Y364 PolarHBondContact O-N 2.8Å; Y364-Y366 PolarHBondContact O-N 2.99Å
365	E	22.6	Very low	28.1	Very low	191 Å²	191	122.3 Å²	122.3	89%	0.893	65%	0.653	S	S	*	*			trans	-57.3	81.4	151.4	-99.3	179.4	156.7	0	0	107	E363 S367	E363-E365 PolarHBondContact O-N 3.31Å; E365-S367 VanDerWaalsContact C-N 3.3Å; E365-S367 PolarHBondContact O-N 3.47Å
366	Y	32.2	Very low	28.3	Very low	151 Å²	151	123.5 Å²	123.5	59%	0.592	66%	0.663	S	S	*	*			trans	-68.1	99.9	163.2	-109.9	-85.5	0	0	0	105.7	Y364 A368 L792	Y364-Y366 PolarHBondContact O-N 2.99Å; Y366-A368 VanDerWaalsContact C-N 3.31Å; Y366-A368 PolarHBondContact O-N 3.29Å; Y366-L792 PolarHBondContact OH-O 2.82Å
367	S	25.4	Very low	29.1	Very low	103 Å²	103	121.1 Å²	121.1	72%	0.72	65%	0.645	S	S	*	*			trans	-47.9	106.6	150.9	-70.3	0	0	0	0	106.1	E365 D369	E365-S367 VanDerWaalsContact C-N 3.3Å; E365-S367 PolarHBondContact O-N 3.47Å; S367-D369 PolarHBondContact O-N 3.41Å
368	A	28.4	Very low	30.6	Very low	81 Å²	81	117.9 Å²	117.9	67%	0.669	63%	0.627	S	S	*	*			trans	-63.9	80.9	175.4	0	0	0	0	0	108.1	Y366 R370	Y366-A368 VanDerWaalsContact C-N 3.31Å; Y366-A368 PolarHBondContact O-N 3.29Å; A368-R370 PolarHBondContact O-N 2.96Å
369	D	24.2	Very low	32.1	Very low	160 Å²	160	114.4 Å²	114.4	86%	0.856	61%	0.611	S	S	*	*			trans	-76.2	31.8	175.6	-142.2	19.5	0	0	0	111	S367	S367-D369 PolarHBondContact O-N 3.41Å
370	R	31.3	Very low	33.3	Very low	116 Å²	116	112.2 Å²	112.2	44%	0.438	59%	0.59	S	S	.	*	S	Bend	trans	-125.9	99.8	177.5	-75.4	-175.4	154.3	172.1	-13	107.3	A368 S372 N391 R703	A368-R370 PolarHBondContact O-N 2.96Å; R370-S372 VanDerWaalsContact C-N 3.3Å; R370-S372 PolarHBondContact O-N 3.47Å; R370-N391 PolarHBondContact NH2-ND2 2.84Å; R370-R703 PolarHBondContact NH1-O 2.04Å
371	V	29	Very low	35.2	Very low	103 Å²	103	109.3 Å²	109.3	62%	0.624	57%	0.566	S	S	*	*			trans	-47.1	87.1	-179.4	174.9	0	0	0	0	110.9	L373	V371-L373 HydrophobicContact CG1-CD1 4.25Å; V371-L373 HydrophobicContact CG1-CD2 3.38Å; V371-L373 HydrophobicContact CG1-CG 3.45Å; V371-L373 VanDerWaalsContact CG1-CG 3.45Å
372	S	34.3	Very low	36.7	Very low	31 Å²	31	102.5 Å²	102.5	22%	0.217	55%	0.548	C	S	.	.			trans	-84.8	99.4	154.8	-63.5	0	0	0	0	105	R370 V374	R370-S372 VanDerWaalsContact C-N 3.3Å; R370-S372 PolarHBondContact O-N 3.47Å; S372-V374 PolarHBondContact O-N 3.37Å
373	L	32.7	Very low	38.3	Very low	61 Å²	61	97 Å²	97	32%	0.319	52%	0.52	S	S	.	.	B	Isolated β-bridge	trans	-69.2	119.4	179	-63.3	162.9	0	0	0	108.6	V371 Y381	V371-L373 HydrophobicContact CG1-CD1 4.25Å; V371-L373 HydrophobicContact CG1-CD2 3.38Å; V371-L373 HydrophobicContact CG1-CG 3.45Å; V371-L373 VanDerWaalsContact CG1-CG 3.45Å; L373-Y381 HydrophobicContact CB-CE1 4.28Å; L373-Y381 HydrophobicContact CB-CE2 4.03Å; L373-Y381 VanDerWaalsContact CB-CZ 3.43Å; L373-Y381 WeakPolarHBondContact CB-OH 3.28Å; L373-Y381 WeakPolarHBondContact CD1-OH 3.42Å; L373-Y381 WeakPolarHBondContact CG-OH 3.44Å; L373-Y381 WeakPolarHBondContact O-CE2 3.35Å
374	V	34	Very low	39.9	Very low	115 Å²	115	89.7 Å²	89.7	70%	0.697	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-89.4	127.6	179.7	-179.9	0	0	0	0	109	S372	S372-V374 PolarHBondContact O-N 3.37Å
375	S	33.7	Very low	41	Very low	36 Å²	36	83.3 Å²	83.3	25%	0.252	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-66.5	145.4	175.4	-156.1	0	0	0	0	112.9	N377 R380 Y381	S375-N377 VanDerWaalsContact C-N 3.33Å; S375-N377 WeakPolarHBondContact CB-O 3.4Å; S375-N377 PolarHBondContact OG-N 2.91Å; S375-N377 PolarHBondContact OG-O 2.94Å; S375-R380 PolarHBondContact OG-O 3.46Å; S375-Y381 VanDerWaalsContact CB-CD2 3.49Å
376	A	31.5	Very low	42.2	Very low	110 Å²	110	79 Å²	79	91%	0.909	47%	0.468	S	S	*	.	S	Bend	trans	-73.8	-23.8	159.6	0	0	0	0	0	112.6
377	N	43.1	Very low	43.2	Very low	83 Å²	83	73.7 Å²	73.7	44%	0.444	45%	0.453	S	S	.	.	S	Bend	trans	-102.8	117	176.9	-168.8	-11	0	0	0	110	S375 S379 R380	S375-N377 VanDerWaalsContact C-N 3.33Å; S375-N377 WeakPolarHBondContact CB-O 3.4Å; S375-N377 PolarHBondContact OG-N 2.91Å; S375-N377 PolarHBondContact OG-O 2.94Å; N377-S379 PolarHBondContact O-N 3.2Å; N377-R380 PolarHBondContact O-N 3.43Å; N377-R380 VanDerWaalsContact O-O 3.06Å
378	P	56.5	Low	44.4	Very low	55 Å²	55	72.5 Å²	72.5	36%	0.357	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.3	-172.7	24.9	-35.4	0	0	0	114	K399 H400	P378-K399 HydrophobicContact CB-CD 4.22Å; P378-H400 PolarHBondContact O-CE1 3.37Å; P378-H400 PolarHBondContact O-ND1 2.83Å
379	S	56.9	Low	45.7	Very low	39 Å²	39	71.4 Å²	71.4	27%	0.273	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-8.8	-170	-35.8	0	0	0	0	115.2	N377 S420 L421	N377-S379 PolarHBondContact O-N 3.2Å; S379-S420 VanDerWaalsContact O-CA 3.31Å; S379-S420 WeakPolarHBondContact O-CA 3.31Å; S379-L421 PolarHBondContact O-N 2.76Å
380	R	53	Low	47.4	Very low	125 Å²	125	67.7 Å²	67.7	47%	0.472	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	140.1	-175.8	-179.5	-179.5	-76.4	176.4	-1.8	110.6	S375 N377 D418	S375-R380 PolarHBondContact OG-O 3.46Å; N377-R380 PolarHBondContact O-N 3.43Å; N377-R380 VanDerWaalsContact O-O 3.06Å; R380-D418 WeakPolarHBondContact CD-OD2 3.33Å; R380-D418 WeakPolarHBondContact CG-OD1 3.14Å; R380-D418 WeakPolarHBondContact CG-OD2 3.49Å; R380-D418 IonicContact NE-OD2 3.57Å
381	Y	66.4	Low	48.8	Very low	26 Å²	26	63.9 Å²	63.9	10%	0.102	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	130.7	176.4	-170.8	-91.5	0	0	0	113.2	L373 S375 V383 I395 D418 L419	L373-Y381 HydrophobicContact CB-CE1 4.28Å; L373-Y381 HydrophobicContact CB-CE2 4.03Å; L373-Y381 VanDerWaalsContact CB-CZ 3.43Å; L373-Y381 WeakPolarHBondContact CB-OH 3.28Å; L373-Y381 WeakPolarHBondContact CD1-OH 3.42Å; L373-Y381 WeakPolarHBondContact CG-OH 3.44Å; L373-Y381 WeakPolarHBondContact O-CE2 3.35Å; S375-Y381 VanDerWaalsContact CB-CD2 3.49Å; Y381-V383 HydrophobicContact CD1-CG2 4.07Å; Y381-V383 HydrophobicContact CE1-CG2 3.61Å; Y381-I395 HydrophobicContact CD1-CB 4.04Å; Y381-I395 HydrophobicContact CD1-CD1 4.01Å; Y381-I395 HydrophobicContact CD1-CG1 3.74Å; Y381-I395 HydrophobicContact CD1-CG2 3.38Å; Y381-I395 HydrophobicContact CE1-CG1 4.12Å; Y381-I395 HydrophobicContact CE1-CG2 4.33Å; Y381-I395 HydrophobicContact CG-CG2 3.76Å; Y381-D418 CarbonylContact O-C 3.6Å; Y381-D418 WeakPolarHBondContact O-CA 3.32Å; Y381-L419 PolarHBondContact N-O 3.44Å; Y381-L419 PolarHBondContact O-N 2.74Å
382	T	57.5	Low	50.7	Low	73 Å²	73	59.3 Å²	59.3	45%	0.448	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.4	-178.1	-47.2	0	0	0	0	111	I417 D418	T382-I417 CarbonylContact C-O 3.58Å; T382-I417 WeakPolarHBondContact CA-O 3.5Å; T382-D418 PolarHBondContact OG1-OD1 3.48Å
383	V	60	Low	52.6	Low	4 Å²	4	58.6 Å²	58.6	2%	0.024	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129	174.5	177.1	0	0	0	0	109.7	Y381 I395 E416 I417	Y381-V383 HydrophobicContact CD1-CG2 4.07Å; Y381-V383 HydrophobicContact CE1-CG2 3.61Å; V383-I395 HydrophobicContact CG2-CD1 3.44Å; V383-I395 VanDerWaalsContact CG2-CD1 3.44Å; V383-I395 HydrophobicContact CG2-CG1 3.29Å; V383-E416 WeakPolarHBondContact O-CA 3.33Å; V383-E416 WeakPolarHBondContact O-CB 3.43Å; V383-I417 PolarHBondContact N-O 2.84Å; V383-I417 PolarHBondContact O-N 3.21Å
384	S	56.7	Low	54.8	Low	50 Å²	50	57 Å²	57	35%	0.35	36%	0.361	S	S	.	.			trans	-95.6	142.7	169.3	65.3	0	0	0	0	111.8	A386 S387	S384-A386 PolarHBondContact O-N 3.38Å; S384-S387 PolarHBondContact O-N 2.98Å; S384-S387 VanDerWaalsContact O-N 3.08Å; S384-S387 PolarHBondContact O-OG 3.01Å
385	P	52.6	Low	57.1	Low	37 Å²	37	51.5 Å²	51.5	24%	0.24	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-64.3	-22.3	-177.4	20.4	-29.9	0	0	0	113.3	S387 L388 E415 E416	P385-S387 PolarHBondContact O-N 2.98Å; P385-S387 VanDerWaalsContact O-N 3.1Å; P385-L388 PolarHBondContact O-N 3.34Å; P385-E415 WeakPolarHBondContact CD-O 3.33Å; P385-E416 HydrophobicContact CG-CG 4.45Å
386	A	46.4	Very low	59.4	Low	101 Å²	101	50.5 Å²	50.5	84%	0.835	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-64.8	-9.3	174.5	0	0	0	0	0	113.7	S384	S384-A386 PolarHBondContact O-N 3.38Å
387	S	53.4	Low	61.9	Low	39 Å²	39	45.5 Å²	45.5	27%	0.273	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-92.9	-1.3	179	63.8	0	0	0	0	114.5	S384 P385 S389 H393	S384-S387 PolarHBondContact O-N 2.98Å; S384-S387 VanDerWaalsContact O-N 3.08Å; S384-S387 PolarHBondContact O-OG 3.01Å; P385-S387 PolarHBondContact O-N 2.98Å; P385-S387 VanDerWaalsContact O-N 3.1Å; S387-S389 PolarHBondContact O-N 3.46Å; S387-H393 VanDerWaalsContact C-NE2 3.32Å; S387-H393 PolarHBondContact O-CE1 2.83Å; S387-H393 PolarHBondContact OG-CE1 2.8Å; S387-H393 PolarHBondContact OG-NE2 2.88Å
388	L	49.8	Very low	63.6	Low	78 Å²	78	46.7 Å²	46.7	41%	0.408	28%	0.279	S	S	.	.			trans	-60.6	119.8	-171.4	-109.3	94.2	0	0	0	113.9	P385 H393	P385-L388 PolarHBondContact O-N 3.34Å; L388-H393 VanDerWaalsContact CA-CE1 3.49Å; L388-H393 WeakPolarHBondContact CA-CE1 3.42Å; L388-H393 WeakPolarHBondContact CA-NE2 3.25Å; L388-H393 WeakPolarHBondContact CD1-CD2 3.18Å; L388-H393 WeakPolarHBondContact CD1-NE2 3.43Å; L388-H393 VanDerWaalsContact CG-CD2 3.42Å; L388-H393 WeakPolarHBondContact CG-CD2 3.3Å; L388-H393 WeakPolarHBondContact CG-NE2 3.17Å; L388-H393 PolarHBondContact N-CE1 2.79Å; L388-H393 PolarHBondContact N-NE2 2.91Å; L388-H393 VanDerWaalsContact N-NE2 3.12Å
389	S	56.5	Low	64.9	Low	58 Å²	58	50.9 Å²	50.9	41%	0.406	29%	0.292	S	S	.	.			trans	-93.3	159.9	167.1	87.5	0	0	0	0	111.2	S387 N391 G392	S387-S389 PolarHBondContact O-N 3.46Å; S389-N391 PolarHBondContact O-N 2.89Å; S389-N391 PolarHBondContact OG-N 3.36Å; S389-G392 PolarHBondContact O-N 2.84Å; S389-G392 VanDerWaalsContact O-N 3.12Å; S389-G392 PolarHBondContact OG-O 2.8Å; S389-G392 VanDerWaalsContact OG-O 3.05Å
390	S	60	Low	66.3	Low	81 Å²	81	49.3 Å²	49.3	57%	0.566	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	1	175.7	57.8	0	0	0	0	115.4	E408 H706	S390-E408 VanDerWaalsContact O-OE2 3.1Å; S390-H706 VanDerWaalsContact O-CB 3.25Å; S390-H706 WeakPolarHBondContact O-CB 3.48Å
391	N	61.5	Low	67.9	Low	36 Å²	36	43.4 Å²	43.4	19%	0.193	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	11.1	176.3	-62.9	-48.2	0	0	0	112.4	R370 S389 A705 H706	R370-N391 PolarHBondContact NH2-ND2 2.84Å; S389-N391 PolarHBondContact O-N 2.89Å; S389-N391 PolarHBondContact OG-N 3.36Å; N391-A705 WeakPolarHBondContact OD1-CA 3.4Å; N391-H706 PolarHBondContact OD1-N 2.8Å
392	G	67.6	Low	69	Low	8 Å²	8	42.1 Å²	42.1	8%	0.082	25%	0.253	C	S	.	.			trans	79.2	-167.2	-171.3	0	0	0	0	0	113	S389 I406	S389-G392 PolarHBondContact O-N 2.84Å; S389-G392 VanDerWaalsContact O-N 3.12Å; S389-G392 PolarHBondContact OG-O 2.8Å; S389-G392 VanDerWaalsContact OG-O 3.05Å; G392-I406 WeakPolarHBondContact CA-O 3.24Å
393	H	74.2	Confident	70.6	Confident	15 Å²	15	39.3 Å²	39.3	7%	0.069	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	150.2	-176.8	-83.3	-60.8	0	0	0	113.1	S387 L388 F405 I406	S387-H393 VanDerWaalsContact C-NE2 3.32Å; S387-H393 PolarHBondContact O-CE1 2.83Å; S387-H393 PolarHBondContact OG-CE1 2.8Å; S387-H393 PolarHBondContact OG-NE2 2.88Å; L388-H393 VanDerWaalsContact CA-CE1 3.49Å; L388-H393 WeakPolarHBondContact CA-CE1 3.42Å; L388-H393 WeakPolarHBondContact CA-NE2 3.25Å; L388-H393 WeakPolarHBondContact CD1-CD2 3.18Å; L388-H393 WeakPolarHBondContact CD1-NE2 3.43Å; L388-H393 VanDerWaalsContact CG-CD2 3.42Å; L388-H393 WeakPolarHBondContact CG-CD2 3.3Å; L388-H393 WeakPolarHBondContact CG-NE2 3.17Å; L388-H393 PolarHBondContact N-CE1 2.79Å; L388-H393 PolarHBondContact N-NE2 2.91Å; L388-H393 VanDerWaalsContact N-NE2 3.12Å; H393-F405 CarbonylContact O-C 3.59Å; H393-F405 WeakPolarHBondContact O-CA 3.24Å; H393-F405 WeakPolarHBondContact O-CD2 3.46Å; H393-I406 HydrophobicContact CB-CB 4.31Å; H393-I406 PolarHBondContact N-O 2.78Å; H393-I406 PolarHBondContact O-N 2.97Å
394	S	79.4	Confident	72	Confident	27 Å²	27	39.1 Å²	39.1	19%	0.189	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	125.7	168	58.6	0	0	0	0	111.5	L404	S394-L404 CarbonylContact C-O 3.59Å; S394-L404 VanDerWaalsContact CA-O 3.24Å; S394-L404 WeakPolarHBondContact CA-O 3.4Å
395	I	82.1	Confident	73.5	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	131.9	164.7	-58.2	177.7	0	0	0	107.7	Y381 V383 S403 L404 I417 L419	Y381-I395 HydrophobicContact CD1-CB 4.04Å; Y381-I395 HydrophobicContact CD1-CD1 4.01Å; Y381-I395 HydrophobicContact CD1-CG1 3.74Å; Y381-I395 HydrophobicContact CD1-CG2 3.38Å; Y381-I395 HydrophobicContact CE1-CG1 4.12Å; Y381-I395 HydrophobicContact CE1-CG2 4.33Å; Y381-I395 HydrophobicContact CG-CG2 3.76Å; V383-I395 HydrophobicContact CG2-CD1 3.44Å; V383-I395 VanDerWaalsContact CG2-CD1 3.44Å; V383-I395 HydrophobicContact CG2-CG1 3.29Å; I395-S403 CarbonylContact O-C 3.51Å; I395-S403 WeakPolarHBondContact O-CA 3.37Å; I395-L404 HydrophobicContact CB-CB 4.18Å; I395-L404 HydrophobicContact CD1-CD2 3.85Å; I395-L404 PolarHBondContact N-O 2.78Å; I395-L404 PolarHBondContact O-N 2.84Å; I395-I417 HydrophobicContact CD1-CG2 4.37Å; I395-L419 HydrophobicContact CB-CD2 4.33Å; I395-L419 HydrophobicContact CD1-CB 3.95Å; I395-L419 HydrophobicContact CG2-CB 4.2Å; I395-L419 HydrophobicContact CG2-CD2 3.84Å
396	L	82	Confident	75.1	Confident	15 Å²	15	35.5 Å²	35.5	8%	0.079	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	105.8	179.4	-172.6	67.1	0	0	0	111.1	K398 F698 P700	L396-K398 VanDerWaalsContact C-N 3.26Å; L396-K398 HydrophobicContact CD2-CB 4.31Å; L396-K398 HydrophobicContact CG-CB 4.28Å; L396-K398 PolarHBondContact O-N 2.87Å; L396-K398 VanDerWaalsContact O-N 3.08Å; L396-F698 HydrophobicContact CD1-CD1 3.45Å; L396-F698 VanDerWaalsContact CD1-CD1 3.45Å; L396-F698 HydrophobicContact CD1-CE1 3.34Å; L396-F698 HydrophobicContact CG-CD1 4.43Å; L396-P700 HydrophobicContact CD2-CB 4.46Å
397	L	83.6	Confident	76.9	Confident	6 Å²	6	31.1 Å²	31.1	3%	0.031	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	73.7	166.9	-58.1	-179.4	0	0	0	108.7	K399 H400 A401 I402 L419	L397-K399 VanDerWaalsContact C-N 3.27Å; L397-K399 PolarHBondContact O-N 3.44Å; L397-K399 VanDerWaalsContact O-N 3.14Å; L397-H400 HydrophobicContact CB-CB 4.29Å; L397-H400 CarbonylContact O-C 3.57Å; L397-H400 PolarHBondContact O-N 3.44Å; L397-A401 PolarHBondContact O-N 2.97Å; L397-I402 HydrophobicContact CB-CB 4.15Å; L397-I402 HydrophobicContact CD1-CB 4.21Å; L397-I402 HydrophobicContact CD1-CD1 4.28Å; L397-I402 HydrophobicContact CD1-CG2 4.45Å; L397-I402 PolarHBondContact N-O 2.81Å; L397-I402 PolarHBondContact O-N 2.77Å; L397-L419 HydrophobicContact CD1-CD2 4.33Å; L397-L419 HydrophobicContact CG-CD2 4.49Å
398	K	80	Confident	78.1	Confident	107 Å²	107	32.8 Å²	32.8	47%	0.465	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-51.8	-41.9	-170.9	-172.5	177.8	-179.8	-178.1	0	113.5	L396 H400 A401	L396-K398 VanDerWaalsContact C-N 3.26Å; L396-K398 HydrophobicContact CD2-CB 4.31Å; L396-K398 HydrophobicContact CG-CB 4.28Å; L396-K398 PolarHBondContact O-N 2.87Å; L396-K398 VanDerWaalsContact O-N 3.08Å; K398-H400 VanDerWaalsContact C-N 3.32Å; K398-H400 PolarHBondContact O-N 2.87Å; K398-A401 PolarHBondContact O-N 2.86Å
399	K	82.1	Confident	79.5	Confident	144 Å²	144	31 Å²	31	63%	0.626	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-61.4	-40.8	177.9	-72.2	-171.8	176.1	-174.3	0	111.5	P378 L397 R571 N575	P378-K399 HydrophobicContact CB-CD 4.22Å; L397-K399 VanDerWaalsContact C-N 3.27Å; L397-K399 PolarHBondContact O-N 3.44Å; L397-K399 VanDerWaalsContact O-N 3.14Å; K399-R571 WeakPolarHBondContact O-CB 3.45Å; K399-N575 VanDerWaalsContact C-ND2 3.35Å; K399-N575 PolarHBondContact O-ND2 3.26Å
400	H	86.5	Confident	80.8	Confident	6 Å²	6	28.3 Å²	28.3	3%	0.028	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-93.6	-1.9	-174.4	-58.6	91.4	0	0	0	114	P378 L397 K398 I402 L421 Y423 A572	P378-H400 PolarHBondContact O-CE1 3.37Å; P378-H400 PolarHBondContact O-ND1 2.83Å; L397-H400 HydrophobicContact CB-CB 4.29Å; L397-H400 CarbonylContact O-C 3.57Å; L397-H400 PolarHBondContact O-N 3.44Å; K398-H400 VanDerWaalsContact C-N 3.32Å; K398-H400 PolarHBondContact O-N 2.87Å; H400-I402 VanDerWaalsContact C-N 3.28Å; H400-I402 HydrophobicContact CB-CD1 4.06Å; H400-I402 HydrophobicContact CB-CG1 4.28Å; H400-I402 PolarHBondContact O-N 2.78Å; H400-L421 HydrophobicContact CB-CD2 4.2Å; H400-L421 WeakPolarHBondContact CD2-CD2 3.32Å; H400-Y423 PolarHBondContact CD2-OH 2.92Å; H400-Y423 VanDerWaalsContact CD2-OH 3.25Å; H400-Y423 PolarHBondContact NE2-OH 3.38Å; H400-A572 HydrophobicContact CB-CB 4.3Å
401	A	87.5	Confident	81.8	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	42.4	-174.5	0	0	0	0	0	114	L397 K398 E462 R571 F698	L397-A401 PolarHBondContact O-N 2.97Å; K398-A401 PolarHBondContact O-N 2.86Å; A401-E462 HydrophobicContact CB-CG 3.94Å; A401-R571 HydrophobicContact CB-CB 4.27Å; A401-R571 VanDerWaalsContact CB-NE 3.35Å; A401-F698 HydrophobicContact CB-CD1 4.22Å; A401-F698 HydrophobicContact CB-CD2 3.89Å; A401-F698 HydrophobicContact CB-CE1 4.4Å; A401-F698 HydrophobicContact CB-CE2 4.09Å; A401-F698 HydrophobicContact CB-CG 3.97Å; A401-F698 HydrophobicContact CB-CZ 4.35Å
402	I	90.3	Very high	82.7	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	131.7	173.7	-59	167.1	0	0	0	108.1	L397 H400 L419 L421 V442 L459 S460 I461	L397-I402 HydrophobicContact CB-CB 4.15Å; L397-I402 HydrophobicContact CD1-CB 4.21Å; L397-I402 HydrophobicContact CD1-CD1 4.28Å; L397-I402 HydrophobicContact CD1-CG2 4.45Å; L397-I402 PolarHBondContact N-O 2.81Å; L397-I402 PolarHBondContact O-N 2.77Å; H400-I402 VanDerWaalsContact C-N 3.28Å; H400-I402 HydrophobicContact CB-CD1 4.06Å; H400-I402 HydrophobicContact CB-CG1 4.28Å; H400-I402 PolarHBondContact O-N 2.78Å; I402-L419 HydrophobicContact CG2-CD2 4.01Å; I402-L421 HydrophobicContact CD1-CD1 3.71Å; I402-L421 HydrophobicContact CD1-CD2 4.29Å; I402-L421 HydrophobicContact CD1-CG 4.49Å; I402-V442 HydrophobicContact CD1-CG2 4Å; I402-L459 HydrophobicContact CG2-CD1 3.84Å; I402-S460 WeakPolarHBondContact CA-O 3.39Å; I402-I461 HydrophobicContact CG1-CG2 4.2Å; I402-I461 HydrophobicContact CG2-CG1 4.32Å
403	S	89.4	Confident	83	Confident	13 Å²	13	33.7 Å²	33.7	9%	0.091	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	137.1	172.3	63.9	0	0	0	0	111.6	I395 S460	I395-S403 CarbonylContact O-C 3.51Å; I395-S403 WeakPolarHBondContact O-CA 3.37Å; S403-S460 PolarHBondContact N-O 3.32Å; S403-S460 PolarHBondContact O-N 2.8Å; S403-S460 WeakPolarHBondContact OG-CB 3.29Å
404	L	90.3	Very high	82.9	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	123.8	170.6	178.3	78.7	0	0	0	108.6	S394 I395 I406 I417 L419 L444 A457 V458 L459	S394-L404 CarbonylContact C-O 3.59Å; S394-L404 VanDerWaalsContact CA-O 3.24Å; S394-L404 WeakPolarHBondContact CA-O 3.4Å; I395-L404 HydrophobicContact CB-CB 4.18Å; I395-L404 HydrophobicContact CD1-CD2 3.85Å; I395-L404 PolarHBondContact N-O 2.78Å; I395-L404 PolarHBondContact O-N 2.84Å; L404-I406 HydrophobicContact CD2-CD1 3.91Å; L404-I406 HydrophobicContact CD2-CG1 3.94Å; L404-I406 HydrophobicContact CG-CG1 4.15Å; L404-I417 HydrophobicContact CD2-CG2 4.18Å; L404-L419 HydrophobicContact CB-CD2 3.84Å; L404-L419 HydrophobicContact CD2-CD1 4.48Å; L404-L444 HydrophobicContact CD1-CD1 4.38Å; L404-L444 HydrophobicContact CD2-CD1 3.42Å; L404-L444 VanDerWaalsContact CD2-CD1 3.42Å; L404-A457 HydrophobicContact CD1-CB 4.08Å; L404-V458 CarbonylContact C-O 3.49Å; L404-V458 WeakPolarHBondContact CA-O 3.38Å; L404-L459 HydrophobicContact CB-CD1 4.48Å; L404-L459 HydrophobicContact CD1-CB 4Å; L404-L459 HydrophobicContact CD1-CD1 4.36Å
405	F	87.8	Confident	82.9	Confident	6 Å²	6	33.4 Å²	33.4	3%	0.026	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	126.7	171.3	178.5	-106.3	0	0	0	110.5	H393 P407 A457 V458 T754	H393-F405 CarbonylContact O-C 3.59Å; H393-F405 WeakPolarHBondContact O-CA 3.24Å; H393-F405 WeakPolarHBondContact O-CD2 3.46Å; F405-P407 HydrophobicContact CD1-CG 4.19Å; F405-P407 HydrophobicContact CE1-CB 4.21Å; F405-P407 HydrophobicContact CE1-CG 3.84Å; F405-A457 CarbonylContact O-C 3.58Å; F405-A457 VanDerWaalsContact O-CA 3.25Å; F405-A457 WeakPolarHBondContact O-CA 3.21Å; F405-A457 VanDerWaalsContact O-CB 3.3Å; F405-A457 WeakPolarHBondContact O-CB 3.27Å; F405-V458 HydrophobicContact CB-CB 4.28Å; F405-V458 HydrophobicContact CD1-CG2 4.25Å; F405-V458 PolarHBondContact N-O 3.31Å; F405-V458 PolarHBondContact O-N 2.93Å; F405-T754 HydrophobicContact CD1-CG2 3.54Å; F405-T754 HydrophobicContact CE1-CG2 3.43Å; F405-T754 VanDerWaalsContact CE1-CG2 3.43Å
406	I	87.1	Confident	82.7	Confident	4 Å²	4	37 Å²	37	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	110.4	178.3	-59.2	159.7	0	0	0	107.3	G392 H393 L404 A410 L411 I417 A457	G392-I406 WeakPolarHBondContact CA-O 3.24Å; H393-I406 HydrophobicContact CB-CB 4.31Å; H393-I406 PolarHBondContact N-O 2.78Å; H393-I406 PolarHBondContact O-N 2.97Å; L404-I406 HydrophobicContact CD2-CD1 3.91Å; L404-I406 HydrophobicContact CD2-CG1 3.94Å; L404-I406 HydrophobicContact CG-CG1 4.15Å; I406-A410 HydrophobicContact CG2-CB 3.79Å; I406-L411 HydrophobicContact CG2-CD1 4.05Å; I406-L411 HydrophobicContact CG2-CG 3.96Å; I406-I417 HydrophobicContact CD1-CB 4.41Å; I406-I417 HydrophobicContact CD1-CD1 3.73Å; I406-I417 HydrophobicContact CD1-CG2 4.43Å; I406-I417 HydrophobicContact CG1-CD1 4.38Å; I406-A457 HydrophobicContact CG1-CB 4.43Å
407	P	83	Confident	82.7	Confident	10 Å²	10	36.3 Å²	36.3	7%	0.065	19%	0.193	C	C	.	.			trans	-61.2	154.3	176.3	-22	31.7	0	0	0	112.7	F405 G409 A410 K455 P456 T754	F405-P407 HydrophobicContact CD1-CG 4.19Å; F405-P407 HydrophobicContact CE1-CB 4.21Å; F405-P407 HydrophobicContact CE1-CG 3.84Å; P407-G409 PolarHBondContact O-N 3.49Å; P407-A410 WeakPolarHBondContact O-CB 3.2Å; P407-A410 PolarHBondContact O-N 2.82Å; P407-A410 VanDerWaalsContact O-N 3.12Å; P407-K455 HydrophobicContact CB-CB 4.48Å; P407-K455 HydrophobicContact CB-CD 4.19Å; P407-P456 WeakPolarHBondContact CD-O 3.4Å; P407-P456 VanDerWaalsContact CG-O 3.23Å; P407-P456 WeakPolarHBondContact CG-O 3.3Å; P407-T754 HydrophobicContact CG-CG2 4.32Å
408	E	79	Confident	82.7	Confident	74 Å²	74	36.8 Å²	36.8	35%	0.346	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	133.2	171.4	-173.7	179.9	172.2	0	0	110.9	S390 A410 K455 H706	S390-E408 VanDerWaalsContact O-OE2 3.1Å; E408-A410 VanDerWaalsContact C-N 3.28Å; E408-A410 PolarHBondContact O-N 3.44Å; E408-K455 WeakPolarHBondContact O-CD 3.38Å; E408-K455 WeakPolarHBondContact O-CE 3.48Å; E408-K455 PolarHBondContact O-NZ 3.5Å; E408-K455 VanDerWaalsContact O-NZ 3.16Å; E408-H706 IonicContact OE2-CD2 3.8Å; E408-H706 IonicContact OE2-CG 3Å
409	G	79.3	Confident	83.2	Confident	40 Å²	40	31.7 Å²	31.7	41%	0.412	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	0.3	-177	0	0	0	0	0	115	P407 L411 K454	P407-G409 PolarHBondContact O-N 3.49Å; G409-L411 VanDerWaalsContact C-N 3.28Å; G409-L411 PolarHBondContact O-N 3.46Å; G409-K454 WeakPolarHBondContact O-CB 3.37Å
410	A	84.5	Confident	83.4	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.008	15%	0.146	C	C	.	.	S	Bend	trans	-66.8	-31.6	174	0	0	0	0	0	112.5	I406 P407 E408 K454 K455	I406-A410 HydrophobicContact CG2-CB 3.79Å; P407-A410 WeakPolarHBondContact O-CB 3.2Å; P407-A410 PolarHBondContact O-N 2.82Å; P407-A410 VanDerWaalsContact O-N 3.12Å; E408-A410 VanDerWaalsContact C-N 3.28Å; E408-A410 PolarHBondContact O-N 3.44Å; A410-K454 PolarHBondContact O-N 2.78Å; A410-K455 HydrophobicContact CB-CB 3.92Å
411	L	81.5	Confident	83.4	Confident	22 Å²	22	25.5 Å²	25.5	12%	0.115	15%	0.148	C	C	.	.	S	Bend	trans	-97.7	151.3	-177.5	-72.5	176.4	0	0	0	113	I406 G409 E415 I417 L453	I406-L411 HydrophobicContact CG2-CD1 4.05Å; I406-L411 HydrophobicContact CG2-CG 3.96Å; G409-L411 VanDerWaalsContact C-N 3.28Å; G409-L411 PolarHBondContact O-N 3.46Å; L411-E415 HydrophobicContact CD2-CB 4.25Å; L411-E415 HydrophobicContact CD2-CG 3.89Å; L411-I417 HydrophobicContact CD1-CD1 4.03Å; L411-I417 HydrophobicContact CD1-CG1 4.39Å; L411-I417 HydrophobicContact CD2-CD1 3.25Å; L411-I417 HydrophobicContact CD2-CG1 3.78Å; L411-I417 HydrophobicContact CG-CD1 4.05Å; L411-L453 HydrophobicContact CD2-CD2 3.95Å
412	S	80.4	Confident	83.2	Confident	32 Å²	32	26.6 Å²	26.6	22%	0.224	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-79.4	153.6	166.9	-61.3	0	0	0	0	111.4	G414 E415 K454	S412-G414 PolarHBondContact O-N 2.81Å; S412-E415 PolarHBondContact N-OE2 2.82Å; S412-E415 VanDerWaalsContact O-CB 3.24Å; S412-E415 WeakPolarHBondContact O-CB 3.23Å; S412-E415 PolarHBondContact O-N 2.75Å; S412-K454 WeakPolarHBondContact OG-CE 3.13Å; S412-K454 PolarHBondContact OG-NZ 2.83Å
413	E	73.4	Confident	82.5	Confident	184 Å²	184	30.2 Å²	30.2	86%	0.86	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	124.6	177.2	-70	-176.3	176.7	0	0	111.1	R448	E413-R448 VanDerWaalsContact O-CZ 3.28Å; E413-R448 PolarHBondContact O-NH1 3.47Å; E413-R448 PolarHBondContact O-NH2 3.13Å
414	G	72.6	Confident	81.6	Confident	35 Å²	35	32 Å²	32	36%	0.361	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	14.1	-179	0	0	0	0	0	115.1	S412 R448	S412-G414 PolarHBondContact O-N 2.81Å; G414-R448 PolarHBondContact O-NE 3.48Å; G414-R448 PolarHBondContact O-NH2 2.88Å
415	E	78.1	Confident	80.7	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	21%	0.205	C	C	.	.			trans	-87.8	129.9	172.9	-170.7	163.3	-150.1	0	0	111.1	P385 L411 S412 S446 R448 S450	P385-E415 WeakPolarHBondContact CD-O 3.33Å; L411-E415 HydrophobicContact CD2-CB 4.25Å; L411-E415 HydrophobicContact CD2-CG 3.89Å; S412-E415 PolarHBondContact N-OE2 2.82Å; S412-E415 VanDerWaalsContact O-CB 3.24Å; S412-E415 WeakPolarHBondContact O-CB 3.23Å; S412-E415 PolarHBondContact O-N 2.75Å; E415-S446 VanDerWaalsContact CG-OG 3.3Å; E415-S446 WeakPolarHBondContact CG-OG 3.19Å; E415-S446 PolarHBondContact OE1-OG 2.81Å; E415-R448 HydrophobicContact CG-CG 4.46Å; E415-S450 WeakPolarHBondContact OE1-CB 3.32Å; E415-S450 PolarHBondContact OE1-OG 2.91Å
416	E	77.7	Confident	79.8	Confident	76 Å²	76	44.1 Å²	44.1	36%	0.355	24%	0.243	S	C	.	.			trans	-110.3	140.1	176.4	-59.7	-178.8	150.7	0	0	109.7	V383 P385 S446 N447	V383-E416 WeakPolarHBondContact O-CA 3.33Å; V383-E416 WeakPolarHBondContact O-CB 3.43Å; P385-E416 HydrophobicContact CG-CG 4.45Å; E416-S446 WeakPolarHBondContact O-CA 3.47Å; E416-N447 HydrophobicContact CB-CB 4.12Å; E416-N447 VanDerWaalsContact CB-ND2 3.34Å; E416-N447 WeakPolarHBondContact CB-ND2 3.3Å; E416-N447 VanDerWaalsContact CG-ND2 3.29Å; E416-N447 WeakPolarHBondContact CG-ND2 3.4Å; E416-N447 PolarHBondContact N-ND2 3.25Å; E416-N447 PolarHBondContact N-OD1 3.02Å; E416-N447 PolarHBondContact O-N 2.83Å; E416-N447 PolarHBondContact O-OD1 3.06Å; E416-N447 PolarHBondContact OE2-ND2 3.01Å
417	I	83.3	Confident	79.3	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	136.9	178.8	-69.6	-177.1	0	0	0	109.9	T382 V383 I395 L404 I406 L411 L444 R445 L453 F531	T382-I417 CarbonylContact C-O 3.58Å; T382-I417 WeakPolarHBondContact CA-O 3.5Å; V383-I417 PolarHBondContact N-O 2.84Å; V383-I417 PolarHBondContact O-N 3.21Å; I395-I417 HydrophobicContact CD1-CG2 4.37Å; L404-I417 HydrophobicContact CD2-CG2 4.18Å; I406-I417 HydrophobicContact CD1-CB 4.41Å; I406-I417 HydrophobicContact CD1-CD1 3.73Å; I406-I417 HydrophobicContact CD1-CG2 4.43Å; I406-I417 HydrophobicContact CG1-CD1 4.38Å; L411-I417 HydrophobicContact CD1-CD1 4.03Å; L411-I417 HydrophobicContact CD1-CG1 4.39Å; L411-I417 HydrophobicContact CD2-CD1 3.25Å; L411-I417 HydrophobicContact CD2-CG1 3.78Å; L411-I417 HydrophobicContact CG-CD1 4.05Å; I417-L444 HydrophobicContact CG2-CD1 3.38Å; I417-L444 HydrophobicContact CG2-CG 4.43Å; I417-R445 CarbonylContact C-O 3.47Å; I417-R445 VanDerWaalsContact CA-O 3.27Å; I417-R445 WeakPolarHBondContact CA-O 3.1Å; I417-L453 HydrophobicContact CD1-CD2 4.16Å; I417-F531 HydrophobicContact CD1-CE1 3.75Å; I417-F531 HydrophobicContact CD1-CZ 4.2Å; I417-F531 HydrophobicContact CG1-CE1 3.92Å; I417-F531 HydrophobicContact CG1-CZ 4.47Å
418	D	83.4	Confident	79.3	Confident	16 Å²	16	46.5 Å²	46.5	9%	0.086	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	131.6	169.6	-170.5	46.4	0	0	0	110.3	R380 Y381 T382 R445	R380-D418 WeakPolarHBondContact CD-OD2 3.33Å; R380-D418 WeakPolarHBondContact CG-OD1 3.14Å; R380-D418 WeakPolarHBondContact CG-OD2 3.49Å; R380-D418 IonicContact NE-OD2 3.57Å; Y381-D418 CarbonylContact O-C 3.6Å; Y381-D418 WeakPolarHBondContact O-CA 3.32Å; T382-D418 PolarHBondContact OG1-OD1 3.48Å; D418-R445 HydrophobicContact CB-CB 4.29Å; D418-R445 PolarHBondContact N-O 2.94Å; D418-R445 PolarHBondContact O-N 3.18Å
419	L	89.2	Confident	79.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.6	173.3	-173.3	74.2	0	0	0	108.8	Y381 I395 L397 I402 L404 V442 W443 L444 L459	Y381-L419 PolarHBondContact N-O 3.44Å; Y381-L419 PolarHBondContact O-N 2.74Å; I395-L419 HydrophobicContact CB-CD2 4.33Å; I395-L419 HydrophobicContact CD1-CB 3.95Å; I395-L419 HydrophobicContact CG2-CB 4.2Å; I395-L419 HydrophobicContact CG2-CD2 3.84Å; L397-L419 HydrophobicContact CD1-CD2 4.33Å; L397-L419 HydrophobicContact CG-CD2 4.49Å; I402-L419 HydrophobicContact CG2-CD2 4.01Å; L404-L419 HydrophobicContact CB-CD2 3.84Å; L404-L419 HydrophobicContact CD2-CD1 4.48Å; L419-V442 HydrophobicContact CD1-CG1 3.4Å; L419-V442 VanDerWaalsContact CD1-CG1 3.4Å; L419-V442 HydrophobicContact CG-CG1 4.13Å; L419-W443 WeakPolarHBondContact CA-O 3.33Å; L419-L444 HydrophobicContact CD1-CD1 4.09Å; L419-L459 HydrophobicContact CD1-CD1 4.28Å
420	S	86.2	Confident	79.6	Confident	8 Å²	8	46.1 Å²	46.1	6%	0.056	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	151.5	-179.9	60.5	0	0	0	0	113	S379 W443	S379-S420 VanDerWaalsContact O-CA 3.31Å; S379-S420 WeakPolarHBondContact O-CA 3.31Å; S420-W443 PolarHBondContact N-O 3Å; S420-W443 PolarHBondContact O-N 3.03Å
421	L	87.9	Confident	79.6	Confident	12 Å²	12	48.5 Å²	48.5	6%	0.063	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	129	175.6	-170.8	61.2	0	0	0	109.6	S379 H400 I402 Y423 P440 V442 A572	S379-L421 PolarHBondContact O-N 2.76Å; H400-L421 HydrophobicContact CB-CD2 4.2Å; H400-L421 WeakPolarHBondContact CD2-CD2 3.32Å; I402-L421 HydrophobicContact CD1-CD1 3.71Å; I402-L421 HydrophobicContact CD1-CD2 4.29Å; I402-L421 HydrophobicContact CD1-CG 4.49Å; L421-Y423 HydrophobicContact CB-CE2 4.39Å; L421-Y423 HydrophobicContact CD2-CE1 4Å; L421-Y423 HydrophobicContact CD2-CE2 3.76Å; L421-Y423 WeakPolarHBondContact CD2-OH 3.38Å; L421-Y423 HydrophobicContact CG-CE1 4.24Å; L421-Y423 HydrophobicContact CG-CE2 3.88Å; L421-P440 HydrophobicContact CD1-CB 3.59Å; L421-P440 HydrophobicContact CD1-CG 3.86Å; L421-V442 HydrophobicContact CD1-CG2 4.2Å; L421-A572 HydrophobicContact CD2-CB 3.94Å
422	V	82.2	Confident	79.7	Confident	22 Å²	22	50.9 Å²	50.9	13%	0.133	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	122.6	-175	-173.4	0	0	0	0	109.9	A424 C427 V441 W443	V422-A424 HydrophobicContact CG1-CB 4.34Å; V422-C427 HydrophobicContact CG1-CB 3.43Å; V422-C427 VanDerWaalsContact CG1-CB 3.43Å; V422-V441 HydrophobicContact CB-CB 4.35Å; V422-V441 HydrophobicContact CB-CG1 4.2Å; V422-V441 PolarHBondContact N-O 3.2Å; V422-W443 HydrophobicContact CG2-CB 3.83Å; V422-W443 HydrophobicContact CG2-CE3 4.14Å
423	Y	76.4	Confident	79.6	Confident	77 Å²	77	55.7 Å²	55.7	30%	0.302	31%	0.305	S	S	.	.			trans	-109.6	-4.1	178.5	-61.6	-76.5	0	0	0	113.3	H400 L421 D425 A572 W576	H400-Y423 PolarHBondContact CD2-OH 2.92Å; H400-Y423 VanDerWaalsContact CD2-OH 3.25Å; H400-Y423 PolarHBondContact NE2-OH 3.38Å; L421-Y423 HydrophobicContact CB-CE2 4.39Å; L421-Y423 HydrophobicContact CD2-CE1 4Å; L421-Y423 HydrophobicContact CD2-CE2 3.76Å; L421-Y423 WeakPolarHBondContact CD2-OH 3.38Å; L421-Y423 HydrophobicContact CG-CE1 4.24Å; L421-Y423 HydrophobicContact CG-CE2 3.88Å; Y423-D425 PolarHBondContact O-N 3.45Å; Y423-A572 PolarHBondContact OH-O 2.82Å; Y423-W576 AromaticContact CD1-CD1 3.29Å; Y423-W576 AromaticContact CD1-CG 3.94Å; Y423-W576 HydrophobicContact CD1-CG 3.94Å; Y423-W576 AromaticContact CD1-NE1 3.74Å; Y423-W576 AromaticContact CD2-CD1 3.69Å; Y423-W576 HydrophobicContact CE1-CB 3.81Å; Y423-W576 AromaticContact CE1-CD1 3.3Å; Y423-W576 AromaticContact CE1-CG 3.71Å; Y423-W576 HydrophobicContact CE1-CG 3.71Å; Y423-W576 AromaticContact CE2-CD1 3.69Å; Y423-W576 AromaticContact CG-CD1 3.46Å; Y423-W576 VanDerWaalsContact CG-CD1 3.46Å; Y423-W576 HydrophobicContact CG-CG 4.49Å; Y423-W576 AromaticContact CG-NE1 3.63Å; Y423-W576 AromaticContact CZ-CD1 3.47Å; Y423-W576 VanDerWaalsContact CZ-CD1 3.47Å
