A0A5K4F6W8_SCHMA Loading...

Putative anosmin

AlphaFold DB , UniProt , Accession A0A5K4F6W8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 789 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	54.7	Low	57.4	Low	220 Å²	220	147 Å²	147	100%	1.084	69%	0.686	S	S	*	*				0	-47.4	0	-88.2	-179	165.2	0	0	114.9	M3 N4	M1-M3 VanDerWaalsContact C-N 3.35Å; M1-M3 PolarHBondContact O-N 3.28Å; M1-N4 PolarHBondContact O-N 2.84Å
2	K	51.3	Low	58	Low	192 Å²	192	148.7 Å²	148.7	84%	0.835	68%	0.684	S	S	*	*	H	α-helix	trans	-58.9	-35.7	-178.4	-88.8	-179.9	174.9	176.9	0	115.1	R5	K2-R5 PolarHBondContact O-N 2.73Å
3	M	51.8	Low	59	Low	149 Å²	149	142.7 Å²	142.7	73%	0.734	67%	0.669	S	S	*	*	H	α-helix	trans	-69.8	-34.6	-176.9	-157.3	152.7	79	0	0	113.7	M1 R5 L6 L7	M1-M3 VanDerWaalsContact C-N 3.35Å; M1-M3 PolarHBondContact O-N 3.28Å; M3-R5 VanDerWaalsContact C-N 3.34Å; M3-R5 PolarHBondContact O-N 3.48Å; M3-L6 PolarHBondContact O-N 2.84Å; M3-L7 PolarHBondContact O-N 2.64Å
4	N	59.4	Low	60.1	Low	122 Å²	122	143.2 Å²	143.2	65%	0.652	67%	0.668	S	S	*	*	H	α-helix	trans	-68.2	-31.2	177.2	-81.9	-4.7	0	0	0	112.8	M1 H8	M1-N4 PolarHBondContact O-N 2.84Å; N4-H8 PolarHBondContact O-N 2.81Å; N4-H8 VanDerWaalsContact O-N 3.11Å
5	R	57.5	Low	61.2	Low	206 Å²	206	144.5 Å²	144.5	78%	0.777	67%	0.671	S	S	*	*	H	α-helix	trans	-67.7	-37.4	175.9	-107.4	-177.7	178.3	178.9	0.1	112.3	K2 M3 H8 N9	K2-R5 PolarHBondContact O-N 2.73Å; M3-R5 VanDerWaalsContact C-N 3.34Å; M3-R5 PolarHBondContact O-N 3.48Å; R5-H8 PolarHBondContact O-N 3.32Å; R5-N9 PolarHBondContact O-N 3.09Å; R5-N9 VanDerWaalsContact O-N 3.08Å
6	L	54	Low	62.3	Low	115 Å²	115	142.6 Å²	142.6	60%	0.602	67%	0.666	S	S	*	*	H	α-helix	trans	-66.7	-45.2	177	-106.6	123.6	0	0	0	111.9	M3 H8 N9 I10	M3-L6 PolarHBondContact O-N 2.84Å; L6-H8 VanDerWaalsContact C-N 3.32Å; L6-H8 PolarHBondContact O-N 2.91Å; L6-N9 PolarHBondContact O-N 2.91Å; L6-I10 WeakPolarHBondContact O-CG1 3.16Å; L6-I10 PolarHBondContact O-N 3.28Å
7	L	57.9	Low	63.2	Low	97 Å²	97	138.1 Å²	138.1	51%	0.508	65%	0.651	S	S	.	*	H	α-helix	trans	-63.1	-36.8	176.7	-86.4	151.3	0	0	0	112.7	M3 R11	M3-L7 PolarHBondContact O-N 2.64Å; L7-R11 PolarHBondContact O-N 3.31Å; L7-R11 VanDerWaalsContact O-N 3.1Å
8	H	58.1	Low	64.3	Low	117 Å²	117	136.6 Å²	136.6	54%	0.542	65%	0.647	S	S	.	*	H	α-helix	trans	-66.4	-43.4	174.8	-116	57.3	0	0	0	112.4	N4 R5 L6 I10 R11 Y12	N4-H8 PolarHBondContact O-N 2.81Å; N4-H8 VanDerWaalsContact O-N 3.11Å; R5-H8 PolarHBondContact O-N 3.32Å; L6-H8 VanDerWaalsContact C-N 3.32Å; L6-H8 PolarHBondContact O-N 2.91Å; H8-I10 PolarHBondContact O-N 3.32Å; H8-R11 PolarHBondContact O-N 2.9Å; H8-Y12 PolarHBondContact O-N 3.39Å
9	N	59.3	Low	65.3	Low	118 Å²	118	135.1 Å²	135.1	63%	0.631	64%	0.643	S	S	*	*	H	α-helix	trans	-65.1	-38.8	177.7	-82.4	-10.5	0	0	0	112.5	R5 L6 Y12 S13	R5-N9 PolarHBondContact O-N 3.09Å; R5-N9 VanDerWaalsContact O-N 3.08Å; L6-N9 PolarHBondContact O-N 2.91Å; N9-Y12 PolarHBondContact O-N 3.24Å; N9-S13 WeakPolarHBondContact O-CB 3.06Å; N9-S13 PolarHBondContact O-N 3Å
10	I	64.7	Low	66.2	Low	91 Å²	91	133.6 Å²	133.6	47%	0.467	64%	0.638	S	S	.	*	H	α-helix	trans	-66	-43	176.8	-66.4	165	0	0	0	110.8	L6 H8 S13 F14	L6-I10 WeakPolarHBondContact O-CG1 3.16Å; L6-I10 PolarHBondContact O-N 3.28Å; H8-I10 PolarHBondContact O-N 3.32Å; I10-S13 PolarHBondContact O-N 2.83Å; I10-F14 HydrophobicContact CG2-CD2 4.37Å; I10-F14 PolarHBondContact O-N 3.34Å
11	R	62.6	Low	67.2	Low	190 Å²	190	132.1 Å²	132.1	72%	0.717	63%	0.633	S	S	*	*	H	α-helix	trans	-64.8	-38.8	176.5	-86.6	-174.6	171.5	-179.7	-0.5	113	L7 H8 K15	L7-R11 PolarHBondContact O-N 3.31Å; L7-R11 VanDerWaalsContact O-N 3.1Å; H8-R11 PolarHBondContact O-N 2.9Å; R11-K15 PolarHBondContact O-N 3.02Å
12	Y	65	Low	68.6	Low	167 Å²	167	127.7 Å²	127.7	66%	0.655	61%	0.61	S	S	*	*	H	α-helix	trans	-66.9	-41.5	175.2	-100.8	-86.2	0	0	0	111.9	H8 N9 F14 K15 L16	H8-Y12 PolarHBondContact O-N 3.39Å; N9-Y12 PolarHBondContact O-N 3.24Å; Y12-F14 PolarHBondContact O-N 3.38Å; Y12-K15 PolarHBondContact O-N 3.16Å; Y12-L16 WeakPolarHBondContact O-CB 2.92Å; Y12-L16 PolarHBondContact O-N 3.06Å
13	S	71.2	Confident	70.4	Confident	71 Å²	71	122.2 Å²	122.2	50%	0.497	59%	0.592	S	S	.	*	H	α-helix	trans	-61.8	-43.3	176.8	-178.5	0	0	0	0	111.7	N9 I10 L16 T17	N9-S13 WeakPolarHBondContact O-CB 3.06Å; N9-S13 PolarHBondContact O-N 3Å; I10-S13 PolarHBondContact O-N 2.83Å; S13-L16 PolarHBondContact O-N 3.25Å; S13-T17 WeakPolarHBondContact O-CG2 3.47Å; S13-T17 PolarHBondContact O-N 2.98Å; S13-T17 PolarHBondContact O-OG1 3.14Å; S13-T17 VanDerWaalsContact O-OG1 3.11Å
14	F	73.5	Confident	71.9	Confident	150 Å²	150	119.7 Å²	119.7	66%	0.658	58%	0.581	S	S	*	*	H	α-helix	trans	-66.2	-39.1	176.2	-106.9	-85.8	0	0	0	113.6	I10 Y12 L16 T17 L18	I10-F14 HydrophobicContact CG2-CD2 4.37Å; I10-F14 PolarHBondContact O-N 3.34Å; Y12-F14 PolarHBondContact O-N 3.38Å; F14-L16 VanDerWaalsContact C-N 3.34Å; F14-T17 WeakPolarHBondContact CA-OG1 3.44Å; F14-T17 PolarHBondContact O-OG1 3.33Å; F14-L18 WeakPolarHBondContact O-CB 3.41Å; F14-L18 PolarHBondContact O-N 3.45Å; F14-L18 VanDerWaalsContact O-N 3.1Å
15	K	77	Confident	73.1	Confident	163 Å²	163	117.7 Å²	117.7	71%	0.709	57%	0.573	S	S	*	*	H	α-helix	trans	-65.8	-39.1	174.7	-86.7	-172.3	172.7	-172.1	0	111.8	R11 Y12 L19	R11-K15 PolarHBondContact O-N 3.02Å; Y12-K15 PolarHBondContact O-N 3.16Å; K15-L19 WeakPolarHBondContact O-CB 3.48Å; K15-L19 PolarHBondContact O-N 3.5Å
16	L	78.5	Confident	74.1	Confident	114 Å²	114	113.3 Å²	113.3	60%	0.597	56%	0.564	S	S	*	*	H	α-helix	trans	-68.4	-41.4	-179.9	-160.7	77.4	0	0	0	111.5	Y12 S13 F14 L19 L20	Y12-L16 WeakPolarHBondContact O-CB 2.92Å; Y12-L16 PolarHBondContact O-N 3.06Å; S13-L16 PolarHBondContact O-N 3.25Å; F14-L16 VanDerWaalsContact C-N 3.34Å; L16-L19 PolarHBondContact O-N 2.97Å; L16-L20 WeakPolarHBondContact O-CB 3.37Å; L16-L20 PolarHBondContact O-N 2.99Å
17	T	78.5	Confident	75.2	Confident	66 Å²	66	112.4 Å²	112.4	41%	0.405	56%	0.56	S	S	.	*	H	α-helix	trans	-67	-39	176.7	49.5	0	0	0	0	112.2	S13 F14 L20 I21	S13-T17 WeakPolarHBondContact O-CG2 3.47Å; S13-T17 PolarHBondContact O-N 2.98Å; S13-T17 PolarHBondContact O-OG1 3.14Å; S13-T17 VanDerWaalsContact O-OG1 3.11Å; F14-T17 WeakPolarHBondContact CA-OG1 3.44Å; F14-T17 PolarHBondContact O-OG1 3.33Å; T17-L20 PolarHBondContact O-N 3.02Å; T17-I21 VanDerWaalsContact O-CG1 3.3Å; T17-I21 WeakPolarHBondContact O-CG1 3.13Å; T17-I21 PolarHBondContact O-N 3.1Å
18	L	82.2	Confident	75.9	Confident	110 Å²	110	112 Å²	112	58%	0.576	56%	0.557	S	S	*	*	H	α-helix	trans	-64.7	-42.8	176.2	-157.1	78.7	0	0	0	111.7	F14 L20 I21 E22	F14-L18 WeakPolarHBondContact O-CB 3.41Å; F14-L18 PolarHBondContact O-N 3.45Å; F14-L18 VanDerWaalsContact O-N 3.1Å; L18-L20 VanDerWaalsContact C-N 3.33Å; L18-L20 PolarHBondContact O-N 2.9Å; L18-I21 PolarHBondContact O-N 2.79Å; L18-E22 PolarHBondContact O-N 3.12Å
19	L	84.4	Confident	76.5	Confident	109 Å²	109	110.1 Å²	110.1	57%	0.571	55%	0.553	S	S	*	*	H	α-helix	trans	-64.2	-38.9	176.8	-152.5	103.7	0	0	0	111.7	K15 L16 E22 V23	K15-L19 WeakPolarHBondContact O-CB 3.48Å; K15-L19 PolarHBondContact O-N 3.5Å; L16-L19 PolarHBondContact O-N 2.97Å; L19-E22 PolarHBondContact O-N 2.83Å; L19-V23 VanDerWaalsContact O-CG2 3.27Å; L19-V23 WeakPolarHBondContact O-CG2 3.44Å; L19-V23 PolarHBondContact O-N 3.21Å
20	L	83.2	Confident	76.8	Confident	104 Å²	104	107.8 Å²	107.8	55%	0.545	54%	0.541	S	S	.	.	H	α-helix	trans	-63.6	-42.1	175.5	-114.1	138	0	0	0	111.6	L16 T17 L18 V23 L24	L16-L20 WeakPolarHBondContact O-CB 3.37Å; L16-L20 PolarHBondContact O-N 2.99Å; T17-L20 PolarHBondContact O-N 3.02Å; L18-L20 VanDerWaalsContact C-N 3.33Å; L18-L20 PolarHBondContact O-N 2.9Å; L20-V23 PolarHBondContact O-N 2.74Å; L20-L24 WeakPolarHBondContact O-CB 3.11Å; L20-L24 PolarHBondContact O-N 2.81Å
21	I	85.4	Confident	76.6	Confident	103 Å²	103	107.6 Å²	107.6	53%	0.528	54%	0.543	S	S	.	.	H	α-helix	trans	-64.8	-44.2	176.7	-69	163.4	0	0	0	110.6	T17 L18 V23 L24 V25	T17-I21 VanDerWaalsContact O-CG1 3.3Å; T17-I21 WeakPolarHBondContact O-CG1 3.13Å; T17-I21 PolarHBondContact O-N 3.1Å; L18-I21 PolarHBondContact O-N 2.79Å; I21-V23 PolarHBondContact O-N 2.75Å; I21-L24 PolarHBondContact O-N 2.95Å; I21-V25 HydrophobicContact CG2-CG2 4.35Å; I21-V25 WeakPolarHBondContact O-CG2 3.48Å; I21-V25 PolarHBondContact O-N 3.03Å
22	E	85.5	Confident	75.9	Confident	128 Å²	128	105.4 Å²	105.4	60%	0.598	54%	0.541	S	S	*	.	H	α-helix	trans	-61.6	-43.5	176.5	-77	-166.3	171.1	0	0	112.1	L18 L19 L24 V25 L26	L18-E22 PolarHBondContact O-N 3.12Å; L19-E22 PolarHBondContact O-N 2.83Å; E22-L24 VanDerWaalsContact C-N 3.31Å; E22-L24 PolarHBondContact O-N 3.1Å; E22-V25 PolarHBondContact O-N 2.76Å; E22-L26 WeakPolarHBondContact O-CB 3.43Å; E22-L26 PolarHBondContact O-N 2.79Å
23	V	88.1	Confident	75.1	Confident	77 Å²	77	102 Å²	102	47%	0.467	54%	0.541	S	S	.	.	H	α-helix	trans	-62.9	-38.6	175.7	171.6	0	0	0	0	111.3	L19 L20 I21 L26 L27	L19-V23 VanDerWaalsContact O-CG2 3.27Å; L19-V23 WeakPolarHBondContact O-CG2 3.44Å; L19-V23 PolarHBondContact O-N 3.21Å; L20-V23 PolarHBondContact O-N 2.74Å; I21-V23 PolarHBondContact O-N 2.75Å; V23-L26 PolarHBondContact O-N 2.81Å; V23-L27 HydrophobicContact CG1-CD1 3.99Å; V23-L27 WeakPolarHBondContact O-CB 3.12Å; V23-L27 WeakPolarHBondContact O-CG 3.33Å; V23-L27 PolarHBondContact O-N 2.83Å
24	L	84.7	Confident	73.7	Confident	96 Å²	96	105.2 Å²	105.2	50%	0.503	55%	0.548	S	S	.	.	H	α-helix	trans	-69.9	-40.5	179.2	-136.5	145.2	0	0	0	111.7	L20 I21 E22 L27 I28	L20-L24 WeakPolarHBondContact O-CB 3.11Å; L20-L24 PolarHBondContact O-N 2.81Å; I21-L24 PolarHBondContact O-N 2.95Å; E22-L24 VanDerWaalsContact C-N 3.31Å; E22-L24 PolarHBondContact O-N 3.1Å; L24-L27 PolarHBondContact O-N 3.01Å; L24-I28 HydrophobicContact CD2-CD1 3.78Å; L24-I28 HydrophobicContact CD2-CG1 4.38Å; L24-I28 VanDerWaalsContact O-CG1 3.25Å; L24-I28 WeakPolarHBondContact O-CG1 3.43Å; L24-I28 PolarHBondContact O-N 2.7Å
25	V	82.9	Confident	72.1	Confident	80 Å²	80	103.6 Å²	103.6	49%	0.485	55%	0.545	S	S	.	.	H	α-helix	trans	-64.9	-42.8	172.6	172.8	0	0	0	0	110.4	I21 E22 L27 I28 V29	I21-V25 HydrophobicContact CG2-CG2 4.35Å; I21-V25 WeakPolarHBondContact O-CG2 3.48Å; I21-V25 PolarHBondContact O-N 3.03Å; E22-V25 PolarHBondContact O-N 2.76Å; V25-L27 VanDerWaalsContact C-N 3.32Å; V25-L27 PolarHBondContact O-N 3.39Å; V25-I28 PolarHBondContact O-N 2.79Å; V25-V29 HydrophobicContact CG1-CG2 4.3Å; V25-V29 WeakPolarHBondContact O-CB 2.84Å; V25-V29 VanDerWaalsContact O-CG2 3.27Å; V25-V29 WeakPolarHBondContact O-CG2 3.26Å; V25-V29 PolarHBondContact O-N 2.89Å
26	L	79.9	Confident	70.3	Confident	114 Å²	114	98.6 Å²	98.6	60%	0.597	53%	0.53	S	S	*	.	H	α-helix	trans	-61.7	-42.3	176.3	-144.5	94.3	0	0	0	111	E22 V23 V29 I30	E22-L26 WeakPolarHBondContact O-CB 3.43Å; E22-L26 PolarHBondContact O-N 2.79Å; V23-L26 PolarHBondContact O-N 2.81Å; L26-V29 PolarHBondContact O-N 3.21Å; L26-I30 HydrophobicContact CD2-CD1 4.01Å; L26-I30 HydrophobicContact CG-CD1 4.26Å; L26-I30 WeakPolarHBondContact O-CB 3.18Å; L26-I30 WeakPolarHBondContact O-CD1 3.38Å; L26-I30 WeakPolarHBondContact O-CG1 3.17Å; L26-I30 PolarHBondContact O-N 2.78Å
27	L	76.5	Confident	68.5	Low	96 Å²	96	99.5 Å²	99.5	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-63.7	-43.3	175	-79.9	165.7	0	0	0	111.9	V23 L24 V25 I30 V31	V23-L27 HydrophobicContact CG1-CD1 3.99Å; V23-L27 WeakPolarHBondContact O-CB 3.12Å; V23-L27 WeakPolarHBondContact O-CG 3.33Å; V23-L27 PolarHBondContact O-N 2.83Å; L24-L27 PolarHBondContact O-N 3.01Å; V25-L27 VanDerWaalsContact C-N 3.32Å; V25-L27 PolarHBondContact O-N 3.39Å; L27-I30 PolarHBondContact O-N 3.25Å; L27-V31 WeakPolarHBondContact O-CB 3.3Å; L27-V31 WeakPolarHBondContact O-CG2 3.32Å; L27-V31 PolarHBondContact O-N 3.2Å
28	I	72.8	Confident	66.7	Low	88 Å²	88	102.3 Å²	102.3	45%	0.451	55%	0.548	S	S	.	.	H	α-helix	trans	-63.6	-43.1	176.7	-68.9	164.1	0	0	0	110.6	L24 V25 V31 H32	L24-I28 HydrophobicContact CD2-CD1 3.78Å; L24-I28 HydrophobicContact CD2-CG1 4.38Å; L24-I28 VanDerWaalsContact O-CG1 3.25Å; L24-I28 WeakPolarHBondContact O-CG1 3.43Å; L24-I28 PolarHBondContact O-N 2.7Å; V25-I28 PolarHBondContact O-N 2.79Å; I28-V31 PolarHBondContact O-N 3.2Å; I28-H32 WeakPolarHBondContact O-CB 3.32Å; I28-H32 PolarHBondContact O-N 3.28Å; I28-H32 PolarHBondContact O-ND1 3.43Å
29	V	70.1	Confident	64.6	Low	77 Å²	77	101.8 Å²	101.8	47%	0.467	54%	0.544	S	S	.	.	H	α-helix	trans	-65.9	-40.9	177.1	172.1	0	0	0	0	110.8	V25 L26 H32 C33	V25-V29 HydrophobicContact CG1-CG2 4.3Å; V25-V29 WeakPolarHBondContact O-CB 2.84Å; V25-V29 VanDerWaalsContact O-CG2 3.27Å; V25-V29 WeakPolarHBondContact O-CG2 3.26Å; V25-V29 PolarHBondContact O-N 2.89Å; L26-V29 PolarHBondContact O-N 3.21Å; V29-H32 PolarHBondContact O-N 3.39Å; V29-C33 WeakPolarHBondContact O-CB 3.48Å; V29-C33 PolarHBondContact O-N 3.14Å
30	I	65.4	Low	62.7	Low	70 Å²	70	98.7 Å²	98.7	36%	0.359	53%	0.532	S	S	.	.	H	α-helix	trans	-64.1	-44.2	175	-69.2	162.5	0	0	0	109.9	L26 L27 Q34	L26-I30 HydrophobicContact CD2-CD1 4.01Å; L26-I30 HydrophobicContact CG-CD1 4.26Å; L26-I30 WeakPolarHBondContact O-CB 3.18Å; L26-I30 WeakPolarHBondContact O-CD1 3.38Å; L26-I30 WeakPolarHBondContact O-CG1 3.17Å; L26-I30 PolarHBondContact O-N 2.78Å; L27-I30 PolarHBondContact O-N 3.25Å; I30-Q34 HydrophobicContact CG2-CG 4.12Å; I30-Q34 WeakPolarHBondContact O-CA 3.22Å; I30-Q34 WeakPolarHBondContact O-CB 3.36Å; I30-Q34 VanDerWaalsContact O-CG 3.28Å; I30-Q34 WeakPolarHBondContact O-CG 3.31Å; I30-Q34 PolarHBondContact O-N 3.12Å
31	V	60.3	Low	61.3	Low	86 Å²	86	96 Å²	96	52%	0.521	52%	0.52	S	S	.	.	H	α-helix	trans	-65.3	-42.1	178.7	171.6	0	0	0	0	111.6	L27 I28 L35	L27-V31 WeakPolarHBondContact O-CB 3.3Å; L27-V31 WeakPolarHBondContact O-CG2 3.32Å; L27-V31 PolarHBondContact O-N 3.2Å; I28-V31 PolarHBondContact O-N 3.2Å; V31-L35 PolarHBondContact O-N 2.7Å
32	H	49.4	Very low	59.8	Low	145 Å²	145	94.1 Å²	94.1	67%	0.671	52%	0.515	S	S	*	.	H	α-helix	trans	-76.4	-33.7	179.3	-84.3	53.9	0	0	0	113.3	I28 V29	I28-H32 WeakPolarHBondContact O-CB 3.32Å; I28-H32 PolarHBondContact O-N 3.28Å; I28-H32 PolarHBondContact O-ND1 3.43Å; V29-H32 PolarHBondContact O-N 3.39Å
33	C	47.7	Very low	58.5	Low	96 Å²	96	96.3 Å²	96.3	65%	0.649	52%	0.518	S	S	*	.	H	α-helix	trans	-81.7	-26.2	176.2	-74.2	0	0	0	0	112.8	V29	V29-C33 WeakPolarHBondContact O-CB 3.48Å; V29-C33 PolarHBondContact O-N 3.14Å
34	Q	41.9	Very low	57.7	Low	138 Å²	138	97.7 Å²	97.7	65%	0.645	52%	0.521	S	S	*	.	H	α-helix	trans	-89.3	-10.5	178.1	-68.4	-163	-29	0	0	114.5	I30 P36	I30-Q34 HydrophobicContact CG2-CG 4.12Å; I30-Q34 WeakPolarHBondContact O-CA 3.22Å; I30-Q34 WeakPolarHBondContact O-CB 3.36Å; I30-Q34 VanDerWaalsContact O-CG 3.28Å; I30-Q34 WeakPolarHBondContact O-CG 3.31Å; I30-Q34 PolarHBondContact O-N 3.12Å; Q34-P36 WeakPolarHBondContact O-CD 3.02Å
35	L	39.2	Very low	57.4	Low	115 Å²	115	96.1 Å²	96.1	60%	0.602	51%	0.511	S	S	*	.			trans	-111.1	77.5	162.7	-89.5	85.1	0	0	0	110.8	V31 N37	V31-L35 PolarHBondContact O-N 2.7Å; L35-N37 PolarHBondContact O-N 2.85Å
36	P	39.2	Very low	57.1	Low	59 Å²	59	97 Å²	97	38%	0.383	51%	0.51	S	S	.	.			trans	-52	126.1	150.3	-11.6	24.1	0	0	0	107.1	Q34 D38 I39	Q34-P36 WeakPolarHBondContact O-CD 3.02Å; P36-D38 HydrophobicContact CB-CB 4.39Å; P36-D38 PolarHBondContact O-N 2.99Å; P36-I39 HydrophobicContact CB-CG1 4.33Å; P36-I39 HydrophobicContact CG-CD1 3.96Å; P36-I39 HydrophobicContact CG-CG1 4.07Å; P36-I39 PolarHBondContact O-N 2.72Å
37	N	42	Very low	57.3	Low	133 Å²	133	93.8 Å²	93.8	71%	0.711	49%	0.49	S	S	*	.	H	α-helix	trans	-48.6	-28.5	173.8	-79	-33.6	0	0	0	111.8	L35 I39 S40 T41	L35-N37 PolarHBondContact O-N 2.85Å; N37-I39 VanDerWaalsContact C-N 3.31Å; N37-I39 PolarHBondContact O-N 2.95Å; N37-S40 WeakPolarHBondContact O-CB 3.28Å; N37-S40 PolarHBondContact O-N 3.03Å; N37-S40 VanDerWaalsContact O-N 3.09Å; N37-S40 PolarHBondContact O-OG 2.86Å; N37-T41 PolarHBondContact O-N 2.93Å; N37-T41 PolarHBondContact O-OG1 2.93Å
38	D	40.4	Very low	57.8	Low	125 Å²	125	89.7 Å²	89.7	67%	0.668	47%	0.469	S	S	*	.	H	α-helix	trans	-56.2	-36.7	174.5	-74.8	-27.1	0	0	0	114.5	P36 S40 T41 S42	P36-D38 HydrophobicContact CB-CB 4.39Å; P36-D38 PolarHBondContact O-N 2.99Å; D38-S40 VanDerWaalsContact C-N 3.32Å; D38-S40 PolarHBondContact O-N 2.84Å; D38-T41 VanDerWaalsContact CA-OG1 3.29Å; D38-T41 WeakPolarHBondContact CA-OG1 3.23Å; D38-T41 PolarHBondContact O-N 3.09Å; D38-T41 PolarHBondContact O-OG1 3.24Å; D38-S42 VanDerWaalsContact O-CB 3.3Å; D38-S42 WeakPolarHBondContact O-CB 3.4Å; D38-S42 PolarHBondContact O-N 3.03Å
39	I	36.7	Very low	58.5	Low	99 Å²	99	86.9 Å²	86.9	51%	0.508	45%	0.453	S	S	.	.	H	α-helix	trans	-66.4	-41.5	177.3	-56.7	-176.2	0	0	0	109.5	P36 N37 S42 W43	P36-I39 HydrophobicContact CB-CG1 4.33Å; P36-I39 HydrophobicContact CG-CD1 3.96Å; P36-I39 HydrophobicContact CG-CG1 4.07Å; P36-I39 PolarHBondContact O-N 2.72Å; N37-I39 VanDerWaalsContact C-N 3.31Å; N37-I39 PolarHBondContact O-N 2.95Å; I39-S42 PolarHBondContact O-N 3.06Å; I39-W43 WeakPolarHBondContact O-CB 3.44Å; I39-W43 PolarHBondContact O-N 3.28Å