424	A	71.3	Confident	80	Confident	50 Å²	50	51.4 Å²	51.4	41%	0.413	29%	0.287	S	S	.	.			trans	-71	126.9	-178.2	0	0	0	0	0	110.8	V422 E426 C427	V422-A424 HydrophobicContact CG1-CB 4.34Å; A424-E426 PolarHBondContact O-N 3.12Å; A424-C427 WeakPolarHBondContact O-CB 3.43Å; A424-C427 PolarHBondContact O-N 3.04Å
425	D	71.3	Confident	80.8	Confident	83 Å²	83	51.3 Å²	51.3	44%	0.444	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-55	-36	179.1	-96.4	-24.5	0	0	0	112.7	Y423 C427 C428 R635	Y423-D425 PolarHBondContact O-N 3.45Å; D425-C427 PolarHBondContact O-N 3.39Å; D425-C428 WeakPolarHBondContact O-CB 3.21Å; D425-C428 PolarHBondContact O-N 2.92Å; D425-C428 VanDerWaalsContact O-N 3.12Å; D425-R635 VanDerWaalsContact CG-NH2 3.33Å; D425-R635 IonicContact OD1-CZ 3.77Å; D425-R635 IonicContact OD1-NE 3.93Å; D425-R635 PolarHBondContact OD1-NE 2.92Å; D425-R635 IonicContact OD1-NH2 3.99Å; D425-R635 PolarHBondContact OD1-NH2 2.91Å; D425-R635 IonicContact OD2-CZ 3.66Å; D425-R635 IonicContact OD2-NE 3.83Å; D425-R635 PolarHBondContact OD2-NE 2.87Å; D425-R635 VanDerWaalsContact OD2-NE 3.09Å; D425-R635 IonicContact OD2-NH1 3.71Å; D425-R635 IonicContact OD2-NH2 3.5Å; D425-R635 PolarHBondContact OD2-NH2 3.29Å
426	E	68.9	Low	81.3	Confident	179 Å²	179	51.2 Å²	51.2	84%	0.836	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-64.1	-24.2	178.9	-62.8	175.3	-179.9	0	0	112.9	A424	A424-E426 PolarHBondContact O-N 3.12Å
427	C	76	Confident	81.9	Confident	26 Å²	26	48.4 Å²	48.4	18%	0.176	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-89.5	-4.1	178.2	-67.7	0	0	0	0	112.8	V422 A424 D425 W500	V422-C427 HydrophobicContact CG1-CB 3.43Å; V422-C427 VanDerWaalsContact CG1-CB 3.43Å; A424-C427 WeakPolarHBondContact O-CB 3.43Å; A424-C427 PolarHBondContact O-N 3.04Å; D425-C427 PolarHBondContact O-N 3.39Å; C427-W500 WeakPolarHBondContact O-CZ2 3.34Å
428	C	82	Confident	82.3	Confident	37 Å²	37	48.4 Å²	48.4	25%	0.25	26%	0.264	C	S	.	.	S	Bend	trans	-80.7	146.7	177.6	-68.6	0	0	0	0	111	D425	D425-C428 WeakPolarHBondContact O-CB 3.21Å; D425-C428 PolarHBondContact O-N 2.92Å; D425-C428 VanDerWaalsContact O-N 3.12Å
429	P	84.7	Confident	82.8	Confident	9 Å²	9	47.6 Å²	47.6	6%	0.058	26%	0.26	C	S	.	.			trans	-63.4	147.7	174.7	27.5	-36.7	0	0	0	112	L431 L437 L486 W500 V535 I537	P429-L431 HydrophobicContact CB-CD2 4.25Å; P429-L431 HydrophobicContact CG-CD2 3.91Å; P429-L431 HydrophobicContact CG-CG 4.45Å; P429-L431 PolarHBondContact O-N 2.67Å; P429-L437 HydrophobicContact CG-CD2 3.99Å; P429-L486 HydrophobicContact CB-CD1 3.62Å; P429-L486 HydrophobicContact CG-CD1 3.91Å; P429-W500 VanDerWaalsContact CA-CD1 3.45Å; P429-W500 HydrophobicContact CB-CB 4.22Å; P429-W500 HydrophobicContact CB-CD2 3.81Å; P429-W500 HydrophobicContact CB-CE3 4.46Å; P429-W500 HydrophobicContact CB-CG 3.69Å; P429-V535 HydrophobicContact CG-CG1 3.93Å; P429-I537 HydrophobicContact CG-CG2 4.46Å
430	P	81.6	Confident	82.9	Confident	97 Å²	97	48.5 Å²	48.5	63%	0.63	27%	0.266	S	S	*	.			trans	-68	114.1	169	28.5	-32.2	0	0	0	109.4
431	L	84.3	Confident	83.1	Confident	51 Å²	51	48.3 Å²	48.3	27%	0.267	26%	0.264	S	S	.	.			trans	-101.5	144.7	-180	-58.8	-176.5	0	0	0	111.7	P429 Q435 L437 I537	P429-L431 HydrophobicContact CB-CD2 4.25Å; P429-L431 HydrophobicContact CG-CD2 3.91Å; P429-L431 HydrophobicContact CG-CG 4.45Å; P429-L431 PolarHBondContact O-N 2.67Å; L431-Q435 HydrophobicContact CB-CB 4.08Å; L431-Q435 HydrophobicContact CD2-CB 4.23Å; L431-L437 HydrophobicContact CD1-CD2 3.96Å; L431-L437 HydrophobicContact CD1-CG 3.95Å; L431-I537 HydrophobicContact CD2-CD1 4.31Å; L431-I537 HydrophobicContact CD2-CG2 3.9Å
432	N	82.1	Confident	83.2	Confident	73 Å²	73	47.7 Å²	47.7	39%	0.39	26%	0.261	S	S	.	.			trans	-77.9	173.3	168.4	73.7	38.2	0	0	0	111.7	L434 Q435	N432-L434 PolarHBondContact O-N 3.3Å; N432-L434 VanDerWaalsContact O-N 3.17Å; N432-L434 WeakPolarHBondContact OD1-CA 3.2Å; N432-L434 PolarHBondContact OD1-N 3.1Å; N432-Q435 VanDerWaalsContact CG-CD 3.43Å; N432-Q435 PolarHBondContact ND2-NE2 3.08Å; N432-Q435 PolarHBondContact ND2-OE1 3.18Å; N432-Q435 PolarHBondContact O-N 2.96Å; N432-Q435 WeakPolarHBondContact OD1-CB 3.48Å; N432-Q435 VanDerWaalsContact OD1-CG 3.28Å; N432-Q435 WeakPolarHBondContact OD1-CG 3.29Å; N432-Q435 PolarHBondContact OD1-N 2.73Å
433	N	78.9	Confident	83.5	Confident	132 Å²	132	48.7 Å²	48.7	71%	0.706	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-13.8	-176.5	-65.3	-18.4	0	0	0	115	Q632	N433-Q632 PolarHBondContact O-NE2 3.2Å
434	L	83	Confident	84.2	Confident	94 Å²	94	45 Å²	45	49%	0.492	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-16.6	178.9	-62.6	178.3	0	0	0	112.5	N432 P540 Y601	N432-L434 PolarHBondContact O-N 3.3Å; N432-L434 VanDerWaalsContact O-N 3.17Å; N432-L434 WeakPolarHBondContact OD1-CA 3.2Å; N432-L434 PolarHBondContact OD1-N 3.1Å; L434-P540 HydrophobicContact CB-CG 4.27Å; L434-P540 HydrophobicContact CD2-CG 4.49Å; L434-P540 WeakPolarHBondContact O-CD 3.19Å; L434-Y601 HydrophobicContact CD2-CE1 4.32Å
435	Q	87.9	Confident	84.8	Confident	33 Å²	33	46.4 Å²	46.4	15%	0.154	24%	0.243	C	C	.	.			trans	-90.6	150.8	-177.3	-76.9	168.9	-12.2	0	0	111.9	L431 N432 I537 G538 E539	L431-Q435 HydrophobicContact CB-CB 4.08Å; L431-Q435 HydrophobicContact CD2-CB 4.23Å; N432-Q435 VanDerWaalsContact CG-CD 3.43Å; N432-Q435 PolarHBondContact ND2-NE2 3.08Å; N432-Q435 PolarHBondContact ND2-OE1 3.18Å; N432-Q435 PolarHBondContact O-N 2.96Å; N432-Q435 WeakPolarHBondContact OD1-CB 3.48Å; N432-Q435 VanDerWaalsContact OD1-CG 3.28Å; N432-Q435 WeakPolarHBondContact OD1-CG 3.29Å; N432-Q435 PolarHBondContact OD1-N 2.73Å; Q435-I537 HydrophobicContact CG-CD1 4.17Å; Q435-G538 CarbonylContact C-O 3.48Å; Q435-G538 WeakPolarHBondContact CA-O 3.28Å; Q435-E539 HydrophobicContact CG-CB 3.8Å; Q435-E539 WeakPolarHBondContact CG-OE2 3.48Å; Q435-E539 PolarHBondContact NE2-OE2 3.33Å
436	T	88.6	Confident	85.4	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	151	174.2	-168.4	0	0	0	0	111.5	I438 W481 I537 G538 K549 F600 F631 Q632	T436-I438 HydrophobicContact CG2-CD1 4.1Å; T436-W481 HydrophobicContact CG2-CH2 3.94Å; T436-W481 HydrophobicContact CG2-CZ3 3.86Å; T436-I537 WeakPolarHBondContact O-CA 3.35Å; T436-G538 PolarHBondContact N-O 2.71Å; T436-G538 PolarHBondContact O-N 3.11Å; T436-K549 VanDerWaalsContact CG2-CE 3.43Å; T436-K549 WeakPolarHBondContact OG1-CE 3.4Å; T436-K549 PolarHBondContact OG1-NZ 3.41Å; T436-F600 HydrophobicContact CG2-CD1 4.31Å; T436-F600 HydrophobicContact CG2-CE1 3.97Å; T436-F600 HydrophobicContact CG2-CZ 4.21Å; T436-F631 PolarHBondContact OG1-O 2.93Å; T436-Q632 WeakPolarHBondContact CA-O 3.22Å; T436-Q632 WeakPolarHBondContact CB-O 3.24Å; T436-Q632 PolarHBondContact OG1-O 3.02Å
437	L	90.9	Very high	85.8	Confident	17 Å²	17	39.2 Å²	39.2	9%	0.089	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	133.1	172.1	-62.9	-180	0	0	0	109.9	P429 L431 V535 I537 K549 D634	P429-L437 HydrophobicContact CG-CD2 3.99Å; L431-L437 HydrophobicContact CD1-CD2 3.96Å; L431-L437 HydrophobicContact CD1-CG 3.95Å; L437-V535 HydrophobicContact CD2-CG2 3.75Å; L437-I537 HydrophobicContact CD2-CG2 4.05Å; L437-K549 WeakPolarHBondContact O-CE 3.42Å; L437-K549 PolarHBondContact O-NZ 3.27Å; L437-D634 HydrophobicContact CB-CB 4.05Å
438	I	91.4	Very high	85.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.225	C	C	.	.	S	Bend	trans	-111.7	-28.3	180	-67.8	-66.2	0	0	0	111.2	T436 H463 S464 A465 W481 L483 L536	T436-I438 HydrophobicContact CG2-CD1 4.1Å; I438-H463 HydrophobicContact CG2-CB 3.71Å; I438-H463 CarbonylContact O-C 3.55Å; I438-H463 WeakPolarHBondContact O-CA 3.22Å; I438-H463 WeakPolarHBondContact O-CB 3.43Å; I438-S464 PolarHBondContact O-N 3.42Å; I438-S464 PolarHBondContact O-OG 3.23Å; I438-A465 HydrophobicContact CD1-CB 3.86Å; I438-A465 HydrophobicContact CG2-CB 3.84Å; I438-W481 HydrophobicContact CD1-CE3 3.98Å; I438-W481 HydrophobicContact CD1-CH2 3.33Å; I438-W481 HydrophobicContact CD1-CZ2 4.07Å; I438-W481 HydrophobicContact CD1-CZ3 3.28Å; I438-W481 HydrophobicContact CG1-CE3 4.48Å; I438-W481 HydrophobicContact CG1-CH2 4.5Å; I438-W481 HydrophobicContact CG1-CZ3 4Å; I438-L483 HydrophobicContact CG1-CD2 4.12Å; I438-L483 HydrophobicContact CG2-CD2 4.33Å; I438-L536 WeakPolarHBondContact CB-O 3.48Å; I438-L536 HydrophobicContact CG2-CD2 4.03Å; I438-L536 PolarHBondContact N-O 3.02Å
439	T	93.6	Very high	84.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	-122.4	161.8	168.9	62.9	0	0	0	0	110	I461 H463 V524 V535 L536	T439-I461 HydrophobicContact CG2-CG2 4.28Å; T439-H463 HydrophobicContact CG2-CB 3.66Å; T439-V524 HydrophobicContact CG2-CG1 3.69Å; T439-V535 WeakPolarHBondContact O-CG2 3.33Å; T439-L536 HydrophobicContact CG2-CB 3.74Å; T439-L536 HydrophobicContact CG2-CD2 4.38Å; T439-L536 PolarHBondContact N-O 3.33Å; T439-L536 PolarHBondContact OG1-N 3.44Å
440	P	91.4	Very high	83.8	Confident	18 Å²	18	52.6 Å²	52.6	12%	0.117	27%	0.269	C	S	.	.			trans	-64.9	163.3	164.3	31.6	-38.8	0	0	0	111.7	L421 I461 A572	L421-P440 HydrophobicContact CD1-CB 3.59Å; L421-P440 HydrophobicContact CD1-CG 3.86Å; P440-I461 HydrophobicContact CG-CG2 3.92Å; P440-A572 HydrophobicContact CG-CB 4.13Å
441	V	90	Very high	83.3	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.024	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	121.4	174.2	-179.5	0	0	0	0	109.5	V422 W500 K533 V535	V422-V441 HydrophobicContact CB-CB 4.35Å; V422-V441 HydrophobicContact CB-CG1 4.2Å; V422-V441 PolarHBondContact N-O 3.2Å; V441-W500 HydrophobicContact CG1-CH2 4.01Å; V441-W500 HydrophobicContact CG1-CZ2 4.21Å; V441-K533 HydrophobicContact CG1-CB 4.28Å; V441-V535 HydrophobicContact CG2-CB 4.13Å; V441-V535 HydrophobicContact CG2-CG2 3.97Å
442	V	91.6	Very high	83.2	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	131.6	178.3	-179	0	0	0	0	109.3	I402 L419 L421 L459 I461 K533 F534	I402-V442 HydrophobicContact CD1-CG2 4Å; L419-V442 HydrophobicContact CD1-CG1 3.4Å; L419-V442 VanDerWaalsContact CD1-CG1 3.4Å; L419-V442 HydrophobicContact CG-CG1 4.13Å; L421-V442 HydrophobicContact CD1-CG2 4.2Å; V442-L459 HydrophobicContact CB-CD2 4.28Å; V442-L459 HydrophobicContact CG1-CD1 4.24Å; V442-L459 HydrophobicContact CG1-CD2 4.09Å; V442-I461 HydrophobicContact CB-CD1 4.27Å; V442-I461 HydrophobicContact CG2-CD1 3.63Å; V442-I461 HydrophobicContact CG2-CG1 4.25Å; V442-K533 CarbonylContact O-C 3.34Å; V442-K533 WeakPolarHBondContact O-CA 3.35Å; V442-F534 PolarHBondContact N-O 3.26Å; V442-F534 PolarHBondContact O-N 3.36Å
443	W	88.1	Confident	83.4	Confident	42 Å²	42	50.5 Å²	50.5	16%	0.159	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	116.2	179.2	-165.6	3.4	0	0	0	110.6	L419 S420 V422 R445 P492 K533	L419-W443 WeakPolarHBondContact CA-O 3.33Å; S420-W443 PolarHBondContact N-O 3Å; S420-W443 PolarHBondContact O-N 3.03Å; V422-W443 HydrophobicContact CG2-CB 3.83Å; V422-W443 HydrophobicContact CG2-CE3 4.14Å; W443-R445 HydrophobicContact CD2-CG 3.99Å; W443-R445 HydrophobicContact CG-CG 3.95Å; W443-R445 HydrophobicContact CZ2-CG 4.36Å; W443-P492 HydrophobicContact CH2-CB 4.2Å; W443-P492 HydrophobicContact CZ2-CB 4.43Å; W443-K533 HydrophobicContact CB-CG 4.3Å; W443-K533 HydrophobicContact CD2-CG 4.09Å; W443-K533 HydrophobicContact CG-CG 3.83Å
444	L	89.9	Confident	83.6	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	120.5	172.6	-176.7	68.5	0	0	0	109.3	L404 I417 L419 L528 F531 G532 F534	L404-L444 HydrophobicContact CD1-CD1 4.38Å; L404-L444 HydrophobicContact CD2-CD1 3.42Å; L404-L444 VanDerWaalsContact CD2-CD1 3.42Å; I417-L444 HydrophobicContact CG2-CD1 3.38Å; I417-L444 HydrophobicContact CG2-CG 4.43Å; L419-L444 HydrophobicContact CD1-CD1 4.09Å; L444-L528 HydrophobicContact CD2-CD1 4.07Å; L444-F531 HydrophobicContact CD2-CD1 4.08Å; L444-F531 HydrophobicContact CD2-CE1 4.45Å; L444-F531 HydrophobicContact CG-CD1 3.92Å; L444-F531 HydrophobicContact CG-CE1 4.43Å; L444-G532 PolarHBondContact N-O 2.9Å; L444-G532 PolarHBondContact O-N 2.86Å; L444-F534 HydrophobicContact CB-CD2 4.4Å; L444-F534 HydrophobicContact CB-CE2 4.13Å; L444-F534 HydrophobicContact CD2-CE2 4.48Å
445	R	84.4	Confident	83.8	Confident	78 Å²	78	49.1 Å²	49.1	29%	0.294	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	142.8	-176.2	-66.6	168.5	50	131.2	0.2	110.7	I417 D418 W443	I417-R445 CarbonylContact C-O 3.47Å; I417-R445 VanDerWaalsContact CA-O 3.27Å; I417-R445 WeakPolarHBondContact CA-O 3.1Å; D418-R445 HydrophobicContact CB-CB 4.29Å; D418-R445 PolarHBondContact N-O 2.94Å; D418-R445 PolarHBondContact O-N 3.18Å; W443-R445 HydrophobicContact CD2-CG 3.99Å; W443-R445 HydrophobicContact CG-CG 3.95Å; W443-R445 HydrophobicContact CZ2-CG 4.36Å
446	S	84.2	Confident	84	Confident	24 Å²	24	48.4 Å²	48.4	17%	0.168	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	148.5	163.8	-177	0	0	0	0	109.8	E415 E416 R448	E415-S446 VanDerWaalsContact CG-OG 3.3Å; E415-S446 WeakPolarHBondContact CG-OG 3.19Å; E415-S446 PolarHBondContact OE1-OG 2.81Å; E416-S446 WeakPolarHBondContact O-CA 3.47Å; S446-R448 WeakPolarHBondContact CB-O 3.33Å; S446-R448 PolarHBondContact OG-N 3.42Å; S446-R448 VanDerWaalsContact OG-N 3.12Å; S446-R448 PolarHBondContact OG-O 3.5Å
447	N	77.3	Confident	84.1	Confident	87 Å²	87	48.4 Å²	48.4	47%	0.465	25%	0.247	S	C	.	.	S	Bend	trans	-75.5	-13.7	167.9	72	-17	0	0	0	112.7	E416	E416-N447 HydrophobicContact CB-CB 4.12Å; E416-N447 VanDerWaalsContact CB-ND2 3.34Å; E416-N447 WeakPolarHBondContact CB-ND2 3.3Å; E416-N447 VanDerWaalsContact CG-ND2 3.29Å; E416-N447 WeakPolarHBondContact CG-ND2 3.4Å; E416-N447 PolarHBondContact N-ND2 3.25Å; E416-N447 PolarHBondContact N-OD1 3.02Å; E416-N447 PolarHBondContact O-N 2.83Å; E416-N447 PolarHBondContact O-OD1 3.06Å; E416-N447 PolarHBondContact OE2-ND2 3.01Å
448	R	71.2	Confident	84.2	Confident	122 Å²	122	47.6 Å²	47.6	46%	0.46	24%	0.243	S	C	.	.	S	Bend	trans	-101.3	153.1	174.6	-66	-165	177.2	-162.1	4	110.5	E413 G414 E415 S446 S450	E413-R448 VanDerWaalsContact O-CZ 3.28Å; E413-R448 PolarHBondContact O-NH1 3.47Å; E413-R448 PolarHBondContact O-NH2 3.13Å; G414-R448 PolarHBondContact O-NE 3.48Å; G414-R448 PolarHBondContact O-NH2 2.88Å; E415-R448 HydrophobicContact CG-CG 4.46Å; S446-R448 WeakPolarHBondContact CB-O 3.33Å; S446-R448 PolarHBondContact OG-N 3.42Å; S446-R448 VanDerWaalsContact OG-N 3.12Å; S446-R448 PolarHBondContact OG-O 3.5Å; R448-S450 PolarHBondContact O-N 2.84Å
449	M	63	Low	84.4	Confident	196 Å²	196	47.6 Å²	47.6	97%	0.966	24%	0.243	S	C	*	.			trans	-71.2	28.8	168.2	-68.7	-168.4	175.8	0	0	112.6	S451	M449-S451 PolarHBondContact O-N 3.21Å
450	S	67.3	Low	84.4	Confident	36 Å²	36	47.6 Å²	47.6	25%	0.252	24%	0.243	S	C	.	.			trans	-67	127.4	170.4	-51	0	0	0	0	108	E415 R448 F531	E415-S450 WeakPolarHBondContact OE1-CB 3.32Å; E415-S450 PolarHBondContact OE1-OG 2.91Å; R448-S450 PolarHBondContact O-N 2.84Å; S450-F531 WeakPolarHBondContact O-CD2 3.5Å
451	S	70.3	Confident	84.5	Confident	96 Å²	96	46.8 Å²	46.8	67%	0.671	24%	0.238	S	C	*	.			trans	-80.3	-23	177.1	54.3	0	0	0	0	113.1	M449	M449-S451 PolarHBondContact O-N 3.21Å
452	S	82.7	Confident	84.6	Confident	69 Å²	69	47.3 Å²	47.3	48%	0.483	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	157.7	-171.5	52.5	0	0	0	0	114	E529	S452-E529 CarbonylContact C-O 3.55Å; S452-E529 WeakPolarHBondContact CA-O 3.42Å; S452-E529 VanDerWaalsContact CB-O 3.29Å; S452-E529 WeakPolarHBondContact CB-O 3.3Å
453	L	85	Confident	84.6	Confident	11 Å²	11	47.3 Å²	47.3	6%	0.058	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	143.4	171.8	-65.4	167	0	0	0	110.1	L411 I417 K455 A457 L528 E529 F531	L411-L453 HydrophobicContact CD2-CD2 3.95Å; I417-L453 HydrophobicContact CD1-CD2 4.16Å; L453-K455 VanDerWaalsContact C-N 3.27Å; L453-K455 VanDerWaalsContact CB-O 3.3Å; L453-K455 WeakPolarHBondContact CB-O 3.35Å; L453-K455 PolarHBondContact O-N 3.37Å; L453-A457 HydrophobicContact CD1-CB 3.7Å; L453-L528 WeakPolarHBondContact CD1-O 3.44Å; L453-E529 PolarHBondContact N-O 3.5Å; L453-F531 HydrophobicContact CD2-CE1 3.97Å; L453-F531 HydrophobicContact CD2-CE2 4.1Å; L453-F531 HydrophobicContact CD2-CZ 3.4Å; L453-F531 HydrophobicContact CG-CE1 4.42Å; L453-F531 HydrophobicContact CG-CE2 4.24Å; L453-F531 HydrophobicContact CG-CZ 3.93Å
454	K	84	Confident	84.8	Confident	146 Å²	146	45.3 Å²	45.3	64%	0.635	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	-22.2	177.6	-65.3	176.8	-177.5	170.1	0	113.5	G409 A410 S412	G409-K454 WeakPolarHBondContact O-CB 3.37Å; A410-K454 PolarHBondContact O-N 2.78Å; S412-K454 WeakPolarHBondContact OG-CE 3.13Å; S412-K454 PolarHBondContact OG-NZ 2.83Å
455	K	87.1	Confident	84.8	Confident	51 Å²	51	45.2 Å²	45.2	22%	0.222	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	146.7	173.2	-68.4	-173.6	177.1	-176.4	0	108.3	P407 E408 A410 L453 A457 E750	P407-K455 HydrophobicContact CB-CB 4.48Å; P407-K455 HydrophobicContact CB-CD 4.19Å; E408-K455 WeakPolarHBondContact O-CD 3.38Å; E408-K455 WeakPolarHBondContact O-CE 3.48Å; E408-K455 PolarHBondContact O-NZ 3.5Å; E408-K455 VanDerWaalsContact O-NZ 3.16Å; A410-K455 HydrophobicContact CB-CB 3.92Å; L453-K455 VanDerWaalsContact C-N 3.27Å; L453-K455 VanDerWaalsContact CB-O 3.3Å; L453-K455 WeakPolarHBondContact CB-O 3.35Å; L453-K455 PolarHBondContact O-N 3.37Å; K455-A457 PolarHBondContact O-N 2.81Å; K455-E750 IonicContact NZ-OE1 3.68Å; K455-E750 PolarHBondContact NZ-OE1 2.92Å; K455-E750 IonicContact NZ-OE2 3.25Å
456	P	91.3	Very high	84.9	Confident	18 Å²	18	44.9 Å²	44.9	12%	0.117	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	134.6	-178.5	23.2	-30.1	0	0	0	112.2	P407 L527 L528 E529 L751	P407-P456 WeakPolarHBondContact CD-O 3.4Å; P407-P456 VanDerWaalsContact CG-O 3.23Å; P407-P456 WeakPolarHBondContact CG-O 3.3Å; P456-L527 HydrophobicContact CB-CB 4.39Å; P456-L527 HydrophobicContact CB-CD2 4.26Å; P456-L528 CarbonylContact C-O 3.6Å; P456-L528 WeakPolarHBondContact CA-O 3.43Å; P456-E529 HydrophobicContact CB-CG 3.99Å; P456-L751 HydrophobicContact CG-CD1 3.73Å; P456-L751 HydrophobicContact CG-CD2 4.11Å; P456-L751 HydrophobicContact CG-CG 3.95Å
457	A	91.7	Very high	84.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	151.8	171.3	0	0	0	0	0	110.8	L404 F405 I406 L453 K455 L527 L528	L404-A457 HydrophobicContact CD1-CB 4.08Å; F405-A457 CarbonylContact O-C 3.58Å; F405-A457 VanDerWaalsContact O-CA 3.25Å; F405-A457 WeakPolarHBondContact O-CA 3.21Å; F405-A457 VanDerWaalsContact O-CB 3.3Å; F405-A457 WeakPolarHBondContact O-CB 3.27Å; I406-A457 HydrophobicContact CG1-CB 4.43Å; L453-A457 HydrophobicContact CD1-CB 3.7Å; K455-A457 PolarHBondContact O-N 2.81Å; A457-L527 CarbonylContact O-C 3.54Å; A457-L527 WeakPolarHBondContact O-CA 3.2Å; A457-L528 PolarHBondContact N-O 3.15Å; A457-L528 PolarHBondContact O-N 3.38Å
458	V	93.4	Very high	84.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	112.3	177.3	-160.3	0	0	0	0	110.5	L404 F405 H525 I526 L527 T754 L755 S758	L404-V458 CarbonylContact C-O 3.49Å; L404-V458 WeakPolarHBondContact CA-O 3.38Å; F405-V458 HydrophobicContact CB-CB 4.28Å; F405-V458 HydrophobicContact CD1-CG2 4.25Å; F405-V458 PolarHBondContact N-O 3.31Å; F405-V458 PolarHBondContact O-N 2.93Å; V458-H525 HydrophobicContact CG1-CB 4.13Å; V458-I526 CarbonylContact C-O 3.5Å; V458-I526 WeakPolarHBondContact CA-O 3.45Å; V458-L527 HydrophobicContact CG2-CD2 3.72Å; V458-T754 HydrophobicContact CG2-CG2 3.67Å; V458-L755 HydrophobicContact CG1-CD1 4.15Å; V458-S758 WeakPolarHBondContact CG1-OG 3.37Å
459	L	94.3	Very high	83.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	118.3	172	176.6	58.7	0	0	0	109.9	I402 L404 L419 V442 I461 H525 I526 L528 F534	I402-L459 HydrophobicContact CG2-CD1 3.84Å; L404-L459 HydrophobicContact CB-CD1 4.48Å; L404-L459 HydrophobicContact CD1-CB 4Å; L404-L459 HydrophobicContact CD1-CD1 4.36Å; L419-L459 HydrophobicContact CD1-CD1 4.28Å; V442-L459 HydrophobicContact CB-CD2 4.28Å; V442-L459 HydrophobicContact CG1-CD1 4.24Å; V442-L459 HydrophobicContact CG1-CD2 4.09Å; L459-I461 HydrophobicContact CD1-CD1 4.25Å; L459-I461 HydrophobicContact CD1-CG1 3.99Å; L459-I461 HydrophobicContact CD2-CD1 3.76Å; L459-I461 HydrophobicContact CD2-CG1 4.38Å; L459-I461 HydrophobicContact CG-CD1 3.77Å; L459-I461 HydrophobicContact CG-CG1 3.85Å; L459-H525 CarbonylContact O-C 3.58Å; L459-H525 WeakPolarHBondContact O-CA 3.49Å; L459-I526 HydrophobicContact CB-CB 4.44Å; L459-I526 PolarHBondContact N-O 3.07Å; L459-I526 PolarHBondContact O-N 3.03Å; L459-L528 HydrophobicContact CB-CD1 3.56Å; L459-L528 HydrophobicContact CB-CG 4.24Å; L459-L528 HydrophobicContact CD2-CD1 3.76Å; L459-L528 HydrophobicContact CG-CD1 4.31Å; L459-F534 HydrophobicContact CD2-CB 4.49Å
460	S	93.6	Very high	82.8	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.007	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	126.7	178.8	-45.6	0	0	0	0	110.4	I402 S403 V524 H525	I402-S460 WeakPolarHBondContact CA-O 3.39Å; S403-S460 PolarHBondContact N-O 3.32Å; S403-S460 PolarHBondContact O-N 2.8Å; S403-S460 WeakPolarHBondContact OG-CB 3.29Å; S460-V524 VanDerWaalsContact CA-O 3.28Å; S460-V524 WeakPolarHBondContact CA-O 3.34Å; S460-H525 WeakPolarHBondContact CB-ND1 3.3Å; S460-H525 PolarHBondContact OG-ND1 2.84Å
461	I	93.5	Very high	81.3	Confident	1 Å²	1	40 Å²	40	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	141.1	-173.3	-49.3	166.8	0	0	0	109.6	I402 T439 P440 V442 L459 L523 V524	I402-I461 HydrophobicContact CG1-CG2 4.2Å; I402-I461 HydrophobicContact CG2-CG1 4.32Å; T439-I461 HydrophobicContact CG2-CG2 4.28Å; P440-I461 HydrophobicContact CG-CG2 3.92Å; V442-I461 HydrophobicContact CB-CD1 4.27Å; V442-I461 HydrophobicContact CG2-CD1 3.63Å; V442-I461 HydrophobicContact CG2-CG1 4.25Å; L459-I461 HydrophobicContact CD1-CD1 4.25Å; L459-I461 HydrophobicContact CD1-CG1 3.99Å; L459-I461 HydrophobicContact CD2-CD1 3.76Å; L459-I461 HydrophobicContact CD2-CG1 4.38Å; L459-I461 HydrophobicContact CG-CD1 3.77Å; L459-I461 HydrophobicContact CG-CG1 3.85Å; I461-L523 CarbonylContact O-C 3.53Å; I461-L523 WeakPolarHBondContact O-CA 3.35Å; I461-V524 HydrophobicContact CB-CG1 4.27Å; I461-V524 PolarHBondContact N-O 2.86Å; I461-V524 PolarHBondContact O-N 2.83Å
462	E	92.1	Very high	79.5	Confident	14 Å²	14	43 Å²	43	7%	0.065	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	135.7	167.6	-71.3	-178.6	159.9	0	0	111.3	A401 R522 L523 M570 R571	A401-E462 HydrophobicContact CB-CG 3.94Å; E462-R522 WeakPolarHBondContact CA-O 3.36Å; E462-L523 HydrophobicContact CB-CD2 4.34Å; E462-L523 HydrophobicContact CG-CD2 3.57Å; E462-M570 HydrophobicContact CB-CB 4.35Å; E462-M570 HydrophobicContact CB-CG 4.35Å; E462-R571 IonicContact OE1-CZ 2.7Å; E462-R571 VanDerWaalsContact OE1-CZ 3.26Å; E462-R571 IonicContact OE1-NE 3.83Å; E462-R571 PolarHBondContact OE1-NE 2.82Å; E462-R571 IonicContact OE1-NH2 2.91Å; E462-R571 PolarHBondContact OE1-NH2 2.8Å; E462-R571 WeakPolarHBondContact OE2-CB 3.37Å; E462-R571 PolarHBondContact OE2-N 2.91Å; E462-R571 IonicContact OE2-NE 3.45Å
463	H	92.6	Very high	77.4	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.253	C	S	.	.			trans	-119.8	153.9	176	75	82.5	0	0	0	111.6	I438 T439 A465 E520 R522 R550	I438-H463 HydrophobicContact CG2-CB 3.71Å; I438-H463 CarbonylContact O-C 3.55Å; I438-H463 WeakPolarHBondContact O-CA 3.22Å; I438-H463 WeakPolarHBondContact O-CB 3.43Å; T439-H463 HydrophobicContact CG2-CB 3.66Å; H463-A465 PolarHBondContact CE1-O 3.36Å; H463-A465 VanDerWaalsContact CE1-O 3.3Å; H463-A465 PolarHBondContact ND1-N 3.5Å; H463-A465 PolarHBondContact ND1-O 2.91Å; H463-E520 PolarHBondContact NE2-O 2.94Å; H463-R522 VanDerWaalsContact CD2-C 3.42Å; H463-R522 PolarHBondContact CD2-O 2.73Å; H463-R522 VanDerWaalsContact CD2-O 3.28Å; H463-R522 PolarHBondContact N-O 2.89Å; H463-R550 VanDerWaalsContact O-CZ 3.26Å; H463-R550 PolarHBondContact O-NH1 2.88Å; H463-R550 PolarHBondContact O-NH2 2.85Å
464	S	91.7	Very high	74.9	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.271	C	S	.	.			trans	-93.4	-9.7	-176.2	65.3	0	0	0	0	115	I438 L466 K549 R550	I438-S464 PolarHBondContact O-N 3.42Å; I438-S464 PolarHBondContact O-OG 3.23Å; S464-L466 PolarHBondContact O-N 3.46Å; S464-K549 CarbonylContact O-C 3.51Å; S464-K549 WeakPolarHBondContact O-CA 3.46Å; S464-R550 PolarHBondContact O-N 2.77Å
465	A	90.3	Very high	72.5	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-58.3	128.1	179.5	0	0	0	0	0	112.6	I438 H463 L467 W481 R550	I438-A465 HydrophobicContact CD1-CB 3.86Å; I438-A465 HydrophobicContact CG2-CB 3.84Å; H463-A465 PolarHBondContact CE1-O 3.36Å; H463-A465 VanDerWaalsContact CE1-O 3.3Å; H463-A465 PolarHBondContact ND1-N 3.5Å; H463-A465 PolarHBondContact ND1-O 2.91Å; A465-L467 HydrophobicContact CB-CD2 4.14Å; A465-L467 PolarHBondContact O-N 3.37Å; A465-W481 HydrophobicContact CB-CD2 4.3Å; A465-W481 HydrophobicContact CB-CZ2 4.24Å; A465-R550 PolarHBondContact O-NH1 2.97Å
466	L	87.3	Confident	70.2	Confident	70 Å²	70	44.4 Å²	44.4	37%	0.366	28%	0.284	S	S	.	.			trans	-80.8	110.8	168.2	-176.8	67.7	0	0	0	108.5	S464 W481 V548 R550 A597	S464-L466 PolarHBondContact O-N 3.46Å; L466-W481 PolarHBondContact O-NE1 3.29Å; L466-V548 HydrophobicContact CB-CB 4.27Å; L466-V548 HydrophobicContact CB-CG1 4.08Å; L466-V548 VanDerWaalsContact CB-O 3.23Å; L466-V548 WeakPolarHBondContact CB-O 2.96Å; L466-V548 HydrophobicContact CD2-CB 4.14Å; L466-V548 HydrophobicContact CD2-CG1 3.56Å; L466-V548 HydrophobicContact CG-CG1 4.48Å; L466-V548 PolarHBondContact N-O 2.96Å; L466-R550 HydrophobicContact CB-CG 3.89Å; L466-R550 HydrophobicContact CD1-CG 3.76Å; L466-R550 HydrophobicContact CG-CG 4.43Å; L466-A597 HydrophobicContact CD2-CB 4Å
467	L	82	Confident	67.8	Low	31 Å²	31	54.4 Å²	54.4	16%	0.162	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-98.2	139.8	176.3	-55.5	-179.4	0	0	0	109.7	A465 S469 V519 E520	A465-L467 HydrophobicContact CB-CD2 4.14Å; A465-L467 PolarHBondContact O-N 3.37Å; L467-S469 PolarHBondContact O-N 2.99Å; L467-V519 HydrophobicContact CD1-CG1 3.65Å; L467-E520 WeakPolarHBondContact CD1-O 3.46Å
468	P	67.7	Low	65.6	Low	68 Å²	68	61 Å²	61	44%	0.442	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-60.1	130.2	176.5	22.9	-30.6	0	0	0	110.5	S470 P476 N479	P468-S470 PolarHBondContact O-N 3.19Å; P468-P476 HydrophobicContact CG-CB 4.36Å; P468-N479 VanDerWaalsContact CD-OD1 3.3Å; P468-N479 WeakPolarHBondContact CD-OD1 3.35Å; P468-N479 WeakPolarHBondContact CG-OD1 2.81Å
469	S	54.7	Low	64.1	Low	84 Å²	84	63.1 Å²	63.1	59%	0.587	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-65.2	133.6	172	65.3	0	0	0	0	109.3	L467 N471	L467-S469 PolarHBondContact O-N 2.99Å; S469-N471 PolarHBondContact O-N 3.11Å; S469-N471 PolarHBondContact OG-OD1 3.09Å
470	S	46.6	Very low	63.3	Low	63 Å²	63	67 Å²	67	44%	0.441	39%	0.386	S	S	.	.			trans	-64.8	86.5	165.8	171.4	0	0	0	0	108.1	P468 N472 S474	P468-S470 PolarHBondContact O-N 3.19Å; S470-N472 PolarHBondContact O-N 3.35Å; S470-S474 PolarHBondContact OG-O 2.92Å
471	N	35.9	Very low	63	Low	117 Å²	117	67.6 Å²	67.6	63%	0.626	39%	0.388	S	S	*	.			trans	-77.9	115.5	166.4	-71.9	-7.7	0	0	0	106.7	S469	S469-N471 PolarHBondContact O-N 3.11Å; S469-N471 PolarHBondContact OG-OD1 3.09Å
472	N	32.5	Very low	62.9	Low	159 Å²	159	69.7 Å²	69.7	85%	0.85	40%	0.398	S	S	*	.	S	Bend	trans	78.4	47.8	171	-57.3	-14.3	0	0	0	118.5	S470 S474	S470-N472 PolarHBondContact O-N 3.35Å; N472-S474 PolarHBondContact O-N 2.97Å
473	G	37.9	Very low	63	Low	70 Å²	70	69.3 Å²	69.3	72%	0.722	40%	0.396	S	S	*	.	S	Bend	trans	67.5	-0.5	161.9	0	0	0	0	0	116.1
474	S	31.7	Very low	63	Low	63 Å²	63	69.6 Å²	69.6	44%	0.441	40%	0.398	S	S	.	.	S	Bend	trans	-81.4	136.6	162.7	46.7	0	0	0	0	109	S470 N472	S470-S474 PolarHBondContact OG-O 2.92Å; N472-S474 PolarHBondContact O-N 2.97Å
475	P	34.7	Very low	63.1	Low	108 Å²	108	69.6 Å²	69.6	70%	0.701	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-53.5	143.6	171.4	23.1	-32.3	0	0	0	109.2	R477	P475-R477 PolarHBondContact O-N 3.3Å; P475-R477 VanDerWaalsContact O-N 3.12Å
476	P	38.6	Very low	63.3	Low	66 Å²	66	70.2 Å²	70.2	43%	0.429	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-47.7	125.4	-179.3	18.9	-30.4	0	0	0	108.8	P468 L478	P468-P476 HydrophobicContact CG-CB 4.36Å; P476-L478 PolarHBondContact O-N 2.78Å
477	R	40.1	Very low	63.5	Low	227 Å²	227	67.3 Å²	67.3	86%	0.857	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-51.9	119	178.1	-74.7	-174.5	174.6	-168	-1.3	107	P475 N479	P475-R477 PolarHBondContact O-N 3.3Å; P475-R477 VanDerWaalsContact O-N 3.12Å; R477-N479 PolarHBondContact O-N 2.82Å
478	L	45.9	Very low	63.7	Low	140 Å²	140	65.8 Å²	65.8	73%	0.733	38%	0.379	S	S	*	.			trans	-23.6	104.6	-176	-146.8	81	0	0	0	111.5	P476 K541	P476-L478 PolarHBondContact O-N 2.78Å; L478-K541 HydrophobicContact CD2-CD 4.43Å; L478-K541 VanDerWaalsContact CG-NZ 3.34Å
479	N	61.8	Low	64.2	Low	43 Å²	43	68.5 Å²	68.5	23%	0.23	39%	0.385	C	S	.	.			trans	-46.3	144.5	-169.7	-72.6	-23.5	0	0	0	113.1	P468 R477 W481 K541	P468-N479 VanDerWaalsContact CD-OD1 3.3Å; P468-N479 WeakPolarHBondContact CD-OD1 3.35Å; P468-N479 WeakPolarHBondContact CG-OD1 2.81Å; R477-N479 PolarHBondContact O-N 2.82Å; N479-W481 HydrophobicContact CB-CB 4.23Å; N479-W481 PolarHBondContact O-N 2.78Å; N479-K541 WeakPolarHBondContact O-CD 3.08Å
480	D	78.2	Confident	64.9	Low	82 Å²	82	66 Å²	66	44%	0.439	36%	0.364	S	S	.	.	S	Bend	trans	-59.3	-27.8	162.8	-79.6	-19.5	0	0	0	111.2	K541 A545 L547	D480-K541 WeakPolarHBondContact O-CB 3.25Å; D480-K541 PolarHBondContact O-N 2.81Å; D480-A545 HydrophobicContact CB-CB 3.91Å; D480-L547 VanDerWaalsContact C-CD2 3.42Å; D480-L547 HydrophobicContact CB-CD2 3.5Å; D480-L547 WeakPolarHBondContact O-CD2 3.26Å
481	W	87.9	Confident	65.4	Low	13 Å²	13	68.7 Å²	68.7	5%	0.049	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	130.2	177.6	-67.7	96.4	0	0	0	112.8	T436 I438 A465 L466 N479 L483 L547 V548 K549 F600	T436-W481 HydrophobicContact CG2-CH2 3.94Å; T436-W481 HydrophobicContact CG2-CZ3 3.86Å; I438-W481 HydrophobicContact CD1-CE3 3.98Å; I438-W481 HydrophobicContact CD1-CH2 3.33Å; I438-W481 HydrophobicContact CD1-CZ2 4.07Å; I438-W481 HydrophobicContact CD1-CZ3 3.28Å; I438-W481 HydrophobicContact CG1-CE3 4.48Å; I438-W481 HydrophobicContact CG1-CH2 4.5Å; I438-W481 HydrophobicContact CG1-CZ3 4Å; A465-W481 HydrophobicContact CB-CD2 4.3Å; A465-W481 HydrophobicContact CB-CZ2 4.24Å; L466-W481 PolarHBondContact O-NE1 3.29Å; N479-W481 HydrophobicContact CB-CB 4.23Å; N479-W481 PolarHBondContact O-N 2.78Å; W481-L483 HydrophobicContact CB-CD2 4.15Å; W481-L483 HydrophobicContact CB-CG 4.2Å; W481-L483 HydrophobicContact CD2-CD2 4.45Å; W481-L483 HydrophobicContact CE3-CD2 4.08Å; W481-L547 HydrophobicContact CB-CD2 4.44Å; W481-L547 HydrophobicContact CD2-CB 4.5Å; W481-L547 HydrophobicContact CD2-CD1 4.07Å; W481-L547 HydrophobicContact CD2-CD2 3.72Å; W481-L547 HydrophobicContact CD2-CG 4.34Å; W481-L547 HydrophobicContact CE3-CD1 3.68Å; W481-L547 HydrophobicContact CE3-CD2 4.18Å; W481-L547 HydrophobicContact CE3-CG 4.41Å; W481-L547 HydrophobicContact CG-CD2 3.81Å; W481-L547 HydrophobicContact CH2-CB 4.01Å; W481-L547 HydrophobicContact CH2-CD1 4.15Å; W481-L547 HydrophobicContact CZ2-CB 3.81Å; W481-L547 HydrophobicContact CZ2-CD2 4.46Å; W481-L547 HydrophobicContact CZ2-CG 4.5Å; W481-L547 HydrophobicContact CZ3-CB 4.43Å; W481-L547 HydrophobicContact CZ3-CD1 3.72Å; W481-V548 VanDerWaalsContact CZ2-O 3.31Å; W481-V548 WeakPolarHBondContact CZ2-O 3.39Å; W481-K549 HydrophobicContact CH2-CG 4.22Å; W481-K549 HydrophobicContact CZ2-CG 4.35Å; W481-F600 AromaticContact CH2-CD1 3.93Å; W481-F600 HydrophobicContact CH2-CD1 3.93Å; W481-F600 AromaticContact CH2-CE1 3.58Å; W481-F600 HydrophobicContact CH2-CE1 3.58Å; W481-F600 HydrophobicContact CZ2-CD1 4.5Å; W481-F600 HydrophobicContact CZ2-CE1 4.34Å; W481-F600 AromaticContact CZ3-CE1 3.95Å; W481-F600 HydrophobicContact CZ3-CE1 3.95Å
482	Q	90.9	Very high	66.1	Low	45 Å²	45	66.2 Å²	66.2	21%	0.21	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	115.3	154.8	177.1	168.7	2	0	0	107.5	V505 G538 E539 K541	Q482-V505 HydrophobicContact CG-CG1 4.09Å; Q482-G538 WeakPolarHBondContact O-CA 3.46Å; Q482-E539 HydrophobicContact CB-CG 3.92Å; Q482-E539 HydrophobicContact CG-CG 4.18Å; Q482-E539 PolarHBondContact N-O 3.34Å; Q482-E539 PolarHBondContact O-N 3.3Å; Q482-K541 HydrophobicContact CB-CB 4.31Å