40	S	46.1	Very low	59.2	Low	44 Å²	44	83.7 Å²	83.7	31%	0.308	44%	0.435	S	S	.	.	H	α-helix	trans	-65.6	-41.7	179	79.9	0	0	0	0	111.3	N37 D38 M44	N37-S40 WeakPolarHBondContact O-CB 3.28Å; N37-S40 PolarHBondContact O-N 3.03Å; N37-S40 VanDerWaalsContact O-N 3.09Å; N37-S40 PolarHBondContact O-OG 2.86Å; D38-S40 VanDerWaalsContact C-N 3.32Å; D38-S40 PolarHBondContact O-N 2.84Å; S40-M44 WeakPolarHBondContact O-CB 3.33Å; S40-M44 WeakPolarHBondContact O-CE 3.34Å; S40-M44 WeakPolarHBondContact O-CG 3.43Å; S40-M44 PolarHBondContact O-N 3.45Å
41	T	52.3	Low	60.5	Low	48 Å²	48	83.5 Å²	83.5	29%	0.294	43%	0.43	S	S	.	.	H	α-helix	trans	-69.5	-41	178.8	52	0	0	0	0	111.9	N37 D38 M44 E45	N37-T41 PolarHBondContact O-N 2.93Å; N37-T41 PolarHBondContact O-OG1 2.93Å; D38-T41 VanDerWaalsContact CA-OG1 3.29Å; D38-T41 WeakPolarHBondContact CA-OG1 3.23Å; D38-T41 PolarHBondContact O-N 3.09Å; D38-T41 PolarHBondContact O-OG1 3.24Å; T41-M44 HydrophobicContact CG2-CE 4.07Å; T41-M44 PolarHBondContact O-N 3.04Å; T41-E45 PolarHBondContact O-N 3.24Å
42	S	55.3	Low	62	Low	62 Å²	62	79.4 Å²	79.4	43%	0.434	41%	0.405	S	S	.	.	H	α-helix	trans	-61.3	-48.6	176.4	-169.1	0	0	0	0	110.8	D38 I39 M44 E45 E46	D38-S42 VanDerWaalsContact O-CB 3.3Å; D38-S42 WeakPolarHBondContact O-CB 3.4Å; D38-S42 PolarHBondContact O-N 3.03Å; I39-S42 PolarHBondContact O-N 3.06Å; S42-M44 VanDerWaalsContact C-N 3.33Å; S42-M44 PolarHBondContact O-N 3.28Å; S42-E45 PolarHBondContact O-N 2.99Å; S42-E46 WeakPolarHBondContact O-CG 3.3Å; S42-E46 PolarHBondContact O-N 3.27Å
43	W	57	Low	63.8	Low	175 Å²	175	73.8 Å²	73.8	66%	0.663	38%	0.378	S	S	*	.	H	α-helix	trans	-63.5	-38.3	178.5	-175	74.8	0	0	0	112.3	I39 E46 R47	I39-W43 WeakPolarHBondContact O-CB 3.44Å; I39-W43 PolarHBondContact O-N 3.28Å; W43-E46 PolarHBondContact O-N 2.95Å; W43-R47 WeakPolarHBondContact O-CB 3.32Å; W43-R47 PolarHBondContact O-N 3.31Å
44	M	72.3	Confident	65.8	Low	106 Å²	106	69.2 Å²	69.2	52%	0.522	35%	0.347	S	S	.	.	H	α-helix	trans	-63.3	-39.4	174.6	-77.8	-171.7	-65.7	0	0	112.5	S40 T41 S42 L48	S40-M44 WeakPolarHBondContact O-CB 3.33Å; S40-M44 WeakPolarHBondContact O-CE 3.34Å; S40-M44 WeakPolarHBondContact O-CG 3.43Å; S40-M44 PolarHBondContact O-N 3.45Å; T41-M44 HydrophobicContact CG2-CE 4.07Å; T41-M44 PolarHBondContact O-N 3.04Å; S42-M44 VanDerWaalsContact C-N 3.33Å; S42-M44 PolarHBondContact O-N 3.28Å; M44-L48 WeakPolarHBondContact O-CB 3.39Å; M44-L48 PolarHBondContact O-N 3.15Å
45	E	77.9	Confident	68.3	Low	62 Å²	62	63.7 Å²	63.7	29%	0.29	32%	0.321	S	S	.	.	H	α-helix	trans	-70.5	-42.2	176.6	-74.4	-166.4	178.8	0	0	112.5	T41 S42 R47 L48 F49 R292 F304	T41-E45 PolarHBondContact O-N 3.24Å; S42-E45 PolarHBondContact O-N 2.99Å; E45-R47 VanDerWaalsContact C-N 3.34Å; E45-R47 PolarHBondContact O-N 3.39Å; E45-L48 WeakPolarHBondContact O-CA 3.31Å; E45-L48 VanDerWaalsContact O-CB 3.23Å; E45-L48 WeakPolarHBondContact O-CB 3.04Å; E45-L48 PolarHBondContact O-N 3.48Å; E45-L48 VanDerWaalsContact O-N 3.08Å; E45-F49 HydrophobicContact CB-CE2 4.26Å; E45-F49 WeakPolarHBondContact O-CD2 3.49Å; E45-F49 WeakPolarHBondContact O-CG 3.48Å; E45-F49 PolarHBondContact O-N 2.8Å; E45-R292 IonicContact OE1-CZ 2.8Å; E45-R292 IonicContact OE1-NH1 3.47Å; E45-R292 IonicContact OE1-NH2 3.32Å; E45-R292 PolarHBondContact OE1-NH2 2.81Å; E45-F304 HydrophobicContact CG-CE2 4.4Å
46	E	76	Confident	70.7	Confident	100 Å²	100	58.2 Å²	58.2	47%	0.467	29%	0.292	S	S	.	.	H	α-helix	trans	-58.2	-47.3	174.9	-75.5	174.3	-171.4	0	0	111.5	S42 W43 L48 F49 A50	S42-E46 WeakPolarHBondContact O-CG 3.3Å; S42-E46 PolarHBondContact O-N 3.27Å; W43-E46 PolarHBondContact O-N 2.95Å; E46-L48 VanDerWaalsContact C-N 3.26Å; E46-L48 PolarHBondContact O-N 2.84Å; E46-F49 PolarHBondContact O-N 3.09Å; E46-A50 PolarHBondContact O-N 3.06Å
47	R	84.1	Confident	73.1	Confident	45 Å²	45	56.4 Å²	56.4	17%	0.17	28%	0.279	C	S	.	.	H	α-helix	trans	-59.4	-40	174.4	175.6	58.5	-175.3	124.4	12	111.3	W43 E45 A50 R51 C104 D105 L106 I129	W43-R47 WeakPolarHBondContact O-CB 3.32Å; W43-R47 PolarHBondContact O-N 3.31Å; E45-R47 VanDerWaalsContact C-N 3.34Å; E45-R47 PolarHBondContact O-N 3.39Å; R47-A50 PolarHBondContact O-N 3.14Å; R47-R51 VanDerWaalsContact O-CG 3.28Å; R47-R51 WeakPolarHBondContact O-CG 3.31Å; R47-R51 PolarHBondContact O-N 3.08Å; R47-C104 PolarHBondContact NH1-O 2.82Å; R47-C104 PolarHBondContact NH2-O 2.87Å; R47-D105 VanDerWaalsContact NH2-C 3.28Å; R47-D105 PolarHBondContact NH2-O 2.76Å; R47-L106 PolarHBondContact NH2-O 3.3Å; R47-I129 VanDerWaalsContact NH1-CD1 3.35Å
48	L	88	Confident	75.4	Confident	11 Å²	11	50 Å²	50	6%	0.058	25%	0.245	C	C	.	.	H	α-helix	trans	-62.1	-42	177.7	-162.7	75.5	0	0	0	112.1	M44 E45 E46 R51 A52 I248 T269 M272 F304	M44-L48 WeakPolarHBondContact O-CB 3.39Å; M44-L48 PolarHBondContact O-N 3.15Å; E45-L48 WeakPolarHBondContact O-CA 3.31Å; E45-L48 VanDerWaalsContact O-CB 3.23Å; E45-L48 WeakPolarHBondContact O-CB 3.04Å; E45-L48 PolarHBondContact O-N 3.48Å; E45-L48 VanDerWaalsContact O-N 3.08Å; E46-L48 VanDerWaalsContact C-N 3.26Å; E46-L48 PolarHBondContact O-N 2.84Å; L48-R51 WeakPolarHBondContact O-CB 3.44Å; L48-R51 PolarHBondContact O-N 3.34Å; L48-A52 PolarHBondContact O-N 3.34Å; L48-I248 HydrophobicContact CD2-CD1 4.33Å; L48-I248 HydrophobicContact CD2-CG2 3.69Å; L48-I248 HydrophobicContact CG-CD1 4.15Å; L48-I248 HydrophobicContact CG-CG2 4.22Å; L48-T269 HydrophobicContact CD1-CG2 4.25Å; L48-T269 WeakPolarHBondContact CD1-OG1 3.28Å; L48-T269 VanDerWaalsContact CD2-OG1 3.31Å; L48-T269 WeakPolarHBondContact CD2-OG1 3.48Å; L48-M272 HydrophobicContact CD1-CE 3.1Å; L48-M272 HydrophobicContact CG-CE 3.69Å; L48-F304 HydrophobicContact CD2-CZ 3.96Å
49	F	87.6	Confident	77.8	Confident	29 Å²	29	45.1 Å²	45.1	13%	0.127	22%	0.219	C	C	.	.	H	α-helix	trans	-69.4	-38.8	176.3	-62.8	-44.6	0	0	0	112.4	E45 E46 R51 A52 R53 I248 A294 V296 T301 F304	E45-F49 HydrophobicContact CB-CE2 4.26Å; E45-F49 WeakPolarHBondContact O-CD2 3.49Å; E45-F49 WeakPolarHBondContact O-CG 3.48Å; E45-F49 PolarHBondContact O-N 2.8Å; E46-F49 PolarHBondContact O-N 3.09Å; F49-R51 VanDerWaalsContact C-N 3.32Å; F49-R51 PolarHBondContact O-N 3.37Å; F49-A52 PolarHBondContact O-N 3.21Å; F49-R53 WeakPolarHBondContact O-CG 3.2Å; F49-R53 PolarHBondContact O-N 3.19Å; F49-I248 HydrophobicContact CD1-CD1 3.61Å; F49-I248 HydrophobicContact CE1-CD1 3.93Å; F49-A294 HydrophobicContact CE1-CB 3.9Å; F49-V296 HydrophobicContact CD1-CG2 4.11Å; F49-T301 HydrophobicContact CB-CG2 4.07Å; F49-T301 HydrophobicContact CD1-CG2 3.71Å; F49-T301 HydrophobicContact CD2-CG2 3.93Å; F49-T301 HydrophobicContact CE1-CG2 4.09Å; F49-T301 HydrophobicContact CE2-CG2 4.28Å; F49-T301 HydrophobicContact CG-CG2 3.63Å; F49-T301 HydrophobicContact CZ-CG2 4.36Å; F49-F304 HydrophobicContact CE1-CD2 4.27Å; F49-F304 AromaticContact CE1-CE2 3.75Å; F49-F304 HydrophobicContact CE1-CE2 3.75Å; F49-F304 HydrophobicContact CE1-CZ 4Å; F49-F304 AromaticContact CZ-CD2 3.76Å; F49-F304 HydrophobicContact CZ-CD2 3.76Å; F49-F304 AromaticContact CZ-CE2 3.47Å; F49-F304 HydrophobicContact CZ-CE2 3.47Å; F49-F304 VanDerWaalsContact CZ-CE2 3.47Å; F49-F304 HydrophobicContact CZ-CZ 4.21Å
50	A	85	Confident	80.2	Confident	10 Å²	10	43.7 Å²	43.7	8%	0.083	21%	0.207	C	C	.	.	H	α-helix	trans	-58.5	-43.8	173.7	0	0	0	0	0	111.7	E46 R47 A52 R53 C54 I129	E46-A50 PolarHBondContact O-N 3.06Å; R47-A50 PolarHBondContact O-N 3.14Å; A50-A52 PolarHBondContact O-N 2.97Å; A50-R53 PolarHBondContact O-N 3.02Å; A50-C54 PolarHBondContact O-N 3.31Å; A50-I129 HydrophobicContact CB-CD1 4.33Å
51	R	91.1	Very high	82.1	Confident	66 Å²	66	42 Å²	42	25%	0.249	19%	0.194	C	C	.	.	H	α-helix	trans	-56.3	-48.1	174.2	-67.5	168.5	59.4	-171	-0.5	111.9	R47 L48 F49 C54 K55 C104 D105 M272	R47-R51 VanDerWaalsContact O-CG 3.28Å; R47-R51 WeakPolarHBondContact O-CG 3.31Å; R47-R51 PolarHBondContact O-N 3.08Å; L48-R51 WeakPolarHBondContact O-CB 3.44Å; L48-R51 PolarHBondContact O-N 3.34Å; F49-R51 VanDerWaalsContact C-N 3.32Å; F49-R51 PolarHBondContact O-N 3.37Å; R51-C54 PolarHBondContact O-N 2.84Å; R51-K55 WeakPolarHBondContact O-CG 3.29Å; R51-K55 PolarHBondContact O-N 2.92Å; R51-C104 WeakPolarHBondContact CG-O 3.22Å; R51-D105 IonicContact CZ-OD1 3.69Å; R51-D105 IonicContact NE-OD1 3Å; R51-D105 PolarHBondContact NE-OD1 2.8Å; R51-D105 VanDerWaalsContact NH2-CG 3.31Å; R51-D105 IonicContact NH2-OD1 2.89Å; R51-D105 PolarHBondContact NH2-OD1 2.98Å; R51-D105 IonicContact NH2-OD2 3.57Å; R51-M272 HydrophobicContact CB-CE 4.25Å; R51-M272 HydrophobicContact CB-SD 4.42Å
52	A	91.9	Very high	83.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67.2	-36.9	-179.5	0	0	0	0	0	112.6	L48 F49 A50 K55 A56 V246 I248 V296	L48-A52 PolarHBondContact O-N 3.34Å; F49-A52 PolarHBondContact O-N 3.21Å; A50-A52 PolarHBondContact O-N 2.97Å; A52-K55 PolarHBondContact O-N 3.36Å; A52-A56 PolarHBondContact O-N 3.44Å; A52-V246 HydrophobicContact CB-CB 4.29Å; A52-V246 HydrophobicContact CB-CG1 3.96Å; A52-I248 HydrophobicContact CB-CD1 3.76Å; A52-I248 HydrophobicContact CB-CG1 3.99Å; A52-V296 HydrophobicContact CB-CB 3.79Å; A52-V296 HydrophobicContact CB-CG1 3.86Å; A52-V296 HydrophobicContact CB-CG2 3.78Å
53	R	87.8	Confident	85.1	Confident	27 Å²	27	42.4 Å²	42.4	10%	0.102	19%	0.189	C	C	.	.	H	α-helix	trans	-63.7	-42.1	172.9	-70.6	175.4	69.3	-152.8	-2	111.9	F49 A50 A56 N57 T132 N135 P137 V296 S297 I298	F49-R53 WeakPolarHBondContact O-CG 3.2Å; F49-R53 PolarHBondContact O-N 3.19Å; A50-R53 PolarHBondContact O-N 3.02Å; R53-A56 PolarHBondContact O-N 3.4Å; R53-N57 PolarHBondContact O-N 3.27Å; R53-N57 PolarHBondContact O-ND2 3.43Å; R53-N57 VanDerWaalsContact O-ND2 3.16Å; R53-T132 HydrophobicContact CB-CG2 4.06Å; R53-T132 PolarHBondContact NH1-O 3.33Å; R53-N135 PolarHBondContact NH2-O 2.98Å; R53-P137 VanDerWaalsContact CZ-CD 3.47Å; R53-P137 VanDerWaalsContact NH1-CD 3.29Å; R53-V296 HydrophobicContact CB-CG1 4.4Å; R53-V296 HydrophobicContact CG-CG1 3.47Å; R53-V296 VanDerWaalsContact CG-CG1 3.47Å; R53-S297 WeakPolarHBondContact CG-O 3.45Å; R53-I298 PolarHBondContact NE-O 3.1Å
54	C	90.8	Very high	86.4	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.9	-46.8	173.8	175	0	0	0	0	111	A50 R51 A56 N57 C58 C104 I129	A50-C54 PolarHBondContact O-N 3.31Å; R51-C54 PolarHBondContact O-N 2.84Å; C54-A56 VanDerWaalsContact C-N 3.33Å; C54-A56 PolarHBondContact O-N 2.75Å; C54-N57 PolarHBondContact O-N 2.78Å; C54-C58 PolarHBondContact O-N 2.77Å; C54-C104 HydrophobicContact CB-CB 3.67Å; C54-C104 WeakPolarHBondContact CB-SG 3.15Å; C54-C104 WeakPolarHBondContact SG-CB 3.28Å; C54-C104 CovalentContact SG-SG 2.04Å; C54-C104 PolarHBondContact SG-SG 2.8Å; C54-I129 HydrophobicContact CB-CB 4.23Å; C54-I129 HydrophobicContact CB-CD1 3.56Å
55	K	92.7	Very high	86.8	Confident	22 Å²	22	35.6 Å²	35.6	10%	0.096	17%	0.172	C	C	.	.	H	α-helix	trans	-61.1	-39	175.9	-69.9	179	179.8	-176.5	0	112.5	R51 A52 C58 L59 F101 C104 D105 V246 M272	R51-K55 WeakPolarHBondContact O-CG 3.29Å; R51-K55 PolarHBondContact O-N 2.92Å; A52-K55 PolarHBondContact O-N 3.36Å; K55-C58 PolarHBondContact O-N 2.88Å; K55-L59 WeakPolarHBondContact O-CG 3.2Å; K55-L59 PolarHBondContact O-N 3.02Å; K55-F101 HydrophobicContact CB-CD1 4.25Å; K55-F101 HydrophobicContact CD-CD1 4.3Å; K55-F101 VanDerWaalsContact CE-O 3.27Å; K55-F101 WeakPolarHBondContact CE-O 3.33Å; K55-F101 HydrophobicContact CG-CD1 4.1Å; K55-F101 HydrophobicContact CG-CG 4.4Å; K55-C104 HydrophobicContact CG-CB 3.87Å; K55-C104 PolarHBondContact N-SG 3.31Å; K55-D105 VanDerWaalsContact CE-OD1 3.3Å; K55-D105 WeakPolarHBondContact CE-OD1 3.35Å; K55-D105 VanDerWaalsContact NZ-CG 3.28Å; K55-D105 IonicContact NZ-OD1 3.07Å; K55-D105 PolarHBondContact NZ-OD1 3.47Å; K55-D105 IonicContact NZ-OD2 3.82Å; K55-D105 PolarHBondContact NZ-OD2 2.88Å; K55-V246 HydrophobicContact CB-CG2 4.03Å; K55-M272 HydrophobicContact CD-SD 4.41Å
56	A	90.9	Very high	86.8	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-40.6	172.7	0	0	0	0	0	112	A52 R53 C54 L59 R60 P244 V246 I298	A52-A56 PolarHBondContact O-N 3.44Å; R53-A56 PolarHBondContact O-N 3.4Å; C54-A56 VanDerWaalsContact C-N 3.33Å; C54-A56 PolarHBondContact O-N 2.75Å; A56-L59 PolarHBondContact O-N 3.13Å; A56-R60 WeakPolarHBondContact O-CB 3.38Å; A56-R60 PolarHBondContact O-N 2.75Å; A56-P244 HydrophobicContact CB-CG 4.39Å; A56-P244 WeakPolarHBondContact O-CG 3.37Å; A56-V246 HydrophobicContact CB-CG2 4.09Å; A56-I298 HydrophobicContact CB-CG2 3.83Å
57	N	88.4	Confident	87	Confident	20 Å²	20	38 Å²	38	11%	0.107	18%	0.184	C	C	.	.	H	α-helix	trans	-66.5	-41.1	175.6	-82.5	-60.9	0	0	0	112.2	R53 C54 R60 L61 L128 I298	R53-N57 PolarHBondContact O-N 3.27Å; R53-N57 PolarHBondContact O-ND2 3.43Å; R53-N57 VanDerWaalsContact O-ND2 3.16Å; C54-N57 PolarHBondContact O-N 2.78Å; N57-R60 PolarHBondContact O-N 2.85Å; N57-R60 PolarHBondContact OD1-NH2 3.07Å; N57-L61 VanDerWaalsContact O-CB 3.3Å; N57-L61 WeakPolarHBondContact O-CB 3.47Å; N57-L61 PolarHBondContact O-N 2.91Å; N57-L128 HydrophobicContact CB-CD1 3.97Å; N57-L128 HydrophobicContact CB-CD2 4.05Å; N57-L128 HydrophobicContact CB-CG 4.44Å; N57-I298 HydrophobicContact CB-CG2 4.32Å; N57-I298 VanDerWaalsContact OD1-CG2 3.27Å; N57-I298 WeakPolarHBondContact OD1-CG2 3.35Å
58	C	90.8	Very high	86.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-56.2	-52.7	171.9	-67.9	0	0	0	0	110	C54 K55 R60 L61 F62 C100 F101 C104	C54-C58 PolarHBondContact O-N 2.77Å; K55-C58 PolarHBondContact O-N 2.88Å; C58-R60 VanDerWaalsContact C-N 3.3Å; C58-R60 PolarHBondContact O-N 2.75Å; C58-L61 PolarHBondContact O-N 3.34Å; C58-F62 VanDerWaalsContact O-CD2 3.26Å; C58-F62 WeakPolarHBondContact O-CD2 3.35Å; C58-F62 PolarHBondContact O-N 3.41Å; C58-C100 HydrophobicContact CB-CB 3.95Å; C58-C100 WeakPolarHBondContact CB-SG 3.38Å; C58-C100 VanDerWaalsContact SG-C 3.53Å; C58-C100 WeakPolarHBondContact SG-CB 3.34Å; C58-C100 CovalentContact SG-SG 2.05Å; C58-C100 PolarHBondContact SG-SG 3.47Å; C58-F101 HydrophobicContact CB-CD2 3.68Å; C58-F101 HydrophobicContact CB-CE2 3.77Å; C58-C104 VanDerWaalsContact SG-SG 3.7Å
59	L	90	Very high	86.1	Confident	22 Å²	22	41.8 Å²	41.8	12%	0.115	20%	0.203	C	C	.	.	H	α-helix	trans	-53.6	-46.3	177.6	-81.1	163.9	0	0	0	112.6	K55 A56 N63 F101 P244 V246 H274	K55-L59 WeakPolarHBondContact O-CG 3.2Å; K55-L59 PolarHBondContact O-N 3.02Å; A56-L59 PolarHBondContact O-N 3.13Å; L59-N63 WeakPolarHBondContact O-CB 3.04Å; L59-N63 PolarHBondContact O-N 2.77Å; L59-N63 PolarHBondContact O-ND2 3.25Å; L59-F101 HydrophobicContact CB-CZ 4.49Å; L59-F101 HydrophobicContact CD1-CE1 4.2Å; L59-F101 HydrophobicContact CD1-CZ 4.03Å; L59-F101 HydrophobicContact CD2-CE1 4.23Å; L59-F101 HydrophobicContact CD2-CE2 4.25Å; L59-F101 HydrophobicContact CD2-CZ 3.41Å; L59-F101 VanDerWaalsContact CD2-CZ 3.41Å; L59-F101 HydrophobicContact CG-CE1 3.96Å; L59-F101 HydrophobicContact CG-CE2 4.02Å; L59-F101 HydrophobicContact CG-CZ 3.29Å; L59-P244 HydrophobicContact CB-CB 3.74Å; L59-P244 HydrophobicContact CB-CG 3.57Å; L59-P244 HydrophobicContact CD1-CB 4.08Å; L59-V246 HydrophobicContact CD1-CG2 3.88Å; L59-H274 HydrophobicContact CD1-CB 4.02Å; L59-H274 WeakPolarHBondContact CD1-CD2 3.38Å
60	R	88.3	Confident	85.6	Confident	68 Å²	68	42.7 Å²	42.7	26%	0.257	22%	0.215	S	C	.	.	H	α-helix	trans	-64.4	-46.6	-178.9	-175.2	176.4	59.7	140.7	-6.3	111.3	A56 N57 C58 F62 N63 N64 E67 P244	A56-R60 WeakPolarHBondContact O-CB 3.38Å; A56-R60 PolarHBondContact O-N 2.75Å; N57-R60 PolarHBondContact O-N 2.85Å; N57-R60 PolarHBondContact OD1-NH2 3.07Å; C58-R60 VanDerWaalsContact C-N 3.3Å; C58-R60 PolarHBondContact O-N 2.75Å; R60-F62 PolarHBondContact O-N 2.94Å; R60-N63 PolarHBondContact O-N 3.47Å; R60-N64 VanDerWaalsContact O-CB 3.23Å; R60-N64 WeakPolarHBondContact O-CB 3.44Å; R60-N64 PolarHBondContact O-N 3.38Å; R60-E67 WeakPolarHBondContact CD-OE1 3.31Å; R60-E67 WeakPolarHBondContact CD-OE2 3.44Å; R60-E67 VanDerWaalsContact CG-OE2 3.25Å; R60-E67 WeakPolarHBondContact CG-OE2 3.43Å; R60-E67 IonicContact CZ-OE1 2.78Å; R60-E67 IonicContact CZ-OE2 3.49Å; R60-E67 IonicContact NE-OE1 3.46Å; R60-E67 IonicContact NE-OE2 2.71Å; R60-E67 PolarHBondContact NE-OE2 2.93Å; R60-E67 IonicContact NH1-OE1 2.95Å; R60-E67 PolarHBondContact NH1-OE1 3.24Å; R60-E67 IonicContact NH1-OE2 3.1Å; R60-E67 PolarHBondContact NH1-OE2 2.95Å; R60-E67 VanDerWaalsContact NH1-OE2 3.1Å; R60-E67 IonicContact NH2-OE2 3.88Å; R60-P244 HydrophobicContact CB-CG 3.93Å
61	L	86.2	Confident	85.2	Confident	8 Å²	8	43.8 Å²	43.8	4%	0.042	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-42.7	-177.9	-179.2	64.2	0	0	0	111.7	N57 C58 S68 F71 F89 I124	N57-L61 VanDerWaalsContact O-CB 3.3Å; N57-L61 WeakPolarHBondContact O-CB 3.47Å; N57-L61 PolarHBondContact O-N 2.91Å; C58-L61 PolarHBondContact O-N 3.34Å; L61-S68 WeakPolarHBondContact O-CB 3.2Å; L61-F71 HydrophobicContact CD1-CB 3.53Å; L61-F71 HydrophobicContact CD1-CD1 4.07Å; L61-F71 HydrophobicContact CD1-CD2 4.14Å; L61-F71 HydrophobicContact CD1-CG 3.66Å; L61-F71 HydrophobicContact CD2-CD1 4.03Å; L61-F71 HydrophobicContact CD2-CD2 4.42Å; L61-F71 HydrophobicContact CD2-CE1 4.06Å; L61-F71 HydrophobicContact CD2-CE2 4.44Å; L61-F71 HydrophobicContact CD2-CG 4.21Å; L61-F71 HydrophobicContact CD2-CZ 4.26Å; L61-F89 HydrophobicContact CD1-CZ 4.5Å; L61-F89 HydrophobicContact CD2-CE1 4.38Å; L61-F89 HydrophobicContact CD2-CZ 4.12Å; L61-F89 HydrophobicContact CG-CE1 4.01Å; L61-F89 HydrophobicContact CG-CZ 4.13Å; L61-I124 HydrophobicContact CD2-CG2 3.59Å