483	L	93.4	Very high	66.9	Low	7 Å²	7	69.1 Å²	69.1	4%	0.037	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	137	-177.2	-61.1	173.8	0	0	0	109.5	I438 W481 V506 V519 L536 I537	I438-L483 HydrophobicContact CG1-CD2 4.12Å; I438-L483 HydrophobicContact CG2-CD2 4.33Å; W481-L483 HydrophobicContact CB-CD2 4.15Å; W481-L483 HydrophobicContact CB-CG 4.2Å; W481-L483 HydrophobicContact CD2-CD2 4.45Å; W481-L483 HydrophobicContact CE3-CD2 4.08Å; L483-V506 HydrophobicContact CB-CB 4.15Å; L483-V506 HydrophobicContact CB-CG2 3.86Å; L483-V506 WeakPolarHBondContact O-CG2 3.33Å; L483-V506 PolarHBondContact O-N 3.48Å; L483-V519 HydrophobicContact CD1-CB 4.39Å; L483-V519 HydrophobicContact CD1-CG1 3.88Å; L483-V519 HydrophobicContact CD1-CG2 3.92Å; L483-L536 HydrophobicContact CB-CD1 4.39Å; L483-L536 HydrophobicContact CD1-CD2 4.36Å; L483-I537 WeakPolarHBondContact CA-O 3.48Å
484	S	93.3	Very high	67.3	Low	5 Å²	5	72 Å²	72	4%	0.035	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	130.8	179.8	-55.2	0	0	0	0	109.9	A504 I537	S484-A504 CarbonylContact C-O 3.59Å; S484-A504 WeakPolarHBondContact CA-O 3.31Å; S484-I537 PolarHBondContact N-O 2.84Å; S484-I537 WeakPolarHBondContact O-CG1 3.36Å; S484-I537 PolarHBondContact O-N 2.79Å
485	C	94.6	Very high	68	Low	0 Å²	0	73.4 Å²	73.4	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122	171	-175.6	0	0	0	0	108.6	A503 A504 L536	C485-A503 PolarHBondContact O-N 3.38Å; C485-A504 HydrophobicContact CB-CB 4.41Å; C485-A504 PolarHBondContact N-O 2.74Å; C485-A504 PolarHBondContact O-N 2.95Å; C485-L536 HydrophobicContact CB-CD1 4.22Å
486	L	92.7	Very high	68.7	Low	13 Å²	13	74.1 Å²	74.1	7%	0.068	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	145.1	172.5	-53.2	-177.8	0	0	0	109.8	P429 W500 T501 I502 F534 V535 I537	P429-L486 HydrophobicContact CB-CD1 3.62Å; P429-L486 HydrophobicContact CG-CD1 3.91Å; L486-W500 HydrophobicContact CB-CE3 3.56Å; L486-W500 HydrophobicContact CB-CZ3 3.99Å; L486-T501 CarbonylContact C-O 3.5Å; L486-T501 VanDerWaalsContact CA-O 3.27Å; L486-T501 WeakPolarHBondContact CA-O 3.34Å; L486-I502 HydrophobicContact CD2-CB 4Å; L486-I502 HydrophobicContact CD2-CG1 3.43Å; L486-I502 VanDerWaalsContact CD2-CG1 3.43Å; L486-I502 HydrophobicContact CD2-CG2 4.35Å; L486-F534 WeakPolarHBondContact O-CA 3.17Å; L486-V535 HydrophobicContact CB-CG1 3.93Å; L486-V535 HydrophobicContact CD1-CG1 4.4Å; L486-V535 HydrophobicContact CG-CG1 4.47Å; L486-V535 PolarHBondContact N-O 2.94Å; L486-V535 PolarHBondContact O-N 2.94Å; L486-V535 VanDerWaalsContact O-N 3.16Å; L486-I537 HydrophobicContact CD1-CD1 3.95Å; L486-I537 HydrophobicContact CD1-CG1 4.26Å; L486-I537 HydrophobicContact CD1-CG2 3.87Å; L486-I537 HydrophobicContact CD2-CD1 4.31Å; L486-I537 HydrophobicContact CG-CD1 4.21Å; L486-I537 HydrophobicContact CG-CG1 4.18Å; L486-I537 HydrophobicContact CG-CG2 4.28Å
487	V	91.6	Very high	69.5	Low	9 Å²	9	78.2 Å²	78.2	6%	0.055	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.2	172.6	65.8	0	0	0	0	110	E489 W500 T501 A503 K533 F534	V487-E489 HydrophobicContact CG2-CG 4.49Å; V487-W500 WeakPolarHBondContact O-CA 3.28Å; V487-T501 WeakPolarHBondContact CG1-OG1 3.34Å; V487-T501 PolarHBondContact N-O 2.96Å; V487-T501 PolarHBondContact O-N 2.98Å; V487-T501 PolarHBondContact O-OG1 2.85Å; V487-A503 HydrophobicContact CB-CB 4.14Å; V487-A503 HydrophobicContact CG1-CB 3.82Å; V487-K533 CarbonylContact C-O 3.59Å; V487-K533 VanDerWaalsContact CA-O 3.28Å; V487-K533 WeakPolarHBondContact CA-O 3.37Å; V487-F534 HydrophobicContact CB-CD1 4.1Å; V487-F534 HydrophobicContact CB-CE1 3.88Å; V487-F534 HydrophobicContact CG2-CD1 3.91Å; V487-F534 HydrophobicContact CG2-CE1 3.36Å; V487-F534 HydrophobicContact CG2-CZ 3.8Å
488	S	87.7	Confident	70.5	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	120.3	166.9	175.3	0	0	0	0	109	E490 G532 K533	S488-E490 PolarHBondContact O-N 3.3Å; S488-E490 WeakPolarHBondContact OG-CG 3.23Å; S488-G532 CarbonylContact O-C 3.49Å; S488-G532 VanDerWaalsContact O-CA 3.3Å; S488-G532 WeakPolarHBondContact O-CA 3.01Å; S488-K533 PolarHBondContact N-O 3.37Å; S488-K533 PolarHBondContact O-N 2.82Å
489	E	78.6	Confident	72.1	Confident	125 Å²	125	65.4 Å²	65.4	58%	0.584	35%	0.349	S	S	*	.			trans	-86.7	13.3	-178.7	-61.6	-173.7	173.4	0	0	112.6	V487 L491	V487-E489 HydrophobicContact CG2-CG 4.49Å; E489-L491 PolarHBondContact O-N 2.78Å
490	E	68.1	Low	73.2	Confident	32 Å²	32	64.9 Å²	64.9	15%	0.15	34%	0.344	C	S	.	.			trans	-51.4	130.3	-175.7	-82.2	-179	165.9	0	0	114	S488 G498 D499 K533	S488-E490 PolarHBondContact O-N 3.3Å; S488-E490 WeakPolarHBondContact OG-CG 3.23Å; E490-G498 WeakPolarHBondContact OE1-CA 3.23Å; E490-G498 PolarHBondContact OE1-N 2.9Å; E490-D499 PolarHBondContact OE1-N 3.27Å; E490-K533 IonicContact OE2-NZ 2.91Å; E490-K533 PolarHBondContact OE2-NZ 3.42Å
491	L	56.9	Low	73.6	Confident	118 Å²	118	62.2 Å²	62.2	62%	0.618	33%	0.33	S	S	*	.			trans	-74.8	146.8	171	-68.7	170.8	0	0	0	110.4	E489 Y493 E494	E489-L491 PolarHBondContact O-N 2.78Å; L491-Y493 PolarHBondContact O-N 3.49Å; L491-E494 PolarHBondContact O-N 3.27Å
492	P	51.2	Low	73.7	Confident	66 Å²	66	64.1 Å²	64.1	43%	0.429	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-0.4	-166.2	21.7	-32.8	0	0	0	117.4	W443	W443-P492 HydrophobicContact CH2-CB 4.2Å; W443-P492 HydrophobicContact CZ2-CB 4.43Å
493	Y	49.7	Very low	73.7	Confident	220 Å²	220	63 Å²	63	86%	0.863	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.2	-3.2	-171.9	-74.2	-78.4	0	0	0	115.3	L491	L491-Y493 PolarHBondContact O-N 3.49Å
494	E	46.1	Very low	73.6	Confident	131 Å²	131	62.7 Å²	62.7	61%	0.612	34%	0.337	S	S	*	.			trans	-103.8	106.7	-178.1	-69.4	-168.6	173.3	0	0	110.4	L491 L496	L491-E494 PolarHBondContact O-N 3.27Å; E494-L496 HydrophobicContact CB-CD1 4.18Å; E494-L496 PolarHBondContact O-N 3.42Å
495	G	46.9	Very low	73.5	Confident	92 Å²	92	63.1 Å²	63.1	95%	0.948	34%	0.34	S	S	*	.			trans	-74.1	34.2	172.7	0	0	0	0	0	113.4
496	L	49.6	Very low	73.3	Confident	123 Å²	123	64.9 Å²	64.9	64%	0.644	35%	0.351	S	S	*	.	S	Bend	trans	-82.7	157.4	173.2	-84.3	131.7	0	0	0	109.6	E494 G498	E494-L496 HydrophobicContact CB-CD1 4.18Å; E494-L496 PolarHBondContact O-N 3.42Å; L496-G498 PolarHBondContact O-N 2.84Å
497	I	54.1	Low	72.9	Confident	151 Å²	151	66.8 Å²	66.8	77%	0.774	37%	0.373	S	S	*	.	S	Bend	trans	-60.7	120.2	176.4	-63.7	163.1	0	0	0	107.8	D499	I497-D499 PolarHBondContact O-N 2.65Å
498	G	62.4	Low	72.7	Confident	10 Å²	10	71.1 Å²	71.1	10%	0.103	39%	0.393	C	S	.	.			trans	-16.7	107.9	172.9	0	0	0	0	0	115.9	E490 L496 W500	E490-G498 WeakPolarHBondContact OE1-CA 3.23Å; E490-G498 PolarHBondContact OE1-N 2.9Å; L496-G498 PolarHBondContact O-N 2.84Å; G498-W500 PolarHBondContact O-N 3.28Å
499	D	77.7	Confident	72.6	Confident	89 Å²	89	71.9 Å²	71.9	48%	0.476	40%	0.397	S	S	.	.			trans	-72.7	65.1	168	-166.5	34.8	0	0	0	110	K55 E490 I497	K55-D499 IonicContact NZ-OD1 3.38Å; E490-D499 PolarHBondContact OE1-N 3.27Å; I497-D499 PolarHBondContact O-N 2.65Å
500	W	86.6	Confident	72.7	Confident	32 Å²	32	67.6 Å²	67.6	12%	0.121	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	123	178.9	-73.8	97.7	0	0	0	109.9	C427 P429 V441 L486 V487 G498 K533 V535	C427-W500 WeakPolarHBondContact O-CZ2 3.34Å; P429-W500 VanDerWaalsContact CA-CD1 3.45Å; P429-W500 HydrophobicContact CB-CB 4.22Å; P429-W500 HydrophobicContact CB-CD2 3.81Å; P429-W500 HydrophobicContact CB-CE3 4.46Å; P429-W500 HydrophobicContact CB-CG 3.69Å; V441-W500 HydrophobicContact CG1-CH2 4.01Å; V441-W500 HydrophobicContact CG1-CZ2 4.21Å; L486-W500 HydrophobicContact CB-CE3 3.56Å; L486-W500 HydrophobicContact CB-CZ3 3.99Å; V487-W500 WeakPolarHBondContact O-CA 3.28Å; G498-W500 PolarHBondContact O-N 3.28Å; W500-K533 HydrophobicContact CH2-CB 3.52Å; W500-K533 HydrophobicContact CZ2-CB 3.91Å; W500-K533 HydrophobicContact CZ2-CD 4.23Å; W500-K533 HydrophobicContact CZ3-CB 4.22Å; W500-K533 WeakPolarHBondContact CZ3-O 3.28Å; W500-V535 HydrophobicContact CE3-CG1 4.2Å; W500-V535 HydrophobicContact CH2-CB 4.25Å; W500-V535 HydrophobicContact CH2-CG1 3.7Å; W500-V535 HydrophobicContact CZ3-CB 4.36Å; W500-V535 HydrophobicContact CZ3-CG1 3.53Å
501	T	86.5	Confident	73.1	Confident	26 Å²	26	72 Å²	72	16%	0.16	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	154.5	173.9	58.9	0	0	0	0	109.7	K55 L486 V487 A503	K55-T501 HydrophobicContact CB-CG2 4.4Å; K55-T501 HydrophobicContact CG-CG2 4.09Å; L486-T501 CarbonylContact C-O 3.5Å; L486-T501 VanDerWaalsContact CA-O 3.27Å; L486-T501 WeakPolarHBondContact CA-O 3.34Å; V487-T501 WeakPolarHBondContact CG1-OG1 3.34Å; V487-T501 PolarHBondContact N-O 2.96Å; V487-T501 PolarHBondContact O-N 2.98Å; V487-T501 PolarHBondContact O-OG1 2.85Å; T501-A503 PolarHBondContact O-N 3.12Å
502	I	89.7	Confident	74.1	Confident	53 Å²	53	71 Å²	71	27%	0.272	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	111.1	176.4	-56	160	0	0	0	108	P57 L486 V505	P57-I502 HydrophobicContact CG-CB 3.67Å; P57-I502 HydrophobicContact CG-CD1 3.89Å; P57-I502 HydrophobicContact CG-CG1 4.39Å; P57-I502 HydrophobicContact CG-CG2 3.66Å; L486-I502 HydrophobicContact CD2-CB 4Å; L486-I502 HydrophobicContact CD2-CG1 3.43Å; L486-I502 VanDerWaalsContact CD2-CG1 3.43Å; L486-I502 HydrophobicContact CD2-CG2 4.35Å; I502-V505 HydrophobicContact CG2-CG2 3.85Å
503	A	90.1	Very high	75.7	Confident	20 Å²	20	68.4 Å²	68.4	17%	0.165	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	-40.9	175.6	0	0	0	0	0	111.7	C485 V487 T501 T513 V515	C485-A503 PolarHBondContact O-N 3.38Å; V487-A503 HydrophobicContact CB-CB 4.14Å; V487-A503 HydrophobicContact CG1-CB 3.82Å; T501-A503 PolarHBondContact O-N 3.12Å; A503-T513 WeakPolarHBondContact O-CG2 3.33Å; A503-V515 HydrophobicContact CB-CB 4.25Å; A503-V515 HydrophobicContact CB-CG2 3.97Å
504	A	90.7	Very high	77.4	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.008	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	143.9	-180	0	0	0	0	0	111.2	S484 C485 E509 T513	S484-A504 CarbonylContact C-O 3.59Å; S484-A504 WeakPolarHBondContact CA-O 3.31Å; C485-A504 HydrophobicContact CB-CB 4.41Å; C485-A504 PolarHBondContact N-O 2.74Å; C485-A504 PolarHBondContact O-N 2.95Å; A504-E509 HydrophobicContact CB-CG 4.43Å; A504-T513 HydrophobicContact CB-CG2 3.5Å
505	V	91.5	Very high	79.5	Confident	14 Å²	14	54.7 Å²	54.7	9%	0.085	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120.5	163	180	0	0	0	0	106.9	P57 Q482 I502 G507 Q508 E509	P57-V505 HydrophobicContact CG-CG2 4.24Å; Q482-V505 HydrophobicContact CG-CG1 4.09Å; I502-V505 HydrophobicContact CG2-CG2 3.85Å; V505-G507 PolarHBondContact O-N 3.39Å; V505-Q508 HydrophobicContact CB-CB 4.12Å; V505-Q508 HydrophobicContact CG1-CB 4.14Å; V505-Q508 HydrophobicContact CG1-CG 4.27Å; V505-Q508 CarbonylContact O-C 3.36Å; V505-Q508 WeakPolarHBondContact O-CA 3.46Å; V505-Q508 PolarHBondContact O-N 2.87Å; V505-E509 PolarHBondContact O-N 3.01Å
506	V	90.1	Very high	81.7	Confident	38 Å²	38	50.3 Å²	50.3	23%	0.23	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	121.9	-171.3	-176.4	0	0	0	0	110.7	L483 Q508 E509 C517 V519 L536	L483-V506 HydrophobicContact CB-CB 4.15Å; L483-V506 HydrophobicContact CB-CG2 3.86Å; L483-V506 WeakPolarHBondContact O-CG2 3.33Å; L483-V506 PolarHBondContact O-N 3.48Å; V506-Q508 VanDerWaalsContact C-N 3.33Å; V506-E509 VanDerWaalsContact CA-OE1 3.29Å; V506-E509 WeakPolarHBondContact CA-OE1 3.25Å; V506-C517 HydrophobicContact CG2-CB 3.8Å; V506-V519 HydrophobicContact CG1-CG2 4.15Å; V506-V519 HydrophobicContact CG2-CG2 4.27Å; V506-L536 HydrophobicContact CG2-CD1 4.42Å
507	G	85.8	Confident	83.8	Confident	53 Å²	53	44.4 Å²	44.4	55%	0.546	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.2	6.1	-175.2	0	0	0	0	0	115.1	V505 E509	V505-G507 PolarHBondContact O-N 3.39Å; G507-E509 WeakPolarHBondContact CA-OE2 3.29Å; G507-E509 VanDerWaalsContact N-CD 3.25Å; G507-E509 PolarHBondContact N-OE1 2.93Å; G507-E509 PolarHBondContact N-OE2 2.81Å
508	Q	85.7	Confident	85.6	Confident	100 Å²	100	38 Å²	38	47%	0.467	22%	0.218	S	C	.	.			trans	-128.8	27.4	171.8	-59.4	179.3	26.8	0	0	110.6	V505 V506	V505-Q508 HydrophobicContact CB-CB 4.12Å; V505-Q508 HydrophobicContact CG1-CB 4.14Å; V505-Q508 HydrophobicContact CG1-CG 4.27Å; V505-Q508 CarbonylContact O-C 3.36Å; V505-Q508 WeakPolarHBondContact O-CA 3.46Å; V505-Q508 PolarHBondContact O-N 2.87Å; V506-Q508 VanDerWaalsContact C-N 3.33Å
509	E	86.4	Confident	87	Confident	16 Å²	16	39 Å²	39	8%	0.075	22%	0.222	C	C	.	.			trans	-64.8	150	177.3	-60.2	85.7	174.3	0	0	111.6	A504 V505 V506 G507 T513 H737 Y738	A504-E509 HydrophobicContact CB-CG 4.43Å; V505-E509 PolarHBondContact O-N 3.01Å; V506-E509 VanDerWaalsContact CA-OE1 3.29Å; V506-E509 WeakPolarHBondContact CA-OE1 3.25Å; G507-E509 WeakPolarHBondContact CA-OE2 3.29Å; G507-E509 VanDerWaalsContact N-CD 3.25Å; G507-E509 PolarHBondContact N-OE1 2.93Å; G507-E509 PolarHBondContact N-OE2 2.81Å; E509-T513 HydrophobicContact CB-CG2 4.19Å; E509-T513 HydrophobicContact CG-CG2 4.08Å; E509-H737 IonicContact OE1-CD2 2.76Å; E509-H737 IonicContact OE1-NE2 3.93Å; E509-H737 PolarHBondContact OE1-NE2 3.02Å; E509-H737 IonicContact OE2-CD2 2.66Å; E509-Y738 HydrophobicContact CB-CD1 3.34Å; E509-Y738 HydrophobicContact CB-CD2 4.07Å; E509-Y738 HydrophobicContact CB-CE1 3.61Å; E509-Y738 HydrophobicContact CB-CE2 4.31Å; E509-Y738 HydrophobicContact CB-CG 3.63Å; E509-Y738 HydrophobicContact CG-CD1 4.12Å; E509-Y738 HydrophobicContact CG-CG 4.42Å; E509-Y738 WeakPolarHBondContact O-CE2 3.48Å
510	T	81.1	Confident	87.4	Confident	35 Å²	35	37.3 Å²	37.3	22%	0.215	21%	0.211	C	C	.	.			trans	-127.5	173	-176.8	70.7	0	0	0	0	110.2	I60 N512 T513 Y738	I60-T510 HydrophobicContact CD1-CG2 3.47Å; I60-T510 VanDerWaalsContact CD1-CG2 3.47Å; T510-N512 PolarHBondContact O-N 3.32Å; T510-N512 VanDerWaalsContact O-N 3.13Å; T510-T513 PolarHBondContact N-OG1 3.3Å; T510-T513 VanDerWaalsContact O-CB 3.3Å; T510-T513 WeakPolarHBondContact O-CB 3.41Å; T510-T513 PolarHBondContact O-N 3.4Å; T510-T513 PolarHBondContact O-OG1 2.94Å; T510-T513 PolarHBondContact OG1-OG1 2.85Å; T510-Y738 WeakPolarHBondContact CA-OH 3.17Å; T510-Y738 WeakPolarHBondContact O-CE1 3.46Å; T510-Y738 PolarHBondContact O-OH 2.96Å
511	L	76.9	Confident	87.3	Confident	124 Å²	124	39.5 Å²	39.5	65%	0.649	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.8	-178	-69.5	170.6	0	0	0	112.8	Y738 P740	L511-Y738 WeakPolarHBondContact CA-OH 3.37Å; L511-Y738 PolarHBondContact N-OH 3.5Å; L511-P740 HydrophobicContact CD2-CB 3.82Å
512	N	77	Confident	87.3	Confident	97 Å²	97	44.6 Å²	44.6	52%	0.519	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	1.1	178.6	-60.4	-21.8	0	0	0	112.9	T510 D514	T510-N512 PolarHBondContact O-N 3.32Å; T510-N512 VanDerWaalsContact O-N 3.13Å; N512-D514 PolarHBondContact O-N 3.43Å
513	T	85.2	Confident	87.3	Confident	11 Å²	11	43 Å²	43	7%	0.067	24%	0.24	C	C	.	.			trans	-77.2	109.6	179.1	-56	0	0	0	0	109.2	A503 A504 E509 T510 V515	A503-T513 WeakPolarHBondContact O-CG2 3.33Å; A504-T513 HydrophobicContact CB-CG2 3.5Å; E509-T513 HydrophobicContact CB-CG2 4.19Å; E509-T513 HydrophobicContact CG-CG2 4.08Å; T510-T513 PolarHBondContact N-OG1 3.3Å; T510-T513 VanDerWaalsContact O-CB 3.3Å; T510-T513 WeakPolarHBondContact O-CB 3.41Å; T510-T513 PolarHBondContact O-N 3.4Å; T510-T513 PolarHBondContact O-OG1 2.94Å; T510-T513 PolarHBondContact OG1-OG1 2.85Å; T513-V515 WeakPolarHBondContact CG2-O 3.27Å; T513-V515 PolarHBondContact O-N 2.78Å
514	D	84.5	Confident	87.5	Confident	61 Å²	61	42 Å²	42	33%	0.326	23%	0.232	S	C	.	.			trans	-79.4	-5.6	-179.1	-64.8	-21.3	0	0	0	113.1	R54 N512 E529	R54-D514 IonicContact NH1-OD2 2.72Å; N512-D514 PolarHBondContact O-N 3.43Å; D514-E529 WeakPolarHBondContact O-CG 3.42Å
515	V	91.2	Very high	87.6	Confident	2 Å²	2	42 Å²	42	1%	0.012	23%	0.231	C	C	.	.			trans	-124	138.6	-178.1	175	0	0	0	0	110.6	A503 T513 I526 L527 L528	A503-V515 HydrophobicContact CB-CB 4.25Å; A503-V515 HydrophobicContact CB-CG2 3.97Å; T513-V515 WeakPolarHBondContact CG2-O 3.27Å; T513-V515 PolarHBondContact O-N 2.78Å; V515-I526 HydrophobicContact CG1-CG2 3.3Å; V515-L527 WeakPolarHBondContact CA-O 3.31Å; V515-L528 HydrophobicContact CG1-CD2 4.5Å; V515-L528 HydrophobicContact CG2-CD2 4.35Å
516	Y	93	Very high	87.8	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	128.2	170.4	175.1	-79.6	0	0	0	110.3	Q518 I526 L527 V735 H737 Y741 F742 L755	Y516-Q518 HydrophobicContact CE1-CB 4.03Å; Y516-Q518 PolarHBondContact OH-OE1 3.01Å; Y516-Q518 VanDerWaalsContact OH-OE1 3.1Å; Y516-I526 CarbonylContact O-C 3.6Å; Y516-I526 WeakPolarHBondContact O-CA 3.23Å; Y516-L527 HydrophobicContact CD1-CD1 3.72Å; Y516-L527 HydrophobicContact CG-CD1 4.14Å; Y516-L527 PolarHBondContact N-O 2.84Å; Y516-L527 PolarHBondContact O-N 3.09Å; Y516-V735 VanDerWaalsContact OH-C 3.29Å; Y516-V735 PolarHBondContact OH-O 3.44Å; Y516-H737 AromaticContact CD2-NE2 3.98Å; Y516-H737 AromaticContact CE1-CE1 3.64Å; Y516-H737 AromaticContact CE2-CE1 3.36Å; Y516-H737 WeakPolarHBondContact CE2-CE1 3.37Å; Y516-H737 AromaticContact CE2-ND1 3.99Å; Y516-H737 AromaticContact CE2-NE2 3.4Å; Y516-H737 WeakPolarHBondContact CE2-NE2 3.23Å; Y516-H737 AromaticContact CZ-CE1 3.02Å; Y516-H737 AromaticContact CZ-ND1 3.58Å; Y516-H737 AromaticContact CZ-NE2 3.59Å; Y516-H737 PolarHBondContact OH-CE1 3.15Å; Y516-H737 PolarHBondContact OH-ND1 3.25Å; Y516-Y741 HydrophobicContact CD2-CD1 4.01Å; Y516-Y741 HydrophobicContact CD2-CG 4.03Å; Y516-Y741 HydrophobicContact CG-CD1 4.02Å; Y516-Y741 HydrophobicContact CG-CE1 4.31Å; Y516-Y741 HydrophobicContact CG-CG 4.32Å; Y516-F742 HydrophobicContact CD1-CZ 4.28Å; Y516-F742 HydrophobicContact CD2-CE2 4.27Å; Y516-F742 HydrophobicContact CD2-CZ 4.27Å; Y516-F742 HydrophobicContact CE1-CE2 4.41Å; Y516-F742 AromaticContact CE1-CZ 3.83Å; Y516-F742 HydrophobicContact CE1-CZ 3.83Å; Y516-F742 AromaticContact CE2-CE2 3.63Å; Y516-F742 HydrophobicContact CE2-CE2 3.63Å; Y516-F742 AromaticContact CE2-CZ 3.83Å; Y516-F742 HydrophobicContact CE2-CZ 3.83Å; Y516-F742 HydrophobicContact CG-CZ 4.47Å; Y516-F742 AromaticContact CZ-CE2 3.7Å; Y516-F742 AromaticContact CZ-CZ 3.58Å; Y516-L755 HydrophobicContact CD1-CD2 4.33Å; Y516-L755 HydrophobicContact CE1-CD2 3.74Å
517	C	93.9	Very high	88	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	107.5	-176	-66.3	0	0	0	0	111.2	V506 H737	V506-C517 HydrophobicContact CG2-CB 3.8Å; C517-H737 PolarHBondContact O-CE1 3.13Å
518	Q	92.6	Very high	88.4	Confident	17 Å²	17	37 Å²	37	8%	0.079	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	107.3	169	-173.7	65.9	28.2	0	0	110.1	Y516 V524 H525 A734 V735 H737 L755	Y516-Q518 HydrophobicContact CE1-CB 4.03Å; Y516-Q518 PolarHBondContact OH-OE1 3.01Å; Y516-Q518 VanDerWaalsContact OH-OE1 3.1Å; Q518-V524 WeakPolarHBondContact O-CA 3.37Å; Q518-H525 HydrophobicContact CB-CB 4.29Å; Q518-H525 PolarHBondContact N-O 3.08Å; Q518-H525 PolarHBondContact O-N 3.31Å; Q518-A734 PolarHBondContact NE2-O 3.42Å; Q518-V735 HydrophobicContact CG-CG1 4.29Å; Q518-H737 PolarHBondContact OE1-ND1 2.83Å; Q518-L755 HydrophobicContact CB-CD1 4.27Å; Q518-L755 HydrophobicContact CB-CD2 4.23Å
519	V	91	Very high	88.5	Confident	30 Å²	30	34.1 Å²	34.1	18%	0.182	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	117.9	178.1	-171	0	0	0	0	109.8	L467 L483 V506 V524	L467-V519 HydrophobicContact CD1-CG1 3.65Å; L483-V519 HydrophobicContact CD1-CB 4.39Å; L483-V519 HydrophobicContact CD1-CG1 3.88Å; L483-V519 HydrophobicContact CD1-CG2 3.92Å; V506-V519 HydrophobicContact CG1-CG2 4.15Å; V506-V519 HydrophobicContact CG2-CG2 4.27Å; V519-V524 HydrophobicContact CG2-CG2 3.97Å
520	E	86.8	Confident	88.6	Confident	53 Å²	53	34 Å²	34	25%	0.248	18%	0.178	C	C	.	.			trans	-99.4	-168.2	172	-57.8	-156.6	140.5	0	0	111.4	H463 L467 L523 H525 R759	H463-E520 PolarHBondContact NE2-O 2.94Å; L467-E520 WeakPolarHBondContact CD1-O 3.46Å; E520-L523 WeakPolarHBondContact CA-O 3.44Å; E520-L523 WeakPolarHBondContact CB-O 3.28Å; E520-L523 PolarHBondContact N-O 2.75Å; E520-H525 IonicContact OE2-NE2 3.28Å; E520-R759 IonicContact OE1-CZ 3.92Å; E520-R759 IonicContact OE1-NE 2.91Å; E520-R759 PolarHBondContact OE1-NE 3.04Å; E520-R759 IonicContact OE1-NH2 3.3Å; E520-R759 PolarHBondContact OE1-NH2 2.84Å
521	S	83.2	Confident	88.9	Confident	79 Å²	79	33.4 Å²	33.4	55%	0.552	17%	0.172	S	C	*	.	S	Bend	trans	-69.7	-30.6	-179.3	60.3	0	0	0	0	113.8	R550	S521-R550 PolarHBondContact O-NH1 2.88Å
522	R	86	Confident	89.5	Confident	132 Å²	132	27.7 Å²	27.7	50%	0.498	14%	0.144	S	C	.	.	S	Bend	trans	-127.4	-32.4	-178.1	-73.5	-170.7	173.5	152.2	1.2	114.5	E462 H463	E462-R522 WeakPolarHBondContact CA-O 3.36Å; H463-R522 VanDerWaalsContact CD2-C 3.42Å; H463-R522 PolarHBondContact CD2-O 2.73Å; H463-R522 VanDerWaalsContact CD2-O 3.28Å; H463-R522 PolarHBondContact N-O 2.89Å
523	L	90.6	Very high	90.1	Very high	20 Å²	20	23.6 Å²	23.6	11%	0.105	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	146.5	-176.7	-67.1	171.1	0	0	0	110	I461 E462 E520	I461-L523 CarbonylContact O-C 3.53Å; I461-L523 WeakPolarHBondContact O-CA 3.35Å; E462-L523 HydrophobicContact CB-CD2 4.34Å; E462-L523 HydrophobicContact CG-CD2 3.57Å; E520-L523 WeakPolarHBondContact CA-O 3.44Å; E520-L523 WeakPolarHBondContact CB-O 3.28Å; E520-L523 PolarHBondContact N-O 2.75Å
524	V	93.5	Very high	90.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135.1	161.1	61.2	0	0	0	0	108.3	T439 S460 I461 Q518 V519 I526 L536	T439-V524 HydrophobicContact CG2-CG1 3.69Å; S460-V524 VanDerWaalsContact CA-O 3.28Å; S460-V524 WeakPolarHBondContact CA-O 3.34Å; I461-V524 HydrophobicContact CB-CG1 4.27Å; I461-V524 PolarHBondContact N-O 2.86Å; I461-V524 PolarHBondContact O-N 2.83Å; Q518-V524 WeakPolarHBondContact O-CA 3.37Å; V519-V524 HydrophobicContact CG2-CG2 3.97Å; V524-I526 HydrophobicContact CG1-CD1 4.45Å; V524-I526 HydrophobicContact CG1-CG1 4.45Å; V524-I526 HydrophobicContact CG2-CD1 4.49Å; V524-I526 HydrophobicContact CG2-CG1 3.89Å; V524-L536 HydrophobicContact CB-CD2 4.33Å; V524-L536 HydrophobicContact CG1-CD2 4.31Å; V524-L536 HydrophobicContact CG2-CD2 4.18Å
525	H	94.1	Very high	90.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118.4	174.3	-53.2	-91.8	0	0	0	108.3	V458 L459 S460 Q518 E520 L755 S758	V458-H525 HydrophobicContact CG1-CB 4.13Å; L459-H525 CarbonylContact O-C 3.58Å; L459-H525 WeakPolarHBondContact O-CA 3.49Å; S460-H525 WeakPolarHBondContact CB-ND1 3.3Å; S460-H525 PolarHBondContact OG-ND1 2.84Å; Q518-H525 HydrophobicContact CB-CB 4.29Å; Q518-H525 PolarHBondContact N-O 3.08Å; Q518-H525 PolarHBondContact O-N 3.31Å; E520-H525 IonicContact OE2-NE2 3.28Å; H525-L755 HydrophobicContact CB-CD1 3.7Å; H525-S758 PolarHBondContact CE1-O 3.24Å; H525-S758 VanDerWaalsContact CE1-O 3.28Å; H525-S758 PolarHBondContact ND1-OG 3.13Å
526	I	95.4	Very high	91.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	120.2	-174.2	-50.4	178.1	0	0	0	108.1	V458 L459 V515 Y516 V524 L528	V458-I526 CarbonylContact C-O 3.5Å; V458-I526 WeakPolarHBondContact CA-O 3.45Å; L459-I526 HydrophobicContact CB-CB 4.44Å; L459-I526 PolarHBondContact N-O 3.07Å; L459-I526 PolarHBondContact O-N 3.03Å; V515-I526 HydrophobicContact CG1-CG2 3.3Å; Y516-I526 CarbonylContact O-C 3.6Å; Y516-I526 WeakPolarHBondContact O-CA 3.23Å; V524-I526 HydrophobicContact CG1-CD1 4.45Å; V524-I526 HydrophobicContact CG1-CG1 4.45Å; V524-I526 HydrophobicContact CG2-CD1 4.49Å; V524-I526 HydrophobicContact CG2-CG1 3.89Å; I526-L528 HydrophobicContact CB-CD2 4.26Å; I526-L528 HydrophobicContact CG2-CD2 3.42Å; I526-L528 VanDerWaalsContact CG2-CD2 3.42Å; I526-L528 HydrophobicContact CG2-CG 4.09Å
527	L	94.6	Very high	91.1	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.005	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	115.3	170.4	-72.6	162	0	0	0	108.5	P456 A457 V458 V515 Y516 Y741 F742 L751 L755	P456-L527 HydrophobicContact CB-CB 4.39Å; P456-L527 HydrophobicContact CB-CD2 4.26Å; A457-L527 CarbonylContact O-C 3.54Å; A457-L527 WeakPolarHBondContact O-CA 3.2Å; V458-L527 HydrophobicContact CG2-CD2 3.72Å; V515-L527 WeakPolarHBondContact CA-O 3.31Å; Y516-L527 HydrophobicContact CD1-CD1 3.72Å; Y516-L527 HydrophobicContact CG-CD1 4.14Å; Y516-L527 PolarHBondContact N-O 2.84Å; Y516-L527 PolarHBondContact O-N 3.09Å; L527-Y741 HydrophobicContact CB-CE1 4.29Å; L527-Y741 HydrophobicContact CD1-CE1 3.85Å; L527-F742 HydrophobicContact CD1-CE1 4.17Å; L527-L751 HydrophobicContact CD1-CD2 3.42Å; L527-L751 VanDerWaalsContact CD1-CD2 3.42Å; L527-L751 HydrophobicContact CD2-CD2 3.74Å; L527-L751 HydrophobicContact CG-CD2 4.2Å; L527-L755 HydrophobicContact CD1-CD1 4.49Å; L527-L755 HydrophobicContact CD1-CD2 4.3Å
528	L	92.9	Very high	91	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.7	-172	-60.7	177	0	0	0	110.7	L444 L453 P456 A457 L459 V515 I526 F534	L444-L528 HydrophobicContact CD2-CD1 4.07Å; L453-L528 WeakPolarHBondContact CD1-O 3.44Å; P456-L528 CarbonylContact C-O 3.6Å; P456-L528 WeakPolarHBondContact CA-O 3.43Å; A457-L528 PolarHBondContact N-O 3.15Å; A457-L528 PolarHBondContact O-N 3.38Å; L459-L528 HydrophobicContact CB-CD1 3.56Å; L459-L528 HydrophobicContact CB-CG 4.24Å; L459-L528 HydrophobicContact CD2-CD1 3.76Å; L459-L528 HydrophobicContact CG-CD1 4.31Å; V515-L528 HydrophobicContact CG1-CD2 4.5Å; V515-L528 HydrophobicContact CG2-CD2 4.35Å; I526-L528 HydrophobicContact CB-CD2 4.26Å; I526-L528 HydrophobicContact CG2-CD2 3.42Å; I526-L528 VanDerWaalsContact CG2-CD2 3.42Å; I526-L528 HydrophobicContact CG2-CG 4.09Å; L528-F534 HydrophobicContact CD1-CD2 4.14Å; L528-F534 HydrophobicContact CD1-CE2 4.05Å; L528-F534 HydrophobicContact CD1-CZ 4.39Å; L528-F534 HydrophobicContact CD2-CD1 3.62Å; L528-F534 HydrophobicContact CD2-CD2 4.29Å; L528-F534 HydrophobicContact CD2-CE1 3.46Å; L528-F534 VanDerWaalsContact CD2-CE1 3.46Å; L528-F534 HydrophobicContact CD2-CE2 4.15Å; L528-F534 HydrophobicContact CD2-CG 4.04Å; L528-F534 HydrophobicContact CD2-CZ 3.75Å
529	E	89.2	Confident	90.8	Very high	39 Å²	39	21.3 Å²	21.3	18%	0.182	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-12	173.2	-65.6	-177.8	-162.1	0	0	112.9	S452 L453 P456 D514 Y741 R745	S452-E529 CarbonylContact C-O 3.55Å; S452-E529 WeakPolarHBondContact CA-O 3.42Å; S452-E529 VanDerWaalsContact CB-O 3.29Å; S452-E529 WeakPolarHBondContact CB-O 3.3Å; L453-E529 PolarHBondContact N-O 3.5Å; P456-E529 HydrophobicContact CB-CG 3.99Å; D514-E529 WeakPolarHBondContact O-CG 3.42Å; E529-Y741 PolarHBondContact OE1-OH 2.98Å; E529-R745 IonicContact OE1-CZ 3.97Å; E529-R745 IonicContact OE1-NE 2.94Å; E529-R745 PolarHBondContact OE1-NE 2.93Å; E529-R745 IonicContact OE1-NH2 3.98Å; E529-R745 PolarHBondContact OE1-NH2 3.45Å; E529-R745 IonicContact OE2-NH2 3.76Å; E529-R745 PolarHBondContact OE2-NH2 2.85Å
530	S	88.5	Confident	90.7	Very high	13 Å²	13	20.8 Å²	20.8	9%	0.091	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	165.2	-178.8	62.5	0	0	0	0	112.8	F534	S530-F534 WeakPolarHBondContact O-CZ 3.46Å
531	F	87.9	Confident	90.5	Very high	22 Å²	22	22.3 Å²	22.3	10%	0.096	11%	0.111	C	C	.	.			trans	-93.9	152.1	172.1	-61.8	-80.6	0	0	0	110.2	I417 L444 S450 L453	I417-F531 HydrophobicContact CD1-CE1 3.75Å; I417-F531 HydrophobicContact CD1-CZ 4.2Å; I417-F531 HydrophobicContact CG1-CE1 3.92Å; I417-F531 HydrophobicContact CG1-CZ 4.47Å; L444-F531 HydrophobicContact CD2-CD1 4.08Å; L444-F531 HydrophobicContact CD2-CE1 4.45Å; L444-F531 HydrophobicContact CG-CD1 3.92Å; L444-F531 HydrophobicContact CG-CE1 4.43Å; S450-F531 WeakPolarHBondContact O-CD2 3.5Å; L453-F531 HydrophobicContact CD2-CE1 3.97Å; L453-F531 HydrophobicContact CD2-CE2 4.1Å; L453-F531 HydrophobicContact CD2-CZ 3.4Å; L453-F531 HydrophobicContact CG-CE1 4.42Å; L453-F531 HydrophobicContact CG-CE2 4.24Å; L453-F531 HydrophobicContact CG-CZ 3.93Å
532	G	88.6	Confident	90.4	Very high	5 Å²	5	24.7 Å²	24.7	5%	0.052	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.4	-175.2	-178.9	0	0	0	0	0	113.9	L444 S488 F534	L444-G532 PolarHBondContact N-O 2.9Å; L444-G532 PolarHBondContact O-N 2.86Å; S488-G532 CarbonylContact O-C 3.49Å; S488-G532 VanDerWaalsContact O-CA 3.3Å; S488-G532 WeakPolarHBondContact O-CA 3.01Å; G532-F534 VanDerWaalsContact O-CD2 3.3Å; G532-F534 WeakPolarHBondContact O-CD2 3.42Å; G532-F534 WeakPolarHBondContact O-CE2 3.31Å
533	K	90.2	Very high	89.9	Confident	11 Å²	11	24.2 Å²	24.2	5%	0.048	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	132.2	168.9	-56.6	169.5	-171.3	166.5	0	108.1	V441 V442 W443 V487 S488 E490 W500	V441-K533 HydrophobicContact CG1-CB 4.28Å; V442-K533 CarbonylContact O-C 3.34Å; V442-K533 WeakPolarHBondContact O-CA 3.35Å; W443-K533 HydrophobicContact CB-CG 4.3Å; W443-K533 HydrophobicContact CD2-CG 4.09Å; W443-K533 HydrophobicContact CG-CG 3.83Å; V487-K533 CarbonylContact C-O 3.59Å; V487-K533 VanDerWaalsContact CA-O 3.28Å; V487-K533 WeakPolarHBondContact CA-O 3.37Å; S488-K533 PolarHBondContact N-O 3.37Å; S488-K533 PolarHBondContact O-N 2.82Å; E490-K533 IonicContact OE2-NZ 2.91Å; E490-K533 PolarHBondContact OE2-NZ 3.42Å; W500-K533 HydrophobicContact CH2-CB 3.52Å; W500-K533 HydrophobicContact CZ2-CB 3.91Å; W500-K533 HydrophobicContact CZ2-CD 4.23Å; W500-K533 HydrophobicContact CZ3-CB 4.22Å; W500-K533 WeakPolarHBondContact CZ3-O 3.28Å
534	F	93.4	Very high	89.1	Confident	1 Å²	1	28.6 Å²	28.6	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	139.9	-179.6	-63.5	-82	0	0	0	110.4	V442 L444 L459 L486 V487 L528 S530 G532	V442-F534 PolarHBondContact N-O 3.26Å; V442-F534 PolarHBondContact O-N 3.36Å; L444-F534 HydrophobicContact CB-CD2 4.4Å; L444-F534 HydrophobicContact CB-CE2 4.13Å; L444-F534 HydrophobicContact CD2-CE2 4.48Å; L459-F534 HydrophobicContact CD2-CB 4.49Å; L486-F534 WeakPolarHBondContact O-CA 3.17Å; V487-F534 HydrophobicContact CB-CD1 4.1Å; V487-F534 HydrophobicContact CB-CE1 3.88Å; V487-F534 HydrophobicContact CG2-CD1 3.91Å; V487-F534 HydrophobicContact CG2-CE1 3.36Å; V487-F534 HydrophobicContact CG2-CZ 3.8Å; L528-F534 HydrophobicContact CD1-CD2 4.14Å; L528-F534 HydrophobicContact CD1-CE2 4.05Å; L528-F534 HydrophobicContact CD1-CZ 4.39Å; L528-F534 HydrophobicContact CD2-CD1 3.62Å; L528-F534 HydrophobicContact CD2-CD2 4.29Å; L528-F534 HydrophobicContact CD2-CE1 3.46Å; L528-F534 VanDerWaalsContact CD2-CE1 3.46Å; L528-F534 HydrophobicContact CD2-CE2 4.15Å; L528-F534 HydrophobicContact CD2-CG 4.04Å; L528-F534 HydrophobicContact CD2-CZ 3.75Å; S530-F534 WeakPolarHBondContact O-CZ 3.46Å; G532-F534 VanDerWaalsContact O-CD2 3.3Å; G532-F534 WeakPolarHBondContact O-CD2 3.42Å; G532-F534 WeakPolarHBondContact O-CE2 3.31Å
535	V	93.2	Very high	88.5	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	144.8	175	67.8	0	0	0	0	110.6	P429 L437 T439 V441 L486 W500 I537	P429-V535 HydrophobicContact CG-CG1 3.93Å; L437-V535 HydrophobicContact CD2-CG2 3.75Å; T439-V535 WeakPolarHBondContact O-CG2 3.33Å; V441-V535 HydrophobicContact CG2-CB 4.13Å; V441-V535 HydrophobicContact CG2-CG2 3.97Å; L486-V535 HydrophobicContact CB-CG1 3.93Å; L486-V535 HydrophobicContact CD1-CG1 4.4Å; L486-V535 HydrophobicContact CG-CG1 4.47Å; L486-V535 PolarHBondContact N-O 2.94Å; L486-V535 PolarHBondContact O-N 2.94Å; L486-V535 VanDerWaalsContact O-N 3.16Å; W500-V535 HydrophobicContact CE3-CG1 4.2Å; W500-V535 HydrophobicContact CH2-CB 4.25Å; W500-V535 HydrophobicContact CH2-CG1 3.7Å; W500-V535 HydrophobicContact CZ3-CB 4.36Å; W500-V535 HydrophobicContact CZ3-CG1 3.53Å; V535-I537 HydrophobicContact CG1-CG2 4.35Å
536	L	94.6	Very high	87.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	127.5	170.5	-163.5	72.6	0	0	0	109.1	I438 T439 L483 C485 V506 V524	I438-L536 WeakPolarHBondContact CB-O 3.48Å; I438-L536 HydrophobicContact CG2-CD2 4.03Å; I438-L536 PolarHBondContact N-O 3.02Å; T439-L536 HydrophobicContact CG2-CB 3.74Å; T439-L536 HydrophobicContact CG2-CD2 4.38Å; T439-L536 PolarHBondContact N-O 3.33Å; T439-L536 PolarHBondContact OG1-N 3.44Å; L483-L536 HydrophobicContact CB-CD1 4.39Å; L483-L536 HydrophobicContact CD1-CD2 4.36Å; C485-L536 HydrophobicContact CB-CD1 4.22Å; V506-L536 HydrophobicContact CG2-CD1 4.42Å; V524-L536 HydrophobicContact CB-CD2 4.33Å; V524-L536 HydrophobicContact CG1-CD2 4.31Å; V524-L536 HydrophobicContact CG2-CD2 4.18Å
537	I	93	Very high	87.3	Confident	5 Å²	5	33.2 Å²	33.2	3%	0.026	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	159	173.8	67.7	159.5	0	0	0	109.9	P429 L431 Q435 T436 L437 L483 S484 L486 V535	P429-I537 HydrophobicContact CG-CG2 4.46Å; L431-I537 HydrophobicContact CD2-CD1 4.31Å; L431-I537 HydrophobicContact CD2-CG2 3.9Å; Q435-I537 HydrophobicContact CG-CD1 4.17Å; T436-I537 WeakPolarHBondContact O-CA 3.35Å; L437-I537 HydrophobicContact CD2-CG2 4.05Å; L483-I537 WeakPolarHBondContact CA-O 3.48Å; S484-I537 PolarHBondContact N-O 2.84Å; S484-I537 WeakPolarHBondContact O-CG1 3.36Å; S484-I537 PolarHBondContact O-N 2.79Å; L486-I537 HydrophobicContact CD1-CD1 3.95Å; L486-I537 HydrophobicContact CD1-CG1 4.26Å; L486-I537 HydrophobicContact CD1-CG2 3.87Å; L486-I537 HydrophobicContact CD2-CD1 4.31Å; L486-I537 HydrophobicContact CG-CD1 4.21Å; L486-I537 HydrophobicContact CG-CG1 4.18Å; L486-I537 HydrophobicContact CG-CG2 4.28Å; V535-I537 HydrophobicContact CG1-CG2 4.35Å
538	G	91.2	Very high	86.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	143.1	176.4	0	0	0	0	0	112.2	Q435 T436 Q482	Q435-G538 CarbonylContact C-O 3.48Å; Q435-G538 WeakPolarHBondContact CA-O 3.28Å; T436-G538 PolarHBondContact N-O 2.71Å; T436-G538 PolarHBondContact O-N 3.11Å; Q482-G538 WeakPolarHBondContact O-CA 3.46Å
539	E	89.3	Confident	86.7	Confident	37 Å²	37	35 Å²	35	17%	0.173	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	163	176.7	74.4	-173.6	173.4	0	0	110.4	Q435 Q482 K541 L547	Q435-E539 HydrophobicContact CG-CB 3.8Å; Q435-E539 WeakPolarHBondContact CG-OE2 3.48Å; Q435-E539 PolarHBondContact NE2-OE2 3.33Å; Q482-E539 HydrophobicContact CB-CG 3.92Å; Q482-E539 HydrophobicContact CG-CG 4.18Å; Q482-E539 PolarHBondContact N-O 3.34Å; Q482-E539 PolarHBondContact O-N 3.3Å; E539-K541 PolarHBondContact O-N 3.46Å; E539-L547 VanDerWaalsContact C-CD1 3.47Å
540	P	87.9	Confident	86.7	Confident	18 Å²	18	33.9 Å²	33.9	12%	0.117	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	124.6	-177.4	30.5	-34.8	0	0	0	110.6	L434 Q542 A545 L547 Y601	L434-P540 HydrophobicContact CB-CG 4.27Å; L434-P540 HydrophobicContact CD2-CG 4.49Å; L434-P540 WeakPolarHBondContact O-CD 3.19Å; P540-Q542 PolarHBondContact O-N 2.63Å; P540-A545 HydrophobicContact CB-CB 3.88Å; P540-L547 HydrophobicContact CB-CD1 3.91Å; P540-L547 HydrophobicContact CB-CG 4.21Å; P540-Y601 WeakPolarHBondContact CD-OH 3.28Å; P540-Y601 VanDerWaalsContact CG-OH 3.23Å; P540-Y601 WeakPolarHBondContact CG-OH 3.43Å
541	K	84.1	Confident	86.7	Confident	86 Å²	86	33.5 Å²	33.5	37%	0.374	18%	0.175	S	C	.	.	S	Bend	trans	-62.7	-27	174.9	-173	170.2	-173	158.4	0	112.6	L478 N479 D480 Q482 E539	L478-K541 HydrophobicContact CD2-CD 4.43Å; L478-K541 VanDerWaalsContact CG-NZ 3.34Å; N479-K541 WeakPolarHBondContact O-CD 3.08Å; D480-K541 WeakPolarHBondContact O-CB 3.25Å; D480-K541 PolarHBondContact O-N 2.81Å; Q482-K541 HydrophobicContact CB-CB 4.31Å; E539-K541 PolarHBondContact O-N 3.46Å
542	Q	80.3	Confident	86.8	Confident	129 Å²	129	33 Å²	33	60%	0.603	17%	0.172	S	C	*	.	S	Bend	trans	-132.9	146.7	176.3	-62.9	-174.8	1.4	0	0	110.4	P540 N544 A545	P540-Q542 PolarHBondContact O-N 2.63Å; Q542-N544 PolarHBondContact O-N 2.99Å; Q542-A545 WeakPolarHBondContact O-CB 3.41Å; Q542-A545 PolarHBondContact O-N 3.11Å
543	P	74.7	Confident	87	Confident	122 Å²	122	32.8 Å²	32.8	79%	0.792	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-28.1	-174.5	-25.8	33.4	0	0	0	115.5
544	N	74.1	Confident	87.1	Confident	112 Å²	112	32.2 Å²	32.2	60%	0.599	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-0.2	-178.5	-62	-22.9	0	0	0	113.3	Q542 Q546	Q542-N544 PolarHBondContact O-N 2.99Å; N544-Q546 PolarHBondContact O-N 3.4Å
545	A	80.8	Confident	87.1	Confident	7 Å²	7	32.2 Å²	32.2	6%	0.058	17%	0.168	C	C	.	.			trans	-63.7	132.1	-176.6	0	0	0	0	0	110.9	D480 P540 Q542 Y601	D480-A545 HydrophobicContact CB-CB 3.91Å; P540-A545 HydrophobicContact CB-CB 3.88Å; Q542-A545 WeakPolarHBondContact O-CB 3.41Å; Q542-A545 PolarHBondContact O-N 3.11Å; A545-Y601 WeakPolarHBondContact O-CE2 3.42Å
546	Q	78.1	Confident	87.2	Confident	89 Å²	89	32.3 Å²	32.3	42%	0.416	17%	0.168	S	C	.	.			trans	-104.4	87.5	-179.6	-69.2	-64.3	-66.9	0	0	108.8	N544 N599	N544-Q546 PolarHBondContact O-N 3.4Å; Q546-N599 PolarHBondContact OE1-ND2 3.04Å
547	L	85.8	Confident	87.1	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	17%	0.171	C	C	.	.			trans	-73.5	140.9	-175.3	-63.4	-174.3	0	0	0	112.9	D480 W481 E539 P540 N599 F600 Y601	D480-L547 VanDerWaalsContact C-CD2 3.42Å; D480-L547 HydrophobicContact CB-CD2 3.5Å; D480-L547 WeakPolarHBondContact O-CD2 3.26Å; W481-L547 HydrophobicContact CB-CD2 4.44Å; W481-L547 HydrophobicContact CD2-CB 4.5Å; W481-L547 HydrophobicContact CD2-CD1 4.07Å; W481-L547 HydrophobicContact CD2-CD2 3.72Å; W481-L547 HydrophobicContact CD2-CG 4.34Å; W481-L547 HydrophobicContact CE3-CD1 3.68Å; W481-L547 HydrophobicContact CE3-CD2 4.18Å; W481-L547 HydrophobicContact CE3-CG 4.41Å; W481-L547 HydrophobicContact CG-CD2 3.81Å; W481-L547 HydrophobicContact CH2-CB 4.01Å; W481-L547 HydrophobicContact CH2-CD1 4.15Å; W481-L547 HydrophobicContact CZ2-CB 3.81Å; W481-L547 HydrophobicContact CZ2-CD2 4.46Å; W481-L547 HydrophobicContact CZ2-CG 4.5Å; W481-L547 HydrophobicContact CZ3-CB 4.43Å; W481-L547 HydrophobicContact CZ3-CD1 3.72Å; E539-L547 VanDerWaalsContact C-CD1 3.47Å; P540-L547 HydrophobicContact CB-CD1 3.91Å; P540-L547 HydrophobicContact CB-CG 4.21Å; L547-N599 WeakPolarHBondContact O-CA 2.97Å; L547-F600 HydrophobicContact CB-CD1 3.55Å; L547-F600 HydrophobicContact CB-CE1 3.05Å; L547-F600 HydrophobicContact CB-CZ 3.9Å; L547-F600 HydrophobicContact CD1-CE1 3.36Å; L547-F600 HydrophobicContact CD1-CZ 3.57Å; L547-F600 HydrophobicContact CG-CE1 3.76Å; L547-F600 HydrophobicContact CG-CZ 4.23Å; L547-F600 PolarHBondContact O-N 2.86Å; L547-Y601 HydrophobicContact CB-CE2 4Å; L547-Y601 HydrophobicContact CG-CE2 4.2Å
548	V	87	Confident	86.9	Confident	34 Å²	34	33 Å²	33	21%	0.206	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	129.5	-172.6	179.7	0	0	0	0	110.6	L466 W481 A597 V598	L466-V548 HydrophobicContact CB-CB 4.27Å; L466-V548 HydrophobicContact CB-CG1 4.08Å; L466-V548 VanDerWaalsContact CB-O 3.23Å; L466-V548 WeakPolarHBondContact CB-O 2.96Å; L466-V548 HydrophobicContact CD2-CB 4.14Å; L466-V548 HydrophobicContact CD2-CG1 3.56Å; L466-V548 HydrophobicContact CG-CG1 4.48Å; L466-V548 PolarHBondContact N-O 2.96Å; W481-V548 VanDerWaalsContact CZ2-O 3.31Å; W481-V548 WeakPolarHBondContact CZ2-O 3.39Å; V548-A597 HydrophobicContact CG1-CB 3.62Å; V548-V598 CarbonylContact C-O 3.53Å; V548-V598 VanDerWaalsContact CA-O 3.3Å; V548-V598 WeakPolarHBondContact CA-O 3.06Å
549	K	89	Confident	86.6	Confident	4 Å²	4	40.4 Å²	40.4	2%	0.017	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	148.6	170.8	-70.8	-174.1	171.9	-174.5	0	110.6	T436 L437 S464 W481 V598 F631 D634	T436-K549 VanDerWaalsContact CG2-CE 3.43Å; T436-K549 WeakPolarHBondContact OG1-CE 3.4Å; T436-K549 PolarHBondContact OG1-NZ 3.41Å; L437-K549 WeakPolarHBondContact O-CE 3.42Å; L437-K549 PolarHBondContact O-NZ 3.27Å; S464-K549 CarbonylContact O-C 3.51Å; S464-K549 WeakPolarHBondContact O-CA 3.46Å; W481-K549 HydrophobicContact CH2-CG 4.22Å; W481-K549 HydrophobicContact CZ2-CG 4.35Å; K549-V598 PolarHBondContact N-O 3.04Å; K549-V598 PolarHBondContact O-N 3.36Å; K549-F631 PolarHBondContact NZ-O 3.43Å; K549-D634 VanDerWaalsContact NZ-CG 3.29Å; K549-D634 IonicContact NZ-OD1 3.24Å; K549-D634 PolarHBondContact NZ-OD1 3.24Å; K549-D634 IonicContact NZ-OD2 2.94Å
550	R	89.4	Confident	86.5	Confident	16 Å²	16	39.4 Å²	39.4	6%	0.06	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	127.3	165.4	-59	-162.3	-45.2	-88.5	2.5	108.5	H463 S464 A465 L466 S521 D569 V595	H463-R550 VanDerWaalsContact O-CZ 3.26Å; H463-R550 PolarHBondContact O-NH1 2.88Å; H463-R550 PolarHBondContact O-NH2 2.85Å; S464-R550 PolarHBondContact O-N 2.77Å; A465-R550 PolarHBondContact O-NH1 2.97Å; L466-R550 HydrophobicContact CB-CG 3.89Å; L466-R550 HydrophobicContact CD1-CG 3.76Å; L466-R550 HydrophobicContact CG-CG 4.43Å; S521-R550 PolarHBondContact O-NH1 2.88Å; R550-D569 HydrophobicContact CB-CB 3.52Å; R550-D569 IonicContact CZ-OD2 3.42Å; R550-D569 IonicContact NE-OD2 3.78Å; R550-D569 PolarHBondContact NE-OD2 2.9Å; R550-D569 IonicContact NH2-OD2 3.81Å; R550-D569 VanDerWaalsContact O-CB 3.3Å; R550-D569 WeakPolarHBondContact O-CB 3.44Å; R550-D569 PolarHBondContact O-N 3.42Å; R550-V595 HydrophobicContact CB-CG1 3.62Å; R550-V595 HydrophobicContact CG-CG1 3.98Å
551	T	88.8	Confident	86.5	Confident	4 Å²	4	39.6 Å²	39.6	3%	0.025	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	139.7	-176.5	-58.9	0	0	0	0	110	C566 A567 F596 V598	T551-C566 HydrophobicContact CG2-CB 3.72Å; T551-A567 CarbonylContact C-O 3.54Å; T551-A567 WeakPolarHBondContact CA-O 3.26Å; T551-A567 WeakPolarHBondContact CG2-O 3.34Å; T551-F596 WeakPolarHBondContact CA-O 3.23Å; T551-F596 VanDerWaalsContact CB-O 3.31Å; T551-F596 WeakPolarHBondContact CB-O 3.34Å; T551-F596 PolarHBondContact N-O 3.17Å; T551-F596 PolarHBondContact O-N 3.47Å; T551-V598 HydrophobicContact CG2-CG2 3.96Å; T551-V598 VanDerWaalsContact OG1-CG2 3.31Å; T551-V598 WeakPolarHBondContact OG1-CG2 3.38Å
552	K	89.5	Confident	87	Confident	11 Å²	11	35.5 Å²	35.5	5%	0.048	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	144.6	170.1	-69.7	-67.6	-174.2	177.3	0	110	A567 D569 T593	K552-A567 PolarHBondContact N-O 2.99Å; K552-A567 PolarHBondContact O-N 2.84Å; K552-D569 WeakPolarHBondContact CE-OD1 2.98Å; K552-D569 HydrophobicContact CG-CB 4.13Å; K552-D569 WeakPolarHBondContact CG-OD1 3.05Å; K552-T593 PolarHBondContact NZ-O 3.03Å
553	L	91.7	Very high	87.6	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	128.5	177.7	-58	178.6	0	0	0	109.9	Y565 C566 C592 I666 L679 M681	L553-Y565 WeakPolarHBondContact CA-O 3.37Å; L553-C566 HydrophobicContact CD2-CB 4.18Å; L553-C566 WeakPolarHBondContact CD2-SG 3.36Å; L553-C592 HydrophobicContact CB-CB 3.94Å; L553-C592 PolarHBondContact O-N 2.95Å; L553-C592 VanDerWaalsContact O-N 3.09Å; L553-I666 HydrophobicContact CD1-CB 4.09Å; L553-I666 HydrophobicContact CD1-CD1 3.56Å; L553-I666 HydrophobicContact CD1-CG1 3.72Å; L553-I666 HydrophobicContact CD1-CG2 4.37Å; L553-L679 HydrophobicContact CD1-CD2 3.81Å; L553-M681 HydrophobicContact CB-SD 3.88Å
554	L	93.3	Very high	88.5	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	137	177.8	-59.7	138.2	0	0	0	108.6	F556 V564 Y565 A567 V574 I577 L588 L591 V691	L554-F556 HydrophobicContact CB-CD2 4.3Å; L554-F556 HydrophobicContact CB-CE2 3.64Å; L554-F556 HydrophobicContact CB-CZ 4.45Å; L554-F556 HydrophobicContact CG-CE2 4.48Å; L554-V564 CarbonylContact O-C 3.59Å; L554-V564 WeakPolarHBondContact O-CA 3.35Å; L554-Y565 PolarHBondContact N-O 2.91Å; L554-Y565 VanDerWaalsContact N-O 3.12Å; L554-Y565 PolarHBondContact O-N 2.89Å; L554-A567 HydrophobicContact CD1-CB 3.74Å; L554-V574 HydrophobicContact CD1-CB 4.42Å; L554-V574 HydrophobicContact CD1-CG1 3.8Å; L554-V574 HydrophobicContact CD1-CG2 4.16Å; L554-V574 HydrophobicContact CD2-CG1 3.87Å; L554-V574 HydrophobicContact CG-CG1 4.46Å; L554-I577 HydrophobicContact CD1-CD1 4.46Å; L554-L588 HydrophobicContact CD2-CD1 4.08Å; L554-L591 HydrophobicContact CD2-CD1 3.48Å; L554-L591 VanDerWaalsContact CD2-CD1 3.48Å; L554-L591 HydrophobicContact CG-CD1 4.17Å; L554-V691 HydrophobicContact CD2-CG2 4.28Å
555	A	94.2	Very high	89.4	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	130	171.1	0	0	0	0	0	110.6	L562 R563 V564 C589 G590 M681 V683	A555-L562 HydrophobicContact CB-CD1 4.2Å; A555-R563 CarbonylContact C-O 3.5Å; A555-R563 WeakPolarHBondContact CA-O 3.23Å; A555-V564 HydrophobicContact CB-CG2 4.46Å; A555-C589 VanDerWaalsContact C-SG 3.55Å; A555-C589 PolarHBondContact O-N 2.97Å; A555-C589 PolarHBondContact O-SG 2.75Å; A555-G590 PolarHBondContact N-O 3.39Å; A555-G590 PolarHBondContact O-N 3.04Å; A555-M681 HydrophobicContact CB-CE 3.59Å; A555-V683 HydrophobicContact CB-CG1 4.45Å; A555-V683 HydrophobicContact CB-CG2 3.95Å
556	F	93.9	Very high	89.9	Confident	3 Å²	3	19.8 Å²	19.8	1%	0.013	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	142.5	174.7	-64.5	-96.3	0	0	0	110	L554 R563 Y565 I577 T578 E581 R587 L588 C589	L554-F556 HydrophobicContact CB-CD2 4.3Å; L554-F556 HydrophobicContact CB-CE2 3.64Å; L554-F556 HydrophobicContact CB-CZ 4.45Å; L554-F556 HydrophobicContact CG-CE2 4.48Å; F556-R563 PolarHBondContact N-O 3.34Å; F556-R563 PolarHBondContact O-N 2.95Å; F556-Y565 AromaticContact CD2-CD2 3.88Å; F556-Y565 HydrophobicContact CD2-CD2 3.88Å; F556-Y565 HydrophobicContact CD2-CE2 4.15Å; F556-Y565 HydrophobicContact CE2-CD2 4.29Å; F556-I577 HydrophobicContact CE2-CG2 3.83Å; F556-I577 HydrophobicContact CZ-CG2 4.33Å; F556-T578 HydrophobicContact CE1-CG2 4.44Å; F556-E581 HydrophobicContact CB-CB 4.48Å; F556-E581 HydrophobicContact CB-CG 4.05Å; F556-E581 WeakPolarHBondContact CB-OE2 3.45Å; F556-E581 HydrophobicContact CD1-CB 3.55Å; F556-E581 HydrophobicContact CD1-CG 3.82Å; F556-E581 HydrophobicContact CD2-CB 4.35Å; F556-E581 HydrophobicContact CD2-CG 3.71Å; F556-E581 HydrophobicContact CE1-CB 3.73Å; F556-E581 HydrophobicContact CE1-CG 4.15Å; F556-E581 HydrophobicContact CE2-CB 4.48Å; F556-E581 HydrophobicContact CE2-CG 4.03Å; F556-E581 HydrophobicContact CG-CB 3.89Å; F556-E581 HydrophobicContact CG-CG 3.59Å; F556-E581 HydrophobicContact CZ-CB 4.2Å; F556-E581 HydrophobicContact CZ-CG 4.25Å; F556-R587 CarbonylContact C-O 3.55Å; F556-R587 VanDerWaalsContact CA-O 3.28Å; F556-R587 WeakPolarHBondContact CA-O 3.49Å; F556-L588 HydrophobicContact CD1-CB 4.15Å; F556-L588 HydrophobicContact CD1-CD1 4.33Å; F556-L588 HydrophobicContact CE1-CB 3.9Å; F556-L588 HydrophobicContact CE1-CD1 3.88Å; F556-L588 HydrophobicContact CE1-CG 4.48Å; F556-L588 HydrophobicContact CE2-CD1 4.15Å; F556-L588 HydrophobicContact CZ-CD1 3.78Å; F556-C589 VanDerWaalsContact C-SG 3.58Å
557	F	92.2	Very high	90.5	Very high	12 Å²	12	15.7 Å²	15.7	5%	0.053	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.3	176.4	-173.8	-107.5	0	0	0	109.8	C561 L562 R587 C589 W615 L645 F660 T685	F557-C561 WeakPolarHBondContact CA-O 3.44Å; F557-C561 WeakPolarHBondContact CD2-O 3.41Å; F557-L562 HydrophobicContact CD2-CB 4.19Å; F557-R587 PolarHBondContact N-O 3.4Å; F557-R587 PolarHBondContact O-N 2.78Å; F557-C589 HydrophobicContact CB-CB 4.27Å; F557-W615 HydrophobicContact CE1-CH2 4.47Å; F557-W615 HydrophobicContact CE1-CZ2 4.25Å; F557-W615 AromaticContact CZ-CH2 3.8Å; F557-W615 HydrophobicContact CZ-CH2 3.8Å; F557-W615 AromaticContact CZ-CZ2 3.8Å; F557-W615 HydrophobicContact CZ-CZ2 3.8Å; F557-W615 HydrophobicContact CZ-CZ3 4.33Å; F557-L645 HydrophobicContact CE2-CD1 3.98Å; F557-F660 HydrophobicContact CD1-CB 4.41Å; F557-F660 HydrophobicContact CE1-CB 4.22Å; F557-F660 HydrophobicContact CE2-CB 4.38Å; F557-F660 HydrophobicContact CZ-CB 4.19Å; F557-T685 HydrophobicContact CB-CG2 3.94Å; F557-T685 HydrophobicContact CD1-CG2 3.77Å; F557-T685 HydrophobicContact CG-CG2 4.05Å
558	G	89.2	Confident	90.7	Very high	7 Å²	7	16.1 Å²	16.1	7%	0.072	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	144.7	177.7	0	0	0	0	0	110.5	G560 C561 R563	G558-G560 PolarHBondContact O-N 3.36Å; G558-C561 PolarHBondContact N-O 2.87Å; G558-C561 VanDerWaalsContact N-O 3.14Å; G558-C561 WeakPolarHBondContact O-CB 3.23Å; G558-C561 PolarHBondContact O-N 2.91Å; G558-R563 PolarHBondContact O-NH1 2.96Å
559	D	86.1	Confident	90.9	Very high	155 Å²	155	14.9 Å²	14.9	83%	0.829	8%	0.083	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	34.7	-179	-61.6	-20.6	0	0	0	114.9	C561	D559-C561 PolarHBondContact O-N 2.87Å
560	G	85.6	Confident	90.9	Very high	16 Å²	16	14.9 Å²	14.9	17%	0.165	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	15.6	-176.6	0	0	0	0	0	113.7	G558 L645	G558-G560 PolarHBondContact O-N 3.36Å; G560-L645 PolarHBondContact O-N 3.4Å
561	C	89.7	Confident	91	Very high	23 Å²	23	15.9 Å²	15.9	16%	0.155	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	126.5	177.8	-170.5	0	0	0	0	110.2	F557 G558 D559 F643	F557-C561 WeakPolarHBondContact CA-O 3.44Å; F557-C561 WeakPolarHBondContact CD2-O 3.41Å; G558-C561 PolarHBondContact N-O 2.87Å; G558-C561 VanDerWaalsContact N-O 3.14Å; G558-C561 WeakPolarHBondContact O-CB 3.23Å; G558-C561 PolarHBondContact O-N 2.91Å; D559-C561 PolarHBondContact O-N 2.87Å; C561-F643 WeakPolarHBondContact CA-O 2.97Å
562	L	92.8	Very high	91	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	116.4	170.5	175.5	69.7	0	0	0	109.1	A555 F557 V564 L608 F643 L645 F660 V664 V683	A555-L562 HydrophobicContact CB-CD1 4.2Å; F557-L562 HydrophobicContact CD2-CB 4.19Å; L562-V564 HydrophobicContact CD2-CG2 4.43Å; L562-V564 HydrophobicContact CG-CG2 4.21Å; L562-L608 HydrophobicContact CD2-CD1 4.45Å; L562-L608 HydrophobicContact CD2-CD2 3.56Å; L562-F643 HydrophobicContact CB-CB 4.34Å; L562-F643 HydrophobicContact CD2-CD2 4.48Å; L562-F643 PolarHBondContact N-O 3.16Å; L562-F643 PolarHBondContact O-N 3.07Å; L562-L645 HydrophobicContact CB-CD1 4.41Å; L562-F660 HydrophobicContact CD1-CE1 4.15Å; L562-F660 HydrophobicContact CD2-CE1 3.82Å; L562-F660 HydrophobicContact CD2-CZ 4.01Å; L562-F660 HydrophobicContact CG-CE1 4.48Å; L562-V664 HydrophobicContact CD2-CG2 4.49Å; L562-V683 HydrophobicContact CD1-CG1 3.98Å
563	R	93.2	Very high	91	Very high	25 Å²	25	15.7 Å²	15.7	9%	0.094	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	119.2	178.9	-62.4	-175.1	-73.5	-83.4	4.4	110	A555 F556 G558 Y565 E581 C641	A555-R563 CarbonylContact C-O 3.5Å; A555-R563 WeakPolarHBondContact CA-O 3.23Å; F556-R563 PolarHBondContact N-O 3.34Å; F556-R563 PolarHBondContact O-N 2.95Å; G558-R563 PolarHBondContact O-NH1 2.96Å; R563-Y565 HydrophobicContact CB-CD2 4.42Å; R563-Y565 HydrophobicContact CB-CE2 3.75Å; R563-E581 WeakPolarHBondContact CD-OE1 3.38Å; R563-E581 IonicContact CZ-OE1 3.61Å; R563-E581 IonicContact CZ-OE2 3.24Å; R563-E581 VanDerWaalsContact CZ-OE2 3.24Å; R563-E581 VanDerWaalsContact NE-CD 3.27Å; R563-E581 IonicContact NE-OE1 2.73Å; R563-E581 PolarHBondContact NE-OE1 3.03Å; R563-E581 IonicContact NE-OE2 3.03Å; R563-E581 PolarHBondContact NE-OE2 3.19Å; R563-E581 IonicContact NH2-OE1 3.66Å; R563-E581 IonicContact NH2-OE2 2.67Å; R563-E581 PolarHBondContact NH2-OE2 2.94Å; R563-C641 CarbonylContact C-O 3.4Å; R563-C641 WeakPolarHBondContact CA-O 3.15Å
564	V	94.1	Very high	90.9	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	115.8	-179.1	-175.8	0	0	0	0	109.2	L554 A555 L562 I606 H640 C641 F643 V664 M681	L554-V564 CarbonylContact O-C 3.59Å; L554-V564 WeakPolarHBondContact O-CA 3.35Å; A555-V564 HydrophobicContact CB-CG2 4.46Å; L562-V564 HydrophobicContact CD2-CG2 4.43Å; L562-V564 HydrophobicContact CG-CG2 4.21Å; V564-I606 HydrophobicContact CB-CD1 4.19Å; V564-I606 HydrophobicContact CB-CG2 4.44Å; V564-I606 HydrophobicContact CG1-CD1 3.92Å; V564-I606 HydrophobicContact CG1-CG2 4.36Å; V564-H640 CarbonylContact O-C 3.58Å; V564-H640 WeakPolarHBondContact O-CA 3.17Å; V564-H640 WeakPolarHBondContact O-CB 3.27Å; V564-C641 PolarHBondContact N-O 3.33Å; V564-C641 PolarHBondContact O-N 3.27Å; V564-F643 HydrophobicContact CG2-CD2 4.46Å; V564-F643 HydrophobicContact CG2-CE2 4.2Å; V564-V664 HydrophobicContact CG2-CG1 4.47Å; V564-V664 HydrophobicContact CG2-CG2 4.37Å; V564-M681 HydrophobicContact CG1-CE 4.09Å
565	Y	93.3	Very high	90.7	Very high	12 Å²	12	17.2 Å²	17.2	5%	0.047	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	137.3	-178	-72.6	-99.3	0	0	0	111.3	L553 L554 F556 R563 I577 E581 V639 H640	L553-Y565 WeakPolarHBondContact CA-O 3.37Å; L554-Y565 PolarHBondContact N-O 2.91Å; L554-Y565 VanDerWaalsContact N-O 3.12Å; L554-Y565 PolarHBondContact O-N 2.89Å; F556-Y565 AromaticContact CD2-CD2 3.88Å; F556-Y565 HydrophobicContact CD2-CD2 3.88Å; F556-Y565 HydrophobicContact CD2-CE2 4.15Å; F556-Y565 HydrophobicContact CE2-CD2 4.29Å; R563-Y565 HydrophobicContact CB-CD2 4.42Å; R563-Y565 HydrophobicContact CB-CE2 3.75Å; Y565-I577 HydrophobicContact CD1-CD1 3.99Å; Y565-I577 HydrophobicContact CD1-CG1 4.16Å; Y565-I577 HydrophobicContact CD1-CG2 3.64Å; Y565-I577 HydrophobicContact CD2-CG2 4.03Å; Y565-I577 HydrophobicContact CE1-CG2 3.93Å; Y565-I577 HydrophobicContact CE2-CG2 4.28Å; Y565-I577 HydrophobicContact CG-CD1 4.47Å; Y565-I577 HydrophobicContact CG-CG2 3.73Å; Y565-E581 HydrophobicContact CE2-CG 3.96Å; Y565-E581 WeakPolarHBondContact CE2-OE1 3.43Å; Y565-E581 PolarHBondContact OH-OE1 3.41Å; Y565-V639 WeakPolarHBondContact CA-O 3.27Å; Y565-H640 HydrophobicContact CD1-CB 3.52Å; Y565-H640 HydrophobicContact CD2-CB 4.02Å; Y565-H640 HydrophobicContact CE1-CB 3.52Å; Y565-H640 AromaticContact CE1-CG 3.79Å; Y565-H640 AromaticContact CE1-ND1 3.92Å; Y565-H640 HydrophobicContact CE2-CB 4.03Å; Y565-H640 HydrophobicContact CG-CB 3.75Å; Y565-H640 AromaticContact CZ-CG 3.77Å
566	C	91.7	Very high	90.4	Very high	3 Å²	3	19.4 Å²	19.4	2%	0.02	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	84.1	165.1	-64.9	0	0	0	0	108.4	T551 L553 I626 F631 V639	T551-C566 HydrophobicContact CG2-CB 3.72Å; L553-C566 HydrophobicContact CD2-CB 4.18Å; L553-C566 WeakPolarHBondContact CD2-SG 3.36Å; C566-I626 HydrophobicContact CB-CD1 4.2Å; C566-F631 HydrophobicContact CB-CE1 3.99Å; C566-F631 HydrophobicContact CB-CZ 4.26Å; C566-V639 HydrophobicContact CB-CG1 3.71Å; C566-V639 PolarHBondContact N-O 3.2Å; C566-V639 VanDerWaalsContact O-CG1 3.26Å; C566-V639 WeakPolarHBondContact O-CG1 3.42Å
567	A	90.5	Very high	90.2	Very high	3 Å²	3	19.4 Å²	19.4	3%	0.025	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	142.4	-176.8	0	0	0	0	0	111.4	T551 K552 L554 D569 V574 I577	T551-A567 CarbonylContact C-O 3.54Å; T551-A567 WeakPolarHBondContact CA-O 3.26Å; T551-A567 WeakPolarHBondContact CG2-O 3.34Å; K552-A567 PolarHBondContact N-O 2.99Å; K552-A567 PolarHBondContact O-N 2.84Å; L554-A567 HydrophobicContact CD1-CB 3.74Å; A567-D569 PolarHBondContact O-N 2.8Å; A567-V574 HydrophobicContact CB-CG2 4.04Å; A567-I577 HydrophobicContact CB-CD1 3.44Å; A567-I577 VanDerWaalsContact CB-CD1 3.44Å
568	A	90.3	Very high	90.1	Very high	9 Å²	9	20.4 Å²	20.4	7%	0.074	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	137.2	164.7	0	0	0	0	0	109.9	M570 A573	A568-M570 HydrophobicContact CB-CE 3.43Å; A568-M570 VanDerWaalsContact CB-CE 3.43Å; A568-M570 PolarHBondContact O-N 2.86Å; A568-A573 HydrophobicContact CB-CB 4.17Å
569	D	90.6	Very high	90.1	Very high	8 Å²	8	24.2 Å²	24.2	4%	0.043	13%	0.131	C	C	.	.	S	Bend	trans	-72.1	68	-179	179.9	41.1	0	0	0	111.3	R550 K552 A567	R550-D569 HydrophobicContact CB-CB 3.52Å; R550-D569 IonicContact CZ-OD2 3.42Å; R550-D569 IonicContact NE-OD2 3.78Å; R550-D569 PolarHBondContact NE-OD2 2.9Å; R550-D569 IonicContact NH2-OD2 3.81Å; R550-D569 VanDerWaalsContact O-CB 3.3Å; R550-D569 WeakPolarHBondContact O-CB 3.44Å; R550-D569 PolarHBondContact O-N 3.42Å; K552-D569 WeakPolarHBondContact CE-OD1 2.98Å; K552-D569 HydrophobicContact CG-CB 4.13Å; K552-D569 WeakPolarHBondContact CG-OD1 3.05Å; A567-D569 PolarHBondContact O-N 2.8Å
570	M	89.8	Confident	90.1	Very high	5 Å²	5	21.4 Å²	21.4	3%	0.025	11%	0.109	C	C	.	.	S	Bend	trans	-144	131.9	-179.6	-56.6	-176.3	-73.4	0	0	107.5	E462 A568 A572 A573 V574	E462-M570 HydrophobicContact CB-CB 4.35Å; E462-M570 HydrophobicContact CB-CG 4.35Å; A568-M570 HydrophobicContact CB-CE 3.43Å; A568-M570 VanDerWaalsContact CB-CE 3.43Å; A568-M570 PolarHBondContact O-N 2.86Å; M570-A572 PolarHBondContact O-N 2.89Å; M570-A572 VanDerWaalsContact O-N 3.16Å; M570-A573 HydrophobicContact CB-CB 4.39Å; M570-A573 HydrophobicContact CE-CB 4.43Å; M570-A573 PolarHBondContact O-N 2.94Å; M570-V574 PolarHBondContact O-N 2.74Å; M570-V574 VanDerWaalsContact O-N 3.08Å
571	R	90	Very high	90.4	Very high	36 Å²	36	20.7 Å²	20.7	14%	0.136	10%	0.101	C	C	.	.	H	α-helix	trans	-57.6	-31.8	177.2	-86.9	175.5	-94.7	-158	-3.5	113	K399 A401 E462 N575 Y695 G696	K399-R571 WeakPolarHBondContact O-CB 3.45Å; A401-R571 HydrophobicContact CB-CB 4.27Å; A401-R571 VanDerWaalsContact CB-NE 3.35Å; E462-R571 IonicContact OE1-CZ 2.7Å; E462-R571 VanDerWaalsContact OE1-CZ 3.26Å; E462-R571 IonicContact OE1-NE 3.83Å; E462-R571 PolarHBondContact OE1-NE 2.82Å; E462-R571 IonicContact OE1-NH2 2.91Å; E462-R571 PolarHBondContact OE1-NH2 2.8Å; E462-R571 WeakPolarHBondContact OE2-CB 3.37Å; E462-R571 PolarHBondContact OE2-N 2.91Å; E462-R571 IonicContact OE2-NE 3.45Å; R571-N575 VanDerWaalsContact O-CB 3.27Å; R571-N575 WeakPolarHBondContact O-CB 3.41Å; R571-N575 VanDerWaalsContact O-CG 3.22Å; R571-N575 PolarHBondContact O-N 3.48Å; R571-N575 PolarHBondContact O-ND2 2.9Å; R571-N575 VanDerWaalsContact O-ND2 3.11Å; R571-Y695 HydrophobicContact CG-CD1 3.88Å; R571-Y695 HydrophobicContact CG-CD2 3.56Å; R571-Y695 HydrophobicContact CG-CE1 4.15Å; R571-Y695 HydrophobicContact CG-CE2 3.84Å; R571-Y695 HydrophobicContact CG-CG 3.57Å; R571-G696 PolarHBondContact NH1-O 2.74Å
572	A	89.5	Confident	90.4	Very high	3 Å²	3	26.6 Å²	26.6	3%	0.025	13%	0.126	C	C	.	.	H	α-helix	trans	-59.5	-49.1	174.3	0	0	0	0	0	112.7	H400 L421 Y423 P440 M570 W576	H400-A572 HydrophobicContact CB-CB 4.3Å; L421-A572 HydrophobicContact CD2-CB 3.94Å; Y423-A572 PolarHBondContact OH-O 2.82Å; P440-A572 HydrophobicContact CG-CB 4.13Å; M570-A572 PolarHBondContact O-N 2.89Å; M570-A572 VanDerWaalsContact O-N 3.16Å; A572-W576 VanDerWaalsContact O-CB 3.3Å; A572-W576 WeakPolarHBondContact O-CB 3.46Å; A572-W576 PolarHBondContact O-N 2.85Å; A572-W576 VanDerWaalsContact O-N 3.12Å
573	A	89.3	Confident	90.2	Very high	9 Å²	9	33 Å²	33	7%	0.074	16%	0.156	C	C	.	.	H	α-helix	trans	-67.2	-44.6	179.5	0	0	0	0	0	111.8	A568 M570 W576 I577	A568-A573 HydrophobicContact CB-CB 4.17Å; M570-A573 HydrophobicContact CB-CB 4.39Å; M570-A573 HydrophobicContact CE-CB 4.43Å; M570-A573 PolarHBondContact O-N 2.94Å; A573-W576 PolarHBondContact O-N 2.95Å; A573-I577 WeakPolarHBondContact O-CG1 3.42Å; A573-I577 PolarHBondContact O-N 2.8Å; A573-I577 VanDerWaalsContact O-N 3.09Å
574	V	90.4	Very high	90	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.012	17%	0.17	C	C	.	.	H	α-helix	trans	-65.8	-46.2	-178.6	179.1	0	0	0	0	111.8	L554 A567 M570 W576 I577 T578 V691 Y695	L554-V574 HydrophobicContact CD1-CB 4.42Å; L554-V574 HydrophobicContact CD1-CG1 3.8Å; L554-V574 HydrophobicContact CD1-CG2 4.16Å; L554-V574 HydrophobicContact CD2-CG1 3.87Å; L554-V574 HydrophobicContact CG-CG1 4.46Å; A567-V574 HydrophobicContact CB-CG2 4.04Å; M570-V574 PolarHBondContact O-N 2.74Å; M570-V574 VanDerWaalsContact O-N 3.08Å; V574-W576 VanDerWaalsContact C-N 3.29Å; V574-W576 PolarHBondContact O-N 2.92Å; V574-I577 PolarHBondContact O-N 2.88Å; V574-T578 PolarHBondContact O-N 2.7Å; V574-T578 PolarHBondContact O-OG1 2.68Å; V574-T578 VanDerWaalsContact O-OG1 3.09Å; V574-V691 HydrophobicContact CB-CG1 4.4Å; V574-V691 HydrophobicContact CG1-CB 4.41Å; V574-V691 HydrophobicContact CG1-CG1 3.36Å; V574-V691 HydrophobicContact CG1-CG2 4.15Å; V574-Y695 HydrophobicContact CB-CE2 4.2Å; V574-Y695 HydrophobicContact CG1-CE2 4.38Å; V574-Y695 HydrophobicContact CG2-CE2 4.06Å; V574-Y695 WeakPolarHBondContact CG2-OH 3.08Å
575	N	88.7	Confident	89.7	Confident	31 Å²	31	37.9 Å²	37.9	17%	0.166	20%	0.196	C	C	.	.	H	α-helix	trans	-64.5	-36.1	178.2	-72.3	-29.6	0	0	0	112.5	K399 R571 I577 T578 N579	K399-N575 VanDerWaalsContact C-ND2 3.35Å; K399-N575 PolarHBondContact O-ND2 3.26Å; R571-N575 VanDerWaalsContact O-CB 3.27Å; R571-N575 WeakPolarHBondContact O-CB 3.41Å; R571-N575 VanDerWaalsContact O-CG 3.22Å; R571-N575 PolarHBondContact O-N 3.48Å; R571-N575 PolarHBondContact O-ND2 2.9Å; R571-N575 VanDerWaalsContact O-ND2 3.11Å; N575-I577 VanDerWaalsContact C-N 3.34Å; N575-T578 PolarHBondContact O-N 3.12Å; N575-N579 WeakPolarHBondContact O-CB 3.4Å; N575-N579 PolarHBondContact O-N 2.98Å; N575-N579 PolarHBondContact O-ND2 2.66Å; N575-N579 VanDerWaalsContact O-ND2 3.15Å
576	W	86.7	Confident	89.6	Confident	46 Å²	46	37.8 Å²	37.8	17%	0.174	20%	0.198	C	C	.	.	H	α-helix	trans	-58.8	-48.7	174.5	-174.6	93.2	0	0	0	110.6	Y423 A572 A573 V574 N579 R580 P636 E637	Y423-W576 AromaticContact CD1-CD1 3.29Å; Y423-W576 AromaticContact CD1-CG 3.94Å; Y423-W576 HydrophobicContact CD1-CG 3.94Å; Y423-W576 AromaticContact CD1-NE1 3.74Å; Y423-W576 AromaticContact CD2-CD1 3.69Å; Y423-W576 HydrophobicContact CE1-CB 3.81Å; Y423-W576 AromaticContact CE1-CD1 3.3Å; Y423-W576 AromaticContact CE1-CG 3.71Å; Y423-W576 HydrophobicContact CE1-CG 3.71Å; Y423-W576 AromaticContact CE2-CD1 3.69Å; Y423-W576 AromaticContact CG-CD1 3.46Å; Y423-W576 VanDerWaalsContact CG-CD1 3.46Å; Y423-W576 HydrophobicContact CG-CG 4.49Å; Y423-W576 AromaticContact CG-NE1 3.63Å; Y423-W576 AromaticContact CZ-CD1 3.47Å; Y423-W576 VanDerWaalsContact CZ-CD1 3.47Å; A572-W576 VanDerWaalsContact O-CB 3.3Å; A572-W576 WeakPolarHBondContact O-CB 3.46Å; A572-W576 PolarHBondContact O-N 2.85Å; A572-W576 VanDerWaalsContact O-N 3.12Å; A573-W576 PolarHBondContact O-N 2.95Å; V574-W576 VanDerWaalsContact C-N 3.29Å; V574-W576 PolarHBondContact O-N 2.92Å; W576-N579 PolarHBondContact O-N 3.44Å; W576-R580 HydrophobicContact CE3-CB 4.48Å; W576-R580 HydrophobicContact CH2-CB 4.04Å; W576-R580 HydrophobicContact CH2-CG 3.85Å; W576-R580 HydrophobicContact CZ3-CB 4.03Å; W576-R580 HydrophobicContact CZ3-CG 4.17Å; W576-R580 WeakPolarHBondContact O-CB 3.01Å; W576-R580 PolarHBondContact O-N 3.14Å; W576-P636 HydrophobicContact CD2-CB 4.05Å; W576-P636 HydrophobicContact CD2-CG 4.33Å; W576-P636 HydrophobicContact CE3-CB 3.33Å; W576-P636 HydrophobicContact CE3-CG 4.09Å; W576-P636 HydrophobicContact CZ3-CB 3.7Å; W576-E637 HydrophobicContact CH2-CB 4.39Å; W576-E637 HydrophobicContact CH2-CG 3.07Å; W576-E637 VanDerWaalsContact CH2-OE1 3.27Å; W576-E637 WeakPolarHBondContact CH2-OE1 2.98Å; W576-E637 HydrophobicContact CZ2-CG 3.89Å; W576-E637 WeakPolarHBondContact CZ2-OE1 3.26Å; W576-E637 HydrophobicContact CZ3-CG 3.67Å
577	I	90.1	Very high	89.5	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-61.9	-47.3	178.2	-66.8	165.3	0	0	0	110.6	L554 F556 Y565 A567 A573 V574 N575 N579 R580 E581 P636	L554-I577 HydrophobicContact CD1-CD1 4.46Å; F556-I577 HydrophobicContact CE2-CG2 3.83Å; F556-I577 HydrophobicContact CZ-CG2 4.33Å; Y565-I577 HydrophobicContact CD1-CD1 3.99Å; Y565-I577 HydrophobicContact CD1-CG1 4.16Å; Y565-I577 HydrophobicContact CD1-CG2 3.64Å; Y565-I577 HydrophobicContact CD2-CG2 4.03Å; Y565-I577 HydrophobicContact CE1-CG2 3.93Å; Y565-I577 HydrophobicContact CE2-CG2 4.28Å; Y565-I577 HydrophobicContact CG-CD1 4.47Å; Y565-I577 HydrophobicContact CG-CG2 3.73Å; A567-I577 HydrophobicContact CB-CD1 3.44Å; A567-I577 VanDerWaalsContact CB-CD1 3.44Å; A573-I577 WeakPolarHBondContact O-CG1 3.42Å; A573-I577 PolarHBondContact O-N 2.8Å; A573-I577 VanDerWaalsContact O-N 3.09Å; V574-I577 PolarHBondContact O-N 2.88Å; N575-I577 VanDerWaalsContact C-N 3.34Å; I577-N579 PolarHBondContact O-N 2.93Å; I577-R580 PolarHBondContact O-N 3.32Å; I577-E581 HydrophobicContact CG2-CG 4.33Å; I577-E581 WeakPolarHBondContact O-CB 3.36Å; I577-E581 PolarHBondContact O-N 3.18Å; I577-P636 HydrophobicContact CD1-CB 4.36Å; I577-P636 HydrophobicContact CG1-CB 4.01Å
578	T	90.1	Very high	89.6	Confident	34 Å²	34	45.3 Å²	45.3	21%	0.209	23%	0.227	C	C	.	.	H	α-helix	trans	-61.6	-43	-179.2	-60.1	0	0	0	0	112.4	F556 V574 N575 R580 E581 H582 V691	F556-T578 HydrophobicContact CE1-CG2 4.44Å; V574-T578 PolarHBondContact O-N 2.7Å; V574-T578 PolarHBondContact O-OG1 2.68Å; V574-T578 VanDerWaalsContact O-OG1 3.09Å; N575-T578 PolarHBondContact O-N 3.12Å; T578-R580 VanDerWaalsContact C-N 3.34Å; T578-E581 PolarHBondContact O-N 2.87Å; T578-H582 WeakPolarHBondContact O-CB 3.19Å; T578-H582 PolarHBondContact O-N 3.08Å; T578-V691 HydrophobicContact CG2-CG2 4.34Å
579	N	89	Confident	89.7	Confident	87 Å²	87	44.9 Å²	44.9	47%	0.465	22%	0.224	S	C	.	.	H	α-helix	trans	-64.2	-42.6	176.4	-69.4	-25.3	0	0	0	110.9	N575 W576 I577 H582 E583	N575-N579 WeakPolarHBondContact O-CB 3.4Å; N575-N579 PolarHBondContact O-N 2.98Å; N575-N579 PolarHBondContact O-ND2 2.66Å; N575-N579 VanDerWaalsContact O-ND2 3.15Å; W576-N579 PolarHBondContact O-N 3.44Å; I577-N579 PolarHBondContact O-N 2.93Å; N579-H582 PolarHBondContact O-N 2.03Å; N579-E583 WeakPolarHBondContact O-CG 3.03Å; N579-E583 PolarHBondContact O-N 2.03Å; N579-E583 VanDerWaalsContact O-N 3.11Å