62	F	86.5	Confident	84.1	Confident	13 Å²	13	45 Å²	45	6%	0.057	22%	0.222	C	C	.	.	H	α-helix	trans	-77.6	-35.5	179.5	-77	-80.4	0	0	0	112	C58 R60 F89 H93 C96 C100 I124	C58-F62 VanDerWaalsContact O-CD2 3.26Å; C58-F62 WeakPolarHBondContact O-CD2 3.35Å; C58-F62 PolarHBondContact O-N 3.41Å; R60-F62 PolarHBondContact O-N 2.94Å; F62-F89 AromaticContact CD1-CD1 3.66Å; F62-F89 HydrophobicContact CD1-CD1 3.66Å; F62-F89 AromaticContact CD1-CE1 3.69Å; F62-F89 HydrophobicContact CD1-CE1 3.69Å; F62-F89 AromaticContact CE1-CD1 3.61Å; F62-F89 HydrophobicContact CE1-CD1 3.61Å; F62-F89 AromaticContact CE1-CE1 3.5Å; F62-F89 HydrophobicContact CE1-CE1 3.5Å; F62-F89 VanDerWaalsContact CE1-CE1 3.5Å; F62-F89 HydrophobicContact CE1-CZ 4.34Å; F62-F89 HydrophobicContact CE2-CE1 4.45Å; F62-F89 HydrophobicContact CG-CE1 4.26Å; F62-F89 HydrophobicContact CZ-CD1 4.45Å; F62-F89 AromaticContact CZ-CE1 3.91Å; F62-F89 HydrophobicContact CZ-CE1 3.91Å; F62-F89 HydrophobicContact CZ-CZ 4.43Å; F62-H93 AromaticContact CD1-CE1 3.94Å; F62-H93 AromaticContact CD1-ND1 3.93Å; F62-H93 PolarHBondContact O-CE1 3.25Å; F62-H93 VanDerWaalsContact O-CE1 3.25Å; F62-C96 HydrophobicContact CE1-CB 3.81Å; F62-C96 HydrophobicContact CZ-CB 3.88Å; F62-C100 HydrophobicContact CE2-CB 3.97Å; F62-I124 HydrophobicContact CE2-CD1 4.32Å; F62-I124 HydrophobicContact CZ-CD1 3.81Å
63	N	84	Confident	83.1	Confident	107 Å²	107	53.6 Å²	53.6	57%	0.572	26%	0.255	S	S	*	.	H	α-helix	trans	-82.8	-13.2	-179	-65.6	-16.9	0	0	0	114.4	L59 R60	L59-N63 WeakPolarHBondContact O-CB 3.04Å; L59-N63 PolarHBondContact O-N 2.77Å; L59-N63 PolarHBondContact O-ND2 3.25Å; R60-N63 PolarHBondContact O-N 3.47Å
64	N	84.2	Confident	82.1	Confident	53 Å²	53	56.4 Å²	56.4	28%	0.283	28%	0.275	S	S	.	.			trans	-112.4	107.3	179.9	-171	-22.6	0	0	0	112.3	R60 E66 E67 S68	R60-N64 VanDerWaalsContact O-CB 3.23Å; R60-N64 WeakPolarHBondContact O-CB 3.44Å; R60-N64 PolarHBondContact O-N 3.38Å; N64-E66 VanDerWaalsContact C-N 3.28Å; N64-E66 PolarHBondContact O-N 2.86Å; N64-E66 PolarHBondContact OD1-N 2.86Å; N64-E67 HydrophobicContact CB-CB 4.12Å; N64-E67 HydrophobicContact CB-CG 4.38Å; N64-E67 PolarHBondContact O-N 2.8Å; N64-E67 PolarHBondContact OD1-N 2.93Å; N64-S68 PolarHBondContact O-N 3.41Å; N64-S68 PolarHBondContact O-OG 2.81Å
65	P	79.8	Confident	80.8	Confident	84 Å²	84	57.3 Å²	57.3	55%	0.545	28%	0.279	S	S	.	.	H	α-helix	trans	-62.7	-26.9	179.4	-23	33.4	0	0	0	114.9	S68 K69	P65-S68 VanDerWaalsContact CA-OG 3.31Å; P65-S68 WeakPolarHBondContact CA-OG 3.45Å; P65-S68 PolarHBondContact O-OG 3.17Å; P65-K69 VanDerWaalsContact O-CG 3.29Å; P65-K69 WeakPolarHBondContact O-CG 3.3Å; P65-K69 PolarHBondContact O-N 2.55Å
66	E	79	Confident	79.1	Confident	154 Å²	154	59.7 Å²	59.7	72%	0.72	29%	0.292	S	S	*	.	H	α-helix	trans	-78.1	-44.3	179.4	-62.6	-157.3	145.8	0	0	111.3	N64 K69 A70	N64-E66 VanDerWaalsContact C-N 3.28Å; N64-E66 PolarHBondContact O-N 2.86Å; N64-E66 PolarHBondContact OD1-N 2.86Å; E66-K69 PolarHBondContact O-N 2.95Å; E66-A70 PolarHBondContact O-N 2.78Å
67	E	79.4	Confident	77.4	Confident	60 Å²	60	66.6 Å²	66.6	28%	0.28	33%	0.329	S	S	.	.	H	α-helix	trans	-65.8	-38.4	175.6	-73.4	-167.7	-164.4	0	0	111.7	R60 N64 K69 A70 F71	R60-E67 WeakPolarHBondContact CD-OE1 3.31Å; R60-E67 WeakPolarHBondContact CD-OE2 3.44Å; R60-E67 VanDerWaalsContact CG-OE2 3.25Å; R60-E67 WeakPolarHBondContact CG-OE2 3.43Å; R60-E67 IonicContact CZ-OE1 2.78Å; R60-E67 IonicContact CZ-OE2 3.49Å; R60-E67 IonicContact NE-OE1 3.46Å; R60-E67 IonicContact NE-OE2 2.71Å; R60-E67 PolarHBondContact NE-OE2 2.93Å; R60-E67 IonicContact NH1-OE1 2.95Å; R60-E67 PolarHBondContact NH1-OE1 3.24Å; R60-E67 IonicContact NH1-OE2 3.1Å; R60-E67 PolarHBondContact NH1-OE2 2.95Å; R60-E67 VanDerWaalsContact NH1-OE2 3.1Å; R60-E67 IonicContact NH2-OE2 3.88Å; N64-E67 HydrophobicContact CB-CB 4.12Å; N64-E67 HydrophobicContact CB-CG 4.38Å; N64-E67 PolarHBondContact O-N 2.8Å; N64-E67 PolarHBondContact OD1-N 2.93Å; E67-K69 VanDerWaalsContact C-N 3.31Å; E67-K69 PolarHBondContact O-N 2.59Å; E67-A70 PolarHBondContact O-N 3.41Å; E67-F71 VanDerWaalsContact O-CB 3.26Å; E67-F71 WeakPolarHBondContact O-CB 2.99Å; E67-F71 PolarHBondContact O-N 2.95Å
68	S	78.1	Confident	75.8	Confident	12 Å²	12	72 Å²	72	8%	0.084	35%	0.354	C	S	.	.	H	α-helix	trans	-62.3	-36.4	174.2	59.2	0	0	0	0	113	L61 N64 P65 R72	L61-S68 WeakPolarHBondContact O-CB 3.2Å; N64-S68 PolarHBondContact O-N 3.41Å; N64-S68 PolarHBondContact O-OG 2.81Å; P65-S68 VanDerWaalsContact CA-OG 3.31Å; P65-S68 WeakPolarHBondContact CA-OG 3.45Å; P65-S68 PolarHBondContact O-OG 3.17Å; S68-R72 WeakPolarHBondContact O-CB 3.28Å; S68-R72 PolarHBondContact O-N 2.99Å; S68-R72 VanDerWaalsContact O-N 3.1Å
69	K	75.9	Confident	74	Confident	123 Å²	123	80.4 Å²	80.4	54%	0.535	39%	0.39	S	S	.	.	H	α-helix	trans	-68.7	-40.8	172.7	-74.3	173.3	-173.4	174.5	0	112.1	P65 E66 E67 R73	P65-K69 VanDerWaalsContact O-CG 3.29Å; P65-K69 WeakPolarHBondContact O-CG 3.3Å; P65-K69 PolarHBondContact O-N 2.55Å; E66-K69 PolarHBondContact O-N 2.95Å; E67-K69 VanDerWaalsContact C-N 3.31Å; E67-K69 PolarHBondContact O-N 2.59Å; K69-R73 WeakPolarHBondContact O-CG 3.33Å; K69-R73 PolarHBondContact O-N 2.83Å
70	A	77.8	Confident	72.3	Confident	47 Å²	47	81.7 Å²	81.7	39%	0.388	40%	0.395	S	S	.	.	H	α-helix	trans	-65.6	-48.5	177.5	0	0	0	0	0	111.5	E66 E67 R72 R73 T74	E66-A70 PolarHBondContact O-N 2.78Å; E67-A70 PolarHBondContact O-N 3.41Å; A70-R72 VanDerWaalsContact C-N 3.3Å; A70-R72 PolarHBondContact O-N 3.04Å; A70-R73 WeakPolarHBondContact O-CB 3.47Å; A70-R73 PolarHBondContact O-N 3.34Å; A70-T74 PolarHBondContact O-N 3.43Å; A70-T74 PolarHBondContact O-OG1 2.97Å
71	F	74.8	Confident	70.6	Confident	34 Å²	34	85.6 Å²	85.6	15%	0.149	42%	0.421	C	S	.	.	H	α-helix	trans	-56.7	-42.5	176.4	-173.5	-93.1	0	0	0	112	L61 E67 R73 T74 W75 I124 F127 L128	L61-F71 HydrophobicContact CD1-CB 3.53Å; L61-F71 HydrophobicContact CD1-CD1 4.07Å; L61-F71 HydrophobicContact CD1-CD2 4.14Å; L61-F71 HydrophobicContact CD1-CG 3.66Å; L61-F71 HydrophobicContact CD2-CD1 4.03Å; L61-F71 HydrophobicContact CD2-CD2 4.42Å; L61-F71 HydrophobicContact CD2-CE1 4.06Å; L61-F71 HydrophobicContact CD2-CE2 4.44Å; L61-F71 HydrophobicContact CD2-CG 4.21Å; L61-F71 HydrophobicContact CD2-CZ 4.26Å; E67-F71 VanDerWaalsContact O-CB 3.26Å; E67-F71 WeakPolarHBondContact O-CB 2.99Å; E67-F71 PolarHBondContact O-N 2.95Å; F71-R73 VanDerWaalsContact C-N 3.31Å; F71-R73 PolarHBondContact O-N 3.42Å; F71-T74 PolarHBondContact O-N 2.88Å; F71-W75 HydrophobicContact CE1-CD2 4.39Å; F71-W75 AromaticContact CE1-CE3 3.69Å; F71-W75 HydrophobicContact CE1-CE3 3.69Å; F71-W75 HydrophobicContact CE1-CZ3 4.15Å; F71-W75 HydrophobicContact CE2-CE3 4.34Å; F71-W75 AromaticContact CZ-CE3 3.46Å; F71-W75 HydrophobicContact CZ-CE3 3.46Å; F71-W75 VanDerWaalsContact CZ-CE3 3.46Å; F71-W75 AromaticContact CZ-CZ3 3.64Å; F71-W75 HydrophobicContact CZ-CZ3 3.64Å; F71-W75 WeakPolarHBondContact O-CB 3.38Å; F71-W75 PolarHBondContact O-N 3.46Å; F71-I124 HydrophobicContact CE1-CG2 4.41Å; F71-I124 HydrophobicContact CZ-CG2 4.32Å; F71-F127 HydrophobicContact CE2-CD1 4.03Å; F71-F127 AromaticContact CE2-CE1 3.79Å; F71-F127 HydrophobicContact CE2-CE1 3.79Å; F71-F127 HydrophobicContact CZ-CD1 4.03Å; F71-F127 HydrophobicContact CZ-CE1 4.15Å; F71-L128 HydrophobicContact CE2-CD2 4.33Å
72	R	69.9	Low	69	Low	90 Å²	90	93 Å²	93	34%	0.34	46%	0.461	S	S	.	.	H	α-helix	trans	-58.5	-39	175.3	-169.9	-174.4	-55.8	-174.7	0.5	113	S68 A70 N76	S68-R72 WeakPolarHBondContact O-CB 3.28Å; S68-R72 PolarHBondContact O-N 2.99Å; S68-R72 VanDerWaalsContact O-N 3.1Å; A70-R72 VanDerWaalsContact C-N 3.3Å; A70-R72 PolarHBondContact O-N 3.04Å; R72-N76 PolarHBondContact O-N 3.37Å
73	R	69.7	Low	67.5	Low	182 Å²	182	94.3 Å²	94.3	69%	0.687	47%	0.468	S	S	*	.	H	α-helix	trans	-69.3	-41	178.5	-69.2	176.5	-172.5	146.7	-0.2	111.8	K69 A70 F71	K69-R73 WeakPolarHBondContact O-CG 3.33Å; K69-R73 PolarHBondContact O-N 2.83Å; A70-R73 WeakPolarHBondContact O-CB 3.47Å; A70-R73 PolarHBondContact O-N 3.34Å; F71-R73 VanDerWaalsContact C-N 3.31Å; F71-R73 PolarHBondContact O-N 3.42Å
74	T	67.7	Low	66.5	Low	86 Å²	86	94.2 Å²	94.2	53%	0.528	47%	0.468	S	S	.	.	H	α-helix	trans	-67.7	-41.8	179.2	-39.5	0	0	0	0	111.2	A70 F71 N77	A70-T74 PolarHBondContact O-N 3.43Å; A70-T74 PolarHBondContact O-OG1 2.97Å; F71-T74 PolarHBondContact O-N 2.88Å; T74-N77 PolarHBondContact O-N 3Å