580	R	87.7	Confident	89.8	Confident	96 Å²	96	44.5 Å²	44.5	36%	0.362	22%	0.222	S	C	.	.	H	α-helix	trans	-64.5	-43.1	178.3	-174.6	56.7	172.6	157.7	1.9	112.3	W576 I577 T578 H582 E583 L584	W576-R580 HydrophobicContact CE3-CB 4.48Å; W576-R580 HydrophobicContact CH2-CB 4.04Å; W576-R580 HydrophobicContact CH2-CG 3.85Å; W576-R580 HydrophobicContact CZ3-CB 4.03Å; W576-R580 HydrophobicContact CZ3-CG 4.17Å; W576-R580 WeakPolarHBondContact O-CB 3.01Å; W576-R580 PolarHBondContact O-N 3.14Å; I577-R580 PolarHBondContact O-N 3.32Å; T578-R580 VanDerWaalsContact C-N 3.34Å; R580-H582 VanDerWaalsContact C-N 3.34Å; R580-E583 IonicContact CZ-OE2 3.88Å; R580-E583 IonicContact NH1-OE2 2.83Å; R580-E583 PolarHBondContact NH1-OE2 3.15Å; R580-E583 WeakPolarHBondContact O-CB 3.24Å; R580-E583 PolarHBondContact O-N 3.01Å; R580-L584 HydrophobicContact CG-CD1 4.41Å; R580-L584 WeakPolarHBondContact O-CG 3.34Å; R580-L584 PolarHBondContact O-N 3.01Å; R580-L584 VanDerWaalsContact O-N 3.1Å
581	E	91.3	Very high	89.9	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.5	-39	176.4	-83.9	-67.9	137.7	0	0	112.1	F556 R563 Y565 I577 T578 E583 L584 G585 G586	F556-E581 HydrophobicContact CB-CB 4.48Å; F556-E581 HydrophobicContact CB-CG 4.05Å; F556-E581 WeakPolarHBondContact CB-OE2 3.45Å; F556-E581 HydrophobicContact CD1-CB 3.55Å; F556-E581 HydrophobicContact CD1-CG 3.82Å; F556-E581 HydrophobicContact CD2-CB 4.35Å; F556-E581 HydrophobicContact CD2-CG 3.71Å; F556-E581 HydrophobicContact CE1-CB 3.73Å; F556-E581 HydrophobicContact CE1-CG 4.15Å; F556-E581 HydrophobicContact CE2-CB 4.48Å; F556-E581 HydrophobicContact CE2-CG 4.03Å; F556-E581 HydrophobicContact CG-CB 3.89Å; F556-E581 HydrophobicContact CG-CG 3.59Å; F556-E581 HydrophobicContact CZ-CB 4.2Å; F556-E581 HydrophobicContact CZ-CG 4.25Å; R563-E581 WeakPolarHBondContact CD-OE1 3.38Å; R563-E581 IonicContact CZ-OE1 3.61Å; R563-E581 IonicContact CZ-OE2 3.24Å; R563-E581 VanDerWaalsContact CZ-OE2 3.24Å; R563-E581 VanDerWaalsContact NE-CD 3.27Å; R563-E581 IonicContact NE-OE1 2.73Å; R563-E581 PolarHBondContact NE-OE1 3.03Å; R563-E581 IonicContact NE-OE2 3.03Å; R563-E581 PolarHBondContact NE-OE2 3.19Å; R563-E581 IonicContact NH2-OE1 3.66Å; R563-E581 IonicContact NH2-OE2 2.67Å; R563-E581 PolarHBondContact NH2-OE2 2.94Å; Y565-E581 HydrophobicContact CE2-CG 3.96Å; Y565-E581 WeakPolarHBondContact CE2-OE1 3.43Å; Y565-E581 PolarHBondContact OH-OE1 3.41Å; I577-E581 HydrophobicContact CG2-CG 4.33Å; I577-E581 WeakPolarHBondContact O-CB 3.36Å; I577-E581 PolarHBondContact O-N 3.18Å; T578-E581 PolarHBondContact O-N 2.87Å; E581-E583 VanDerWaalsContact C-N 3.32Å; E581-E583 PolarHBondContact O-N 2.97Å; E581-L584 CarbonylContact O-C 3.57Å; E581-L584 PolarHBondContact O-N 2.89Å; E581-L584 VanDerWaalsContact O-N 3.11Å; E581-G585 PolarHBondContact O-N 3.36Å; E581-G585 VanDerWaalsContact O-N 3.13Å; E581-G586 WeakPolarHBondContact O-CA 3.41Å; E581-G586 PolarHBondContact O-N 2.85Å
582	H	89.3	Confident	89.7	Confident	147 Å²	147	43.9 Å²	43.9	68%	0.681	22%	0.222	S	C	*	.	H	α-helix	trans	-60.3	-40.5	173.4	179.1	-84.2	0	0	0	112.1	T578 N579 R580 L584 G585	T578-H582 WeakPolarHBondContact O-CB 3.19Å; T578-H582 PolarHBondContact O-N 3.08Å; N579-H582 PolarHBondContact O-N 2.03Å; R580-H582 VanDerWaalsContact C-N 3.34Å; H582-L584 VanDerWaalsContact C-N 3.3Å; H582-L584 PolarHBondContact O-N 3.22Å; H582-G585 PolarHBondContact O-N 3.36Å
583	E	88.9	Confident	89.3	Confident	134 Å²	134	48 Å²	48	63%	0.626	25%	0.247	S	C	*	.	H	α-helix	trans	-63.9	-34.5	173.5	-68.1	171.6	-179.6	0	0	112.9	N579 R580 E581 G585	N579-E583 WeakPolarHBondContact O-CG 3.03Å; N579-E583 PolarHBondContact O-N 2.03Å; N579-E583 VanDerWaalsContact O-N 3.11Å; R580-E583 IonicContact CZ-OE2 3.88Å; R580-E583 IonicContact NH1-OE2 2.83Å; R580-E583 PolarHBondContact NH1-OE2 3.15Å; R580-E583 WeakPolarHBondContact O-CB 3.24Å; R580-E583 PolarHBondContact O-N 3.01Å; E581-E583 VanDerWaalsContact C-N 3.32Å; E581-E583 PolarHBondContact O-N 2.97Å; E583-G585 PolarHBondContact O-N 2.97Å
584	L	89.5	Confident	89	Confident	76 Å²	76	52.6 Å²	52.6	40%	0.398	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	5.7	176.1	-63.5	174.6	0	0	0	113.1	R580 E581 H582 G586	R580-L584 HydrophobicContact CG-CD1 4.41Å; R580-L584 WeakPolarHBondContact O-CG 3.34Å; R580-L584 PolarHBondContact O-N 3.01Å; R580-L584 VanDerWaalsContact O-N 3.1Å; E581-L584 CarbonylContact O-C 3.57Å; E581-L584 PolarHBondContact O-N 2.89Å; E581-L584 VanDerWaalsContact O-N 3.11Å; H582-L584 VanDerWaalsContact C-N 3.3Å; H582-L584 PolarHBondContact O-N 3.22Å; L584-G586 PolarHBondContact O-N 3.04Å
585	G	87.6	Confident	88.5	Confident	52 Å²	52	55.1 Å²	55.1	54%	0.536	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	14.3	-177.8	0	0	0	0	0	114.5	E581 H582 E583	E581-G585 PolarHBondContact O-N 3.36Å; E581-G585 VanDerWaalsContact O-N 3.13Å; H582-G585 PolarHBondContact O-N 3.36Å; E583-G585 PolarHBondContact O-N 2.97Å
586	G	90.1	Very high	88.4	Confident	10 Å²	10	55 Å²	55	10%	0.103	28%	0.284	C	S	.	.			trans	-75.9	136.5	174.2	0	0	0	0	0	112.4	E581 L584	E581-G586 WeakPolarHBondContact O-CA 3.41Å; E581-G586 PolarHBondContact O-N 2.85Å; L584-G586 PolarHBondContact O-N 3.04Å
587	R	90.6	Very high	88.4	Confident	142 Å²	142	55.1 Å²	55.1	54%	0.536	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.1	173.7	-172.1	179.2	-177.4	-155.8	-4.3	110.3	F556 F557 C589 T685	F556-R587 CarbonylContact C-O 3.55Å; F556-R587 VanDerWaalsContact CA-O 3.28Å; F556-R587 WeakPolarHBondContact CA-O 3.49Å; F557-R587 PolarHBondContact N-O 3.4Å; F557-R587 PolarHBondContact O-N 2.78Å; R587-C589 PolarHBondContact O-N 2.79Å; R587-T685 PolarHBondContact NH1-O 2.95Å; R587-T685 VanDerWaalsContact NH1-O 3.09Å
588	L	92.8	Very high	88.2	Confident	23 Å²	23	55 Å²	55	12%	0.12	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	125.9	173.6	-174.4	67.3	0	0	0	109.8	L554 F556 W689 V691	L554-L588 HydrophobicContact CD2-CD1 4.08Å; F556-L588 HydrophobicContact CD1-CB 4.15Å; F556-L588 HydrophobicContact CD1-CD1 4.33Å; F556-L588 HydrophobicContact CE1-CB 3.9Å; F556-L588 HydrophobicContact CE1-CD1 3.88Å; F556-L588 HydrophobicContact CE1-CG 4.48Å; F556-L588 HydrophobicContact CE2-CD1 4.15Å; F556-L588 HydrophobicContact CZ-CD1 3.78Å; L588-W689 HydrophobicContact CB-CB 4.46Å; L588-W689 HydrophobicContact CD2-CB 3.57Å; L588-W689 HydrophobicContact CG-CB 3.74Å; L588-W689 HydrophobicContact CG-CG 4.45Å; L588-V691 HydrophobicContact CD2-CG2 3.99Å
589	C	92.8	Very high	88	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	-0.1	-174.6	62.8	0	0	0	0	113.4	A555 F556 F557 R587 V683 D684 T685 W689	A555-C589 VanDerWaalsContact C-SG 3.55Å; A555-C589 PolarHBondContact O-N 2.97Å; A555-C589 PolarHBondContact O-SG 2.75Å; F556-C589 VanDerWaalsContact C-SG 3.58Å; F557-C589 HydrophobicContact CB-CB 4.27Å; R587-C589 PolarHBondContact O-N 2.79Å; C589-V683 HydrophobicContact CB-CG1 3.96Å; C589-V683 CarbonylContact O-C 3.43Å; C589-V683 WeakPolarHBondContact O-CA 3.25Å; C589-V683 WeakPolarHBondContact O-CG1 3.25Å; C589-V683 WeakPolarHBondContact SG-CG1 3.36Å; C589-D684 CarbonylContact O-C 3.55Å; C589-D684 PolarHBondContact O-N 2.91Å; C589-T685 HydrophobicContact CB-CG2 3.78Å; C589-W689 VanDerWaalsContact C-NE1 3.27Å; C589-W689 PolarHBondContact O-NE1 2.73Å; C589-W689 VanDerWaalsContact O-NE1 3.13Å
590	G	92.2	Very high	87.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	141.9	172.3	0	0	0	0	0	110.9	A555	A555-G590 PolarHBondContact N-O 3.39Å; A555-G590 PolarHBondContact O-N 3.04Å
591	L	90.7	Very high	87.5	Confident	15 Å²	15	48 Å²	48	8%	0.079	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	124.8	-177.3	-179	55.5	0	0	0	109.9	L554 W689 D690 C694	L554-L591 HydrophobicContact CD2-CD1 3.48Å; L554-L591 VanDerWaalsContact CD2-CD1 3.48Å; L554-L591 HydrophobicContact CG-CD1 4.17Å; L591-W689 HydrophobicContact CB-CE3 3.85Å; L591-W689 HydrophobicContact CB-CZ3 4.29Å; L591-D690 WeakPolarHBondContact CD2-O 3.41Å; L591-C694 WeakPolarHBondContact CD1-SG 3.07Å; L591-C694 VanDerWaalsContact CD2-SG 3.54Å; L591-C694 WeakPolarHBondContact CG-SG 3.31Å
592	C	87.3	Confident	87.1	Confident	12 Å²	12	51.3 Å²	51.3	8%	0.081	27%	0.273	C	S	.	.			trans	-91.5	118.1	173.7	-170.1	0	0	0	0	110.5	L553 D594 M681	L553-C592 HydrophobicContact CB-CB 3.94Å; L553-C592 PolarHBondContact O-N 2.95Å; L553-C592 VanDerWaalsContact O-N 3.09Å; C592-D594 VanDerWaalsContact C-N 3.32Å; C592-M681 HydrophobicContact CB-SD 4.47Å
593	T	80.4	Confident	87.1	Confident	89 Å²	89	47.5 Å²	47.5	55%	0.546	26%	0.257	S	S	.	.			trans	-72.3	-27.3	175.5	51	0	0	0	0	112.3	K552	K552-T593 PolarHBondContact NZ-O 3.03Å
594	D	81.8	Confident	87.2	Confident	106 Å²	106	41.1 Å²	41.1	57%	0.567	23%	0.228	S	C	*	.	S	Bend	trans	-76.9	152.1	177.3	-64.4	-34.2	0	0	0	111.6	C592	C592-D594 VanDerWaalsContact C-N 3.32Å
595	V	82	Confident	87.3	Confident	56 Å²	56	38.2 Å²	38.2	34%	0.339	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-86.7	123.8	176	175.5	0	0	0	0	108.8	R550	R550-V595 HydrophobicContact CB-CG1 3.62Å; R550-V595 HydrophobicContact CG-CG1 3.98Å
596	F	85.9	Confident	87.5	Confident	28 Å²	28	35.8 Å²	35.8	12%	0.123	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	120.6	171.1	-173.4	-121.1	0	0	0	109.5	T551 V598 V604 I666 L679	T551-F596 WeakPolarHBondContact CA-O 3.23Å; T551-F596 VanDerWaalsContact CB-O 3.31Å; T551-F596 WeakPolarHBondContact CB-O 3.34Å; T551-F596 PolarHBondContact N-O 3.17Å; T551-F596 PolarHBondContact O-N 3.47Å; F596-V598 HydrophobicContact CD1-CG2 3.4Å; F596-V598 VanDerWaalsContact CD1-CG2 3.4Å; F596-V598 HydrophobicContact CE1-CG2 3.63Å; F596-V598 HydrophobicContact CG-CG2 4.43Å; F596-V598 PolarHBondContact O-N 2.79Å; F596-V604 HydrophobicContact CE1-CG1 4.49Å; F596-I666 HydrophobicContact CD1-CG2 4.23Å; F596-I666 HydrophobicContact CE1-CG2 3.71Å; F596-I666 HydrophobicContact CZ-CG2 4.05Å; F596-L679 HydrophobicContact CD2-CB 4.16Å; F596-L679 HydrophobicContact CD2-CD1 4.41Å; F596-L679 HydrophobicContact CE2-CB 4.39Å
597	A	87	Confident	87.6	Confident	48 Å²	48	41 Å²	41	40%	0.397	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	105.4	179.1	0	0	0	0	0	109.9	L466 V548	L466-A597 HydrophobicContact CD2-CB 4Å; V548-A597 HydrophobicContact CG1-CB 3.62Å
598	V	86.3	Confident	87.6	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	119.3	-177.9	175.8	0	0	0	0	110.8	V548 K549 T551 F596 F600 V604 F631	V548-V598 CarbonylContact C-O 3.53Å; V548-V598 VanDerWaalsContact CA-O 3.3Å; V548-V598 WeakPolarHBondContact CA-O 3.06Å; K549-V598 PolarHBondContact N-O 3.04Å; K549-V598 PolarHBondContact O-N 3.36Å; T551-V598 HydrophobicContact CG2-CG2 3.96Å; T551-V598 VanDerWaalsContact OG1-CG2 3.31Å; T551-V598 WeakPolarHBondContact OG1-CG2 3.38Å; F596-V598 HydrophobicContact CD1-CG2 3.4Å; F596-V598 VanDerWaalsContact CD1-CG2 3.4Å; F596-V598 HydrophobicContact CE1-CG2 3.63Å; F596-V598 HydrophobicContact CG-CG2 4.43Å; F596-V598 PolarHBondContact O-N 2.79Å; V598-F600 PolarHBondContact O-N 3.04Å; V598-V604 HydrophobicContact CG1-CG2 3.76Å; V598-V604 HydrophobicContact CG2-CG2 4.32Å; V598-F631 HydrophobicContact CG1-CD1 3.99Å; V598-F631 HydrophobicContact CG1-CE1 3.87Å; V598-F631 HydrophobicContact CG1-CG 4.38Å; V598-F631 HydrophobicContact CG1-CZ 4.2Å
599	N	85.9	Confident	87.3	Confident	13 Å²	13	37 Å²	37	7%	0.07	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	117.6	166	-179	-37.5	0	0	0	109.6	Q546 L547 Y601 K602 Q668	Q546-N599 PolarHBondContact OE1-ND2 3.04Å; L547-N599 WeakPolarHBondContact O-CA 2.97Å; N599-Y601 PolarHBondContact O-N 3.19Å; N599-Y601 WeakPolarHBondContact OD1-CB 3.37Å; N599-Y601 PolarHBondContact OD1-N 3.3Å; N599-K602 HydrophobicContact CB-CB 4.45Å; N599-K602 HydrophobicContact CB-CD 4.34Å; N599-K602 HydrophobicContact CB-CG 4.45Å; N599-K602 PolarHBondContact O-N 2.02Å; N599-Q668 PolarHBondContact O-NE2 2.96Å
600	F	82.2	Confident	87.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-8.5	-172.6	75.5	-109.6	0	0	0	114.4	T436 W481 L547 V598 S628 F631 Q632	T436-F600 HydrophobicContact CG2-CD1 4.31Å; T436-F600 HydrophobicContact CG2-CE1 3.97Å; T436-F600 HydrophobicContact CG2-CZ 4.21Å; W481-F600 AromaticContact CH2-CD1 3.93Å; W481-F600 HydrophobicContact CH2-CD1 3.93Å; W481-F600 AromaticContact CH2-CE1 3.58Å; W481-F600 HydrophobicContact CH2-CE1 3.58Å; W481-F600 HydrophobicContact CZ2-CD1 4.5Å; W481-F600 HydrophobicContact CZ2-CE1 4.34Å; W481-F600 AromaticContact CZ3-CE1 3.95Å; W481-F600 HydrophobicContact CZ3-CE1 3.95Å; L547-F600 HydrophobicContact CB-CD1 3.55Å; L547-F600 HydrophobicContact CB-CE1 3.05Å; L547-F600 HydrophobicContact CB-CZ 3.9Å; L547-F600 HydrophobicContact CD1-CE1 3.36Å; L547-F600 HydrophobicContact CD1-CZ 3.57Å; L547-F600 HydrophobicContact CG-CE1 3.76Å; L547-F600 HydrophobicContact CG-CZ 4.23Å; L547-F600 PolarHBondContact O-N 2.86Å; V598-F600 PolarHBondContact O-N 3.04Å; F600-S628 WeakPolarHBondContact O-CB 3.42Å; F600-F631 HydrophobicContact CB-CB 4.17Å; F600-Q632 HydrophobicContact CD2-CG 4.2Å
601	Y	82.5	Confident	86.8	Confident	55 Å²	55	42.5 Å²	42.5	22%	0.216	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-6.1	173.6	-56.6	-69	0	0	0	113.3	L434 P540 A545 L547 N599	L434-Y601 HydrophobicContact CD2-CE1 4.32Å; P540-Y601 WeakPolarHBondContact CD-OH 3.28Å; P540-Y601 VanDerWaalsContact CG-OH 3.23Å; P540-Y601 WeakPolarHBondContact CG-OH 3.43Å; A545-Y601 WeakPolarHBondContact O-CE2 3.42Å; L547-Y601 HydrophobicContact CB-CE2 4Å; L547-Y601 HydrophobicContact CG-CE2 4.2Å; N599-Y601 PolarHBondContact O-N 3.19Å; N599-Y601 WeakPolarHBondContact OD1-CB 3.37Å; N599-Y601 PolarHBondContact OD1-N 3.3Å
602	K	84.2	Confident	86.4	Confident	70 Å²	70	42.8 Å²	42.8	30%	0.304	23%	0.23	S	C	.	.	S	Bend	trans	-121.5	143	-173.6	-63.4	-177.9	-176.1	179.2	0	111.1	N599 Q668	N599-K602 HydrophobicContact CB-CB 4.45Å; N599-K602 HydrophobicContact CB-CD 4.34Å; N599-K602 HydrophobicContact CB-CG 4.45Å; N599-K602 PolarHBondContact O-N 2.02Å; K602-Q668 PolarHBondContact O-NE2 2.97Å; K602-Q668 VanDerWaalsContact O-NE2 3.08Å
603	D	89	Confident	85.7	Confident	67 Å²	67	48.1 Å²	48.1	36%	0.358	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-64.6	143.7	175.3	-59.1	-16.6	0	0	0	110.9	I626 P627 S628	D603-I626 WeakPolarHBondContact CA-O 3.2Å; D603-P627 WeakPolarHBondContact OD1-CA 3.45Å; D603-S628 PolarHBondContact OD1-N 3.33Å
604	V	91	Very high	85.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.1	172.4	174.6	0	0	0	0	108.3	F596 V598 I606 S625 I626 F631 I666 Q668	F596-V604 HydrophobicContact CE1-CG1 4.49Å; V598-V604 HydrophobicContact CG1-CG2 3.76Å; V598-V604 HydrophobicContact CG2-CG2 4.32Å; V604-I606 HydrophobicContact CG1-CG1 4.4Å; V604-S625 CarbonylContact O-C 3.58Å; V604-S625 VanDerWaalsContact O-CA 3.23Å; V604-S625 WeakPolarHBondContact O-CA 3.39Å; V604-I626 HydrophobicContact CB-CB 4.42Å; V604-I626 PolarHBondContact N-O 2.93Å; V604-I626 PolarHBondContact O-N 3.04Å; V604-F631 HydrophobicContact CB-CE2 4Å; V604-F631 HydrophobicContact CB-CZ 3.79Å; V604-F631 HydrophobicContact CG2-CE1 4.24Å; V604-F631 HydrophobicContact CG2-CE2 3.6Å; V604-F631 HydrophobicContact CG2-CZ 3.35Å; V604-I666 HydrophobicContact CG1-CG2 3.66Å; V604-Q668 HydrophobicContact CG2-CG 3.92Å
605	H	91	Very high	85.8	Confident	16 Å²	16	41.4 Å²	41.4	7%	0.074	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	133.7	176.8	-63.3	-68.2	0	0	0	110.5	S625 I666 Y667 K669	H605-S625 WeakPolarHBondContact ND1-CB 3.32Å; H605-I666 WeakPolarHBondContact O-CA 3.45Å; H605-Y667 HydrophobicContact CB-CD1 4.19Å; H605-Y667 HydrophobicContact CB-CD2 4.13Å; H605-Y667 HydrophobicContact CB-CE1 3.78Å; H605-Y667 HydrophobicContact CB-CE2 3.71Å; H605-Y667 HydrophobicContact CB-CG 4.35Å; H605-Y667 AromaticContact CD2-CE2 3.91Å; H605-Y667 PolarHBondContact N-O 3.11Å; H605-Y667 PolarHBondContact O-N 3.09Å; H605-K669 VanDerWaalsContact NE2-CE 3.31Å; H605-K669 WeakPolarHBondContact NE2-CE 3.06Å
606	I	92.4	Very high	85.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.6	177.5	-55.8	-175.3	0	0	0	107.8	V564 V604 R623 Q624 I626 C641 F643 V664 R665 I666	V564-I606 HydrophobicContact CB-CD1 4.19Å; V564-I606 HydrophobicContact CB-CG2 4.44Å; V564-I606 HydrophobicContact CG1-CD1 3.92Å; V564-I606 HydrophobicContact CG1-CG2 4.36Å; V604-I606 HydrophobicContact CG1-CG1 4.4Å; I606-R623 WeakPolarHBondContact O-CA 3.16Å; I606-Q624 PolarHBondContact N-O 3.34Å; I606-Q624 PolarHBondContact O-N 3.08Å; I606-I626 HydrophobicContact CD1-CD1 3.91Å; I606-I626 HydrophobicContact CD1-CG1 4.45Å; I606-C641 HydrophobicContact CD1-CB 4.06Å; I606-F643 HydrophobicContact CB-CZ 4.27Å; I606-F643 HydrophobicContact CG2-CE2 3.88Å; I606-F643 HydrophobicContact CG2-CZ 3.83Å; I606-V664 HydrophobicContact CG2-CG1 3.37Å; I606-R665 WeakPolarHBondContact CA-O 3.34Å; I606-I666 HydrophobicContact CG1-CG1 4.33Å; I606-I666 HydrophobicContact CG1-CG2 4.47Å
607	R	90.8	Very high	85.8	Confident	120 Å²	120	41.4 Å²	41.4	45%	0.453	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	133.2	178.7	-177.1	179.7	-176.7	170	2	110.7	S622 V664 R665 Y667	R607-S622 CarbonylContact C-O 3.55Å; R607-S622 VanDerWaalsContact CA-O 3.3Å; R607-S622 WeakPolarHBondContact CA-O 3.31Å; R607-V664 CarbonylContact O-C 3.57Å; R607-V664 WeakPolarHBondContact O-CA 3.37Å; R607-R665 PolarHBondContact N-O 3.16Å; R607-R665 PolarHBondContact O-N 3.06Å; R607-Y667 HydrophobicContact CB-CE1 4.47Å
608	L	90.7	Very high	85.5	Confident	9 Å²	9	42.4 Å²	42.4	5%	0.047	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	115.4	166.9	-71.4	168.2	0	0	0	109.5	L562 L617 S622 F643 V664	L562-L608 HydrophobicContact CD2-CD1 4.45Å; L562-L608 HydrophobicContact CD2-CD2 3.56Å; L608-L617 HydrophobicContact CD1-CD2 3.58Å; L608-S622 PolarHBondContact N-O 2.96Å; L608-F643 HydrophobicContact CD1-CB 3.66Å; L608-F643 HydrophobicContact CD1-CD1 3.43Å; L608-F643 VanDerWaalsContact CD1-CD1 3.43Å; L608-F643 HydrophobicContact CD1-CD2 3.95Å; L608-F643 HydrophobicContact CD1-CE1 3.97Å; L608-F643 HydrophobicContact CD1-CE2 4.45Å; L608-F643 HydrophobicContact CD1-CG 3.4Å; L608-F643 HydrophobicContact CD1-CZ 4.46Å; L608-F643 HydrophobicContact CG-CD1 4.12Å; L608-F643 HydrophobicContact CG-CD2 4.33Å; L608-F643 HydrophobicContact CG-CE1 4.18Å; L608-F643 HydrophobicContact CG-CE2 4.4Å; L608-F643 HydrophobicContact CG-CG 4.19Å; L608-F643 HydrophobicContact CG-CZ 4.32Å; L608-V664 HydrophobicContact CD2-CG2 3.76Å
609	E	88.4	Confident	84.8	Confident	72 Å²	72	49.6 Å²	49.6	34%	0.336	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-41.3	-179.9	-60.3	-136.6	122	0	0	112.4	R663 R665 L680	E609-R663 HydrophobicContact CB-CB 4.46Å; E609-R663 PolarHBondContact N-O 2.87Å; E609-R665 HydrophobicContact CG-CB 3.74Å; E609-R665 IonicContact OE1-CZ 3.73Å; E609-R665 IonicContact OE1-NE 3.57Å; E609-R665 PolarHBondContact OE1-NE 3.12Å; E609-R665 VanDerWaalsContact OE1-NE 3.13Å; E609-R665 IonicContact OE1-NH1 3.9Å; E609-R665 PolarHBondContact OE1-NH1 3.35Å; E609-R665 IonicContact OE1-NH2 3.26Å; E609-R665 PolarHBondContact OE1-NH2 3.2Å; E609-R665 IonicContact OE2-CZ 3.78Å; E609-R665 IonicContact OE2-NE 3.82Å; E609-R665 IonicContact OE2-NH1 2.74Å; E609-R665 IonicContact OE2-NH2 2.95Å; E609-R665 PolarHBondContact OE2-NH2 3.25Å; E609-L680 HydrophobicContact CG-CD2 4.44Å; E609-L680 VanDerWaalsContact OE2-CD2 3.31Å; E609-L680 WeakPolarHBondContact OE2-CD2 3.37Å
610	S	87.7	Confident	84.3	Confident	56 Å²	56	56.5 Å²	56.5	39%	0.392	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	138	178.3	65.2	0	0	0	0	110.7	G662 R663	S610-G662 CarbonylContact O-C 3.55Å; S610-G662 WeakPolarHBondContact O-CA 3.38Å; S610-R663 PolarHBondContact N-O 2.79Å; S610-R663 PolarHBondContact O-N 2.94Å; S610-R663 WeakPolarHBondContact OG-CB 3.33Å; S610-R663 PolarHBondContact OG-N 2.99Å
611	I	86.7	Confident	84.3	Confident	59 Å²	59	60.9 Å²	60.9	30%	0.303	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128.2	175.7	-60.9	172.8	0	0	0	106.1	W615 L617 F660	I611-W615 HydrophobicContact CG2-CB 3.72Å; I611-W615 WeakPolarHBondContact CG2-O 3.48Å; I611-L617 HydrophobicContact CD1-CB 3.46Å; I611-L617 VanDerWaalsContact CD1-CB 3.46Å; I611-L617 HydrophobicContact CD1-CD2 4.22Å; I611-F660 HydrophobicContact CG2-CE2 4.14Å
612	G	81	Confident	84.4	Confident	21 Å²	21	59.5 Å²	59.5	22%	0.216	33%	0.33	C	S	.	.			trans	-64	162.5	179.9	0	0	0	0	0	112.4	G614 W615 K661	G612-G614 PolarHBondContact O-N 2.66Å; G612-W615 PolarHBondContact O-N 2.72Å; G612-K661 WeakPolarHBondContact CA-O 3.4Å; G612-K661 PolarHBondContact N-O 3.33Å
613	S	74.1	Confident	84.6	Confident	125 Å²	125	61.2 Å²	61.2	87%	0.874	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	134.4	179.1	51.5	0	0	0	0	111.6
614	G	77.1	Confident	84.7	Confident	28 Å²	28	60.8 Å²	60.8	29%	0.289	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.7	-6.4	176.2	0	0	0	0	0	115.1	G612 M647 I648	G612-G614 PolarHBondContact O-N 2.66Å; G614-M647 CarbonylContact O-C 3.54Å; G614-M647 WeakPolarHBondContact O-CA 3.4Å; G614-M647 WeakPolarHBondContact O-CG 3.32Å; G614-I648 PolarHBondContact O-N 2.8Å
615	W	85.2	Confident	84.7	Confident	25 Å²	25	63.6 Å²	63.6	10%	0.095	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	146.6	176.8	-62.1	93	0	0	0	111.8	F557 I611 G612 L645 T646 M647 N657 S659 F660	F557-W615 HydrophobicContact CE1-CH2 4.47Å; F557-W615 HydrophobicContact CE1-CZ2 4.25Å; F557-W615 AromaticContact CZ-CH2 3.8Å; F557-W615 HydrophobicContact CZ-CH2 3.8Å; F557-W615 AromaticContact CZ-CZ2 3.8Å; F557-W615 HydrophobicContact CZ-CZ2 3.8Å; F557-W615 HydrophobicContact CZ-CZ3 4.33Å; I611-W615 HydrophobicContact CG2-CB 3.72Å; I611-W615 WeakPolarHBondContact CG2-O 3.48Å; G612-W615 PolarHBondContact O-N 2.72Å; W615-L645 HydrophobicContact CD2-CB 4.29Å; W615-L645 HydrophobicContact CE3-CB 3.57Å; W615-L645 HydrophobicContact CZ3-CB 4.17Å; W615-T646 CarbonylContact C-O 3.51Å; W615-M647 HydrophobicContact CE3-CB 4.22Å; W615-M647 HydrophobicContact CH2-CB 4.49Å; W615-M647 HydrophobicContact CZ3-CB 4.08Å; W615-N657 WeakPolarHBondContact CH2-O 3.46Å; W615-N657 VanDerWaalsContact CZ2-O 3.26Å; W615-N657 WeakPolarHBondContact CZ2-O 3.45Å; W615-S659 PolarHBondContact NE1-O 2.84Å; W615-F660 HydrophobicContact CB-CD2 4.49Å; W615-F660 AromaticContact CD1-CD2 3.86Å; W615-F660 HydrophobicContact CG-CD2 4.11Å
616	T	83.3	Confident	84.6	Confident	64 Å²	64	63 Å²	63	39%	0.393	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	148.2	173.1	44.4	0	0	0	0	110.9	T646 I648	T616-T646 PolarHBondContact N-O 3.38Å; T616-T646 PolarHBondContact O-N 3.28Å; T616-T646 PolarHBondContact OG1-O 2.88Å; T616-I648 HydrophobicContact CG2-CD1 3.37Å; T616-I648 HydrophobicContact CG2-CG1 3.43Å; T616-I648 VanDerWaalsContact CG2-CG1 3.43Å
617	L	85.7	Confident	84.4	Confident	21 Å²	21	65.4 Å²	65.4	11%	0.11	36%	0.363	C	S	.	.			trans	-132.1	137.9	170.6	-176.7	74	0	0	0	107.7	L608 I611 L619 E621 F643 K644 L645	L608-L617 HydrophobicContact CD1-CD2 3.58Å; I611-L617 HydrophobicContact CD1-CB 3.46Å; I611-L617 VanDerWaalsContact CD1-CB 3.46Å; I611-L617 HydrophobicContact CD1-CD2 4.22Å; L617-L619 PolarHBondContact O-N 2.86Å; L617-E621 HydrophobicContact CD1-CB 4.16Å; L617-E621 HydrophobicContact CG-CB 4.31Å; L617-F643 HydrophobicContact CD2-CD1 4.36Å; L617-K644 VanDerWaalsContact CD1-O 3.27Å; L617-K644 WeakPolarHBondContact CD1-O 3.18Å; L617-L645 HydrophobicContact CB-CD2 3.98Å; L617-L645 HydrophobicContact CD1-CD2 4.07Å; L617-L645 HydrophobicContact CG-CD2 4.48Å
618	P	80.2	Confident	84	Confident	68 Å²	68	61.1 Å²	61.1	44%	0.442	35%	0.352	S	S	.	.			trans	-55.5	134.7	169.1	-22.8	34.2	0	0	0	110.8	D620 E621	P618-D620 PolarHBondContact O-N 3.35Å; P618-D620 VanDerWaalsContact O-N 3.17Å; P618-E621 HydrophobicContact CB-CB 4.45Å; P618-E621 HydrophobicContact CB-CG 4.25Å; P618-E621 PolarHBondContact O-N 3.44Å
619	L	71.7	Confident	83.5	Confident	152 Å²	152	63.1 Å²	63.1	80%	0.796	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-55.9	-37.3	-175.1	-76.6	166.3	0	0	0	112.8	L617 E621 S622	L617-L619 PolarHBondContact O-N 2.86Å; L619-E621 PolarHBondContact O-N 2.84Å; L619-S622 WeakPolarHBondContact O-CB 3.5Å; L619-S622 PolarHBondContact O-N 2.03Å; L619-S622 PolarHBondContact O-OG 3.4Å
620	D	75.5	Confident	83.2	Confident	159 Å²	159	63.1 Å²	63.1	85%	0.85	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-69.5	-17.3	-179.3	-62.5	-31.9	0	0	0	113.3	P618	P618-D620 PolarHBondContact O-N 3.35Å; P618-D620 VanDerWaalsContact O-N 3.17Å
621	E	82.3	Confident	82.8	Confident	92 Å²	92	60.8 Å²	60.8	43%	0.43	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-100.2	-1	-179.4	-63.6	-176	176.6	0	0	113.1	L617 P618 L619 R623 F643	L617-E621 HydrophobicContact CD1-CB 4.16Å; L617-E621 HydrophobicContact CG-CB 4.31Å; P618-E621 HydrophobicContact CB-CB 4.45Å; P618-E621 HydrophobicContact CB-CG 4.25Å; P618-E621 PolarHBondContact O-N 3.44Å; L619-E621 PolarHBondContact O-N 2.84Å; E621-R623 PolarHBondContact O-N 2.99Å; E621-R623 VanDerWaalsContact O-N 3.15Å; E621-F643 WeakPolarHBondContact O-CD1 3.31Å
622	S	84.4	Confident	82	Confident	25 Å²	25	59.9 Å²	59.9	18%	0.175	35%	0.347	C	S	.	.	S	Bend	trans	-65.6	-14	179	65	0	0	0	0	114.3	R607 L608 L619	R607-S622 CarbonylContact C-O 3.55Å; R607-S622 VanDerWaalsContact CA-O 3.3Å; R607-S622 WeakPolarHBondContact CA-O 3.31Å; L608-S622 PolarHBondContact N-O 2.96Å; L619-S622 WeakPolarHBondContact O-CB 3.5Å; L619-S622 PolarHBondContact O-N 2.03Å; L619-S622 PolarHBondContact O-OG 3.4Å
623	R	88	Confident	81.4	Confident	107 Å²	107	66.2 Å²	66.2	40%	0.404	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	128.2	179.8	-178.6	-174.2	179.5	165.4	6.4	110.3	I606 E621 Y667	I606-R623 WeakPolarHBondContact O-CA 3.16Å; E621-R623 PolarHBondContact O-N 2.99Å; E621-R623 VanDerWaalsContact O-N 3.15Å; R623-Y667 PolarHBondContact NE-OH 3.06Å; R623-Y667 PolarHBondContact NH2-OH 2.9Å
624	Q	91.6	Very high	81	Confident	58 Å²	58	61.4 Å²	61.4	27%	0.271	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	167.2	171	-66.4	-175	14.5	0	0	110.3	I606 C641 S642 F643	I606-Q624 PolarHBondContact N-O 3.34Å; I606-Q624 PolarHBondContact O-N 3.08Å; Q624-C641 HydrophobicContact CB-CB 3.94Å; Q624-C641 VanDerWaalsContact CB-SG 3.57Å; Q624-S642 PolarHBondContact NE2-O 3.01Å; Q624-S642 VanDerWaalsContact OE1-N 3.14Å; Q624-S642 PolarHBondContact OE1-O 3.1Å; Q624-F643 HydrophobicContact CB-CE1 4.18Å; Q624-F643 HydrophobicContact CB-CZ 4.15Å; Q624-F643 HydrophobicContact CG-CD1 4.36Å; Q624-F643 HydrophobicContact CG-CE1 3.76Å; Q624-F643 HydrophobicContact CG-CZ 4.2Å
625	S	90.1	Very high	80.5	Confident	58 Å²	58	64.3 Å²	64.3	41%	0.406	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	139.6	177.6	56.6	0	0	0	0	111.2	V604 H605	V604-S625 CarbonylContact O-C 3.58Å; V604-S625 VanDerWaalsContact O-CA 3.23Å; V604-S625 WeakPolarHBondContact O-CA 3.39Å; H605-S625 WeakPolarHBondContact ND1-CB 3.32Å
626	I	89.5	Confident	79.5	Confident	3 Å²	3	64.9 Å²	64.9	2%	0.015	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	116.1	170.5	-53	177.1	0	0	0	107.3	C566 D603 V604 I606 H630 F631 V639 C641	C566-I626 HydrophobicContact CB-CD1 4.2Å; D603-I626 WeakPolarHBondContact CA-O 3.2Å; V604-I626 HydrophobicContact CB-CB 4.42Å; V604-I626 PolarHBondContact N-O 2.93Å; V604-I626 PolarHBondContact O-N 3.04Å; I606-I626 HydrophobicContact CD1-CD1 3.91Å; I606-I626 HydrophobicContact CD1-CG1 4.45Å; I626-H630 HydrophobicContact CG2-CB 4.05Å; I626-F631 HydrophobicContact CB-CE2 3.89Å; I626-F631 HydrophobicContact CB-CZ 4.07Å; I626-F631 HydrophobicContact CD1-CZ 4.42Å; I626-F631 HydrophobicContact CG2-CD2 4.3Å; I626-F631 HydrophobicContact CG2-CE2 3.51Å; I626-F631 HydrophobicContact CG2-CZ 3.77Å; I626-V639 HydrophobicContact CD1-CG1 4.1Å; I626-V639 HydrophobicContact CG2-CG1 3.87Å; I626-C641 VanDerWaalsContact CG1-SG 3.51Å
627	P	88.4	Confident	78.3	Confident	52 Å²	52	67 Å²	67	34%	0.338	34%	0.343	S	S	.	.			trans	-63.2	145.4	178.8	-22	33.6	0	0	0	112.5	D603 A629 H630	D603-P627 WeakPolarHBondContact OD1-CA 3.45Å; P627-A629 PolarHBondContact O-N 2.81Å; P627-A629 VanDerWaalsContact O-N 3.15Å; P627-H630 WeakPolarHBondContact O-CB 3.3Å; P627-H630 PolarHBondContact O-N 3.09Å
628	S	82.5	Confident	77.2	Confident	29 Å²	29	67.3 Å²	67.3	20%	0.203	35%	0.349	C	S	.	.	H	α-helix	trans	-52.6	-35.4	176.5	59	0	0	0	0	113.7	F600 D603 H630 F631 Q632	F600-S628 WeakPolarHBondContact O-CB 3.42Å; D603-S628 PolarHBondContact OD1-N 3.33Å; S628-H630 PolarHBondContact O-N 3.02Å; S628-H630 VanDerWaalsContact O-N 3.13Å; S628-F631 PolarHBondContact O-N 2.84Å; S628-Q632 PolarHBondContact O-N 3.34Å
629	A	80.6	Confident	77	Confident	51 Å²	51	64.3 Å²	64.3	42%	0.421	33%	0.329	S	S	.	.	H	α-helix	trans	-57.2	-27.6	177.3	0	0	0	0	0	113.9	P627	P627-A629 PolarHBondContact O-N 2.81Å; P627-A629 VanDerWaalsContact O-N 3.15Å
630	H	82	Confident	77.8	Confident	73 Å²	73	60 Å²	60	34%	0.338	31%	0.305	S	S	.	.	H	α-helix	trans	-73	-34.8	177.4	-69.7	-161.8	0	0	0	111.7	I626 P627 S628 D634 A638	I626-H630 HydrophobicContact CG2-CB 4.05Å; P627-H630 WeakPolarHBondContact O-CB 3.3Å; P627-H630 PolarHBondContact O-N 3.09Å; S628-H630 PolarHBondContact O-N 3.02Å; S628-H630 VanDerWaalsContact O-N 3.13Å; H630-D634 PolarHBondContact O-N 2.94Å; H630-A638 HydrophobicContact CB-CB 4.17Å; H630-A638 PolarHBondContact ND1-O 2.96Å
631	F	78.4	Confident	78.4	Confident	6 Å²	6	52.6 Å²	52.6	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-73	-28.8	176.1	-63.2	-81.2	0	0	0	112.7	T436 K549 C566 V598 F600 V604 I626 S628 D634 V639	T436-F631 PolarHBondContact OG1-O 2.93Å; K549-F631 PolarHBondContact NZ-O 3.43Å; C566-F631 HydrophobicContact CB-CE1 3.99Å; C566-F631 HydrophobicContact CB-CZ 4.26Å; V598-F631 HydrophobicContact CG1-CD1 3.99Å; V598-F631 HydrophobicContact CG1-CE1 3.87Å; V598-F631 HydrophobicContact CG1-CG 4.38Å; V598-F631 HydrophobicContact CG1-CZ 4.2Å; F600-F631 HydrophobicContact CB-CB 4.17Å; V604-F631 HydrophobicContact CB-CE2 4Å; V604-F631 HydrophobicContact CB-CZ 3.79Å; V604-F631 HydrophobicContact CG2-CE1 4.24Å; V604-F631 HydrophobicContact CG2-CE2 3.6Å; V604-F631 HydrophobicContact CG2-CZ 3.35Å; I626-F631 HydrophobicContact CB-CE2 3.89Å; I626-F631 HydrophobicContact CB-CZ 4.07Å; I626-F631 HydrophobicContact CD1-CZ 4.42Å; I626-F631 HydrophobicContact CG2-CD2 4.3Å; I626-F631 HydrophobicContact CG2-CE2 3.51Å; I626-F631 HydrophobicContact CG2-CZ 3.77Å; S628-F631 PolarHBondContact O-N 2.84Å; F631-D634 PolarHBondContact O-N 3.32Å; F631-V639 HydrophobicContact CD1-CG1 3.7Å; F631-V639 HydrophobicContact CE1-CG1 3.16Å; F631-V639 HydrophobicContact CE2-CG1 4.27Å; F631-V639 HydrophobicContact CG-CG1 4.45Å; F631-V639 HydrophobicContact CZ-CG1 3.48Å; F631-V639 VanDerWaalsContact CZ-CG1 3.48Å
632	Q	69.8	Low	78.9	Confident	40 Å²	40	50.1 Å²	50.1	19%	0.187	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-43	177.6	-70.9	177.3	-20.2	0	0	112.1	N433 T436 F600 S628 D634	N433-Q632 PolarHBondContact O-NE2 3.2Å; T436-Q632 WeakPolarHBondContact CA-O 3.22Å; T436-Q632 WeakPolarHBondContact CB-O 3.24Å; T436-Q632 PolarHBondContact OG1-O 3.02Å; F600-Q632 HydrophobicContact CD2-CG 4.2Å; S628-Q632 PolarHBondContact O-N 3.34Å; Q632-D634 VanDerWaalsContact C-N 3.34Å
633	R	68.7	Low	79.2	Confident	155 Å²	155	49 Å²	49	59%	0.585	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-9.1	178.2	-62.8	-171.6	178.6	-176.8	-0.1	114.1	R635	R633-R635 HydrophobicContact CB-CG 4.04Å; R633-R635 PolarHBondContact O-N 2.77Å
634	D	65.3	Low	79.3	Confident	24 Å²	24	51.2 Å²	51.2	13%	0.128	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	31.7	-176.7	-144.1	50.3	0	0	0	113.9	L437 K549 H630 F631 Q632 P636	L437-D634 HydrophobicContact CB-CB 4.05Å; K549-D634 VanDerWaalsContact NZ-CG 3.29Å; K549-D634 IonicContact NZ-OD1 3.24Å; K549-D634 PolarHBondContact NZ-OD1 3.24Å; K549-D634 IonicContact NZ-OD2 2.94Å; H630-D634 PolarHBondContact O-N 2.94Å; F631-D634 PolarHBondContact O-N 3.32Å; Q632-D634 VanDerWaalsContact C-N 3.34Å; D634-P636 WeakPolarHBondContact O-CD 3.3Å
635	R	67	Low	79.2	Confident	88 Å²	88	49 Å²	49	33%	0.332	25%	0.253	S	S	.	.			trans	-72.7	112.1	-179.5	-75.5	-176	176.5	174.2	-0.5	109.3	D425 R633 E637 A638 V639	D425-R635 VanDerWaalsContact CG-NH2 3.33Å; D425-R635 IonicContact OD1-CZ 3.77Å; D425-R635 IonicContact OD1-NE 3.93Å; D425-R635 PolarHBondContact OD1-NE 2.92Å; D425-R635 IonicContact OD1-NH2 3.99Å; D425-R635 PolarHBondContact OD1-NH2 2.91Å; D425-R635 IonicContact OD2-CZ 3.66Å; D425-R635 IonicContact OD2-NE 3.83Å; D425-R635 PolarHBondContact OD2-NE 2.87Å; D425-R635 VanDerWaalsContact OD2-NE 3.09Å; D425-R635 IonicContact OD2-NH1 3.71Å; D425-R635 IonicContact OD2-NH2 3.5Å; D425-R635 PolarHBondContact OD2-NH2 3.29Å; R633-R635 HydrophobicContact CB-CG 4.04Å; R633-R635 PolarHBondContact O-N 2.77Å; R635-E637 PolarHBondContact O-N 3.23Å; R635-A638 HydrophobicContact CB-CB 3.95Å; R635-A638 PolarHBondContact O-N 2.73Å; R635-V639 WeakPolarHBondContact O-CG2 3.41Å
636	P	63.7	Low	78.9	Confident	37 Å²	37	50.1 Å²	50.1	24%	0.24	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-31.9	-174.6	-25.4	35.4	0	0	0	113.3	W576 I577 D634	W576-P636 HydrophobicContact CD2-CB 4.05Å; W576-P636 HydrophobicContact CD2-CG 4.33Å; W576-P636 HydrophobicContact CE3-CB 3.33Å; W576-P636 HydrophobicContact CE3-CG 4.09Å; W576-P636 HydrophobicContact CZ3-CB 3.7Å; I577-P636 HydrophobicContact CD1-CB 4.36Å; I577-P636 HydrophobicContact CG1-CB 4.01Å; D634-P636 WeakPolarHBondContact O-CD 3.3Å
637	E	58.1	Low	78.5	Confident	110 Å²	110	52.7 Å²	52.7	51%	0.514	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-37.5	176.2	-69	-174.1	171.5	0	0	114.1	W576 R635 H640	W576-E637 HydrophobicContact CH2-CB 4.39Å; W576-E637 HydrophobicContact CH2-CG 3.07Å; W576-E637 VanDerWaalsContact CH2-OE1 3.27Å; W576-E637 WeakPolarHBondContact CH2-OE1 2.98Å; W576-E637 HydrophobicContact CZ2-CG 3.89Å; W576-E637 WeakPolarHBondContact CZ2-OE1 3.26Å; W576-E637 HydrophobicContact CZ3-CG 3.67Å; R635-E637 PolarHBondContact O-N 3.23Å; E637-H640 PolarHBondContact O-CE1 2.94Å; E637-H640 PolarHBondContact O-ND1 3.39Å
638	A	63	Low	77.9	Confident	27 Å²	27	55.1 Å²	55.1	22%	0.223	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-17.2	-167.8	0	0	0	0	0	112.6	H630 R635 H640	H630-A638 HydrophobicContact CB-CB 4.17Å; H630-A638 PolarHBondContact ND1-O 2.96Å; R635-A638 HydrophobicContact CB-CB 3.95Å; R635-A638 PolarHBondContact O-N 2.73Å; A638-H640 VanDerWaalsContact C-N 3.33Å; A638-H640 PolarHBondContact O-N 2.78Å
639	V	77.1	Confident	77.3	Confident	5 Å²	5	56.5 Å²	56.5	3%	0.03	30%	0.298	C	S	.	.	S	Bend	trans	-96	52.7	-170.3	-152.5	0	0	0	0	112	Y565 C566 I626 F631 R635	Y565-V639 WeakPolarHBondContact CA-O 3.27Å; C566-V639 HydrophobicContact CB-CG1 3.71Å; C566-V639 PolarHBondContact N-O 3.2Å; C566-V639 VanDerWaalsContact O-CG1 3.26Å; C566-V639 WeakPolarHBondContact O-CG1 3.42Å; I626-V639 HydrophobicContact CD1-CG1 4.1Å; I626-V639 HydrophobicContact CG2-CG1 3.87Å; F631-V639 HydrophobicContact CD1-CG1 3.7Å; F631-V639 HydrophobicContact CE1-CG1 3.16Å; F631-V639 HydrophobicContact CE2-CG1 4.27Å; F631-V639 HydrophobicContact CG-CG1 4.45Å; F631-V639 HydrophobicContact CZ-CG1 3.48Å; F631-V639 VanDerWaalsContact CZ-CG1 3.48Å; R635-V639 WeakPolarHBondContact O-CG2 3.41Å
640	H	87.2	Confident	76.3	Confident	61 Å²	61	61 Å²	61	28%	0.282	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	155.9	176.3	80.7	-83.1	0	0	0	113.6	V564 Y565 E637 A638 S642	V564-H640 CarbonylContact O-C 3.58Å; V564-H640 WeakPolarHBondContact O-CA 3.17Å; V564-H640 WeakPolarHBondContact O-CB 3.27Å; Y565-H640 HydrophobicContact CD1-CB 3.52Å; Y565-H640 HydrophobicContact CD2-CB 4.02Å; Y565-H640 HydrophobicContact CE1-CB 3.52Å; Y565-H640 AromaticContact CE1-CG 3.79Å; Y565-H640 AromaticContact CE1-ND1 3.92Å; Y565-H640 HydrophobicContact CE2-CB 4.03Å; Y565-H640 HydrophobicContact CG-CB 3.75Å; Y565-H640 AromaticContact CZ-CG 3.77Å; E637-H640 PolarHBondContact O-CE1 2.94Å; E637-H640 PolarHBondContact O-ND1 3.39Å; A638-H640 VanDerWaalsContact C-N 3.33Å; A638-H640 PolarHBondContact O-N 2.78Å; H640-S642 PolarHBondContact CD2-OG 2.79Å; H640-S642 PolarHBondContact NE2-OG 3.24Å; H640-S642 VanDerWaalsContact NE2-OG 3.09Å
641	C	89.9	Confident	75	Confident	3 Å²	3	67.9 Å²	67.9	2%	0.02	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	143.5	165.6	-70	0	0	0	0	109.6	R563 V564 I606 Q624 I626 F643	R563-C641 CarbonylContact C-O 3.4Å; R563-C641 WeakPolarHBondContact CA-O 3.15Å; V564-C641 PolarHBondContact N-O 3.33Å; V564-C641 PolarHBondContact O-N 3.27Å; I606-C641 HydrophobicContact CD1-CB 4.06Å; Q624-C641 HydrophobicContact CB-CB 3.94Å; Q624-C641 VanDerWaalsContact CB-SG 3.57Å; I626-C641 VanDerWaalsContact CG1-SG 3.51Å; C641-F643 HydrophobicContact CB-CE2 3.88Å; C641-F643 HydrophobicContact CB-CZ 4.15Å
642	S	91.3	Very high	73.8	Confident	41 Å²	41	72.5 Å²	72.5	29%	0.287	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	115	-176.5	-77.5	0	0	0	0	110.1	Q624 H640	Q624-S642 PolarHBondContact NE2-O 3.01Å; Q624-S642 VanDerWaalsContact OE1-N 3.14Å; Q624-S642 PolarHBondContact OE1-O 3.1Å; H640-S642 PolarHBondContact CD2-OG 2.79Å; H640-S642 PolarHBondContact NE2-OG 3.24Å; H640-S642 VanDerWaalsContact NE2-OG 3.09Å
643	F	92.1	Very high	73	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	112.4	179.8	-57.8	-86.5	0	0	0	110.3	C561 L562 V564 I606 L608 L617 E621 Q624 C641 L645	C561-F643 WeakPolarHBondContact CA-O 2.97Å; L562-F643 HydrophobicContact CB-CB 4.34Å; L562-F643 HydrophobicContact CD2-CD2 4.48Å; L562-F643 PolarHBondContact N-O 3.16Å; L562-F643 PolarHBondContact O-N 3.07Å; V564-F643 HydrophobicContact CG2-CD2 4.46Å; V564-F643 HydrophobicContact CG2-CE2 4.2Å; I606-F643 HydrophobicContact CB-CZ 4.27Å; I606-F643 HydrophobicContact CG2-CE2 3.88Å; I606-F643 HydrophobicContact CG2-CZ 3.83Å; L608-F643 HydrophobicContact CD1-CB 3.66Å; L608-F643 HydrophobicContact CD1-CD1 3.43Å; L608-F643 VanDerWaalsContact CD1-CD1 3.43Å; L608-F643 HydrophobicContact CD1-CD2 3.95Å; L608-F643 HydrophobicContact CD1-CE1 3.97Å; L608-F643 HydrophobicContact CD1-CE2 4.45Å; L608-F643 HydrophobicContact CD1-CG 3.4Å; L608-F643 HydrophobicContact CD1-CZ 4.46Å; L608-F643 HydrophobicContact CG-CD1 4.12Å; L608-F643 HydrophobicContact CG-CD2 4.33Å; L608-F643 HydrophobicContact CG-CE1 4.18Å; L608-F643 HydrophobicContact CG-CE2 4.4Å; L608-F643 HydrophobicContact CG-CG 4.19Å; L608-F643 HydrophobicContact CG-CZ 4.32Å; L617-F643 HydrophobicContact CD2-CD1 4.36Å; E621-F643 WeakPolarHBondContact O-CD1 3.31Å; Q624-F643 HydrophobicContact CB-CE1 4.18Å; Q624-F643 HydrophobicContact CB-CZ 4.15Å; Q624-F643 HydrophobicContact CG-CD1 4.36Å; Q624-F643 HydrophobicContact CG-CE1 3.76Å; Q624-F643 HydrophobicContact CG-CZ 4.2Å; C641-F643 HydrophobicContact CB-CE2 3.88Å; C641-F643 HydrophobicContact CB-CZ 4.15Å; F643-L645 PolarHBondContact O-N 2.84Å
644	K	89.4	Confident	72	Confident	155 Å²	155	71.8 Å²	71.8	67%	0.674	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	114	179.3	-169.6	175	-175.5	176	0	110.3	L617	L617-K644 VanDerWaalsContact CD1-O 3.27Å; L617-K644 WeakPolarHBondContact CD1-O 3.18Å
645	L	88.2	Confident	71.3	Confident	10 Å²	10	79.8 Å²	79.8	5%	0.052	43%	0.425	C	S	.	.			trans	-98.2	141.3	-178	-58.9	177.6	0	0	0	110.8	F557 G560 L562 W615 L617 F643 F660	F557-L645 HydrophobicContact CE2-CD1 3.98Å; G560-L645 PolarHBondContact O-N 3.4Å; L562-L645 HydrophobicContact CB-CD1 4.41Å; W615-L645 HydrophobicContact CD2-CB 4.29Å; W615-L645 HydrophobicContact CE3-CB 3.57Å; W615-L645 HydrophobicContact CZ3-CB 4.17Å; L617-L645 HydrophobicContact CB-CD2 3.98Å; L617-L645 HydrophobicContact CD1-CD2 4.07Å; L617-L645 HydrophobicContact CG-CD2 4.48Å; F643-L645 PolarHBondContact O-N 2.84Å; L645-F660 HydrophobicContact CD1-CD2 3.56Å; L645-F660 HydrophobicContact CD1-CE2 3.37Å; L645-F660 HydrophobicContact CD1-CG 4.25Å; L645-F660 HydrophobicContact CD1-CZ 3.92Å
646	T	85.2	Confident	70.6	Confident	83 Å²	83	82.3 Å²	82.3	51%	0.509	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	127.2	176.1	-54.7	0	0	0	0	109.9	W615 T616	W615-T646 CarbonylContact C-O 3.51Å; T616-T646 PolarHBondContact N-O 3.38Å; T616-T646 PolarHBondContact O-N 3.28Å; T616-T646 PolarHBondContact OG1-O 2.88Å
647	M	80.8	Confident	70.5	Confident	56 Å²	56	83.2 Å²	83.2	28%	0.276	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	137.8	179.5	-164.1	-174.9	-171.9	0	0	111.2	G614 W615 N657	G614-M647 CarbonylContact O-C 3.54Å; G614-M647 WeakPolarHBondContact O-CA 3.4Å; G614-M647 WeakPolarHBondContact O-CG 3.32Å; W615-M647 HydrophobicContact CE3-CB 4.22Å; W615-M647 HydrophobicContact CH2-CB 4.49Å; W615-M647 HydrophobicContact CZ3-CB 4.08Å; M647-N657 VanDerWaalsContact CE-OD1 3.29Å; M647-N657 WeakPolarHBondContact CE-OD1 3.43Å; M647-N657 PolarHBondContact SD-OD1 2.97Å
648	I	75.4	Confident	71.1	Confident	103 Å²	103	84 Å²	84	53%	0.528	45%	0.452	S	S	.	.			trans	-91.7	97.2	176.2	-46	172.2	0	0	0	108.5	G614 T616	G614-I648 PolarHBondContact O-N 2.8Å; T616-I648 HydrophobicContact CG2-CD1 3.37Å; T616-I648 HydrophobicContact CG2-CG1 3.43Å; T616-I648 VanDerWaalsContact CG2-CG1 3.43Å
649	G	70.4	Confident	71.9	Confident	58 Å²	58	84.7 Å²	84.7	60%	0.598	45%	0.454	S	S	*	.	S	Bend	trans	143	164.4	173.9	0	0	0	0	0	115
650	D	59.2	Low	72.3	Confident	145 Å²	145	84.5 Å²	84.5	78%	0.775	45%	0.453	S	S	*	.			trans	-66.9	133.1	179.4	-110.8	-18.3	0	0	0	111.2	S652	D650-S652 PolarHBondContact O-N 3.38Å
651	R	54.5	Low	72.4	Confident	218 Å²	218	85.6 Å²	85.6	82%	0.823	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	6	-176.4	-71.2	-174.9	172.2	-159.1	-2.8	115.3
652	S	52.4	Low	72.5	Confident	103 Å²	103	86 Å²	86	72%	0.72	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-6.1	-171.5	57.2	0	0	0	0	114.9	D650	D650-S652 PolarHBondContact O-N 3.38Å
653	S	53.9	Low	72.6	Confident	56 Å²	56	88.7 Å²	88.7	39%	0.392	47%	0.465	S	S	.	.			trans	-96	93.9	168.6	58.7	0	0	0	0	110.5	E655	S653-E655 VanDerWaalsContact C-N 3.25Å; S653-E655 PolarHBondContact O-N 2.7Å; S653-E655 VanDerWaalsContact O-N 3.16Å
654	V	48.5	Very low	72.6	Confident	124 Å²	124	88.7 Å²	88.7	75%	0.752	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-11.6	-165.8	175.2	0	0	0	0	114.6
655	E	49.8	Very low	72.6	Confident	192 Å²	192	85.4 Å²	85.4	90%	0.897	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-9.6	-172.3	-67.3	-175.3	167.6	0	0	115.8	S653	S653-E655 VanDerWaalsContact C-N 3.25Å; S653-E655 PolarHBondContact O-N 2.7Å; S653-E655 VanDerWaalsContact O-N 3.16Å
656	Q	52.1	Low	72.8	Confident	141 Å²	141	84.9 Å²	84.9	66%	0.659	45%	0.446	S	S	*	.	S	Bend	trans	-99.2	2.1	-177.1	-79.4	178.6	-15.8	0	0	115.1	N658	Q656-N658 VanDerWaalsContact C-N 3.28Å; Q656-N658 PolarHBondContact O-N 3.48Å; Q656-N658 VanDerWaalsContact O-N 3.13Å
657	N	61.8	Low	72.9	Confident	56 Å²	56	82.5 Å²	82.5	30%	0.299	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-10.1	-170	-83	-2.6	0	0	0	116.5	W615 M647	W615-N657 WeakPolarHBondContact CH2-O 3.46Å; W615-N657 VanDerWaalsContact CZ2-O 3.26Å; W615-N657 WeakPolarHBondContact CZ2-O 3.45Å; M647-N657 VanDerWaalsContact CE-OD1 3.29Å; M647-N657 WeakPolarHBondContact CE-OD1 3.43Å; M647-N657 PolarHBondContact SD-OD1 2.97Å
658	N	70	Confident	73.2	Confident	128 Å²	128	81.1 Å²	81.1	68%	0.684	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.5	1.5	-170	-72.3	9.7	0	0	0	114.9	Q656 T685	Q656-N658 VanDerWaalsContact C-N 3.28Å; Q656-N658 PolarHBondContact O-N 3.48Å; Q656-N658 VanDerWaalsContact O-N 3.13Å; N658-T685 PolarHBondContact O-OG1 3.49Å
659	S	80.5	Confident	73.3	Confident	40 Å²	40	82.3 Å²	82.3	28%	0.28	42%	0.422	S	S	.	.			trans	-89.6	119.2	177.9	-174.1	0	0	0	0	110.8	W615 T685 E686	W615-S659 PolarHBondContact NE1-O 2.84Å; S659-T685 WeakPolarHBondContact CA-OG1 3.3Å; S659-E686 WeakPolarHBondContact CB-OE1 3.47Å; S659-E686 VanDerWaalsContact OG-CD 3.23Å; S659-E686 WeakPolarHBondContact OG-CG 3.31Å; S659-E686 PolarHBondContact OG-OE1 3.22Å
660	F	85.2	Confident	73	Confident	1 Å²	1	82.6 Å²	82.6	0%	0.004	41%	0.412	C	S	.	.			trans	-132.7	131.7	176.4	170.9	-99.8	0	0	0	109.8	F557 L562 I611 W615 L645 V683 T685	F557-F660 HydrophobicContact CD1-CB 4.41Å; F557-F660 HydrophobicContact CE1-CB 4.22Å; F557-F660 HydrophobicContact CE2-CB 4.38Å; F557-F660 HydrophobicContact CZ-CB 4.19Å; L562-F660 HydrophobicContact CD1-CE1 4.15Å; L562-F660 HydrophobicContact CD2-CE1 3.82Å; L562-F660 HydrophobicContact CD2-CZ 4.01Å; L562-F660 HydrophobicContact CG-CE1 4.48Å; I611-F660 HydrophobicContact CG2-CE2 4.14Å; W615-F660 HydrophobicContact CB-CD2 4.49Å; W615-F660 AromaticContact CD1-CD2 3.86Å; W615-F660 HydrophobicContact CG-CD2 4.11Å; L645-F660 HydrophobicContact CD1-CD2 3.56Å; L645-F660 HydrophobicContact CD1-CE2 3.37Å; L645-F660 HydrophobicContact CD1-CG 4.25Å; L645-F660 HydrophobicContact CD1-CZ 3.92Å; F660-V683 HydrophobicContact CD1-CG1 3.85Å; F660-V683 HydrophobicContact CE1-CB 4.13Å; F660-V683 HydrophobicContact CE1-CG1 3.68Å; F660-T685 HydrophobicContact CB-CG2 3.88Å; F660-T685 PolarHBondContact N-OG1 2.83Å; F660-T685 PolarHBondContact O-N 3.01Å; F660-T685 PolarHBondContact O-OG1 2.91Å
661	K	90.6	Very high	72.7	Confident	85 Å²	85	80.9 Å²	80.9	37%	0.37	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	146.3	169.1	-56.4	-165.6	-171.5	-143	0	109.2	G612 V683 D684 E686	G612-K661 WeakPolarHBondContact CA-O 3.4Å; G612-K661 PolarHBondContact N-O 3.33Å; K661-V683 CarbonylContact C-O 3.57Å; K661-V683 VanDerWaalsContact CA-O 3.23Å; K661-V683 WeakPolarHBondContact CA-O 3.06Å; K661-D684 WeakPolarHBondContact CE-OD1 3.25Å; K661-D684 WeakPolarHBondContact CE-OD2 3.37Å; K661-D684 HydrophobicContact CG-CB 4.37Å; K661-D684 IonicContact NZ-OD1 3.3Å; K661-D684 PolarHBondContact NZ-OD1 3.35Å; K661-D684 IonicContact NZ-OD2 2.81Å; K661-D684 PolarHBondContact NZ-OD2 3.42Å; K661-E686 WeakPolarHBondContact CE-OE2 3.26Å; K661-E686 IonicContact NZ-OE2 2.86Å; K661-E686 PolarHBondContact NZ-OE2 2.87Å
662	G	91.8	Very high	72.3	Confident	10 Å²	10	79.3 Å²	79.3	10%	0.103	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.8	178	-179.3	0	0	0	0	0	113	S610 V683	S610-G662 CarbonylContact O-C 3.55Å; S610-G662 WeakPolarHBondContact O-CA 3.38Å; G662-V683 PolarHBondContact N-O 2.91Å; G662-V683 PolarHBondContact O-N 3.44Å
663	R	92.1	Very high	71.9	Confident	98 Å²	98	78 Å²	78	37%	0.37	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	129.6	176.7	-175.7	170.1	-71.4	174.8	-3.8	109.8	E609 S610 L680 D682	E609-R663 HydrophobicContact CB-CB 4.46Å; E609-R663 PolarHBondContact N-O 2.87Å; S610-R663 PolarHBondContact N-O 2.79Å; S610-R663 PolarHBondContact O-N 2.94Å; S610-R663 WeakPolarHBondContact OG-CB 3.33Å; S610-R663 PolarHBondContact OG-N 2.99Å; R663-L680 HydrophobicContact CG-CD2 4.11Å; R663-D682 IonicContact CZ-OD1 3.13Å; R663-D682 VanDerWaalsContact CZ-OD1 3.27Å; R663-D682 IonicContact NE-OD1 3.11Å; R663-D682 PolarHBondContact NE-OD1 3.4Å; R663-D682 IonicContact NH2-OD1 2.72Å; R663-D682 PolarHBondContact NH2-OD1 3.18Å; R663-D682 IonicContact NH2-OD2 3.68Å; R663-D682 PolarHBondContact NH2-OD2 3.38Å
664	V	92.8	Very high	71.5	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.1	-179.7	-172.7	0	0	0	0	108.4	L562 V564 I606 R607 L608 I666 L680 M681 V683	L562-V664 HydrophobicContact CD2-CG2 4.49Å; V564-V664 HydrophobicContact CG2-CG1 4.47Å; V564-V664 HydrophobicContact CG2-CG2 4.37Å; I606-V664 HydrophobicContact CG2-CG1 3.37Å; R607-V664 CarbonylContact O-C 3.57Å; R607-V664 WeakPolarHBondContact O-CA 3.37Å; L608-V664 HydrophobicContact CD2-CG2 3.76Å; V664-I666 HydrophobicContact CB-CD1 4.23Å; V664-I666 HydrophobicContact CG1-CD1 3.77Å; V664-I666 HydrophobicContact CG1-CG1 4.24Å; V664-L680 CarbonylContact O-C 3.52Å; V664-L680 WeakPolarHBondContact O-CA 3.42Å; V664-M681 HydrophobicContact CB-CE 4.29Å; V664-M681 HydrophobicContact CG2-CE 4.22Å; V664-M681 PolarHBondContact N-O 3.45Å; V664-M681 PolarHBondContact O-N 3.08Å; V664-V683 HydrophobicContact CG2-CG2 3.75Å
665	R	90.3	Very high	71.3	Confident	86 Å²	86	81.1 Å²	81.1	33%	0.325	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129.9	170.5	-177.2	174.7	-80.7	162.5	-4.8	109.9	I606 R607 E609 Y667 L679 L680	I606-R665 WeakPolarHBondContact CA-O 3.34Å; R607-R665 PolarHBondContact N-O 3.16Å; R607-R665 PolarHBondContact O-N 3.06Å; E609-R665 HydrophobicContact CG-CB 3.74Å; E609-R665 IonicContact OE1-CZ 3.73Å; E609-R665 IonicContact OE1-NE 3.57Å; E609-R665 PolarHBondContact OE1-NE 3.12Å; E609-R665 VanDerWaalsContact OE1-NE 3.13Å; E609-R665 IonicContact OE1-NH1 3.9Å; E609-R665 PolarHBondContact OE1-NH1 3.35Å; E609-R665 IonicContact OE1-NH2 3.26Å; E609-R665 PolarHBondContact OE1-NH2 3.2Å; E609-R665 IonicContact OE2-CZ 3.78Å; E609-R665 IonicContact OE2-NE 3.82Å; E609-R665 IonicContact OE2-NH1 2.74Å; E609-R665 IonicContact OE2-NH2 2.95Å; E609-R665 PolarHBondContact OE2-NH2 3.25Å; R665-Y667 HydrophobicContact CG-CD1 4.2Å; R665-L679 WeakPolarHBondContact CA-O 3.33Å; R665-L680 HydrophobicContact CB-CD2 3.8Å; R665-L680 HydrophobicContact CG-CD2 4.09Å
666	I	90.6	Very high	71.4	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	129.5	-179.9	-55.5	86.3	0	0	0	108.8	L553 F596 V604 H605 I606 V664 G678 L679 M681	L553-I666 HydrophobicContact CD1-CB 4.09Å; L553-I666 HydrophobicContact CD1-CD1 3.56Å; L553-I666 HydrophobicContact CD1-CG1 3.72Å; L553-I666 HydrophobicContact CD1-CG2 4.37Å; F596-I666 HydrophobicContact CD1-CG2 4.23Å; F596-I666 HydrophobicContact CE1-CG2 3.71Å; F596-I666 HydrophobicContact CZ-CG2 4.05Å; V604-I666 HydrophobicContact CG1-CG2 3.66Å; H605-I666 WeakPolarHBondContact O-CA 3.45Å; I606-I666 HydrophobicContact CG1-CG1 4.33Å; I606-I666 HydrophobicContact CG1-CG2 4.47Å; V664-I666 HydrophobicContact CB-CD1 4.23Å; V664-I666 HydrophobicContact CG1-CD1 3.77Å; V664-I666 HydrophobicContact CG1-CG1 4.24Å; I666-G678 CarbonylContact O-C 3.55Å; I666-G678 WeakPolarHBondContact O-CA 3.47Å; I666-L679 PolarHBondContact N-O 3.45Å; I666-L679 PolarHBondContact O-N 3.02Å; I666-M681 HydrophobicContact CD1-CB 4.14Å
667	Y	88.8	Confident	71.9	Confident	33 Å²	33	74.9 Å²	74.9	13%	0.129	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	157.4	-178.8	62.2	-80.4	0	0	0	112.4	H605 R607 R623 R665	H605-Y667 HydrophobicContact CB-CD1 4.19Å; H605-Y667 HydrophobicContact CB-CD2 4.13Å; H605-Y667 HydrophobicContact CB-CE1 3.78Å; H605-Y667 HydrophobicContact CB-CE2 3.71Å; H605-Y667 HydrophobicContact CB-CG 4.35Å; H605-Y667 AromaticContact CD2-CE2 3.91Å; H605-Y667 PolarHBondContact N-O 3.11Å; H605-Y667 PolarHBondContact O-N 3.09Å; R607-Y667 HydrophobicContact CB-CE1 4.47Å; R623-Y667 PolarHBondContact NE-OH 3.06Å; R623-Y667 PolarHBondContact NH2-OH 2.9Å; R665-Y667 HydrophobicContact CG-CD1 4.2Å
668	Q	87.3	Confident	72.6	Confident	27 Å²	27	73 Å²	73	13%	0.126	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	139.7	167.4	-62.6	-170.9	-73.5	0	0	108.7	N599 K602 V604 T670	N599-Q668 PolarHBondContact O-NE2 2.96Å; K602-Q668 PolarHBondContact O-NE2 2.97Å; K602-Q668 VanDerWaalsContact O-NE2 3.08Å; V604-Q668 HydrophobicContact CG2-CG 3.92Å; Q668-T670 PolarHBondContact O-N 2.96Å
669	K	77	Confident	73.3	Confident	127 Å²	127	68.7 Å²	68.7	55%	0.552	39%	0.391	S	S	*	.			trans	-69.6	118.3	175.3	-71.3	174.6	-177.2	170.8	0	109.3	H605	H605-K669 VanDerWaalsContact NE2-CE 3.31Å; H605-K669 WeakPolarHBondContact NE2-CE 3.06Å
670	T	64.1	Low	73.7	Confident	65 Å²	65	70.5 Å²	70.5	40%	0.399	40%	0.397	S	S	.	.			trans	-91.3	147	166.1	50.1	0	0	0	0	108.9	Q668 E672 T673	Q668-T670 PolarHBondContact O-N 2.96Å; T670-E672 PolarHBondContact O-N 3.03Å; T670-T673 PolarHBondContact OG1-OG1 3.48Å; T670-T673 VanDerWaalsContact OG1-OG1 3.13Å
671	A	52.6	Low	74	Confident	109 Å²	109	70.9 Å²	70.9	90%	0.901	40%	0.399	S	S	*	.	S	Bend	trans	-63.5	-20.4	-179	0	0	0	0	0	112.9
672	E	47.2	Very low	74.1	Confident	185 Å²	185	70.9 Å²	70.9	86%	0.864	40%	0.403	S	S	*	.	S	Bend	trans	-103.8	-16.5	-167	-65.1	179	178.6	0	0	114.7	T670	T670-E672 PolarHBondContact O-N 3.03Å
673	T	42.3	Very low	74.2	Confident	76 Å²	76	70.6 Å²	70.6	47%	0.466	40%	0.399	S	S	.	.			trans	-138.1	110.1	178.5	46.7	0	0	0	0	111.3	T670 N675 G676	T670-T673 PolarHBondContact OG1-OG1 3.48Å; T670-T673 VanDerWaalsContact OG1-OG1 3.13Å; T673-N675 PolarHBondContact O-N 3.25Å; T673-G676 PolarHBondContact O-N 2.89Å
674	G	45.6	Very low	74.2	Confident	89 Å²	89	67.5 Å²	67.5	92%	0.918	39%	0.39	S	S	*	.	S	Bend	trans	-61.7	-12.4	176.8	0	0	0	0	0	114.9
675	N	44.6	Very low	74	Confident	155 Å²	155	67.8 Å²	67.8	83%	0.829	39%	0.392	S	S	*	.	S	Bend	trans	-122.4	81.9	169.4	-76.7	-16.1	0	0	0	108.3	T673 D677	T673-N675 PolarHBondContact O-N 3.25Å; N675-D677 PolarHBondContact O-N 3.4Å
676	G	52.6	Low	73.7	Confident	25 Å²	25	69.5 Å²	69.5	26%	0.258	40%	0.403	S	S	.	.			trans	-64.4	131.2	168.5	0	0	0	0	0	109.4	T673 G678	T673-G676 PolarHBondContact O-N 2.89Å; G676-G678 VanDerWaalsContact C-N 3.29Å; G676-G678 PolarHBondContact O-N 3.31Å
677	D	61.9	Low	73.5	Confident	177 Å²	177	71 Å²	71	95%	0.947	42%	0.416	S	S	*	.			trans	-56	97	165.8	-87.8	-26	0	0	0	107.9	N675	N675-D677 PolarHBondContact O-N 3.4Å
678	G	76.2	Confident	73.3	Confident	17 Å²	17	79.8 Å²	79.8	18%	0.175	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-79.6	151.2	175.4	0	0	0	0	0	110.8	I666 G676	I666-G678 CarbonylContact O-C 3.55Å; I666-G678 WeakPolarHBondContact O-CA 3.47Å; G676-G678 VanDerWaalsContact C-N 3.29Å; G676-G678 PolarHBondContact O-N 3.31Å
679	L	86.2	Confident	73.2	Confident	38 Å²	38	82.1 Å²	82.1	20%	0.199	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	133.3	171.2	-170	141.4	0	0	0	109.4	L553 F596 R665 I666	L553-L679 HydrophobicContact CD1-CD2 3.81Å; F596-L679 HydrophobicContact CD2-CB 4.16Å; F596-L679 HydrophobicContact CD2-CD1 4.41Å; F596-L679 HydrophobicContact CE2-CB 4.39Å; R665-L679 WeakPolarHBondContact CA-O 3.33Å; I666-L679 PolarHBondContact N-O 3.45Å; I666-L679 PolarHBondContact O-N 3.02Å
680	L	88.9	Confident	73.5	Confident	78 Å²	78	78.8 Å²	78.8	41%	0.408	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	133.1	174.3	-69.6	172.2	0	0	0	109.4	E609 R663 V664 R665	E609-L680 HydrophobicContact CG-CD2 4.44Å; E609-L680 VanDerWaalsContact OE2-CD2 3.31Å; E609-L680 WeakPolarHBondContact OE2-CD2 3.37Å; R663-L680 HydrophobicContact CG-CD2 4.11Å; V664-L680 CarbonylContact O-C 3.52Å; V664-L680 WeakPolarHBondContact O-CA 3.42Å; R665-L680 HydrophobicContact CB-CD2 3.8Å; R665-L680 HydrophobicContact CG-CD2 4.09Å
681	M	91.5	Very high	74.5	Confident	8 Å²	8	76.3 Å²	76.3	4%	0.039	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	123.2	175.2	-176.5	-179.2	73.6	0	0	108.8	L553 A555 V564 C592 V664 I666 V683	L553-M681 HydrophobicContact CB-SD 3.88Å; A555-M681 HydrophobicContact CB-CE 3.59Å; V564-M681 HydrophobicContact CG1-CE 4.09Å; C592-M681 HydrophobicContact CB-SD 4.47Å; V664-M681 HydrophobicContact CB-CE 4.29Å; V664-M681 HydrophobicContact CG2-CE 4.22Å; V664-M681 PolarHBondContact N-O 3.45Å; V664-M681 PolarHBondContact O-N 3.08Å; I666-M681 HydrophobicContact CD1-CB 4.14Å; M681-V683 HydrophobicContact CE-CG2 4.03Å
682	D	92.2	Very high	75.8	Confident	85 Å²	85	74.7 Å²	74.7	46%	0.455	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	141.4	171.5	-70.6	-39	0	0	0	109.7	R663	R663-D682 IonicContact CZ-OD1 3.13Å; R663-D682 VanDerWaalsContact CZ-OD1 3.27Å; R663-D682 IonicContact NE-OD1 3.11Å; R663-D682 PolarHBondContact NE-OD1 3.4Å; R663-D682 IonicContact NH2-OD1 2.72Å; R663-D682 PolarHBondContact NH2-OD1 3.18Å; R663-D682 IonicContact NH2-OD2 3.68Å; R663-D682 PolarHBondContact NH2-OD2 3.38Å
683	V	92.8	Very high	77.2	Confident	4 Å²	4	70.9 Å²	70.9	2%	0.024	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.2	178	-179.3	0	0	0	0	107.8	A555 L562 C589 F660 K661 G662 V664 M681	A555-V683 HydrophobicContact CB-CG1 4.45Å; A555-V683 HydrophobicContact CB-CG2 3.95Å; L562-V683 HydrophobicContact CD1-CG1 3.98Å; C589-V683 HydrophobicContact CB-CG1 3.96Å; C589-V683 CarbonylContact O-C 3.43Å; C589-V683 WeakPolarHBondContact O-CA 3.25Å; C589-V683 WeakPolarHBondContact O-CG1 3.25Å; C589-V683 WeakPolarHBondContact SG-CG1 3.36Å; F660-V683 HydrophobicContact CD1-CG1 3.85Å; F660-V683 HydrophobicContact CE1-CB 4.13Å; F660-V683 HydrophobicContact CE1-CG1 3.68Å; K661-V683 CarbonylContact C-O 3.57Å; K661-V683 VanDerWaalsContact CA-O 3.23Å; K661-V683 WeakPolarHBondContact CA-O 3.06Å; G662-V683 PolarHBondContact N-O 2.91Å; G662-V683 PolarHBondContact O-N 3.44Å; V664-V683 HydrophobicContact CG2-CG2 3.75Å; M681-V683 HydrophobicContact CE-CG2 4.03Å
684	D	92.2	Very high	78.7	Confident	34 Å²	34	68.2 Å²	68.2	18%	0.182	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	113.5	177.9	-172.8	-11.3	0	0	0	109.9	C589 K661 E686 A687 W689	C589-D684 CarbonylContact O-C 3.55Å; C589-D684 PolarHBondContact O-N 2.91Å; K661-D684 WeakPolarHBondContact CE-OD1 3.25Å; K661-D684 WeakPolarHBondContact CE-OD2 3.37Å; K661-D684 HydrophobicContact CG-CB 4.37Å; K661-D684 IonicContact NZ-OD1 3.3Å; K661-D684 PolarHBondContact NZ-OD1 3.35Å; K661-D684 IonicContact NZ-OD2 2.81Å; K661-D684 PolarHBondContact NZ-OD2 3.42Å; D684-E686 VanDerWaalsContact C-N 3.25Å; D684-E686 PolarHBondContact O-N 3.44Å; D684-E686 WeakPolarHBondContact OD1-CB 3.34Å; D684-E686 PolarHBondContact OD1-N 2.95Å; D684-A687 HydrophobicContact CB-CB 3.91Å; D684-A687 PolarHBondContact O-N 3.47Å; D684-A687 PolarHBondContact OD1-N 2.94Å; D684-W689 HydrophobicContact CB-CZ2 4.45Å; D684-W689 PolarHBondContact O-NE1 2.9Å
685	T	88.4	Confident	80.3	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.031	34%	0.344	C	S	.	.	S	Bend	trans	-71.8	-16.7	177.9	54.7	0	0	0	0	114.2	F557 R587 C589 N658 S659 F660	F557-T685 HydrophobicContact CB-CG2 3.94Å; F557-T685 HydrophobicContact CD1-CG2 3.77Å; F557-T685 HydrophobicContact CG-CG2 4.05Å; R587-T685 PolarHBondContact NH1-O 2.95Å; R587-T685 VanDerWaalsContact NH1-O 3.09Å; C589-T685 HydrophobicContact CB-CG2 3.78Å; N658-T685 PolarHBondContact O-OG1 3.49Å; S659-T685 WeakPolarHBondContact CA-OG1 3.3Å; F660-T685 HydrophobicContact CB-CG2 3.88Å; F660-T685 PolarHBondContact N-OG1 2.83Å; F660-T685 PolarHBondContact O-N 3.01Å; F660-T685 PolarHBondContact O-OG1 2.91Å
686	E	84.9	Confident	81.6	Confident	122 Å²	122	60.8 Å²	60.8	57%	0.57	33%	0.332	S	S	*	.	S	Bend	trans	-89.3	-22	179.1	-60.9	177.6	168	0	0	112	S659 K661 D684	S659-E686 WeakPolarHBondContact CB-OE1 3.47Å; S659-E686 VanDerWaalsContact OG-CD 3.23Å; S659-E686 WeakPolarHBondContact OG-CG 3.31Å; S659-E686 PolarHBondContact OG-OE1 3.22Å; K661-E686 WeakPolarHBondContact CE-OE2 3.26Å; K661-E686 IonicContact NZ-OE2 2.86Å; K661-E686 PolarHBondContact NZ-OE2 2.87Å; D684-E686 VanDerWaalsContact C-N 3.25Å; D684-E686 PolarHBondContact O-N 3.44Å; D684-E686 WeakPolarHBondContact OD1-CB 3.34Å; D684-E686 PolarHBondContact OD1-N 2.95Å
687	A	86.6	Confident	82.5	Confident	31 Å²	31	64.7 Å²	64.7	26%	0.256	35%	0.347	S	S	.	.	S	Bend	trans	-69.2	149.7	173.4	0	0	0	0	0	110.9	D684 W689	D684-A687 HydrophobicContact CB-CB 3.91Å; D684-A687 PolarHBondContact O-N 3.47Å; D684-A687 PolarHBondContact OD1-N 2.94Å; A687-W689 HydrophobicContact CB-CZ2 3.98Å; A687-W689 VanDerWaalsContact O-CD1 3.3Å
688	W	83.5	Confident	83.1	Confident	218 Å²	218	56.8 Å²	56.8	83%	0.826	30%	0.304	S	S	*	.			trans	-89.5	118.4	176	-146.1	74.1	0	0	0	108.4
689	W	85.5	Confident	83	Confident	76 Å²	76	61.3 Å²	61.3	29%	0.288	32%	0.319	S	S	.	.			trans	-119	131.4	-179.2	-56.8	97.6	0	0	0	109.4	L588 C589 L591 D684 A687	L588-W689 HydrophobicContact CB-CB 4.46Å; L588-W689 HydrophobicContact CD2-CB 3.57Å; L588-W689 HydrophobicContact CG-CB 3.74Å; L588-W689 HydrophobicContact CG-CG 4.45Å; C589-W689 VanDerWaalsContact C-NE1 3.27Å; C589-W689 PolarHBondContact O-NE1 2.73Å; C589-W689 VanDerWaalsContact O-NE1 3.13Å; L591-W689 HydrophobicContact CB-CE3 3.85Å; L591-W689 HydrophobicContact CB-CZ3 4.29Å; D684-W689 HydrophobicContact CB-CZ2 4.45Å; D684-W689 PolarHBondContact O-NE1 2.9Å; A687-W689 HydrophobicContact CB-CZ2 3.98Å; A687-W689 VanDerWaalsContact O-CD1 3.3Å
690	D	84.2	Confident	82.1	Confident	57 Å²	57	62 Å²	62	31%	0.305	33%	0.326	S	S	.	.			trans	-124	133.7	169.5	-169.3	-10.1	0	0	0	110	L591 S692 D693	L591-D690 WeakPolarHBondContact CD2-O 3.41Å; D690-S692 PolarHBondContact O-N 2.85Å; D690-S692 WeakPolarHBondContact OD1-CB 3.49Å; D690-S692 PolarHBondContact OD1-N 3.32Å; D690-S692 PolarHBondContact OD1-OG 2.94Å; D690-S692 WeakPolarHBondContact OD2-CB 2.94Å; D690-S692 PolarHBondContact OD2-OG 2.93Å; D690-D693 PolarHBondContact N-OD2 3.4Å; D690-D693 VanDerWaalsContact O-CB 3.25Å; D690-D693 WeakPolarHBondContact O-CB 3.36Å; D690-D693 PolarHBondContact O-N 2.98Å
691	V	84.1	Confident	81.4	Confident	13 Å²	13	59 Å²	59	8%	0.079	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-60.3	-28.8	172.1	171.8	0	0	0	0	111.2	L554 V574 T578 L588 D693 C694 Y695	L554-V691 HydrophobicContact CD2-CG2 4.28Å; V574-V691 HydrophobicContact CB-CG1 4.4Å; V574-V691 HydrophobicContact CG1-CB 4.41Å; V574-V691 HydrophobicContact CG1-CG1 3.36Å; V574-V691 HydrophobicContact CG1-CG2 4.15Å; T578-V691 HydrophobicContact CG2-CG2 4.34Å; L588-V691 HydrophobicContact CD2-CG2 3.99Å; V691-D693 PolarHBondContact O-N 2.86Å; V691-C694 WeakPolarHBondContact O-CB 2.91Å; V691-C694 PolarHBondContact O-N 2.85Å; V691-Y695 HydrophobicContact CG1-CD2 4.29Å; V691-Y695 HydrophobicContact CG1-CE2 4.27Å
692	S	80.5	Confident	80.8	Confident	75 Å²	75	59.5 Å²	59.5	52%	0.524	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-58.8	-24.2	174.4	-48.3	0	0	0	0	112.1	D690 C694 Y695	D690-S692 PolarHBondContact O-N 2.85Å; D690-S692 WeakPolarHBondContact OD1-CB 3.49Å; D690-S692 PolarHBondContact OD1-N 3.32Å; D690-S692 PolarHBondContact OD1-OG 2.94Å; D690-S692 WeakPolarHBondContact OD2-CB 2.94Å; D690-S692 PolarHBondContact OD2-OG 2.93Å; S692-C694 PolarHBondContact O-N 2.77Å; S692-Y695 CarbonylContact O-C 3.58Å; S692-Y695 PolarHBondContact O-N 3.31Å; S692-Y695 VanDerWaalsContact O-N 3.12Å
693	D	76.4	Confident	80.3	Confident	105 Å²	105	56.5 Å²	56.5	56%	0.561	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-67.8	-24.2	176	-60.3	-30.9	0	0	0	112.4	D690 V691 Y695	D690-D693 PolarHBondContact N-OD2 3.4Å; D690-D693 VanDerWaalsContact O-CB 3.25Å; D690-D693 WeakPolarHBondContact O-CB 3.36Å; D690-D693 PolarHBondContact O-N 2.98Å; V691-D693 PolarHBondContact O-N 2.86Å; D693-Y695 VanDerWaalsContact C-N 3.34Å
694	C	74.9	Confident	79.9	Confident	21 Å²	21	56.3 Å²	56.3	14%	0.142	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-74.8	-23.9	173.4	-83.8	0	0	0	0	113.6	L591 V691 S692	L591-C694 WeakPolarHBondContact CD1-SG 3.07Å; L591-C694 VanDerWaalsContact CD2-SG 3.54Å; L591-C694 WeakPolarHBondContact CG-SG 3.31Å; V691-C694 WeakPolarHBondContact O-CB 2.91Å; V691-C694 PolarHBondContact O-N 2.85Å; S692-C694 PolarHBondContact O-N 2.77Å
695	Y	79.1	Confident	79.4	Confident	30 Å²	30	55.6 Å²	55.6	12%	0.118	30%	0.296	C	S	.	.	S	Bend	trans	-137.8	120.8	-166.9	-56	-72.6	0	0	0	111.3	R571 V574 V691 S692 D693	R571-Y695 HydrophobicContact CG-CD1 3.88Å; R571-Y695 HydrophobicContact CG-CD2 3.56Å; R571-Y695 HydrophobicContact CG-CE1 4.15Å; R571-Y695 HydrophobicContact CG-CE2 3.84Å; R571-Y695 HydrophobicContact CG-CG 3.57Å; V574-Y695 HydrophobicContact CB-CE2 4.2Å; V574-Y695 HydrophobicContact CG1-CE2 4.38Å; V574-Y695 HydrophobicContact CG2-CE2 4.06Å; V574-Y695 WeakPolarHBondContact CG2-OH 3.08Å; V691-Y695 HydrophobicContact CG1-CD2 4.29Å; V691-Y695 HydrophobicContact CG1-CE2 4.27Å; S692-Y695 CarbonylContact O-C 3.58Å; S692-Y695 PolarHBondContact O-N 3.31Å; S692-Y695 VanDerWaalsContact O-N 3.12Å; D693-Y695 VanDerWaalsContact C-N 3.34Å
696	G	71.6	Confident	79.2	Confident	57 Å²	57	57.1 Å²	57.1	59%	0.588	30%	0.303	S	S	*	.			trans	-60.4	163.7	169.6	0	0	0	0	0	112.7	R571 F698	R571-G696 PolarHBondContact NH1-O 2.74Å; G696-F698 PolarHBondContact O-N 2.03Å
697	N	70.9	Confident	79.2	Confident	108 Å²	108	54.4 Å²	54.4	58%	0.578	30%	0.298	S	S	*	.			trans	-51.7	130.2	175.1	-80.9	-41.8	0	0	0	111.5	F699	N697-F699 HydrophobicContact CB-CD2 4.22Å; N697-F699 HydrophobicContact CB-CE1 4.03Å; N697-F699 HydrophobicContact CB-CE2 3.58Å; N697-F699 HydrophobicContact CB-CZ 3.48Å; N697-F699 VanDerWaalsContact CB-CZ 3.48Å; N697-F699 VanDerWaalsContact O-CD2 3.32Å; N697-F699 WeakPolarHBondContact O-CD2 3.43Å; N697-F699 PolarHBondContact O-N 3.09Å
698	F	75.4	Confident	79.3	Confident	10 Å²	10	53.7 Å²	53.7	4%	0.044	29%	0.289	C	S	.	.			trans	-82.4	109.2	168.6	-164.8	-120.5	0	0	0	108.5	L396 A401 G696	L396-F698 HydrophobicContact CD1-CD1 3.45Å; L396-F698 VanDerWaalsContact CD1-CD1 3.45Å; L396-F698 HydrophobicContact CD1-CE1 3.34Å; L396-F698 HydrophobicContact CG-CD1 4.43Å; A401-F698 HydrophobicContact CB-CD1 4.22Å; A401-F698 HydrophobicContact CB-CD2 3.89Å; A401-F698 HydrophobicContact CB-CE1 4.4Å; A401-F698 HydrophobicContact CB-CE2 4.09Å; A401-F698 HydrophobicContact CB-CG 3.97Å; A401-F698 HydrophobicContact CB-CZ 4.35Å; G696-F698 PolarHBondContact O-N 2.03Å