75	W	62.1	Low	65.4	Low	19 Å²	19	92.6 Å²	92.6	7%	0.072	46%	0.458	C	S	.	.	H	α-helix	trans	-72.7	-40.4	-174.8	-168.2	-76	0	0	0	114.5	F71 N77 E78 F80 W85 F127	F71-W75 HydrophobicContact CE1-CD2 4.39Å; F71-W75 AromaticContact CE1-CE3 3.69Å; F71-W75 HydrophobicContact CE1-CE3 3.69Å; F71-W75 HydrophobicContact CE1-CZ3 4.15Å; F71-W75 HydrophobicContact CE2-CE3 4.34Å; F71-W75 AromaticContact CZ-CE3 3.46Å; F71-W75 HydrophobicContact CZ-CE3 3.46Å; F71-W75 VanDerWaalsContact CZ-CE3 3.46Å; F71-W75 AromaticContact CZ-CZ3 3.64Å; F71-W75 HydrophobicContact CZ-CZ3 3.64Å; F71-W75 WeakPolarHBondContact O-CB 3.38Å; F71-W75 PolarHBondContact O-N 3.46Å; W75-N77 PolarHBondContact O-N 2.96Å; W75-E78 PolarHBondContact O-N 3.16Å; W75-F80 AromaticContact CE2-CD2 3.56Å; W75-F80 AromaticContact CE2-CE2 3.95Å; W75-F80 AromaticContact CZ2-CD2 3.61Å; W75-F80 HydrophobicContact CZ2-CD2 3.61Å; W75-F80 AromaticContact CZ2-CE2 3.5Å; W75-F80 HydrophobicContact CZ2-CE2 3.5Å; W75-F80 VanDerWaalsContact CZ2-CE2 3.5Å; W75-F80 HydrophobicContact CZ2-CZ 4.43Å; W75-F80 AromaticContact NE1-CD2 3.09Å; W75-F80 AromaticContact NE1-CE2 3.94Å; W75-F80 AromaticContact NE1-CG 3.68Å; W75-W85 AromaticContact CD1-CZ2 3.71Å; W75-W85 HydrophobicContact CD2-CH2 4.48Å; W75-W85 HydrophobicContact CD2-CZ2 4.47Å; W75-W85 AromaticContact CE2-CZ2 3.9Å; W75-W85 HydrophobicContact CG-CZ2 4.37Å; W75-W85 HydrophobicContact CZ2-CH2 4.38Å; W75-W85 HydrophobicContact CZ2-CZ2 4.45Å; W75-W85 AromaticContact NE1-CZ2 3.38Å; W75-F127 HydrophobicContact CE3-CD1 4.17Å; W75-F127 HydrophobicContact CE3-CD2 4.4Å; W75-F127 HydrophobicContact CE3-CE1 4.25Å; W75-F127 HydrophobicContact CE3-CE2 4.5Å; W75-F127 HydrophobicContact CE3-CG 4.2Å; W75-F127 HydrophobicContact CE3-CZ 4.4Å; W75-F127 HydrophobicContact CH2-CB 3.41Å; W75-F127 VanDerWaalsContact CH2-CB 3.41Å; W75-F127 HydrophobicContact CH2-CD1 4.38Å; W75-F127 HydrophobicContact CH2-CD2 4.01Å; W75-F127 AromaticContact CH2-CG 3.73Å; W75-F127 HydrophobicContact CH2-CG 3.73Å; W75-F127 HydrophobicContact CZ3-CB 3.36Å; W75-F127 AromaticContact CZ3-CD1 3.45Å; W75-F127 HydrophobicContact CZ3-CD1 3.45Å; W75-F127 VanDerWaalsContact CZ3-CD1 3.45Å; W75-F127 AromaticContact CZ3-CD2 3.61Å; W75-F127 HydrophobicContact CZ3-CD2 3.61Å; W75-F127 AromaticContact CZ3-CE1 3.97Å; W75-F127 HydrophobicContact CZ3-CE1 3.97Å; W75-F127 HydrophobicContact CZ3-CE2 4.13Å; W75-F127 AromaticContact CZ3-CG 3.21Å; W75-F127 HydrophobicContact CZ3-CG 3.21Å; W75-F127 HydrophobicContact CZ3-CZ 4.27Å
76	N	57.3	Low	64.4	Low	71 Å²	71	91.3 Å²	91.3	38%	0.38	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-21.7	178	-82.6	-0.2	0	0	0	112.4	R72	R72-N76 PolarHBondContact O-N 3.37Å
77	N	55.6	Low	63.9	Low	145 Å²	145	86.3 Å²	86.3	78%	0.775	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-22.5	176.4	-72.3	-12.6	0	0	0	114.1	T74 W75	T74-N77 PolarHBondContact O-N 3Å; W75-N77 PolarHBondContact O-N 2.96Å
78	E	55.2	Low	63.7	Low	133 Å²	133	83.4 Å²	83.4	62%	0.621	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-25.7	-162.5	-75.3	-169.3	165.5	0	0	116.6	W75	W75-E78 PolarHBondContact O-N 3.16Å
79	K	53.2	Low	63.5	Low	177 Å²	177	84.1 Å²	84.1	77%	0.77	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-169	-11.4	177.1	-119.7	165.2	179	176.5	0	120.6
80	F	52.8	Low	63.3	Low	50 Å²	50	81.8 Å²	81.8	22%	0.219	42%	0.423	C	S	.	.			trans	-135	73.3	-165.6	-62.3	-91.1	0	0	0	113.4	W75 D82	W75-F80 AromaticContact CE2-CD2 3.56Å; W75-F80 AromaticContact CE2-CE2 3.95Å; W75-F80 AromaticContact CZ2-CD2 3.61Å; W75-F80 HydrophobicContact CZ2-CD2 3.61Å; W75-F80 AromaticContact CZ2-CE2 3.5Å; W75-F80 HydrophobicContact CZ2-CE2 3.5Å; W75-F80 VanDerWaalsContact CZ2-CE2 3.5Å; W75-F80 HydrophobicContact CZ2-CZ 4.43Å; W75-F80 AromaticContact NE1-CD2 3.09Å; W75-F80 AromaticContact NE1-CE2 3.94Å; W75-F80 AromaticContact NE1-CG 3.68Å; F80-D82 VanDerWaalsContact C-N 3.26Å; F80-D82 PolarHBondContact O-N 2.89Å
81	N	52.5	Low	62.7	Low	150 Å²	150	86.3 Å²	86.3	80%	0.802	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-13.5	177.1	-95.3	-12.6	0	0	0	114.4
82	D	53.4	Low	62.4	Low	164 Å²	164	86.4 Å²	86.4	88%	0.877	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	2.9	-168.1	-113.8	-5.9	0	0	0	115.3	F80	F80-D82 VanDerWaalsContact C-N 3.26Å; F80-D82 PolarHBondContact O-N 2.89Å
83	L	56	Low	62.7	Low	40 Å²	40	85.1 Å²	85.1	21%	0.209	44%	0.443	C	S	.	.			trans	-103.5	125.6	-177.8	-107.7	64.2	0	0	0	111.8	W85 I120	L83-W85 VanDerWaalsContact C-N 3.29Å; L83-W85 HydrophobicContact CD2-CZ2 4.35Å; L83-W85 PolarHBondContact O-N 2.86Å; L83-I120 HydrophobicContact CB-CD1 4.36Å; L83-I120 HydrophobicContact CD2-CB 4.23Å; L83-I120 HydrophobicContact CD2-CD1 3.93Å; L83-I120 HydrophobicContact CD2-CG1 3.57Å; L83-I120 HydrophobicContact CD2-CG2 4.23Å; L83-I120 HydrophobicContact CG-CD1 4.04Å; L83-I120 HydrophobicContact CG-CG1 4.12Å
84	D	62.5	Low	63.2	Low	105 Å²	105	84.1 Å²	84.1	56%	0.561	45%	0.446	S	S	*	.			trans	-77.4	78.6	172.3	-174	14	0	0	0	111.5	S86 T87	D84-S86 PolarHBondContact O-N 2.88Å; D84-S86 VanDerWaalsContact O-N 3.15Å; D84-S86 WeakPolarHBondContact OD1-CB 3.37Å; D84-S86 PolarHBondContact OD1-N 2.81Å; D84-S86 PolarHBondContact OD1-OG 3.28Å; D84-S86 PolarHBondContact OD2-OG 2.88Å; D84-T87 PolarHBondContact O-N 2.93Å; D84-T87 PolarHBondContact O-OG1 3.33Å
85	W	60.5	Low	63.9	Low	18 Å²	18	89 Å²	89	7%	0.068	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-21.5	179	-71	93.8	0	0	0	114.5	W75 L83 T87 C88 F89 I120 I124	W75-W85 AromaticContact CD1-CZ2 3.71Å; W75-W85 HydrophobicContact CD2-CH2 4.48Å; W75-W85 HydrophobicContact CD2-CZ2 4.47Å; W75-W85 AromaticContact CE2-CZ2 3.9Å; W75-W85 HydrophobicContact CG-CZ2 4.37Å; W75-W85 HydrophobicContact CZ2-CH2 4.38Å; W75-W85 HydrophobicContact CZ2-CZ2 4.45Å; W75-W85 AromaticContact NE1-CZ2 3.38Å; L83-W85 VanDerWaalsContact C-N 3.29Å; L83-W85 HydrophobicContact CD2-CZ2 4.35Å; L83-W85 PolarHBondContact O-N 2.86Å; W85-T87 PolarHBondContact O-N 2.83Å; W85-T87 VanDerWaalsContact O-N 3.16Å; W85-C88 PolarHBondContact O-N 2.75Å; W85-F89 HydrophobicContact CE3-CE2 4.28Å; W85-I120 HydrophobicContact CD2-CG2 3.85Å; W85-I120 HydrophobicContact CE3-CG2 3.26Å; W85-I120 HydrophobicContact CH2-CG2 3.47Å; W85-I120 VanDerWaalsContact CH2-CG2 3.47Å; W85-I120 HydrophobicContact CZ2-CG2 4.01Å; W85-I120 HydrophobicContact CZ3-CG2 3.09Å; W85-I124 HydrophobicContact CH2-CD1 4.48Å; W85-I124 HydrophobicContact CH2-CG1 3.84Å; W85-I124 HydrophobicContact CZ3-CD1 3.68Å; W85-I124 HydrophobicContact CZ3-CG1 3.51Å
86	S	59.2	Low	65	Low	57 Å²	57	88.4 Å²	88.4	40%	0.399	45%	0.454	S	S	.	.	H	α-helix	trans	-57.3	-33.9	-176.6	69.8	0	0	0	0	111	D84 A90	D84-S86 PolarHBondContact O-N 2.88Å; D84-S86 VanDerWaalsContact O-N 3.15Å; D84-S86 WeakPolarHBondContact OD1-CB 3.37Å; D84-S86 PolarHBondContact OD1-N 2.81Å; D84-S86 PolarHBondContact OD1-OG 3.28Å; D84-S86 PolarHBondContact OD2-OG 2.88Å; S86-A90 WeakPolarHBondContact O-CB 3.07Å; S86-A90 PolarHBondContact O-N 3.16Å
87	T	68	Low	66.4	Low	49 Å²	49	86 Å²	86	30%	0.301	44%	0.443	S	S	.	.	H	α-helix	trans	-65.4	-38.8	177.1	61.9	0	0	0	0	112.9	D84 W85 N91 S92	D84-T87 PolarHBondContact O-N 2.93Å; D84-T87 PolarHBondContact O-OG1 3.33Å; W85-T87 PolarHBondContact O-N 2.83Å; W85-T87 VanDerWaalsContact O-N 3.16Å; T87-N91 CarbonylContact O-C 3.5Å; T87-N91 WeakPolarHBondContact O-CA 3.41Å; T87-N91 PolarHBondContact O-N 3.3Å; T87-S92 PolarHBondContact O-N 2.92Å; T87-S92 PolarHBondContact O-OG 3.09Å
88	C	75.5	Confident	67.9	Low	0 Å²	0	82.6 Å²	82.6	0%	0	43%	0.43	C	S	.	.	H	α-helix	trans	-70.3	-42.6	-168.5	-170.2	0	0	0	0	114.4	W85 S92 H93 C96 I120	W85-C88 PolarHBondContact O-N 2.75Å; C88-S92 WeakPolarHBondContact CA-OG 3.32Å; C88-S92 CarbonylContact O-C 3.58Å; C88-H93 VanDerWaalsContact O-CA 3.27Å; C88-H93 WeakPolarHBondContact O-CA 3.45Å; C88-H93 PolarHBondContact O-N 2.64Å; C88-C96 WeakPolarHBondContact CA-SG 3.49Å; C88-C96 HydrophobicContact CB-CB 4.2Å; C88-C96 WeakPolarHBondContact CB-SG 3.2Å; C88-C96 WeakPolarHBondContact SG-CB 3.47Å; C88-C96 CovalentContact SG-SG 2.03Å; C88-C96 PolarHBondContact SG-SG 2.71Å; C88-I120 HydrophobicContact CB-CB 4.33Å; C88-I120 HydrophobicContact CB-CD1 4.4Å; C88-I120 HydrophobicContact CB-CG2 4.08Å
89	F	73.7	Confident	69.4	Low	26 Å²	26	78.1 Å²	78.1	11%	0.114	41%	0.41	C	S	.	.	H	α-helix	trans	-89.2	-22.4	178.3	-67.9	-75.6	0	0	0	113.4	L61 F62 W85 I124	L61-F89 HydrophobicContact CD1-CZ 4.5Å; L61-F89 HydrophobicContact CD2-CE1 4.38Å; L61-F89 HydrophobicContact CD2-CZ 4.12Å; L61-F89 HydrophobicContact CG-CE1 4.01Å; L61-F89 HydrophobicContact CG-CZ 4.13Å; F62-F89 AromaticContact CD1-CD1 3.66Å; F62-F89 HydrophobicContact CD1-CD1 3.66Å; F62-F89 AromaticContact CD1-CE1 3.69Å; F62-F89 HydrophobicContact CD1-CE1 3.69Å; F62-F89 AromaticContact CE1-CD1 3.61Å; F62-F89 HydrophobicContact CE1-CD1 3.61Å; F62-F89 AromaticContact CE1-CE1 3.5Å; F62-F89 HydrophobicContact CE1-CE1 3.5Å; F62-F89 VanDerWaalsContact CE1-CE1 3.5Å; F62-F89 HydrophobicContact CE1-CZ 4.34Å; F62-F89 HydrophobicContact CE2-CE1 4.45Å; F62-F89 HydrophobicContact CG-CE1 4.26Å; F62-F89 HydrophobicContact CZ-CD1 4.45Å; F62-F89 AromaticContact CZ-CE1 3.91Å; F62-F89 HydrophobicContact CZ-CE1 3.91Å; F62-F89 HydrophobicContact CZ-CZ 4.43Å; W85-F89 HydrophobicContact CE3-CE2 4.28Å; F89-I124 HydrophobicContact CZ-CD1 4.09Å
90	A	71	Confident	71.2	Confident	75 Å²	75	69.7 Å²	69.7	62%	0.62	37%	0.374	S	S	*	.	H	α-helix	trans	-100.6	-57.2	-177.4	0	0	0	0	0	113.3	S86	S86-A90 WeakPolarHBondContact O-CB 3.07Å; S86-A90 PolarHBondContact O-N 3.16Å
91	N	65.6	Low	72.9	Confident	141 Å²	141	70.2 Å²	70.2	75%	0.754	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-26.9	-169.5	-66.5	-12.3	0	0	0	113.9	T87	T87-N91 CarbonylContact O-C 3.5Å; T87-N91 WeakPolarHBondContact O-CA 3.41Å; T87-N91 PolarHBondContact O-N 3.3Å
92	S	68.7	Low	74.6	Confident	37 Å²	37	72.3 Å²	72.3	26%	0.259	37%	0.373	S	S	.	.	S	Bend	trans	-126.7	32.3	-175.8	60.5	0	0	0	0	112.9	T87 C88 E94 R95 C96	T87-S92 PolarHBondContact O-N 2.92Å; T87-S92 PolarHBondContact O-OG 3.09Å; C88-S92 WeakPolarHBondContact CA-OG 3.32Å; C88-S92 CarbonylContact O-C 3.58Å; S92-E94 PolarHBondContact O-N 3.38Å; S92-R95 PolarHBondContact O-N 3.17Å; S92-R95 VanDerWaalsContact O-N 3.14Å; S92-C96 WeakPolarHBondContact O-CB 3.29Å; S92-C96 PolarHBondContact O-N 3.42Å
93	H	76.9	Confident	76.3	Confident	63 Å²	63	64.7 Å²	64.7	29%	0.292	33%	0.332	S	S	.	.	H	α-helix	trans	-47.9	-52.5	-176.6	-178.7	96.6	0	0	0	114	F62 C88 S97	F62-H93 AromaticContact CD1-CE1 3.94Å; F62-H93 AromaticContact CD1-ND1 3.93Å; F62-H93 PolarHBondContact O-CE1 3.25Å; F62-H93 VanDerWaalsContact O-CE1 3.25Å; C88-H93 VanDerWaalsContact O-CA 3.27Å; C88-H93 WeakPolarHBondContact O-CA 3.45Å; C88-H93 PolarHBondContact O-N 2.64Å; H93-S97 VanDerWaalsContact O-CB 3.32Å; H93-S97 WeakPolarHBondContact O-CB 3.41Å; H93-S97 PolarHBondContact O-N 2.93Å; H93-S97 PolarHBondContact O-OG 3Å
94	E	79.2	Confident	77.9	Confident	161 Å²	161	62.8 Å²	62.8	75%	0.752	32%	0.322	S	S	*	.	H	α-helix	trans	-66.4	-41.1	-178.6	-66.6	-179.3	176	0	0	112.3	S92 S97 S98	S92-E94 PolarHBondContact O-N 3.38Å; E94-S97 WeakPolarHBondContact CA-OG 3.4Å; E94-S97 PolarHBondContact O-OG 3.45Å; E94-S98 VanDerWaalsContact O-CB 3.24Å; E94-S98 WeakPolarHBondContact O-CB 3.47Å; E94-S98 PolarHBondContact O-N 3.48Å
95	R	83.3	Confident	79.2	Confident	187 Å²	187	60.6 Å²	60.6	71%	0.706	31%	0.311	S	S	*	.	H	α-helix	trans	-66.3	-47.4	178.5	-174	174.5	-179.3	173	2.1	111	S92 S98 D99	S92-R95 PolarHBondContact O-N 3.17Å; S92-R95 VanDerWaalsContact O-N 3.14Å; R95-S98 PolarHBondContact O-N 3.04Å; R95-D99 WeakPolarHBondContact O-CB 3.47Å; R95-D99 PolarHBondContact O-N 3.09Å
96	C	84.9	Confident	80.4	Confident	8 Å²	8	62.1 Å²	62.1	5%	0.054	32%	0.32	C	S	.	.	H	α-helix	trans	-64.5	-41.9	178.8	-95.6	0	0	0	0	113.1	F62 C88 S92 D99 C100 G121	F62-C96 HydrophobicContact CE1-CB 3.81Å; F62-C96 HydrophobicContact CZ-CB 3.88Å; C88-C96 WeakPolarHBondContact CA-SG 3.49Å; C88-C96 HydrophobicContact CB-CB 4.2Å; C88-C96 WeakPolarHBondContact CB-SG 3.2Å; C88-C96 WeakPolarHBondContact SG-CB 3.47Å; C88-C96 CovalentContact SG-SG 2.03Å; C88-C96 PolarHBondContact SG-SG 2.71Å; S92-C96 WeakPolarHBondContact O-CB 3.29Å; S92-C96 PolarHBondContact O-N 3.42Å; C96-D99 PolarHBondContact O-N 3Å; C96-C100 WeakPolarHBondContact O-CB 3.45Å; C96-C100 PolarHBondContact O-N 3.11Å; C96-G121 WeakPolarHBondContact O-CA 3.3Å
97	S	86.1	Confident	81.4	Confident	21 Å²	21	61.6 Å²	61.6	15%	0.147	32%	0.315	C	S	.	.	H	α-helix	trans	-64.5	-45.8	174.7	55.3	0	0	0	0	110.8	H93 E94 D99 C100 F101	H93-S97 VanDerWaalsContact O-CB 3.32Å; H93-S97 WeakPolarHBondContact O-CB 3.41Å; H93-S97 PolarHBondContact O-N 2.93Å; H93-S97 PolarHBondContact O-OG 3Å; E94-S97 WeakPolarHBondContact CA-OG 3.4Å; E94-S97 PolarHBondContact O-OG 3.45Å; S97-D99 VanDerWaalsContact C-N 3.33Å; S97-D99 PolarHBondContact O-N 3.28Å; S97-C100 WeakPolarHBondContact O-CB 3.46Å; S97-C100 PolarHBondContact O-N 3.29Å; S97-F101 WeakPolarHBondContact O-CD2 3.46Å; S97-F101 PolarHBondContact O-N 2.55Å
98	S	87	Confident	81.8	Confident	73 Å²	73	61.4 Å²	61.4	51%	0.51	32%	0.315	S	S	.	.	H	α-helix	trans	-56.7	-44.4	173.9	176.7	0	0	0	0	112.6	E94 R95 F101 R102	E94-S98 VanDerWaalsContact O-CB 3.24Å; E94-S98 WeakPolarHBondContact O-CB 3.47Å; E94-S98 PolarHBondContact O-N 3.48Å; R95-S98 PolarHBondContact O-N 3.04Å; S98-F101 PolarHBondContact O-N 3.17Å; S98-R102 PolarHBondContact O-N 2.77Å
99	D	88.2	Confident	81.8	Confident	38 Å²	38	67.6 Å²	67.6	20%	0.203	35%	0.353	C	S	.	.	H	α-helix	trans	-62.9	-42.4	177.4	-70.6	-25.9	0	0	0	111.3	R95 C96 S97 F101 R102 T103 I119	R95-D99 WeakPolarHBondContact O-CB 3.47Å; R95-D99 PolarHBondContact O-N 3.09Å; C96-D99 PolarHBondContact O-N 3Å; S97-D99 VanDerWaalsContact C-N 3.33Å; S97-D99 PolarHBondContact O-N 3.28Å; D99-F101 VanDerWaalsContact C-N 3.34Å; D99-F101 PolarHBondContact O-N 3.03Å; D99-R102 PolarHBondContact O-N 2.79Å; D99-T103 PolarHBondContact O-N 2.87Å; D99-T103 PolarHBondContact O-OG1 2.84Å; D99-T103 VanDerWaalsContact O-OG1 3.06Å; D99-I119 HydrophobicContact CB-CG2 4.06Å; D99-I119 WeakPolarHBondContact OD2-CG2 3.42Å
100	C	89.5	Confident	82.1	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-56.6	-46.1	174.1	-168.8	0	0	0	0	111.8	C58 F62 C96 S97 T103 C104 G121	C58-C100 HydrophobicContact CB-CB 3.95Å; C58-C100 WeakPolarHBondContact CB-SG 3.38Å; C58-C100 VanDerWaalsContact SG-C 3.53Å; C58-C100 WeakPolarHBondContact SG-CB 3.34Å; C58-C100 CovalentContact SG-SG 2.05Å; C58-C100 PolarHBondContact SG-SG 3.47Å; F62-C100 HydrophobicContact CE2-CB 3.97Å; C96-C100 WeakPolarHBondContact O-CB 3.45Å; C96-C100 PolarHBondContact O-N 3.11Å; S97-C100 WeakPolarHBondContact O-CB 3.46Å; S97-C100 PolarHBondContact O-N 3.29Å; C100-T103 PolarHBondContact O-N 3.07Å; C100-C104 PolarHBondContact O-N 2.84Å; C100-C104 PolarHBondContact O-SG 3.09Å; C100-C104 VanDerWaalsContact O-SG 3.36Å; C100-G121 WeakPolarHBondContact CA-O 3.45Å; C100-G121 PolarHBondContact N-O 2.89Å
101	F	89	Confident	82.5	Confident	61 Å²	61	67.5 Å²	67.5	27%	0.268	34%	0.34	S	S	.	.	H	α-helix	trans	-66.4	-42.5	-179	-82.8	-126.6	0	0	0	112.6	K55 C58 L59 S97 S98 D99 T103 C104	K55-F101 HydrophobicContact CB-CD1 4.25Å; K55-F101 HydrophobicContact CD-CD1 4.3Å; K55-F101 VanDerWaalsContact CE-O 3.27Å; K55-F101 WeakPolarHBondContact CE-O 3.33Å; K55-F101 HydrophobicContact CG-CD1 4.1Å; K55-F101 HydrophobicContact CG-CG 4.4Å; C58-F101 HydrophobicContact CB-CD2 3.68Å; C58-F101 HydrophobicContact CB-CE2 3.77Å; L59-F101 HydrophobicContact CB-CZ 4.49Å; L59-F101 HydrophobicContact CD1-CE1 4.2Å; L59-F101 HydrophobicContact CD1-CZ 4.03Å; L59-F101 HydrophobicContact CD2-CE1 4.23Å; L59-F101 HydrophobicContact CD2-CE2 4.25Å; L59-F101 HydrophobicContact CD2-CZ 3.41Å; L59-F101 VanDerWaalsContact CD2-CZ 3.41Å; L59-F101 HydrophobicContact CG-CE1 3.96Å; L59-F101 HydrophobicContact CG-CE2 4.02Å; L59-F101 HydrophobicContact CG-CZ 3.29Å; S97-F101 WeakPolarHBondContact O-CD2 3.46Å; S97-F101 PolarHBondContact O-N 2.55Å; S98-F101 PolarHBondContact O-N 3.17Å; D99-F101 VanDerWaalsContact C-N 3.34Å; D99-F101 PolarHBondContact O-N 3.03Å; F101-T103 VanDerWaalsContact C-N 3.28Å; F101-T103 PolarHBondContact O-N 3.17Å; F101-C104 WeakPolarHBondContact O-CB 3.11Å; F101-C104 PolarHBondContact O-N 3.32Å
102	R	87.9	Confident	82.9	Confident	194 Å²	194	65.7 Å²	65.7	73%	0.732	33%	0.33	S	S	*	.	H	α-helix	trans	-63.6	-38.5	178.8	-174.8	178.4	178.1	178	-0.3	110.7	S98 D99 C104 D105	S98-R102 PolarHBondContact O-N 2.77Å; D99-R102 PolarHBondContact O-N 2.79Å; R102-C104 VanDerWaalsContact C-N 3.35Å; R102-C104 PolarHBondContact O-N 2.78Å; R102-D105 WeakPolarHBondContact O-CB 3.38Å; R102-D105 PolarHBondContact O-N 2.86Å