699	F	72.8	Confident	79.7	Confident	112 Å²	112	43.8 Å²	43.8	49%	0.491	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-90.9	146.9	-179.8	-65.6	-76.5	0	0	0	110.9	N697 Q761	N697-F699 HydrophobicContact CB-CD2 4.22Å; N697-F699 HydrophobicContact CB-CE1 4.03Å; N697-F699 HydrophobicContact CB-CE2 3.58Å; N697-F699 HydrophobicContact CB-CZ 3.48Å; N697-F699 VanDerWaalsContact CB-CZ 3.48Å; N697-F699 VanDerWaalsContact O-CD2 3.32Å; N697-F699 WeakPolarHBondContact O-CD2 3.43Å; N697-F699 PolarHBondContact O-N 3.09Å; F699-Q761 HydrophobicContact CB-CB 4.49Å
700	P	67.9	Low	79.9	Confident	53 Å²	53	45 Å²	45	34%	0.344	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-60.9	143.5	167.8	28.8	-33.6	0	0	0	109.2	L396	L396-P700 HydrophobicContact CD2-CB 4.46Å
701	A	74.8	Confident	80.3	Confident	14 Å²	14	46.9 Å²	46.9	12%	0.116	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-75.4	151	-174.6	0	0	0	0	0	111	R703 E757 E760	A701-R703 VanDerWaalsContact C-NH1 3.26Å; A701-R703 VanDerWaalsContact CB-NH1 3.29Å; A701-R703 PolarHBondContact O-NH1 2.94Å; A701-R703 VanDerWaalsContact O-NH1 3.17Å; A701-E757 WeakPolarHBondContact CB-O 3.41Å; A701-E760 CarbonylContact C-O 3.55Å; A701-E760 WeakPolarHBondContact CA-O 3.43Å
702	V	78.6	Confident	80.7	Confident	19 Å²	19	46.4 Å²	46.4	12%	0.115	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-68.9	150	-173.3	175.4	0	0	0	0	110.5	E757 E760 F766	V702-E757 WeakPolarHBondContact O-CB 3.28Å; V702-E760 PolarHBondContact N-O 2.86Å; V702-F766 HydrophobicContact CG1-CD2 4.1Å; V702-F766 HydrophobicContact CG1-CE1 3.78Å; V702-F766 HydrophobicContact CG1-CE2 3.23Å; V702-F766 HydrophobicContact CG1-CZ 3.05Å
703	R	81.1	Confident	81.3	Confident	22 Å²	22	43.1 Å²	43.1	8%	0.083	24%	0.242	C	C	.	.			trans	-132.9	128.4	-174.6	-56.3	-69.7	176	-107.9	4	112.6	R370 A701 E757	R370-R703 PolarHBondContact NH1-O 2.04Å; A701-R703 VanDerWaalsContact C-NH1 3.26Å; A701-R703 VanDerWaalsContact CB-NH1 3.29Å; A701-R703 PolarHBondContact O-NH1 2.94Å; A701-R703 VanDerWaalsContact O-NH1 3.17Å; R703-E757 PolarHBondContact NH1-O 3.44Å
704	L	83.7	Confident	82.1	Confident	1 Å²	1	42 Å²	42	1%	0.005	24%	0.242	C	C	.	.			trans	-76.4	147.4	164.3	-68.8	163.9	0	0	0	109.4	I708 K709 L753 W756 E757 F766 L769 L785	L704-I708 HydrophobicContact CD2-CG2 4.16Å; L704-K709 HydrophobicContact CB-CD 4.34Å; L704-K709 HydrophobicContact CB-CG 3.85Å; L704-K709 HydrophobicContact CD1-CG 4.07Å; L704-L753 HydrophobicContact CD1-CD1 4.39Å; L704-L753 HydrophobicContact CD1-CD2 4.4Å; L704-W756 HydrophobicContact CD1-CE3 4.29Å; L704-W756 HydrophobicContact CD1-CZ3 3.75Å; L704-W756 HydrophobicContact CG-CZ3 3.98Å; L704-E757 WeakPolarHBondContact CA-OE1 3.39Å; L704-E757 VanDerWaalsContact CB-OE1 3.28Å; L704-E757 WeakPolarHBondContact CB-OE1 3.13Å; L704-E757 PolarHBondContact N-OE1 2.83Å; L704-F766 HydrophobicContact CD2-CD1 3.85Å; L704-F766 HydrophobicContact CD2-CE1 3.44Å; L704-F766 VanDerWaalsContact CD2-CE1 3.44Å; L704-F766 HydrophobicContact CG-CE1 3.89Å; L704-L769 HydrophobicContact CD1-CD2 4.22Å; L704-L785 HydrophobicContact CD2-CD1 3.78Å
705	A	82.4	Confident	82.8	Confident	19 Å²	19	43.3 Å²	43.3	16%	0.157	25%	0.248	C	C	.	.			trans	-61	141.5	168.2	0	0	0	0	0	110.4	N391 S707 I708 K709	N391-A705 WeakPolarHBondContact OD1-CA 3.4Å; A705-S707 PolarHBondContact O-N 3.16Å; A705-I708 HydrophobicContact CB-CG1 4.07Å; A705-I708 WeakPolarHBondContact O-CB 3.43Å; A705-I708 PolarHBondContact O-N 3.12Å; A705-K709 PolarHBondContact O-N 2.98Å; A705-K709 VanDerWaalsContact O-N 3.17Å
706	H	83.6	Confident	83.4	Confident	36 Å²	36	42 Å²	42	17%	0.167	24%	0.243	C	C	.	.	H	α-helix	trans	-55.8	-39.7	179.9	-177	57.9	0	0	0	112.7	S390 N391 E408 I708 K709 Q710 E750	S390-H706 VanDerWaalsContact O-CB 3.25Å; S390-H706 WeakPolarHBondContact O-CB 3.48Å; N391-H706 PolarHBondContact OD1-N 2.8Å; E408-H706 IonicContact OE2-CD2 3.8Å; E408-H706 IonicContact OE2-CG 3Å; H706-I708 VanDerWaalsContact C-N 3.28Å; H706-I708 PolarHBondContact O-N 3.46Å; H706-K709 PolarHBondContact O-N 2.95Å; H706-Q710 PolarHBondContact NE2-NE2 3.19Å; H706-Q710 WeakPolarHBondContact O-CG 3.48Å; H706-Q710 PolarHBondContact O-N 3.05Å; H706-E750 IonicContact CE1-OE1 2.63Å
707	S	85.5	Confident	84.3	Confident	66 Å²	66	41 Å²	41	46%	0.462	22%	0.224	S	C	.	.	H	α-helix	trans	-58.3	-37.5	175.5	54.7	0	0	0	0	113.2	A705 Q711	A705-S707 PolarHBondContact O-N 3.16Å; S707-Q711 WeakPolarHBondContact O-CG 3.39Å; S707-Q711 PolarHBondContact O-N 3.05Å
708	I	89.2	Confident	85	Confident	16 Å²	16	42.3 Å²	42.3	8%	0.082	23%	0.227	C	C	.	.	H	α-helix	trans	-71.2	-41.7	178.2	-61.7	-62.1	0	0	0	110.6	L704 A705 H706 Q710 Q711 L712 V784 H788	L704-I708 HydrophobicContact CD2-CG2 4.16Å; A705-I708 HydrophobicContact CB-CG1 4.07Å; A705-I708 WeakPolarHBondContact O-CB 3.43Å; A705-I708 PolarHBondContact O-N 3.12Å; H706-I708 VanDerWaalsContact C-N 3.28Å; H706-I708 PolarHBondContact O-N 3.46Å; I708-Q710 VanDerWaalsContact C-N 3.33Å; I708-Q710 PolarHBondContact O-N 3.17Å; I708-Q711 PolarHBondContact O-N 3.48Å; I708-L712 HydrophobicContact CG2-CD1 4.09Å; I708-L712 HydrophobicContact CG2-CG 4.45Å; I708-L712 WeakPolarHBondContact O-CG 3.45Å; I708-L712 PolarHBondContact O-N 3.18Å; I708-V784 HydrophobicContact CD1-CG1 4.02Å; I708-V784 HydrophobicContact CG2-CG1 4.03Å; I708-H788 HydrophobicContact CD1-CB 3.94Å; I708-H788 HydrophobicContact CG1-CB 4.05Å
709	K	90.5	Very high	85.2	Confident	9 Å²	9	46.4 Å²	46.4	4%	0.039	25%	0.254	C	S	.	.	H	α-helix	trans	-60.8	-42.5	174.9	-71	-164.9	-76.4	-170.1	0	111.8	L704 A705 H706 L712 A713 L753 T754 E757	L704-K709 HydrophobicContact CB-CD 4.34Å; L704-K709 HydrophobicContact CB-CG 3.85Å; L704-K709 HydrophobicContact CD1-CG 4.07Å; A705-K709 PolarHBondContact O-N 2.98Å; A705-K709 VanDerWaalsContact O-N 3.17Å; H706-K709 PolarHBondContact O-N 2.95Å; K709-L712 PolarHBondContact O-N 3.13Å; K709-A713 VanDerWaalsContact O-CB 3.26Å; K709-A713 WeakPolarHBondContact O-CB 2.9Å; K709-A713 PolarHBondContact O-N 3.26Å; K709-L753 HydrophobicContact CD-CB 4.19Å; K709-L753 HydrophobicContact CG-CB 4.48Å; K709-L753 HydrophobicContact CG-CD1 4.21Å; K709-T754 PolarHBondContact NZ-OG1 2.72Å; K709-E757 WeakPolarHBondContact CD-OE1 3.43Å; K709-E757 WeakPolarHBondContact CE-OE1 3.42Å; K709-E757 IonicContact NZ-OE1 3.11Å; K709-E757 PolarHBondContact NZ-OE1 2.78Å; K709-E757 IonicContact NZ-OE2 2.99Å; K709-E757 PolarHBondContact NZ-OE2 2.83Å
710	Q	90.2	Very high	85.5	Confident	103 Å²	103	44.5 Å²	44.5	48%	0.481	25%	0.249	S	C	.	.	H	α-helix	trans	-63.2	-41.6	175.5	-71.5	-176.3	-16.7	0	0	112.7	H706 I708 A713 S714	H706-Q710 PolarHBondContact NE2-NE2 3.19Å; H706-Q710 WeakPolarHBondContact O-CG 3.48Å; H706-Q710 PolarHBondContact O-N 3.05Å; I708-Q710 VanDerWaalsContact C-N 3.33Å; I708-Q710 PolarHBondContact O-N 3.17Å; Q710-A713 PolarHBondContact O-N 3.22Å; Q710-S714 PolarHBondContact O-N 3.25Å; Q710-S714 PolarHBondContact O-OG 3.24Å
711	Q	92.6	Very high	85.7	Confident	96 Å²	96	52 Å²	52	45%	0.449	28%	0.28	S	S	.	.	H	α-helix	trans	-65.5	-39.6	175.5	-75.4	-179	-3.9	0	0	112.2	S707 I708 S714 L715 V784	S707-Q711 WeakPolarHBondContact O-CG 3.39Å; S707-Q711 PolarHBondContact O-N 3.05Å; I708-Q711 PolarHBondContact O-N 3.48Å; Q711-S714 PolarHBondContact O-OG 3.21Å; Q711-L715 VanDerWaalsContact O-CG 3.25Å; Q711-L715 WeakPolarHBondContact O-CG 3.44Å; Q711-L715 PolarHBondContact O-N 3.19Å; Q711-V784 HydrophobicContact CB-CG1 3.99Å; Q711-V784 HydrophobicContact CB-CG2 4.44Å
712	L	93.2	Very high	85.9	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-68.3	-40.2	175.1	-69.3	173.9	0	0	0	111.5	I708 K709 L715 L716 T749 L753 L773 A781 V784	I708-L712 HydrophobicContact CG2-CD1 4.09Å; I708-L712 HydrophobicContact CG2-CG 4.45Å; I708-L712 WeakPolarHBondContact O-CG 3.45Å; I708-L712 PolarHBondContact O-N 3.18Å; K709-L712 PolarHBondContact O-N 3.13Å; L712-L715 PolarHBondContact O-N 3.46Å; L712-L716 WeakPolarHBondContact O-CB 3.43Å; L712-L716 WeakPolarHBondContact O-CG 3.05Å; L712-L716 PolarHBondContact O-N 3.28Å; L712-T749 HydrophobicContact CB-CG2 4.48Å; L712-L753 HydrophobicContact CB-CD1 3.98Å; L712-L753 HydrophobicContact CD1-CD1 3.76Å; L712-L773 HydrophobicContact CD2-CD1 4.36Å; L712-A781 HydrophobicContact CD2-CB 3.79Å; L712-V784 HydrophobicContact CD2-CB 4.36Å; L712-V784 HydrophobicContact CD2-CG1 4.26Å; L712-V784 HydrophobicContact CG-CG1 4.33Å
713	A	92.5	Very high	86	Confident	7 Å²	7	55.5 Å²	55.5	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-61.4	-46	176.6	0	0	0	0	0	112.2	K709 Q710 L715 L716 D717 S747 T749	K709-A713 VanDerWaalsContact O-CB 3.26Å; K709-A713 WeakPolarHBondContact O-CB 2.9Å; K709-A713 PolarHBondContact O-N 3.26Å; Q710-A713 PolarHBondContact O-N 3.22Å; A713-L715 PolarHBondContact O-N 3.08Å; A713-L715 VanDerWaalsContact O-N 3.16Å; A713-L716 PolarHBondContact O-N 3.41Å; A713-D717 VanDerWaalsContact O-CB 3.23Å; A713-D717 WeakPolarHBondContact O-CB 3.4Å; A713-D717 VanDerWaalsContact O-CG 3.25Å; A713-D717 PolarHBondContact O-N 3.06Å; A713-S747 WeakPolarHBondContact CB-OG 3.45Å; A713-T749 HydrophobicContact CB-CG2 4.44Å
714	S	92.4	Very high	86.3	Confident	80 Å²	80	56.1 Å²	56.1	56%	0.559	32%	0.318	S	S	*	.	H	α-helix	trans	-61.8	-26	177.7	71	0	0	0	0	113.3	Q710 Q711	Q710-S714 PolarHBondContact O-N 3.25Å; Q710-S714 PolarHBondContact O-OG 3.24Å; Q711-S714 PolarHBondContact O-OG 3.21Å
715	L	91.5	Very high	86.6	Confident	50 Å²	50	56.3 Å²	56.3	26%	0.262	32%	0.319	S	S	.	.	H	α-helix	trans	-85.6	-35.8	176.6	-67.5	176.4	0	0	0	113.4	Q711 L712 A713 R778 D780 A781 V784	Q711-L715 VanDerWaalsContact O-CG 3.25Å; Q711-L715 WeakPolarHBondContact O-CG 3.44Å; Q711-L715 PolarHBondContact O-N 3.19Å; L712-L715 PolarHBondContact O-N 3.46Å; A713-L715 PolarHBondContact O-N 3.08Å; A713-L715 VanDerWaalsContact O-N 3.16Å; L715-R778 PolarHBondContact O-NH1 3.13Å; L715-R778 PolarHBondContact O-NH2 2.86Å; L715-D780 HydrophobicContact CD1-CB 4.31Å; L715-A781 HydrophobicContact CD1-CB 4.34Å; L715-V784 HydrophobicContact CD1-CG2 4.19Å
716	L	91.7	Very high	87.1	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-107.4	-19.1	-167.7	-62.2	-178.7	0	0	0	114.8	L712 A713 W726 L729 T749 L773 M776 R778	L712-L716 WeakPolarHBondContact O-CB 3.43Å; L712-L716 WeakPolarHBondContact O-CG 3.05Å; L712-L716 PolarHBondContact O-N 3.28Å; A713-L716 PolarHBondContact O-N 3.41Å; L716-W726 PolarHBondContact O-N 3.38Å; L716-L729 HydrophobicContact CD1-CD2 3.91Å; L716-T749 HydrophobicContact CB-CG2 3.99Å; L716-T749 WeakPolarHBondContact CB-OG1 3.27Å; L716-T749 HydrophobicContact CD1-CG2 4Å; L716-L773 HydrophobicContact CD1-CD2 4.12Å; L716-M776 HydrophobicContact CD2-CE 4.09Å; L716-R778 HydrophobicContact CD2-CG 4.12Å
717	D	90.1	Very high	87.5	Confident	38 Å²	38	58.9 Å²	58.9	20%	0.203	32%	0.323	C	S	.	.	S	Bend	trans	-70.4	-31.9	-178.1	-76.8	-17.4	0	0	0	112.8	A713 S747 P748 T749	A713-D717 VanDerWaalsContact O-CB 3.23Å; A713-D717 WeakPolarHBondContact O-CB 3.4Å; A713-D717 VanDerWaalsContact O-CG 3.25Å; A713-D717 PolarHBondContact O-N 3.06Å; D717-S747 PolarHBondContact OD1-OG 3.12Å; D717-S747 VanDerWaalsContact OD2-CB 3.3Å; D717-S747 WeakPolarHBondContact OD2-CB 3.19Å; D717-S747 PolarHBondContact OD2-OG 2.98Å; D717-P748 WeakPolarHBondContact OD1-CD 3.45Å; D717-T749 WeakPolarHBondContact OD1-CB 3.26Å; D717-T749 PolarHBondContact OD1-N 3.27Å; D717-T749 PolarHBondContact OD1-OG1 2.79Å
718	Q	84.7	Confident	87.8	Confident	134 Å²	134	57.6 Å²	57.6	63%	0.626	31%	0.311	S	S	*	.	S	Bend	trans	-69.3	128.4	178.9	-65.9	-172.3	-0.9	0	0	110.5	L720	Q718-L720 PolarHBondContact O-N 2.82Å
719	P	80	Confident	87.9	Confident	96 Å²	96	56.9 Å²	56.9	62%	0.623	31%	0.307	S	S	*	.			trans	-66	127.4	175.8	27.6	-32.9	0	0	0	109.6
720	L	78.2	Confident	87.9	Confident	72 Å²	72	56.4 Å²	56.4	38%	0.377	31%	0.305	S	S	.	.			trans	-109.9	142.9	177.5	-67.7	171.3	0	0	0	109.9	Q718 A722 G723	Q718-L720 PolarHBondContact O-N 2.82Å; L720-A722 PolarHBondContact O-N 2.82Å; L720-A722 VanDerWaalsContact O-N 3.12Å; L720-G723 PolarHBondContact O-N 2.86Å
721	E	73.6	Confident	87.9	Confident	212 Å²	212	56.7 Å²	56.7	99%	0.991	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-29.7	177.5	-65.5	-173.3	166	0	0	113	G723	E721-G723 PolarHBondContact O-N 2.98Å
722	A	78	Confident	87.8	Confident	74 Å²	74	53.6 Å²	53.6	61%	0.612	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-10.3	177.6	0	0	0	0	0	114	L720 N724	L720-A722 PolarHBondContact O-N 2.82Å; L720-A722 VanDerWaalsContact O-N 3.12Å; A722-N724 PolarHBondContact O-N 3.12Å; A722-N724 PolarHBondContact O-OD1 3.45Å
723	G	81.7	Confident	87.7	Confident	32 Å²	32	54 Å²	54	33%	0.33	29%	0.294	S	S	.	.	S	Bend	trans	72.1	4	-174.8	0	0	0	0	0	114.8	L720 E721 D725 M728	L720-G723 PolarHBondContact O-N 2.86Å; E721-G723 PolarHBondContact O-N 2.98Å; G723-D725 PolarHBondContact O-N 2.85Å; G723-M728 VanDerWaalsContact O-CB 3.3Å; G723-M728 WeakPolarHBondContact O-CB 3.31Å
724	N	87.7	Confident	87.5	Confident	35 Å²	35	56.3 Å²	56.3	19%	0.187	31%	0.314	C	S	.	.			trans	-82.9	46.1	-179	-58	-17.6	0	0	0	112.6	A722 M728 M776 R778	A722-N724 PolarHBondContact O-N 3.12Å; A722-N724 PolarHBondContact O-OD1 3.45Å; N724-M728 HydrophobicContact CB-CE 3.88Å; N724-M728 WeakPolarHBondContact OD1-CE 3.43Å; N724-M776 WeakPolarHBondContact CB-O 3.48Å; N724-M776 VanDerWaalsContact CG-O 3.26Å; N724-M776 PolarHBondContact ND2-O 2.73Å; N724-R778 HydrophobicContact CB-CG 4.45Å; N724-R778 PolarHBondContact O-NH1 3.09Å
725	D	89.4	Confident	87.4	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.021	29%	0.287	C	S	.	.	S	Bend	trans	-108.6	-167.5	-177.8	67	18.6	0	0	0	111.3	G723 R727 M728 L729 M776	G723-D725 PolarHBondContact O-N 2.85Å; D725-R727 PolarHBondContact O-N 2.92Å; D725-R727 VanDerWaalsContact O-N 3.16Å; D725-R727 WeakPolarHBondContact OD1-CB 3.4Å; D725-R727 WeakPolarHBondContact OD1-CG 3.42Å; D725-R727 PolarHBondContact OD1-N 3.44Å; D725-R727 IonicContact OD2-CZ 3.85Å; D725-R727 IonicContact OD2-NH1 3.42Å; D725-R727 PolarHBondContact OD2-NH1 3.39Å; D725-M728 PolarHBondContact O-N 3Å; D725-L729 PolarHBondContact O-N 2.94Å; D725-M776 WeakPolarHBondContact O-CE 3.41Å
726	W	93.1	Very high	87.1	Confident	9 Å²	9	53.1 Å²	53.1	3%	0.034	29%	0.291	C	S	.	.	H	α-helix	trans	-54.8	-27.1	177.2	67.2	-95.5	0	0	0	114.4	L716 L729 A730 L739 F742 A743 P748 T749 I752	L716-W726 PolarHBondContact O-N 3.38Å; W726-L729 WeakPolarHBondContact O-CB 3.39Å; W726-L729 PolarHBondContact O-N 3.15Å; W726-A730 WeakPolarHBondContact O-CB 3.47Å; W726-A730 PolarHBondContact O-N 3.39Å; W726-L739 HydrophobicContact CH2-CB 4.34Å; W726-L739 HydrophobicContact CZ3-CB 4.34Å; W726-L739 HydrophobicContact CZ3-CD2 3.92Å; W726-F742 HydrophobicContact CE3-CB 4.45Å; W726-F742 HydrophobicContact CH2-CB 4.43Å; W726-F742 HydrophobicContact CZ3-CB 3.9Å; W726-A743 HydrophobicContact CH2-CB 3.85Å; W726-A743 HydrophobicContact CZ2-CB 3.97Å; W726-P748 HydrophobicContact CB-CB 4.25Å; W726-P748 HydrophobicContact CD2-CB 3.51Å; W726-P748 HydrophobicContact CD2-CG 4.12Å; W726-P748 HydrophobicContact CE3-CB 3.76Å; W726-P748 HydrophobicContact CG-CB 3.75Å; W726-P748 HydrophobicContact CG-CG 4.34Å; W726-P748 HydrophobicContact CZ2-CB 4.41Å; W726-P748 HydrophobicContact CZ2-CG 4.35Å; W726-P748 HydrophobicContact CZ3-CB 4.29Å; W726-T749 WeakPolarHBondContact CB-OG1 3.2Å; W726-I752 HydrophobicContact CB-CD1 4.3Å; W726-I752 HydrophobicContact CE3-CD1 3.8Å
727	R	91.5	Very high	86.8	Confident	100 Å²	100	56.8 Å²	56.8	38%	0.377	31%	0.308	S	S	.	.	H	α-helix	trans	-67.8	-42.5	179	-59	176.7	178.2	95.7	-1.7	110.7	D725 L729 A730 Q731 L739	D725-R727 PolarHBondContact O-N 2.92Å; D725-R727 VanDerWaalsContact O-N 3.16Å; D725-R727 WeakPolarHBondContact OD1-CB 3.4Å; D725-R727 WeakPolarHBondContact OD1-CG 3.42Å; D725-R727 PolarHBondContact OD1-N 3.44Å; D725-R727 IonicContact OD2-CZ 3.85Å; D725-R727 IonicContact OD2-NH1 3.42Å; D725-R727 PolarHBondContact OD2-NH1 3.39Å; R727-L729 VanDerWaalsContact C-N 3.33Å; R727-A730 WeakPolarHBondContact O-CB 3.38Å; R727-A730 PolarHBondContact O-N 3.09Å; R727-Q731 WeakPolarHBondContact O-CG 3.48Å; R727-Q731 PolarHBondContact O-N 3.21Å; R727-L739 HydrophobicContact CB-CD1 4.42Å; R727-L739 HydrophobicContact CG-CD1 4.49Å
728	M	91.2	Very high	86.8	Confident	40 Å²	40	56.1 Å²	56.1	20%	0.197	30%	0.303	C	S	.	.	H	α-helix	trans	-71	-32.1	176.3	-167.5	168.3	80.6	0	0	111.6	G723 N724 D725 Q731 L732 M776	G723-M728 VanDerWaalsContact O-CB 3.3Å; G723-M728 WeakPolarHBondContact O-CB 3.31Å; N724-M728 HydrophobicContact CB-CE 3.88Å; N724-M728 WeakPolarHBondContact OD1-CE 3.43Å; D725-M728 PolarHBondContact O-N 3Å; M728-Q731 PolarHBondContact O-N 3.43Å; M728-L732 HydrophobicContact CG-CD1 4.46Å; M728-L732 WeakPolarHBondContact O-CB 3.31Å; M728-L732 VanDerWaalsContact O-CG 3.29Å; M728-L732 WeakPolarHBondContact O-CG 3.37Å; M728-L732 PolarHBondContact O-N 2.78Å; M728-M776 HydrophobicContact CB-CE 4.42Å; M728-M776 HydrophobicContact CE-CB 3.36Å; M728-M776 HydrophobicContact CE-CE 4.32Å; M728-M776 HydrophobicContact CE-CG 3.38Å
729	L	92	Very high	87	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.4	-46.4	169.3	-179.2	63.2	0	0	0	111.1	L716 D725 W726 R727 Q731 L732 L733 T749 I752 L753 L769 M776	L716-L729 HydrophobicContact CD1-CD2 3.91Å; D725-L729 PolarHBondContact O-N 2.94Å; W726-L729 WeakPolarHBondContact O-CB 3.39Å; W726-L729 PolarHBondContact O-N 3.15Å; R727-L729 VanDerWaalsContact C-N 3.33Å; L729-Q731 VanDerWaalsContact C-N 3.32Å; L729-Q731 PolarHBondContact O-N 2.94Å; L729-L732 PolarHBondContact O-N 3.01Å; L729-L733 HydrophobicContact CD1-CD1 3.8Å; L729-L733 HydrophobicContact CD1-CG 4.15Å; L729-L733 HydrophobicContact CG-CD1 3.9Å; L729-L733 WeakPolarHBondContact O-CB 3.37Å; L729-L733 WeakPolarHBondContact O-CG 3.44Å; L729-L733 PolarHBondContact O-N 3.02Å; L729-T749 HydrophobicContact CD2-CG2 4.27Å; L729-I752 HydrophobicContact CD2-CG2 4.1Å; L729-I752 HydrophobicContact CG-CG2 4.13Å; L729-L753 HydrophobicContact CD2-CD2 4.26Å; L729-L769 HydrophobicContact CD1-CD1 4.2Å; L729-M776 HydrophobicContact CB-CE 3.88Å; L729-M776 HydrophobicContact CB-SD 3.96Å; L729-M776 HydrophobicContact CD1-SD 4.01Å
730	A	91.7	Very high	87.3	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.8	-44.7	176.6	0	0	0	0	0	111.7	W726 R727 L733 A734 V735 D736 L739 I752	W726-A730 WeakPolarHBondContact O-CB 3.47Å; W726-A730 PolarHBondContact O-N 3.39Å; R727-A730 WeakPolarHBondContact O-CB 3.38Å; R727-A730 PolarHBondContact O-N 3.09Å; A730-L733 CarbonylContact O-C 3.47Å; A730-L733 PolarHBondContact O-N 2.83Å; A730-A734 PolarHBondContact O-N 3.24Å; A730-V735 HydrophobicContact CB-CG2 3.97Å; A730-V735 PolarHBondContact O-N 3.01Å; A730-D736 HydrophobicContact CB-CB 4.24Å; A730-L739 HydrophobicContact CB-CD2 3.73Å; A730-I752 HydrophobicContact CB-CD1 3.84Å; A730-I752 HydrophobicContact CB-CG1 4.47Å
731	Q	89.6	Confident	87.8	Confident	108 Å²	108	46.4 Å²	46.4	51%	0.505	25%	0.253	S	S	.	.	H	α-helix	trans	-62.4	-45.8	176.6	-73.1	174.3	-9	0	0	112.6	R727 M728 L729 L733 A734 D736	R727-Q731 WeakPolarHBondContact O-CG 3.48Å; R727-Q731 PolarHBondContact O-N 3.21Å; M728-Q731 PolarHBondContact O-N 3.43Å; L729-Q731 VanDerWaalsContact C-N 3.32Å; L729-Q731 PolarHBondContact O-N 2.94Å; Q731-L733 PolarHBondContact O-N 2.99Å; Q731-A734 PolarHBondContact O-N 3.24Å; Q731-D736 HydrophobicContact CB-CB 4.39Å; Q731-D736 HydrophobicContact CG-CB 3.72Å; Q731-D736 WeakPolarHBondContact CG-OD2 3.42Å
732	L	90.4	Very high	88.6	Confident	32 Å²	32	36.3 Å²	36.3	17%	0.168	21%	0.206	C	C	.	.	H	α-helix	trans	-65.3	-30.1	178.9	-72.8	174.3	0	0	0	112.6	M728 L729 F772 R775 M776	M728-L732 HydrophobicContact CG-CD1 4.46Å; M728-L732 WeakPolarHBondContact O-CB 3.31Å; M728-L732 VanDerWaalsContact O-CG 3.29Å; M728-L732 WeakPolarHBondContact O-CG 3.37Å; M728-L732 PolarHBondContact O-N 2.78Å; L729-L732 PolarHBondContact O-N 3.01Å; L732-F772 HydrophobicContact CB-CB 4.32Å; L732-F772 HydrophobicContact CB-CD1 3.98Å; L732-F772 HydrophobicContact CB-CG 4.17Å; L732-F772 HydrophobicContact CD1-CB 4.11Å; L732-F772 HydrophobicContact CD1-CD1 4.49Å; L732-F772 HydrophobicContact CD2-CD1 4.34Å; L732-R775 HydrophobicContact CD2-CG 4.49Å; L732-M776 HydrophobicContact CD1-CG 3.44Å; L732-M776 VanDerWaalsContact CD1-CG 3.44Å; L732-M776 HydrophobicContact CD1-SD 4.21Å
733	L	91	Very high	89	Confident	9 Å²	9	35.4 Å²	35.4	5%	0.047	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-2.1	174.9	-65.3	176.3	0	0	0	113.3	L729 A730 Q731 V735 I752 W756 R759 F772	L729-L733 HydrophobicContact CD1-CD1 3.8Å; L729-L733 HydrophobicContact CD1-CG 4.15Å; L729-L733 HydrophobicContact CG-CD1 3.9Å; L729-L733 WeakPolarHBondContact O-CB 3.37Å; L729-L733 WeakPolarHBondContact O-CG 3.44Å; L729-L733 PolarHBondContact O-N 3.02Å; A730-L733 CarbonylContact O-C 3.47Å; A730-L733 PolarHBondContact O-N 2.83Å; Q731-L733 PolarHBondContact O-N 2.99Å; L733-V735 VanDerWaalsContact C-N 3.35Å; L733-V735 HydrophobicContact CB-CG2 4.12Å; L733-V735 PolarHBondContact O-N 3.25Å; L733-I752 HydrophobicContact CD1-CG2 3.67Å; L733-W756 HydrophobicContact CD1-CB 4.15Å; L733-W756 HydrophobicContact CD1-CG 4.35Å; L733-W756 HydrophobicContact CD2-CG 4.37Å; L733-R759 PolarHBondContact O-NH1 3Å; L733-R759 PolarHBondContact O-NH2 3.31Å; L733-F772 HydrophobicContact CD2-CD2 3.68Å; L733-F772 HydrophobicContact CD2-CE2 3.75Å
734	A	89.1	Confident	89.2	Confident	56 Å²	56	37 Å²	37	46%	0.463	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	42.6	-175.9	0	0	0	0	0	114	Q518 A730 Q731	Q518-A734 PolarHBondContact NE2-O 3.42Å; A730-A734 PolarHBondContact O-N 3.24Å; Q731-A734 PolarHBondContact O-N 3.24Å
735	V	89.4	Confident	89.1	Confident	1 Å²	1	38 Å²	38	1%	0.006	21%	0.205	C	C	.	.			trans	-120.2	31.1	174.8	-60.5	0	0	0	0	111.1	Y516 Q518 A730 L733 F742 I752 L755 R759	Y516-V735 VanDerWaalsContact OH-C 3.29Å; Y516-V735 PolarHBondContact OH-O 3.44Å; Q518-V735 HydrophobicContact CG-CG1 4.29Å; A730-V735 HydrophobicContact CB-CG2 3.97Å; A730-V735 PolarHBondContact O-N 3.01Å; L733-V735 VanDerWaalsContact C-N 3.35Å; L733-V735 HydrophobicContact CB-CG2 4.12Å; L733-V735 PolarHBondContact O-N 3.25Å; V735-F742 VanDerWaalsContact O-CE2 3.24Å; V735-F742 WeakPolarHBondContact O-CE2 3.45Å; V735-I752 HydrophobicContact CG2-CG1 4.47Å; V735-I752 HydrophobicContact CG2-CG2 4.09Å; V735-L755 HydrophobicContact CB-CD2 4.03Å; V735-L755 HydrophobicContact CG1-CD2 3.69Å; V735-L755 HydrophobicContact CG1-CG 4.42Å; V735-R759 VanDerWaalsContact CG1-NH1 3.29Å
736	D	85.7	Confident	88.8	Confident	63 Å²	63	44.5 Å²	44.5	34%	0.337	25%	0.245	S	C	.	.			trans	-102.9	5	-172.6	60.6	-56.5	0	0	0	114.3	A730 Q731 Y738 L739	A730-D736 HydrophobicContact CB-CB 4.24Å; Q731-D736 HydrophobicContact CB-CB 4.39Å; Q731-D736 HydrophobicContact CG-CB 3.72Å; Q731-D736 WeakPolarHBondContact CG-OD2 3.42Å; D736-Y738 PolarHBondContact O-N 2.73Å; D736-Y738 VanDerWaalsContact O-N 3.16Å; D736-L739 HydrophobicContact CB-CD2 3.85Å; D736-L739 HydrophobicContact CB-CG 4.34Å
737	H	85.8	Confident	88.7	Confident	77 Å²	77	44.7 Å²	44.7	36%	0.356	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.4	-176.8	70.3	-97.4	0	0	0	113	E509 Y516 C517 Q518	E509-H737 IonicContact OE1-CD2 2.76Å; E509-H737 IonicContact OE1-NE2 3.93Å; E509-H737 PolarHBondContact OE1-NE2 3.02Å; E509-H737 IonicContact OE2-CD2 2.66Å; Y516-H737 AromaticContact CD2-NE2 3.98Å; Y516-H737 AromaticContact CE1-CE1 3.64Å; Y516-H737 AromaticContact CE2-CE1 3.36Å; Y516-H737 WeakPolarHBondContact CE2-CE1 3.37Å; Y516-H737 AromaticContact CE2-ND1 3.99Å; Y516-H737 AromaticContact CE2-NE2 3.4Å; Y516-H737 WeakPolarHBondContact CE2-NE2 3.23Å; Y516-H737 AromaticContact CZ-CE1 3.02Å; Y516-H737 AromaticContact CZ-ND1 3.58Å; Y516-H737 AromaticContact CZ-NE2 3.59Å; Y516-H737 PolarHBondContact OH-CE1 3.15Å; Y516-H737 PolarHBondContact OH-ND1 3.25Å; C517-H737 PolarHBondContact O-CE1 3.13Å; Q518-H737 PolarHBondContact OE1-ND1 2.83Å
738	Y	88.7	Confident	88.8	Confident	25 Å²	25	40.5 Å²	40.5	10%	0.098	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.9	75.4	175.2	-172.5	-122	0	0	0	112.4	E509 T510 L511 D736 P740 Y741	E509-Y738 HydrophobicContact CB-CD1 3.34Å; E509-Y738 HydrophobicContact CB-CD2 4.07Å; E509-Y738 HydrophobicContact CB-CE1 3.61Å; E509-Y738 HydrophobicContact CB-CE2 4.31Å; E509-Y738 HydrophobicContact CB-CG 3.63Å; E509-Y738 HydrophobicContact CG-CD1 4.12Å; E509-Y738 HydrophobicContact CG-CG 4.42Å; E509-Y738 WeakPolarHBondContact O-CE2 3.48Å; T510-Y738 WeakPolarHBondContact CA-OH 3.17Å; T510-Y738 WeakPolarHBondContact O-CE1 3.46Å; T510-Y738 PolarHBondContact O-OH 2.96Å; L511-Y738 WeakPolarHBondContact CA-OH 3.37Å; L511-Y738 PolarHBondContact N-OH 3.5Å; D736-Y738 PolarHBondContact O-N 2.73Å; D736-Y738 VanDerWaalsContact O-N 3.16Å; Y738-P740 HydrophobicContact CD2-CG 4.17Å; Y738-P740 HydrophobicContact CE2-CB 3.85Å; Y738-P740 HydrophobicContact CE2-CG 3.68Å; Y738-Y741 VanDerWaalsContact CD1-CB 3.48Å; Y738-Y741 PolarHBondContact O-N 3.09Å
739	L	88.8	Confident	88.9	Confident	40 Å²	40	38.6 Å²	38.6	21%	0.209	22%	0.224	C	C	.	.	H	α-helix	trans	-57.2	-34.7	178.3	-63.3	177.8	0	0	0	116	W726 R727 A730 D736 Y741 F742 A743	W726-L739 HydrophobicContact CH2-CB 4.34Å; W726-L739 HydrophobicContact CZ3-CB 4.34Å; W726-L739 HydrophobicContact CZ3-CD2 3.92Å; R727-L739 HydrophobicContact CB-CD1 4.42Å; R727-L739 HydrophobicContact CG-CD1 4.49Å; A730-L739 HydrophobicContact CB-CD2 3.73Å; D736-L739 HydrophobicContact CB-CD2 3.85Å; D736-L739 HydrophobicContact CB-CG 4.34Å; L739-Y741 PolarHBondContact O-N 2.87Å; L739-F742 PolarHBondContact O-N 2.84Å; L739-F742 VanDerWaalsContact O-N 3.13Å; L739-A743 PolarHBondContact O-N 3.02Å; L739-A743 VanDerWaalsContact O-N 3.13Å
740	P	87.3	Confident	88.9	Confident	56 Å²	56	40 Å²	40	36%	0.364	23%	0.231	S	C	.	.	H	α-helix	trans	-59.7	-26.2	-179.9	-25.3	34.5	0	0	0	114.5	L511 Y738 A743 S744	L511-P740 HydrophobicContact CD2-CB 3.82Å; Y738-P740 HydrophobicContact CD2-CG 4.17Å; Y738-P740 HydrophobicContact CE2-CB 3.85Å; Y738-P740 HydrophobicContact CE2-CG 3.68Å; P740-A743 PolarHBondContact O-N 2.79Å; P740-S744 PolarHBondContact O-N 3.02Å; P740-S744 PolarHBondContact O-OG 2.9Å
741	Y	88.5	Confident	88.8	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-59.1	-50.9	172.4	-178.9	-93.3	0	0	0	111.5	Y516 L527 E529 Y738 L739 A743 S744 R745 L751	Y516-Y741 HydrophobicContact CD2-CD1 4.01Å; Y516-Y741 HydrophobicContact CD2-CG 4.03Å; Y516-Y741 HydrophobicContact CG-CD1 4.02Å; Y516-Y741 HydrophobicContact CG-CE1 4.31Å; Y516-Y741 HydrophobicContact CG-CG 4.32Å; L527-Y741 HydrophobicContact CB-CE1 4.29Å; L527-Y741 HydrophobicContact CD1-CE1 3.85Å; E529-Y741 PolarHBondContact OE1-OH 2.98Å; Y738-Y741 VanDerWaalsContact CD1-CB 3.48Å; Y738-Y741 PolarHBondContact O-N 3.09Å; L739-Y741 PolarHBondContact O-N 2.87Å; Y741-A743 PolarHBondContact O-N 3.43Å; Y741-S744 PolarHBondContact O-OG 3.21Å; Y741-R745 WeakPolarHBondContact O-CG 3.35Å; Y741-L751 HydrophobicContact CE1-CD2 4.08Å
742	F	90.3	Very high	89	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.2	-39.2	179	-57.2	-74.5	0	0	0	112.1	Y516 L527 W726 V735 L739 S744 R745 P748 L751 I752 L755	Y516-F742 HydrophobicContact CD1-CZ 4.28Å; Y516-F742 HydrophobicContact CD2-CE2 4.27Å; Y516-F742 HydrophobicContact CD2-CZ 4.27Å; Y516-F742 HydrophobicContact CE1-CE2 4.41Å; Y516-F742 AromaticContact CE1-CZ 3.83Å; Y516-F742 HydrophobicContact CE1-CZ 3.83Å; Y516-F742 AromaticContact CE2-CE2 3.63Å; Y516-F742 HydrophobicContact CE2-CE2 3.63Å; Y516-F742 AromaticContact CE2-CZ 3.83Å; Y516-F742 HydrophobicContact CE2-CZ 3.83Å; Y516-F742 HydrophobicContact CG-CZ 4.47Å; Y516-F742 AromaticContact CZ-CE2 3.7Å; Y516-F742 AromaticContact CZ-CZ 3.58Å; L527-F742 HydrophobicContact CD1-CE1 4.17Å; W726-F742 HydrophobicContact CE3-CB 4.45Å; W726-F742 HydrophobicContact CH2-CB 4.43Å; W726-F742 HydrophobicContact CZ3-CB 3.9Å; V735-F742 VanDerWaalsContact O-CE2 3.24Å; V735-F742 WeakPolarHBondContact O-CE2 3.45Å; L739-F742 PolarHBondContact O-N 2.84Å; L739-F742 VanDerWaalsContact O-N 3.13Å; F742-S744 PolarHBondContact O-N 3.21Å; F742-R745 PolarHBondContact O-N 2.95Å; F742-P748 HydrophobicContact CB-CB 4.09Å; F742-P748 WeakPolarHBondContact O-CG 3.44Å; F742-L751 HydrophobicContact CD1-CB 4.23Å; F742-L751 HydrophobicContact CD1-CD2 3.94Å; F742-L751 HydrophobicContact CE1-CD2 3.85Å; F742-I752 HydrophobicContact CD1-CG1 3.79Å; F742-I752 HydrophobicContact CE1-CG1 3.93Å; F742-I752 HydrophobicContact CG-CD1 4.41Å; F742-I752 HydrophobicContact CG-CG1 4.13Å; F742-I752 HydrophobicContact CZ-CG1 4.39Å; F742-L755 HydrophobicContact CZ-CD2 4.27Å
743	A	86.9	Confident	89.1	Confident	55 Å²	55	34.1 Å²	34.1	46%	0.455	20%	0.203	S	C	.	.	H	α-helix	trans	-63.1	-27	-176.7	0	0	0	0	0	114.1	W726 L739 P740 Y741 R745	W726-A743 HydrophobicContact CH2-CB 3.85Å; W726-A743 HydrophobicContact CZ2-CB 3.97Å; L739-A743 PolarHBondContact O-N 3.02Å; L739-A743 VanDerWaalsContact O-N 3.13Å; P740-A743 PolarHBondContact O-N 2.79Å; Y741-A743 PolarHBondContact O-N 3.43Å; A743-R745 VanDerWaalsContact C-N 3.33Å
744	S	84.9	Confident	89.1	Confident	64 Å²	64	34 Å²	34	45%	0.448	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-0.6	-177	45.9	0	0	0	0	113.3	P740 Y741 F742	P740-S744 PolarHBondContact O-N 3.02Å; P740-S744 PolarHBondContact O-OG 2.9Å; Y741-S744 PolarHBondContact O-OG 3.21Å; F742-S744 PolarHBondContact O-N 3.21Å
745	R	85	Confident	89.2	Confident	56 Å²	56	31.3 Å²	31.3	21%	0.211	18%	0.181	C	C	.	.	S	Bend	trans	-106.3	167.4	-179.2	-50.6	-34.3	-168.8	-136.1	15.2	111.3	E529 Y741 F742 A743 S747 L751	E529-R745 IonicContact OE1-CZ 3.97Å; E529-R745 IonicContact OE1-NE 2.94Å; E529-R745 PolarHBondContact OE1-NE 2.93Å; E529-R745 IonicContact OE1-NH2 3.98Å; E529-R745 PolarHBondContact OE1-NH2 3.45Å; E529-R745 IonicContact OE2-NH2 3.76Å; E529-R745 PolarHBondContact OE2-NH2 2.85Å; Y741-R745 WeakPolarHBondContact O-CG 3.35Å; F742-R745 PolarHBondContact O-N 2.95Å; A743-R745 VanDerWaalsContact C-N 3.33Å; R745-S747 PolarHBondContact O-N 2.88Å; R745-L751 HydrophobicContact CB-CD1 3.79Å; R745-L751 HydrophobicContact CG-CD1 3.75Å
746	T	84.7	Confident	89.2	Confident	142 Å²	142	31.4 Å²	31.4	87%	0.871	18%	0.181	S	C	*	.	S	Bend	trans	-62.7	-35.6	-170.6	50.8	0	0	0	0	114.4
747	S	90.6	Very high	89.4	Confident	12 Å²	12	28.4 Å²	28.4	8%	0.084	17%	0.165	C	C	.	.			trans	-142.4	105.2	172.7	176	0	0	0	0	110.4	A713 D717 R745 T749 E750 L751	A713-S747 WeakPolarHBondContact CB-OG 3.45Å; D717-S747 PolarHBondContact OD1-OG 3.12Å; D717-S747 VanDerWaalsContact OD2-CB 3.3Å; D717-S747 WeakPolarHBondContact OD2-CB 3.19Å; D717-S747 PolarHBondContact OD2-OG 2.98Å; R745-S747 PolarHBondContact O-N 2.88Å; S747-T749 VanDerWaalsContact C-N 3.31Å; S747-T749 PolarHBondContact O-N 3.13Å; S747-E750 WeakPolarHBondContact OG-CB 3.42Å; S747-E750 PolarHBondContact OG-N 3.24Å; S747-L751 PolarHBondContact O-N 3.04Å
748	P	92.4	Very high	89.3	Confident	13 Å²	13	25 Å²	25	8%	0.084	15%	0.15	C	C	.	.	H	α-helix	trans	-57	-42.6	173.9	-23.9	31.4	0	0	0	112.5	D717 W726 F742 L751 I752	D717-P748 WeakPolarHBondContact OD1-CD 3.45Å; W726-P748 HydrophobicContact CB-CB 4.25Å; W726-P748 HydrophobicContact CD2-CB 3.51Å; W726-P748 HydrophobicContact CD2-CG 4.12Å; W726-P748 HydrophobicContact CE3-CB 3.76Å; W726-P748 HydrophobicContact CG-CB 3.75Å; W726-P748 HydrophobicContact CG-CG 4.34Å; W726-P748 HydrophobicContact CZ2-CB 4.41Å; W726-P748 HydrophobicContact CZ2-CG 4.35Å; W726-P748 HydrophobicContact CZ3-CB 4.29Å; F742-P748 HydrophobicContact CB-CB 4.09Å; F742-P748 WeakPolarHBondContact O-CG 3.44Å; P748-L751 PolarHBondContact O-N 3.36Å; P748-I752 WeakPolarHBondContact O-CB 3.17Å; P748-I752 WeakPolarHBondContact O-CD1 3.38Å; P748-I752 VanDerWaalsContact O-CG1 3.25Å; P748-I752 WeakPolarHBondContact O-CG1 3.44Å; P748-I752 PolarHBondContact O-N 2.62Å
749	T	93.5	Very high	89.2	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-66.3	-44.9	-177.3	-56.7	0	0	0	0	112	L712 A713 L716 D717 W726 L729 S747 L751 I752 L753	L712-T749 HydrophobicContact CB-CG2 4.48Å; A713-T749 HydrophobicContact CB-CG2 4.44Å; L716-T749 HydrophobicContact CB-CG2 3.99Å; L716-T749 WeakPolarHBondContact CB-OG1 3.27Å; L716-T749 HydrophobicContact CD1-CG2 4Å; D717-T749 WeakPolarHBondContact OD1-CB 3.26Å; D717-T749 PolarHBondContact OD1-N 3.27Å; D717-T749 PolarHBondContact OD1-OG1 2.79Å; W726-T749 WeakPolarHBondContact CB-OG1 3.2Å; L729-T749 HydrophobicContact CD2-CG2 4.27Å; S747-T749 VanDerWaalsContact C-N 3.31Å; S747-T749 PolarHBondContact O-N 3.13Å; T749-L751 PolarHBondContact O-N 2.84Å; T749-I752 PolarHBondContact O-N 2.78Å; T749-L753 HydrophobicContact CG2-CD1 3.91Å; T749-L753 HydrophobicContact CG2-CG 4.24Å; T749-L753 WeakPolarHBondContact O-CB 3.46Å; T749-L753 VanDerWaalsContact O-CG 3.29Å; T749-L753 WeakPolarHBondContact O-CG 3.39Å; T749-L753 PolarHBondContact O-N 2.83Å
750	E	91.7	Very high	89	Confident	28 Å²	28	26 Å²	26	13%	0.131	15%	0.152	C	C	.	.	H	α-helix	trans	-58.6	-40.1	178.4	-174.8	-178.6	164.3	0	0	110.9	K455 H706 S747 T754	K455-E750 IonicContact NZ-OE1 3.68Å; K455-E750 PolarHBondContact NZ-OE1 2.92Å; K455-E750 IonicContact NZ-OE2 3.25Å; H706-E750 IonicContact CE1-OE1 2.63Å; S747-E750 WeakPolarHBondContact OG-CB 3.42Å; S747-E750 PolarHBondContact OG-N 3.24Å; E750-T754 VanDerWaalsContact O-CB 3.24Å; E750-T754 WeakPolarHBondContact O-CB 3.43Å; E750-T754 PolarHBondContact O-N 2.87Å; E750-T754 PolarHBondContact O-OG1 3.44Å
751	L	91.5	Very high	88.5	Confident	15 Å²	15	26.8 Å²	26.8	8%	0.079	15%	0.151	C	C	.	.	H	α-helix	trans	-71.2	-43.7	-178.3	-138.8	156.8	0	0	0	111.7	P456 L527 Y741 F742 R745 S747 P748 T749 T754 L755	P456-L751 HydrophobicContact CG-CD1 3.73Å; P456-L751 HydrophobicContact CG-CD2 4.11Å; P456-L751 HydrophobicContact CG-CG 3.95Å; L527-L751 HydrophobicContact CD1-CD2 3.42Å; L527-L751 VanDerWaalsContact CD1-CD2 3.42Å; L527-L751 HydrophobicContact CD2-CD2 3.74Å; L527-L751 HydrophobicContact CG-CD2 4.2Å; Y741-L751 HydrophobicContact CE1-CD2 4.08Å; F742-L751 HydrophobicContact CD1-CB 4.23Å; F742-L751 HydrophobicContact CD1-CD2 3.94Å; F742-L751 HydrophobicContact CE1-CD2 3.85Å; R745-L751 HydrophobicContact CB-CD1 3.79Å; R745-L751 HydrophobicContact CG-CD1 3.75Å; S747-L751 PolarHBondContact O-N 3.04Å; P748-L751 PolarHBondContact O-N 3.36Å; T749-L751 PolarHBondContact O-N 2.84Å; L751-T754 PolarHBondContact O-N 2.86Å; L751-L755 WeakPolarHBondContact O-CB 3.39Å; L751-L755 PolarHBondContact O-N 2.85Å
752	I	93.5	Very high	88	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-45.2	173.5	-71.6	161.1	0	0	0	111.1	W726 L729 A730 L733 V735 F742 P748 T749 T754 L755 W756	W726-I752 HydrophobicContact CB-CD1 4.3Å; W726-I752 HydrophobicContact CE3-CD1 3.8Å; L729-I752 HydrophobicContact CD2-CG2 4.1Å; L729-I752 HydrophobicContact CG-CG2 4.13Å; A730-I752 HydrophobicContact CB-CD1 3.84Å; A730-I752 HydrophobicContact CB-CG1 4.47Å; L733-I752 HydrophobicContact CD1-CG2 3.67Å; V735-I752 HydrophobicContact CG2-CG1 4.47Å; V735-I752 HydrophobicContact CG2-CG2 4.09Å; F742-I752 HydrophobicContact CD1-CG1 3.79Å; F742-I752 HydrophobicContact CE1-CG1 3.93Å; F742-I752 HydrophobicContact CG-CD1 4.41Å; F742-I752 HydrophobicContact CG-CG1 4.13Å; F742-I752 HydrophobicContact CZ-CG1 4.39Å; P748-I752 WeakPolarHBondContact O-CB 3.17Å; P748-I752 WeakPolarHBondContact O-CD1 3.38Å; P748-I752 VanDerWaalsContact O-CG1 3.25Å; P748-I752 WeakPolarHBondContact O-CG1 3.44Å; P748-I752 PolarHBondContact O-N 2.62Å; T749-I752 PolarHBondContact O-N 2.78Å; I752-T754 VanDerWaalsContact C-N 3.33Å; I752-L755 PolarHBondContact O-N 2.83Å; I752-W756 WeakPolarHBondContact O-CB 3.23Å; I752-W756 PolarHBondContact O-N 2.85Å
753	L	92.3	Very high	87.3	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-66.4	-37	177.6	-70.5	177.6	0	0	0	111.6	L704 K709 L712 L729 T749 W756 E757 L769	L704-L753 HydrophobicContact CD1-CD1 4.39Å; L704-L753 HydrophobicContact CD1-CD2 4.4Å; K709-L753 HydrophobicContact CD-CB 4.19Å; K709-L753 HydrophobicContact CG-CB 4.48Å; K709-L753 HydrophobicContact CG-CD1 4.21Å; L712-L753 HydrophobicContact CB-CD1 3.98Å; L712-L753 HydrophobicContact CD1-CD1 3.76Å; L729-L753 HydrophobicContact CD2-CD2 4.26Å; T749-L753 HydrophobicContact CG2-CD1 3.91Å; T749-L753 HydrophobicContact CG2-CG 4.24Å; T749-L753 WeakPolarHBondContact O-CB 3.46Å; T749-L753 VanDerWaalsContact O-CG 3.29Å; T749-L753 WeakPolarHBondContact O-CG 3.39Å; T749-L753 PolarHBondContact O-N 2.83Å; L753-W756 WeakPolarHBondContact O-CB 3.35Å; L753-W756 PolarHBondContact O-N 2.85Å; L753-E757 WeakPolarHBondContact O-CB 3.39Å; L753-E757 VanDerWaalsContact O-CG 3.27Å; L753-E757 WeakPolarHBondContact O-CG 3.21Å; L753-E757 PolarHBondContact O-N 3.25Å; L753-L769 HydrophobicContact CD2-CD1 4.19Å; L753-L769 HydrophobicContact CD2-CD2 4.12Å
754	T	89.8	Confident	86.9	Confident	6 Å²	6	38.1 Å²	38.1	4%	0.037	20%	0.203	C	C	.	.	H	α-helix	trans	-66	-40.3	175.6	-64.7	0	0	0	0	111.7	F405 P407 V458 K709 E750 L751 I752 E757 S758	F405-T754 HydrophobicContact CD1-CG2 3.54Å; F405-T754 HydrophobicContact CE1-CG2 3.43Å; F405-T754 VanDerWaalsContact CE1-CG2 3.43Å; P407-T754 HydrophobicContact CG-CG2 4.32Å; V458-T754 HydrophobicContact CG2-CG2 3.67Å; K709-T754 PolarHBondContact NZ-OG1 2.72Å; E750-T754 VanDerWaalsContact O-CB 3.24Å; E750-T754 WeakPolarHBondContact O-CB 3.43Å; E750-T754 PolarHBondContact O-N 2.87Å; E750-T754 PolarHBondContact O-OG1 3.44Å; L751-T754 PolarHBondContact O-N 2.86Å; I752-T754 VanDerWaalsContact C-N 3.33Å; T754-E757 WeakPolarHBondContact O-CB 3.47Å; T754-E757 PolarHBondContact O-N 3.21Å; T754-S758 PolarHBondContact O-N 2.84Å
755	L	91.3	Very high	86.8	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.6	-43	172.2	-177.8	61.8	0	0	0	111.1	V458 Y516 Q518 H525 L527 V735 F742 L751 I752 S758 R759	V458-L755 HydrophobicContact CG1-CD1 4.15Å; Y516-L755 HydrophobicContact CD1-CD2 4.33Å; Y516-L755 HydrophobicContact CE1-CD2 3.74Å; Q518-L755 HydrophobicContact CB-CD1 4.27Å; Q518-L755 HydrophobicContact CB-CD2 4.23Å; H525-L755 HydrophobicContact CB-CD1 3.7Å; L527-L755 HydrophobicContact CD1-CD1 4.49Å; L527-L755 HydrophobicContact CD1-CD2 4.3Å; V735-L755 HydrophobicContact CB-CD2 4.03Å; V735-L755 HydrophobicContact CG1-CD2 3.69Å; V735-L755 HydrophobicContact CG1-CG 4.42Å; F742-L755 HydrophobicContact CZ-CD2 4.27Å; L751-L755 WeakPolarHBondContact O-CB 3.39Å; L751-L755 PolarHBondContact O-N 2.85Å; I752-L755 PolarHBondContact O-N 2.83Å; L755-S758 PolarHBondContact O-N 3.03Å; L755-S758 VanDerWaalsContact O-N 3.16Å; L755-S758 PolarHBondContact O-OG 3.3Å; L755-R759 WeakPolarHBondContact O-CD 3.38Å; L755-R759 WeakPolarHBondContact O-CG 3.36Å; L755-R759 PolarHBondContact O-N 3.18Å
756	W	90.9	Very high	86.9	Confident	3 Å²	3	32.8 Å²	32.8	1%	0.011	17%	0.174	C	C	.	.	H	α-helix	trans	-60.1	-44.3	174.6	169.5	76.1	0	0	0	112.8	L704 L733 I752 L753 S758 R759 E760 G765 F766 L769	L704-W756 HydrophobicContact CD1-CE3 4.29Å; L704-W756 HydrophobicContact CD1-CZ3 3.75Å; L704-W756 HydrophobicContact CG-CZ3 3.98Å; L733-W756 HydrophobicContact CD1-CB 4.15Å; L733-W756 HydrophobicContact CD1-CG 4.35Å; L733-W756 HydrophobicContact CD2-CG 4.37Å; I752-W756 WeakPolarHBondContact O-CB 3.23Å; I752-W756 PolarHBondContact O-N 2.85Å; L753-W756 WeakPolarHBondContact O-CB 3.35Å; L753-W756 PolarHBondContact O-N 2.85Å; W756-S758 PolarHBondContact O-N 2.82Å; W756-R759 WeakPolarHBondContact O-CB 3.44Å; W756-R759 PolarHBondContact O-N 3.47Å; W756-E760 HydrophobicContact CD2-CG 4.43Å; W756-E760 HydrophobicContact CZ2-CB 4.4Å; W756-E760 HydrophobicContact CZ2-CG 3.87Å; W756-E760 VanDerWaalsContact NE1-CG 3.3Å; W756-E760 PolarHBondContact O-N 3.1Å; W756-E760 VanDerWaalsContact O-N 3.08Å; W756-G765 WeakPolarHBondContact CZ2-O 3.39Å; W756-F766 AromaticContact CH2-CD1 3.66Å; W756-F766 HydrophobicContact CH2-CD1 3.66Å; W756-F766 AromaticContact CH2-CE1 3.93Å; W756-F766 HydrophobicContact CH2-CE1 3.93Å; W756-F766 HydrophobicContact CH2-CG 4.49Å; W756-F766 HydrophobicContact CZ3-CD1 4.42Å; W756-F766 HydrophobicContact CZ3-CE1 4.35Å; W756-L769 HydrophobicContact CD2-CD2 4.43Å; W756-L769 HydrophobicContact CE3-CD2 4.15Å; W756-L769 HydrophobicContact CH2-CB 4.33Å; W756-L769 HydrophobicContact CH2-CD2 3.79Å; W756-L769 HydrophobicContact CZ2-CB 3.86Å; W756-L769 HydrophobicContact CZ2-CD2 4.05Å; W756-L769 HydrophobicContact CZ2-CG 4.49Å; W756-L769 HydrophobicContact CZ3-CD2 3.84Å
757	E	88.2	Confident	87	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-57.3	-32.7	174.4	-79.4	175.6	161.1	0	0	112.4	A701 V702 R703 L704 K709 L753 T754 R759	A701-E757 WeakPolarHBondContact CB-O 3.41Å; V702-E757 WeakPolarHBondContact O-CB 3.28Å; R703-E757 PolarHBondContact NH1-O 3.44Å; L704-E757 WeakPolarHBondContact CA-OE1 3.39Å; L704-E757 VanDerWaalsContact CB-OE1 3.28Å; L704-E757 WeakPolarHBondContact CB-OE1 3.13Å; L704-E757 PolarHBondContact N-OE1 2.83Å; K709-E757 WeakPolarHBondContact CD-OE1 3.43Å; K709-E757 WeakPolarHBondContact CE-OE1 3.42Å; K709-E757 IonicContact NZ-OE1 3.11Å; K709-E757 PolarHBondContact NZ-OE1 2.78Å; K709-E757 IonicContact NZ-OE2 2.99Å; K709-E757 PolarHBondContact NZ-OE2 2.83Å; L753-E757 WeakPolarHBondContact O-CB 3.39Å; L753-E757 VanDerWaalsContact O-CG 3.27Å; L753-E757 WeakPolarHBondContact O-CG 3.21Å; L753-E757 PolarHBondContact O-N 3.25Å; T754-E757 WeakPolarHBondContact O-CB 3.47Å; T754-E757 PolarHBondContact O-N 3.21Å; E757-R759 VanDerWaalsContact C-N 3.29Å
758	S	85.2	Confident	86.9	Confident	6 Å²	6	31.7 Å²	31.7	4%	0.042	16%	0.161	C	C	.	.	H	α-helix	trans	-73.9	-21.8	177.3	77.8	0	0	0	0	113.5	V458 H525 T754 L755 W756	V458-S758 WeakPolarHBondContact CG1-OG 3.37Å; H525-S758 PolarHBondContact CE1-O 3.24Å; H525-S758 VanDerWaalsContact CE1-O 3.28Å; H525-S758 PolarHBondContact ND1-OG 3.13Å; T754-S758 PolarHBondContact O-N 2.84Å; L755-S758 PolarHBondContact O-N 3.03Å; L755-S758 VanDerWaalsContact O-N 3.16Å; L755-S758 PolarHBondContact O-OG 3.3Å; W756-S758 PolarHBondContact O-N 2.82Å
759	R	86.3	Confident	86.8	Confident	50 Å²	50	31.1 Å²	31.1	19%	0.189	16%	0.158	C	C	.	.	H	α-helix	trans	-91	-36.1	-176.8	-64.3	163.3	63.7	-161.5	2.5	112.3	E520 L733 V735 L755 W756 E757	E520-R759 IonicContact OE1-CZ 3.92Å; E520-R759 IonicContact OE1-NE 2.91Å; E520-R759 PolarHBondContact OE1-NE 3.04Å; E520-R759 IonicContact OE1-NH2 3.3Å; E520-R759 PolarHBondContact OE1-NH2 2.84Å; L733-R759 PolarHBondContact O-NH1 3Å; L733-R759 PolarHBondContact O-NH2 3.31Å; V735-R759 VanDerWaalsContact CG1-NH1 3.29Å; L755-R759 WeakPolarHBondContact O-CD 3.38Å; L755-R759 WeakPolarHBondContact O-CG 3.36Å; L755-R759 PolarHBondContact O-N 3.18Å; W756-R759 WeakPolarHBondContact O-CB 3.44Å; W756-R759 PolarHBondContact O-N 3.47Å; E757-R759 VanDerWaalsContact C-N 3.29Å
760	E	84.6	Confident	86.7	Confident	36 Å²	36	31.8 Å²	31.8	17%	0.168	16%	0.161	C	C	.	.			trans	-86.6	123.3	-177.8	-69.6	-66.3	171.1	0	0	112.3	A701 V702 W756	A701-E760 CarbonylContact C-O 3.55Å; A701-E760 WeakPolarHBondContact CA-O 3.43Å; V702-E760 PolarHBondContact N-O 2.86Å; W756-E760 HydrophobicContact CD2-CG 4.43Å; W756-E760 HydrophobicContact CZ2-CB 4.4Å; W756-E760 HydrophobicContact CZ2-CG 3.87Å; W756-E760 VanDerWaalsContact NE1-CG 3.3Å; W756-E760 PolarHBondContact O-N 3.1Å; W756-E760 VanDerWaalsContact O-N 3.08Å
761	Q	76	Confident	86.6	Confident	72 Å²	72	35.2 Å²	35.2	34%	0.336	18%	0.177	S	C	.	.			trans	-104.6	-7.5	176.4	-64.6	177.7	6.5	0	0	112.9	F699	F699-Q761 HydrophobicContact CB-CB 4.49Å
762	N	78.9	Confident	86.6	Confident	103 Å²	103	36.1 Å²	36.1	55%	0.551	18%	0.181	S	C	*	.	S	Bend	trans	-121.6	140.5	-174.9	-170.2	-32.1	0	0	0	110.8	H764 G765	N762-H764 PolarHBondContact O-N 2.89Å; N762-H764 VanDerWaalsContact O-N 3.15Å; N762-H764 PolarHBondContact OD1-N 3.11Å; N762-G765 WeakPolarHBondContact O-CA 3.38Å; N762-G765 PolarHBondContact O-N 3.35Å
763	V	74.6	Confident	86.6	Confident	85 Å²	85	36.2 Å²	36.2	52%	0.515	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-28.2	174.1	-174.8	0	0	0	0	112	G765 F766	V763-G765 PolarHBondContact O-N 2.96Å; V763-G765 VanDerWaalsContact O-N 3.07Å; V763-F766 HydrophobicContact CB-CD2 4.48Å; V763-F766 HydrophobicContact CG1-CD2 3.81Å; V763-F766 HydrophobicContact CG1-CE2 4.16Å; V763-F766 VanDerWaalsContact O-CD2 3.29Å; V763-F766 WeakPolarHBondContact O-CD2 3.4Å; V763-F766 PolarHBondContact O-N 2.81Å
764	H	79.6	Confident	86.6	Confident	106 Å²	106	41.6 Å²	41.6	49%	0.491	20%	0.201	S	C	.	.	H	α-helix	trans	-57.1	-22.1	171.5	-168.2	80	0	0	0	113.2	N762 F766 V767 K768	N762-H764 PolarHBondContact O-N 2.89Å; N762-H764 VanDerWaalsContact O-N 3.15Å; N762-H764 PolarHBondContact OD1-N 3.11Å; H764-F766 PolarHBondContact O-N 3.43Å; H764-V767 WeakPolarHBondContact O-CB 3.3Å; H764-V767 PolarHBondContact O-N 3.3Å; H764-V767 VanDerWaalsContact O-N 3.07Å; H764-K768 PolarHBondContact O-N 2.87Å
765	G	83.4	Confident	86.6	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-54.8	-37.7	171.2	0	0	0	0	0	112.7	W756 N762 V763 V767 K768 L769	W756-G765 WeakPolarHBondContact CZ2-O 3.39Å; N762-G765 WeakPolarHBondContact O-CA 3.38Å; N762-G765 PolarHBondContact O-N 3.35Å; V763-G765 PolarHBondContact O-N 2.96Å; V763-G765 VanDerWaalsContact O-N 3.07Å; G765-V767 VanDerWaalsContact C-N 3.29Å; G765-V767 PolarHBondContact O-N 3.47Å; G765-K768 WeakPolarHBondContact O-CB 3.35Å; G765-K768 PolarHBondContact O-N 3.39Å; G765-L769 PolarHBondContact O-N 3.09Å
766	F	87	Confident	86.6	Confident	8 Å²	8	48.2 Å²	48.2	4%	0.035	23%	0.225	C	C	.	.	H	α-helix	trans	-64.3	-34.8	177.1	-63.3	-63.8	0	0	0	112.6	V702 L704 W756 V763 H764 L769 L770 L785 L789 L792	V702-F766 HydrophobicContact CG1-CD2 4.1Å; V702-F766 HydrophobicContact CG1-CE1 3.78Å; V702-F766 HydrophobicContact CG1-CE2 3.23Å; V702-F766 HydrophobicContact CG1-CZ 3.05Å; L704-F766 HydrophobicContact CD2-CD1 3.85Å; L704-F766 HydrophobicContact CD2-CE1 3.44Å; L704-F766 VanDerWaalsContact CD2-CE1 3.44Å; L704-F766 HydrophobicContact CG-CE1 3.89Å; W756-F766 AromaticContact CH2-CD1 3.66Å; W756-F766 HydrophobicContact CH2-CD1 3.66Å; W756-F766 AromaticContact CH2-CE1 3.93Å; W756-F766 HydrophobicContact CH2-CE1 3.93Å; W756-F766 HydrophobicContact CH2-CG 4.49Å; W756-F766 HydrophobicContact CZ3-CD1 4.42Å; W756-F766 HydrophobicContact CZ3-CE1 4.35Å; V763-F766 HydrophobicContact CB-CD2 4.48Å; V763-F766 HydrophobicContact CG1-CD2 3.81Å; V763-F766 HydrophobicContact CG1-CE2 4.16Å; V763-F766 VanDerWaalsContact O-CD2 3.29Å; V763-F766 WeakPolarHBondContact O-CD2 3.4Å; V763-F766 PolarHBondContact O-N 2.81Å; H764-F766 PolarHBondContact O-N 3.43Å; F766-L769 PolarHBondContact O-N 2.96Å; F766-L770 WeakPolarHBondContact O-CB 3.21Å; F766-L770 PolarHBondContact O-N 3.47Å; F766-L785 HydrophobicContact CD1-CD1 4.41Å; F766-L789 HydrophobicContact CB-CD1 4.19Å; F766-L789 HydrophobicContact CB-CD2 3.66Å; F766-L789 HydrophobicContact CB-CG 4.33Å; F766-L789 HydrophobicContact CD2-CD2 4.07Å; F766-L789 HydrophobicContact CG-CD2 4.02Å; F766-L792 HydrophobicContact CE2-CD1 4.39Å
767	V	86.5	Confident	86.5	Confident	75 Å²	75	56.4 Å²	56.4	46%	0.455	26%	0.261	S	S	.	.	H	α-helix	trans	-66.9	-40.2	176.1	-177.8	0	0	0	0	110.2	H764 G765 L770 H771	H764-V767 WeakPolarHBondContact O-CB 3.3Å; H764-V767 PolarHBondContact O-N 3.3Å; H764-V767 VanDerWaalsContact O-N 3.07Å; G765-V767 VanDerWaalsContact C-N 3.29Å; G765-V767 PolarHBondContact O-N 3.47Å; V767-L770 PolarHBondContact O-N 2.86Å; V767-H771 PolarHBondContact O-N 3.5Å
768	K	87.8	Confident	86.5	Confident	55 Å²	55	57.5 Å²	57.5	24%	0.239	27%	0.265	C	S	.	.	H	α-helix	trans	-62	-46.1	172.7	-66	-179.7	178.6	175.2	0	111.6	H764 G765 L770 H771 F772	H764-K768 PolarHBondContact O-N 2.87Å; G765-K768 WeakPolarHBondContact O-CB 3.35Å; G765-K768 PolarHBondContact O-N 3.39Å; K768-L770 VanDerWaalsContact C-N 3.32Å; K768-L770 PolarHBondContact O-N 2.87Å; K768-H771 WeakPolarHBondContact O-CB 3.44Å; K768-H771 PolarHBondContact O-N 2.65Å; K768-H771 VanDerWaalsContact O-N 3.13Å; K768-F772 HydrophobicContact CB-CE2 4.32Å; K768-F772 VanDerWaalsContact O-CD2 3.24Å; K768-F772 WeakPolarHBondContact O-CD2 3.45Å; K768-F772 WeakPolarHBondContact O-CG 3.16Å; K768-F772 PolarHBondContact O-N 3.29Å
769	L	91	Very high	86.7	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-59.6	-43.8	176.5	-177.5	62.2	0	0	0	111.2	L704 L729 L753 W756 G765 F766 H771 F772 L773 L785	L704-L769 HydrophobicContact CD1-CD2 4.22Å; L729-L769 HydrophobicContact CD1-CD1 4.2Å; L753-L769 HydrophobicContact CD2-CD1 4.19Å; L753-L769 HydrophobicContact CD2-CD2 4.12Å; W756-L769 HydrophobicContact CD2-CD2 4.43Å; W756-L769 HydrophobicContact CE3-CD2 4.15Å; W756-L769 HydrophobicContact CH2-CB 4.33Å; W756-L769 HydrophobicContact CH2-CD2 3.79Å; W756-L769 HydrophobicContact CZ2-CB 3.86Å; W756-L769 HydrophobicContact CZ2-CD2 4.05Å; W756-L769 HydrophobicContact CZ2-CG 4.49Å; W756-L769 HydrophobicContact CZ3-CD2 3.84Å; G765-L769 PolarHBondContact O-N 3.09Å; F766-L769 PolarHBondContact O-N 2.96Å; L769-H771 VanDerWaalsContact C-N 3.32Å; L769-H771 PolarHBondContact O-N 3.06Å; L769-F772 PolarHBondContact O-N 3.41Å; L769-L773 HydrophobicContact CG-CD1 4.49Å; L769-L773 WeakPolarHBondContact O-CG 3.13Å; L769-L773 PolarHBondContact O-N 2.95Å; L769-L785 HydrophobicContact CB-CD2 4.08Å; L769-L785 HydrophobicContact CD2-CD2 3.93Å; L769-L785 HydrophobicContact CG-CD2 3.84Å
770	L	90.5	Very high	87	Confident	15 Å²	15	66.1 Å²	66.1	8%	0.079	31%	0.309	C	S	.	.	H	α-helix	trans	-60.5	-41.1	175	-174.1	64	0	0	0	111.9	F766 V767 K768 L773 R774 C782 L785 S786 L789	F766-L770 WeakPolarHBondContact O-CB 3.21Å; F766-L770 PolarHBondContact O-N 3.47Å; V767-L770 PolarHBondContact O-N 2.86Å; K768-L770 VanDerWaalsContact C-N 3.32Å; K768-L770 PolarHBondContact O-N 2.87Å; L770-L773 PolarHBondContact O-N 3.17Å; L770-R774 WeakPolarHBondContact O-CG 3.49Å; L770-R774 PolarHBondContact O-N 2.89Å; L770-C782 HydrophobicContact CD1-CB 3.99Å; L770-L785 HydrophobicContact CB-CD2 3.87Å; L770-L785 HydrophobicContact CD1-CB 4.36Å; L770-L785 HydrophobicContact CD1-CD2 4.22Å; L770-S786 WeakPolarHBondContact CD1-OG 3.46Å; L770-L789 HydrophobicContact CD2-CD1 4.34Å
771	H	90.3	Very high	87.3	Confident	100 Å²	100	64.4 Å²	64.4	46%	0.463	30%	0.301	S	S	.	.	H	α-helix	trans	-62.6	-41.8	174.6	-179.2	78.7	0	0	0	112.2	V767 K768 L769 R774 R775	V767-H771 PolarHBondContact O-N 3.5Å; K768-H771 WeakPolarHBondContact O-CB 3.44Å; K768-H771 PolarHBondContact O-N 2.65Å; K768-H771 VanDerWaalsContact O-N 3.13Å; L769-H771 VanDerWaalsContact C-N 3.32Å; L769-H771 PolarHBondContact O-N 3.06Å; H771-R774 PolarHBondContact O-N 3.4Å; H771-R775 PolarHBondContact O-N 3.19Å
772	F	92.3	Very high	88	Confident	34 Å²	34	61.6 Å²	61.6	15%	0.149	29%	0.289	C	S	.	.	H	α-helix	trans	-62.7	-46.6	174.9	-64.6	-44.8	0	0	0	111.9	L732 L733 K768 L769 R774 R775 M776	L732-F772 HydrophobicContact CB-CB 4.32Å; L732-F772 HydrophobicContact CB-CD1 3.98Å; L732-F772 HydrophobicContact CB-CG 4.17Å; L732-F772 HydrophobicContact CD1-CB 4.11Å; L732-F772 HydrophobicContact CD1-CD1 4.49Å; L732-F772 HydrophobicContact CD2-CD1 4.34Å; L733-F772 HydrophobicContact CD2-CD2 3.68Å; L733-F772 HydrophobicContact CD2-CE2 3.75Å; K768-F772 HydrophobicContact CB-CE2 4.32Å; K768-F772 VanDerWaalsContact O-CD2 3.24Å; K768-F772 WeakPolarHBondContact O-CD2 3.45Å; K768-F772 WeakPolarHBondContact O-CG 3.16Å; K768-F772 PolarHBondContact O-N 3.29Å; L769-F772 PolarHBondContact O-N 3.41Å; F772-R774 VanDerWaalsContact C-N 3.26Å; F772-R774 PolarHBondContact O-N 3.27Å; F772-R775 CarbonylContact O-C 3.57Å; F772-R775 WeakPolarHBondContact O-CA 3.43Å; F772-R775 WeakPolarHBondContact O-CB 3.32Å; F772-R775 PolarHBondContact O-N 3.09Å; F772-M776 VanDerWaalsContact O-CG 3.29Å; F772-M776 WeakPolarHBondContact O-CG 3.44Å; F772-M776 PolarHBondContact O-N 2.89Å
773	L	92.2	Very high	88.6	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-36.3	176.1	-66.2	175.6	0	0	0	112.4	L712 L716 L769 L770 M776 K777 R778 A781 C782 L785	L712-L773 HydrophobicContact CD2-CD1 4.36Å; L716-L773 HydrophobicContact CD1-CD2 4.12Å; L769-L773 HydrophobicContact CG-CD1 4.49Å; L769-L773 WeakPolarHBondContact O-CG 3.13Å; L769-L773 PolarHBondContact O-N 2.95Å; L770-L773 PolarHBondContact O-N 3.17Å; L773-M776 HydrophobicContact CD2-SD 3.99Å; L773-M776 WeakPolarHBondContact O-CB 3.47Å; L773-M776 PolarHBondContact O-N 3.03Å; L773-K777 PolarHBondContact O-N 2.71Å; L773-R778 PolarHBondContact O-N 2.76Å; L773-A781 HydrophobicContact CD1-CB 4.24Å; L773-A781 HydrophobicContact CD2-CB 4.04Å; L773-C782 VanDerWaalsContact CB-SG 3.54Å; L773-L785 HydrophobicContact CD1-CB 4.24Å; L773-L785 HydrophobicContact CD1-CD2 3.87Å
774	R	91.8	Very high	89.4	Confident	115 Å²	115	57 Å²	57	43%	0.434	27%	0.272	S	S	.	.	H	α-helix	trans	-65.8	-43.4	173	-73.5	177.9	-173.9	165.1	2.4	111.9	L770 H771 F772 M776 K777 C782	L770-R774 WeakPolarHBondContact O-CG 3.49Å; L770-R774 PolarHBondContact O-N 2.89Å; H771-R774 PolarHBondContact O-N 3.4Å; F772-R774 VanDerWaalsContact C-N 3.26Å; F772-R774 PolarHBondContact O-N 3.27Å; R774-M776 PolarHBondContact O-N 2.67Å; R774-K777 WeakPolarHBondContact O-CA 3.27Å; R774-K777 PolarHBondContact O-N 3.14Å; R774-C782 VanDerWaalsContact CG-SG 3.55Å; R774-C782 PolarHBondContact N-SG 2.86Å; R774-C782 VanDerWaalsContact N-SG 3.4Å
775	R	90.5	Very high	89.9	Confident	146 Å²	146	52 Å²	52	55%	0.551	25%	0.249	S	C	*	.	H	α-helix	trans	-62.2	-30.4	174.8	-173.2	172.7	170.4	179.1	-4.7	111.7	L732 H771 F772 K777	L732-R775 HydrophobicContact CD2-CG 4.49Å; H771-R775 PolarHBondContact O-N 3.19Å; F772-R775 CarbonylContact O-C 3.57Å; F772-R775 WeakPolarHBondContact O-CA 3.43Å; F772-R775 WeakPolarHBondContact O-CB 3.32Å; F772-R775 PolarHBondContact O-N 3.09Å; R775-K777 PolarHBondContact O-N 2.8Å
776	M	91.1	Very high	90.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-3.3	171.3	-57.2	171.7	68.9	0	0	114.7	L716 N724 D725 M728 L729 L732 F772 L773 R774 R778	L716-M776 HydrophobicContact CD2-CE 4.09Å; N724-M776 WeakPolarHBondContact CB-O 3.48Å; N724-M776 VanDerWaalsContact CG-O 3.26Å; N724-M776 PolarHBondContact ND2-O 2.73Å; D725-M776 WeakPolarHBondContact O-CE 3.41Å; M728-M776 HydrophobicContact CB-CE 4.42Å; M728-M776 HydrophobicContact CE-CB 3.36Å; M728-M776 HydrophobicContact CE-CE 4.32Å; M728-M776 HydrophobicContact CE-CG 3.38Å; L729-M776 HydrophobicContact CB-CE 3.88Å; L729-M776 HydrophobicContact CB-SD 3.96Å; L729-M776 HydrophobicContact CD1-SD 4.01Å; L732-M776 HydrophobicContact CD1-CG 3.44Å; L732-M776 VanDerWaalsContact CD1-CG 3.44Å; L732-M776 HydrophobicContact CD1-SD 4.21Å; F772-M776 VanDerWaalsContact O-CG 3.29Å; F772-M776 WeakPolarHBondContact O-CG 3.44Å; F772-M776 PolarHBondContact O-N 2.89Å; L773-M776 HydrophobicContact CD2-SD 3.99Å; L773-M776 WeakPolarHBondContact O-CB 3.47Å; L773-M776 PolarHBondContact O-N 3.03Å; R774-M776 PolarHBondContact O-N 2.67Å; M776-R778 HydrophobicContact CB-CB 4.45Å; M776-R778 HydrophobicContact CB-CG 4Å; M776-R778 PolarHBondContact O-N 3.46Å
777	K	89.9	Confident	89.9	Confident	175 Å²	175	55.1 Å²	55.1	76%	0.761	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	28.5	-174.5	-55	179.1	179.2	177.2	0	112.9	L773 R774 R775	L773-K777 PolarHBondContact O-N 2.71Å; R774-K777 WeakPolarHBondContact O-CA 3.27Å; R774-K777 PolarHBondContact O-N 3.14Å; R775-K777 PolarHBondContact O-N 2.8Å
778	R	88.3	Confident	89.7	Confident	22 Å²	22	52.6 Å²	52.6	8%	0.083	26%	0.261	C	S	.	.			trans	-99.1	80.1	178.4	-67.1	-59.8	-61.1	-100.2	5	110.7	L715 L716 N724 L773 M776 D780 A781 C782	L715-R778 PolarHBondContact O-NH1 3.13Å; L715-R778 PolarHBondContact O-NH2 2.86Å; L716-R778 HydrophobicContact CD2-CG 4.12Å; N724-R778 HydrophobicContact CB-CG 4.45Å; N724-R778 PolarHBondContact O-NH1 3.09Å; L773-R778 PolarHBondContact O-N 2.76Å; M776-R778 HydrophobicContact CB-CB 4.45Å; M776-R778 HydrophobicContact CB-CG 4Å; M776-R778 PolarHBondContact O-N 3.46Å; R778-D780 VanDerWaalsContact C-N 3.28Å; R778-D780 WeakPolarHBondContact CA-OD1 3.42Å; R778-D780 WeakPolarHBondContact CB-OD1 3.46Å; R778-D780 IonicContact CZ-OD1 2.72Å; R778-D780 IonicContact CZ-OD2 3.26Å; R778-D780 IonicContact NE-OD1 3.8Å; R778-D780 PolarHBondContact NE-OD1 2.81Å; R778-D780 IonicContact NE-OD2 2.71Å; R778-D780 PolarHBondContact NE-OD2 3.43Å; R778-D780 IonicContact NH2-OD1 3.3Å; R778-D780 IonicContact NH2-OD2 3.44Å; R778-D780 PolarHBondContact NH2-OD2 2.85Å; R778-D780 PolarHBondContact O-N 3.34Å; R778-A781 HydrophobicContact CB-CB 3.93Å; R778-A781 PolarHBondContact O-N 2.78Å; R778-C782 PolarHBondContact O-N 3.4Å; R778-C782 PolarHBondContact O-SG 3.17Å
779	Q	88.9	Confident	89.4	Confident	170 Å²	170	51.9 Å²	51.9	79%	0.794	26%	0.26	S	S	*	.	H	α-helix	trans	-64.6	-33.3	179.6	-70.4	-172.1	-15.4	0	0	112.6	C782 A783	Q779-C782 PolarHBondContact O-N 3.47Å; Q779-A783 WeakPolarHBondContact O-CB 3.36Å; Q779-A783 PolarHBondContact O-N 3.11Å
780	D	91.8	Very high	88.8	Confident	67 Å²	67	58.5 Å²	58.5	36%	0.358	30%	0.295	S	S	.	.	H	α-helix	trans	-57.4	-52.1	172.1	54.3	-16.8	0	0	0	112.1	L715 R778 C782 A783 V784	L715-D780 HydrophobicContact CD1-CB 4.31Å; R778-D780 VanDerWaalsContact C-N 3.28Å; R778-D780 WeakPolarHBondContact CA-OD1 3.42Å; R778-D780 WeakPolarHBondContact CB-OD1 3.46Å; R778-D780 IonicContact CZ-OD1 2.72Å; R778-D780 IonicContact CZ-OD2 3.26Å; R778-D780 IonicContact NE-OD1 3.8Å; R778-D780 PolarHBondContact NE-OD1 2.81Å; R778-D780 IonicContact NE-OD2 2.71Å; R778-D780 PolarHBondContact NE-OD2 3.43Å; R778-D780 IonicContact NH2-OD1 3.3Å; R778-D780 IonicContact NH2-OD2 3.44Å; R778-D780 PolarHBondContact NH2-OD2 2.85Å; R778-D780 PolarHBondContact O-N 3.34Å; D780-C782 PolarHBondContact O-N 2.76Å; D780-A783 PolarHBondContact O-N 3.32Å; D780-V784 PolarHBondContact O-N 3.15Å
781	A	91.6	Very high	88	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-66.9	-37	176.5	0	0	0	0	0	112	L712 L715 L773 R778 A783 V784 L785	L712-A781 HydrophobicContact CD2-CB 3.79Å; L715-A781 HydrophobicContact CD1-CB 4.34Å; L773-A781 HydrophobicContact CD1-CB 4.24Å; L773-A781 HydrophobicContact CD2-CB 4.04Å; R778-A781 HydrophobicContact CB-CB 3.93Å; R778-A781 PolarHBondContact O-N 2.78Å; A781-A783 VanDerWaalsContact C-N 3.32Å; A781-A783 PolarHBondContact O-N 2.81Å; A781-V784 PolarHBondContact O-N 2.62Å; A781-L785 PolarHBondContact O-N 3.15Å; A781-L785 VanDerWaalsContact O-N 3.16Å
782	C	91	Very high	86.7	Confident	13 Å²	13	62.5 Å²	62.5	9%	0.088	33%	0.326	C	S	.	.	H	α-helix	trans	-61.8	-39.6	174.6	-69	0	0	0	0	112.3	L770 L773 R774 R778 Q779 D780 L785 S786	L770-C782 HydrophobicContact CD1-CB 3.99Å; L773-C782 VanDerWaalsContact CB-SG 3.54Å; R774-C782 VanDerWaalsContact CG-SG 3.55Å; R774-C782 PolarHBondContact N-SG 2.86Å; R774-C782 VanDerWaalsContact N-SG 3.4Å; R778-C782 PolarHBondContact O-N 3.4Å; R778-C782 PolarHBondContact O-SG 3.17Å; Q779-C782 PolarHBondContact O-N 3.47Å; D780-C782 PolarHBondContact O-N 2.76Å; C782-L785 PolarHBondContact O-N 3.3Å; C782-S786 VanDerWaalsContact O-CB 3.23Å; C782-S786 WeakPolarHBondContact O-CB 3.26Å; C782-S786 PolarHBondContact O-N 3.43Å; C782-S786 PolarHBondContact O-OG 3.21Å
783	A	91.1	Very high	86.4	Confident	64 Å²	64	64 Å²	64	53%	0.529	34%	0.335	S	S	.	.	H	α-helix	trans	-64.2	-41.7	178.4	0	0	0	0	0	111.6	Q779 D780 A781 G787	Q779-A783 WeakPolarHBondContact O-CB 3.36Å; Q779-A783 PolarHBondContact O-N 3.11Å; D780-A783 PolarHBondContact O-N 3.32Å; A781-A783 VanDerWaalsContact C-N 3.32Å; A781-A783 PolarHBondContact O-N 2.81Å; A783-G787 PolarHBondContact O-N 3.13Å
784	V	91.1	Very high	86.1	Confident	29 Å²	29	67.2 Å²	67.2	18%	0.176	35%	0.352	C	S	.	.	H	α-helix	trans	-58.5	-52.8	174.8	171.3	0	0	0	0	111	I708 Q711 L712 L715 D780 A781 G787 H788	I708-V784 HydrophobicContact CD1-CG1 4.02Å; I708-V784 HydrophobicContact CG2-CG1 4.03Å; Q711-V784 HydrophobicContact CB-CG1 3.99Å; Q711-V784 HydrophobicContact CB-CG2 4.44Å; L712-V784 HydrophobicContact CD2-CB 4.36Å; L712-V784 HydrophobicContact CD2-CG1 4.26Å; L712-V784 HydrophobicContact CG-CG1 4.33Å; L715-V784 HydrophobicContact CD1-CG2 4.19Å; D780-V784 PolarHBondContact O-N 3.15Å; A781-V784 PolarHBondContact O-N 2.62Å; V784-G787 PolarHBondContact O-N 3.17Å; V784-H788 PolarHBondContact O-N 2.79Å; V784-H788 VanDerWaalsContact O-N 3.1Å
785	L	89.4	Confident	85.8	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-68.3	-38.3	-178.3	-175.9	62.5	0	0	0	112.6	L704 F766 L769 L770 L773 A781 C782 G787 H788 L789	L704-L785 HydrophobicContact CD2-CD1 3.78Å; F766-L785 HydrophobicContact CD1-CD1 4.41Å; L769-L785 HydrophobicContact CB-CD2 4.08Å; L769-L785 HydrophobicContact CD2-CD2 3.93Å; L769-L785 HydrophobicContact CG-CD2 3.84Å; L770-L785 HydrophobicContact CB-CD2 3.87Å; L770-L785 HydrophobicContact CD1-CB 4.36Å; L770-L785 HydrophobicContact CD1-CD2 4.22Å; L773-L785 HydrophobicContact CD1-CB 4.24Å; L773-L785 HydrophobicContact CD1-CD2 3.87Å; A781-L785 PolarHBondContact O-N 3.15Å; A781-L785 VanDerWaalsContact O-N 3.16Å; C782-L785 PolarHBondContact O-N 3.3Å; L785-G787 VanDerWaalsContact C-N 3.34Å; L785-H788 PolarHBondContact O-N 3.47Å; L785-L789 HydrophobicContact CG-CD1 4.36Å; L785-L789 PolarHBondContact O-N 2.82Å
786	S	87.6	Confident	85.5	Confident	33 Å²	33	59.8 Å²	59.8	23%	0.231	34%	0.336	C	S	.	.	H	α-helix	trans	-65.7	-38.8	176.4	-55.9	0	0	0	0	111.4	L770 C782 H788 L789 N790	L770-S786 WeakPolarHBondContact CD1-OG 3.46Å; C782-S786 VanDerWaalsContact O-CB 3.23Å; C782-S786 WeakPolarHBondContact O-CB 3.26Å; C782-S786 PolarHBondContact O-N 3.43Å; C782-S786 PolarHBondContact O-OG 3.21Å; S786-H788 VanDerWaalsContact C-N 3.31Å; S786-H788 PolarHBondContact O-N 3.49Å; S786-L789 PolarHBondContact O-N 3.3Å; S786-N790 VanDerWaalsContact O-CG 3.23Å; S786-N790 PolarHBondContact O-N 2.93Å; S786-N790 PolarHBondContact O-ND2 3.05Å
787	G	84.3	Confident	85.2	Confident	42 Å²	42	63.5 Å²	63.5	43%	0.433	36%	0.357	S	S	.	.	H	α-helix	trans	-60.4	-41.2	173.3	0	0	0	0	0	112.1	A783 V784 L785 N790 S791	A783-G787 PolarHBondContact O-N 3.13Å; V784-G787 PolarHBondContact O-N 3.17Å; L785-G787 VanDerWaalsContact C-N 3.34Å; G787-N790 PolarHBondContact O-N 3.43Å; G787-S791 PolarHBondContact O-N 2.98Å
788	H	81.5	Confident	84.8	Confident	21 Å²	21	56.1 Å²	56.1	10%	0.097	33%	0.33	C	S	.	.	H	α-helix	trans	-65.4	-44.7	173.9	-174.5	50.4	0	0	0	112.6	I708 V784 L785 S786 N790 S791 L792	I708-H788 HydrophobicContact CD1-CB 3.94Å; I708-H788 HydrophobicContact CG1-CB 4.05Å; V784-H788 PolarHBondContact O-N 2.79Å; V784-H788 VanDerWaalsContact O-N 3.1Å; L785-H788 PolarHBondContact O-N 3.47Å; S786-H788 VanDerWaalsContact C-N 3.31Å; S786-H788 PolarHBondContact O-N 3.49Å; H788-N790 VanDerWaalsContact C-N 3.28Å; H788-N790 PolarHBondContact O-N 2.81Å; H788-S791 WeakPolarHBondContact CA-OG 3.29Å; H788-S791 WeakPolarHBondContact O-CA 3.33Å; H788-S791 WeakPolarHBondContact O-CB 3.42Å; H788-S791 PolarHBondContact O-N 2.89Å; H788-S791 PolarHBondContact O-OG 3.16Å; H788-L792 PolarHBondContact O-N 2.94Å
789	L	80.6	Confident	84.6	Confident	41 Å²	41	58.5 Å²	58.5	22%	0.215	35%	0.347	C	S	.	.	H	α-helix	trans	-63.2	-32.9	177.9	-77.1	169.2	0	0	0	113.2	F766 L770 L785 S786 S791 L792	F766-L789 HydrophobicContact CB-CD1 4.19Å; F766-L789 HydrophobicContact CB-CD2 3.66Å; F766-L789 HydrophobicContact CB-CG 4.33Å; F766-L789 HydrophobicContact CD2-CD2 4.07Å; F766-L789 HydrophobicContact CG-CD2 4.02Å; L770-L789 HydrophobicContact CD2-CD1 4.34Å; L785-L789 HydrophobicContact CG-CD1 4.36Å; L785-L789 PolarHBondContact O-N 2.82Å; S786-L789 PolarHBondContact O-N 3.3Å; L789-S791 VanDerWaalsContact C-N 3.25Å; L789-S791 PolarHBondContact O-N 2.77Å; L789-L792 HydrophobicContact CD2-CD1 4.28Å
790	N	78.3	Confident	84.3	Confident	140 Å²	140	49.9 Å²	49.9	75%	0.749	31%	0.313	S	S	*	.	H	α-helix	trans	-73.8	-17.4	173.2	-68.8	-20.7	0	0	0	113.1	S786 G787 H788	S786-N790 VanDerWaalsContact O-CG 3.23Å; S786-N790 PolarHBondContact O-N 2.93Å; S786-N790 PolarHBondContact O-ND2 3.05Å; G787-N790 PolarHBondContact O-N 3.43Å; H788-N790 VanDerWaalsContact C-N 3.28Å; H788-N790 PolarHBondContact O-N 2.81Å
791	S	73.5	Confident	83.6	Confident	87 Å²	87	48.5 Å²	48.5	61%	0.608	31%	0.309	S	S	*	.	H	α-helix	trans	-90.1	-15.8	178	73.6	0	0	0	0	113.8	G787 H788 L789	G787-S791 PolarHBondContact O-N 2.98Å; H788-S791 WeakPolarHBondContact CA-OG 3.29Å; H788-S791 WeakPolarHBondContact O-CA 3.33Å; H788-S791 WeakPolarHBondContact O-CB 3.42Å; H788-S791 PolarHBondContact O-N 2.89Å; H788-S791 PolarHBondContact O-OG 3.16Å; L789-S791 VanDerWaalsContact C-N 3.25Å; L789-S791 PolarHBondContact O-N 2.77Å
792	L	63.5	Low	82.9	Confident	112 Å²	112	52.9 Å²	52.9	59%	0.586	34%	0.337	S	S	*	.			trans	-82.6	0	171.2	-69.6	168.2	0	0	0	109.1	Y366 F766 H788 L789	Y366-L792 PolarHBondContact OH-O 2.82Å; F766-L792 HydrophobicContact CE2-CD1 4.39Å; H788-L792 PolarHBondContact O-N 2.94Å; L789-L792 HydrophobicContact CD2-CD1 4.28Å

Retrieved 792 of 792 residues in 343.1 ms (Link to these results)

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