103	T	90	Very high	83.3	Confident	4 Å²	4	68.6 Å²	68.6	3%	0.025	35%	0.35	C	S	.	.	H	α-helix	trans	-65.6	-35.2	178.3	-64.6	0	0	0	0	113.3	D99 C100 F101 D105 L106 C111 C122 C126	D99-T103 PolarHBondContact O-N 2.87Å; D99-T103 PolarHBondContact O-OG1 2.84Å; D99-T103 VanDerWaalsContact O-OG1 3.06Å; C100-T103 PolarHBondContact O-N 3.07Å; F101-T103 VanDerWaalsContact C-N 3.28Å; F101-T103 PolarHBondContact O-N 3.17Å; T103-D105 PolarHBondContact O-N 3Å; T103-L106 HydrophobicContact CG2-CD1 4.36Å; T103-L106 WeakPolarHBondContact O-CB 3.31Å; T103-L106 PolarHBondContact O-N 2.87Å; T103-C111 WeakPolarHBondContact CG2-SG 3.29Å; T103-C122 WeakPolarHBondContact CG2-O 3.28Å; T103-C122 WeakPolarHBondContact OG1-CA 3.18Å; T103-C122 PolarHBondContact OG1-SG 2.8Å; T103-C126 HydrophobicContact CG2-CB 4.33Å; T103-C126 WeakPolarHBondContact CG2-SG 3.27Å
104	C	89.8	Confident	83.4	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-23.6	176.5	-66.4	0	0	0	0	113.2	R47 R51 C54 K55 C58 C100 F101 R102	R47-C104 PolarHBondContact NH1-O 2.82Å; R47-C104 PolarHBondContact NH2-O 2.87Å; R51-C104 WeakPolarHBondContact CG-O 3.22Å; C54-C104 HydrophobicContact CB-CB 3.67Å; C54-C104 WeakPolarHBondContact CB-SG 3.15Å; C54-C104 WeakPolarHBondContact SG-CB 3.28Å; C54-C104 CovalentContact SG-SG 2.04Å; C54-C104 PolarHBondContact SG-SG 2.8Å; K55-C104 HydrophobicContact CG-CB 3.87Å; K55-C104 PolarHBondContact N-SG 3.31Å; C58-C104 VanDerWaalsContact SG-SG 3.7Å; C100-C104 PolarHBondContact O-N 2.84Å; C100-C104 PolarHBondContact O-SG 3.09Å; C100-C104 VanDerWaalsContact O-SG 3.36Å; F101-C104 WeakPolarHBondContact O-CB 3.11Å; F101-C104 PolarHBondContact O-N 3.32Å; R102-C104 VanDerWaalsContact C-N 3.35Å; R102-C104 PolarHBondContact O-N 2.78Å
105	D	88.3	Confident	83.4	Confident	60 Å²	60	63.7 Å²	63.7	32%	0.321	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-17.6	177.8	-65.3	-38.4	0	0	0	113.7	R47 R51 K55 R102 T103	R47-D105 VanDerWaalsContact NH2-C 3.28Å; R47-D105 PolarHBondContact NH2-O 2.76Å; R51-D105 IonicContact CZ-OD1 3.69Å; R51-D105 IonicContact NE-OD1 3Å; R51-D105 PolarHBondContact NE-OD1 2.8Å; R51-D105 VanDerWaalsContact NH2-CG 3.31Å; R51-D105 IonicContact NH2-OD1 2.89Å; R51-D105 PolarHBondContact NH2-OD1 2.98Å; R51-D105 IonicContact NH2-OD2 3.57Å; K55-D105 VanDerWaalsContact CE-OD1 3.3Å; K55-D105 WeakPolarHBondContact CE-OD1 3.35Å; K55-D105 VanDerWaalsContact NZ-CG 3.28Å; K55-D105 IonicContact NZ-OD1 3.07Å; K55-D105 PolarHBondContact NZ-OD1 3.47Å; K55-D105 IonicContact NZ-OD2 3.82Å; K55-D105 PolarHBondContact NZ-OD2 2.88Å; R102-D105 WeakPolarHBondContact O-CB 3.38Å; R102-D105 PolarHBondContact O-N 2.86Å; T103-D105 PolarHBondContact O-N 3Å
106	L	86.2	Confident	82.9	Confident	50 Å²	50	58.3 Å²	58.3	26%	0.262	32%	0.319	S	S	.	.	S	Bend	trans	-76	146.2	176.5	-61.4	177.3	0	0	0	112.2	R47 T103 H114	R47-L106 PolarHBondContact NH2-O 3.3Å; T103-L106 HydrophobicContact CG2-CD1 4.36Å; T103-L106 WeakPolarHBondContact O-CB 3.31Å; T103-L106 PolarHBondContact O-N 2.87Å; L106-H114 HydrophobicContact CD1-CB 3.91Å
107	P	81.5	Confident	82.1	Confident	46 Å²	46	63.3 Å²	63.3	30%	0.299	35%	0.345	S	S	.	.			trans	-64.3	139.4	175.6	26.3	-31	0	0	0	110.7	T109 E110 C111	P107-T109 PolarHBondContact O-N 2.83Å; P107-E110 HydrophobicContact CG-CB 4Å; P107-E110 HydrophobicContact CG-CG 4.03Å; P107-E110 VanDerWaalsContact CG-OE2 3.27Å; P107-E110 WeakPolarHBondContact CG-OE2 3.36Å; P107-E110 PolarHBondContact O-N 2.72Å; P107-E110 VanDerWaalsContact O-N 3.14Å; P107-C111 PolarHBondContact O-N 3.49Å; P107-C111 VanDerWaalsContact O-N 3.15Å
108	P	75.8	Confident	81.3	Confident	45 Å²	45	71.5 Å²	71.5	29%	0.292	38%	0.378	S	S	.	.	H	α-helix	trans	-55.5	-38.7	-174.7	-24.8	32.1	0	0	0	113.6	E110 C111 I129	P108-E110 VanDerWaalsContact C-N 3.32Å; P108-E110 PolarHBondContact O-N 2.86Å; P108-C111 WeakPolarHBondContact O-CB 3.26Å; P108-C111 PolarHBondContact O-N 2.81Å; P108-I129 HydrophobicContact CG-CG1 4.13Å
109	T	76.2	Confident	80.9	Confident	130 Å²	130	71.3 Å²	71.3	80%	0.798	37%	0.37	S	S	*	.	H	α-helix	trans	-67	-27.5	-177.3	50.5	0	0	0	0	114.1	P107	P107-T109 PolarHBondContact O-N 2.83Å
110	E	79.9	Confident	80.5	Confident	96 Å²	96	70.3 Å²	70.3	45%	0.449	37%	0.365	S	S	.	.	H	α-helix	trans	-106.7	-2.5	-177.3	-52.1	173	172.6	0	0	111.7	P107 P108 L112 S113 H114	P107-E110 HydrophobicContact CG-CB 4Å; P107-E110 HydrophobicContact CG-CG 4.03Å; P107-E110 VanDerWaalsContact CG-OE2 3.27Å; P107-E110 WeakPolarHBondContact CG-OE2 3.36Å; P107-E110 PolarHBondContact O-N 2.72Å; P107-E110 VanDerWaalsContact O-N 3.14Å; P108-E110 VanDerWaalsContact C-N 3.32Å; P108-E110 PolarHBondContact O-N 2.86Å; E110-L112 PolarHBondContact O-N 3.33Å; E110-S113 PolarHBondContact O-N 2.89Å; E110-S113 VanDerWaalsContact O-N 3.14Å; E110-S113 PolarHBondContact O-OG 2.82Å; E110-H114 PolarHBondContact O-CD2 2.85Å; E110-H114 VanDerWaalsContact O-CD2 3.24Å; E110-H114 PolarHBondContact O-N 3.36Å
111	C	79.1	Confident	80.2	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.014	37%	0.365	C	S	.	.	H	α-helix	trans	-60.3	-50.4	-170	-161.8	0	0	0	0	112.2	T103 P107 P108 S113 H114 C115 C126	T103-C111 WeakPolarHBondContact CG2-SG 3.29Å; P107-C111 PolarHBondContact O-N 3.49Å; P107-C111 VanDerWaalsContact O-N 3.15Å; P108-C111 WeakPolarHBondContact O-CB 3.26Å; P108-C111 PolarHBondContact O-N 2.81Å; C111-S113 VanDerWaalsContact C-N 3.26Å; C111-S113 PolarHBondContact O-N 2.84Å; C111-H114 PolarHBondContact O-N 3.16Å; C111-H114 VanDerWaalsContact O-N 3.16Å; C111-C115 PolarHBondContact O-N 2.91Å; C111-C115 VanDerWaalsContact O-N 3.08Å; C111-C126 HydrophobicContact CB-CB 3.9Å; C111-C126 WeakPolarHBondContact CB-SG 3.46Å; C111-C126 PolarHBondContact O-SG 2.87Å; C111-C126 VanDerWaalsContact O-SG 3.36Å; C111-C126 WeakPolarHBondContact SG-CA 3.45Å; C111-C126 WeakPolarHBondContact SG-CB 3.35Å; C111-C126 CovalentContact SG-SG 2.04Å; C111-C126 PolarHBondContact SG-SG 2.99Å
112	L	72.7	Confident	80	Confident	104 Å²	104	68 Å²	68	55%	0.545	36%	0.356	S	S	.	.	H	α-helix	trans	-64.7	-28	179.2	-69.6	171.9	0	0	0	112.9	E110 C126	E110-L112 PolarHBondContact O-N 3.33Å; L112-C126 HydrophobicContact CD2-CB 4.27Å
113	S	77	Confident	79.7	Confident	97 Å²	97	59 Å²	59	68%	0.678	32%	0.322	S	S	*	.	H	α-helix	trans	-75	-27.3	176.1	60.9	0	0	0	0	113.6	E110 C111	E110-S113 PolarHBondContact O-N 2.89Å; E110-S113 VanDerWaalsContact O-N 3.14Å; E110-S113 PolarHBondContact O-OG 2.82Å; C111-S113 VanDerWaalsContact C-N 3.26Å; C111-S113 PolarHBondContact O-N 2.84Å
114	H	79.5	Confident	79.4	Confident	116 Å²	116	58.9 Å²	58.9	54%	0.537	32%	0.321	S	S	.	.	H	α-helix	trans	-90.3	-23.8	179.9	-77.4	-66.3	0	0	0	113.4	L106 E110 C111	L106-H114 HydrophobicContact CD1-CB 3.91Å; E110-H114 PolarHBondContact O-CD2 2.85Å; E110-H114 VanDerWaalsContact O-CD2 3.24Å; E110-H114 PolarHBondContact O-N 3.36Å; C111-H114 PolarHBondContact O-N 3.16Å; C111-H114 VanDerWaalsContact O-N 3.16Å
115	C	80.1	Confident	79.2	Confident	6 Å²	6	58.9 Å²	58.9	4%	0.041	32%	0.321	C	S	.	.	S	Bend	trans	-87	112.5	177.4	-72.6	0	0	0	0	111.5	C111 C122 Q123 C126	C111-C115 PolarHBondContact O-N 2.91Å; C111-C115 VanDerWaalsContact O-N 3.08Å; C115-C122 WeakPolarHBondContact CA-SG 3.22Å; C115-C122 HydrophobicContact CB-CB 3.76Å; C115-C122 WeakPolarHBondContact CB-SG 3.35Å; C115-C122 VanDerWaalsContact SG-C 3.55Å; C115-C122 WeakPolarHBondContact SG-CB 2.97Å; C115-C122 PolarHBondContact SG-O 2.88Å; C115-C122 CovalentContact SG-SG 2.02Å; C115-C122 PolarHBondContact SG-SG 3.38Å; C115-Q123 PolarHBondContact O-NE2 2.89Å; C115-C126 PolarHBondContact SG-SG 2.86Å
116	S	72.7	Confident	79	Confident	74 Å²	74	56.2 Å²	56.2	52%	0.517	31%	0.307	S	S	.	.			trans	-66.1	144.4	168.9	-55.3	0	0	0	0	111.2	K118 I119	S116-K118 PolarHBondContact O-N 3.45Å; S116-I119 PolarHBondContact O-N 3.12Å
117	D	66.7	Low	78.8	Confident	112 Å²	112	55.8 Å²	55.8	60%	0.599	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-25	-179.3	-61.3	-36.5	0	0	0	113.7	I119	D117-I119 VanDerWaalsContact C-N 3.33Å; D117-I119 PolarHBondContact O-N 2.59Å
118	K	71	Confident	78.9	Confident	194 Å²	194	54 Å²	54	84%	0.843	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-21.8	178.4	-64.1	-175.2	179.4	-179.1	0	114	S116 I120	S116-K118 PolarHBondContact O-N 3.45Å; K118-I120 PolarHBondContact O-N 2.93Å
119	I	79	Confident	79.2	Confident	68 Å²	68	51.9 Å²	51.9	35%	0.349	28%	0.278	S	S	.	.			trans	-97.2	87.1	-174.8	-50.8	178.3	0	0	0	108.9	D99 S116 D117 G121 C122 Q123	D99-I119 HydrophobicContact CB-CG2 4.06Å; D99-I119 WeakPolarHBondContact OD2-CG2 3.42Å; S116-I119 PolarHBondContact O-N 3.12Å; D117-I119 VanDerWaalsContact C-N 3.33Å; D117-I119 PolarHBondContact O-N 2.59Å; I119-G121 PolarHBondContact O-N 2.86Å; I119-C122 HydrophobicContact CB-CB 3.89Å; I119-C122 HydrophobicContact CG2-CB 3.64Å; I119-C122 WeakPolarHBondContact O-CB 3.49Å; I119-C122 PolarHBondContact O-N 2.87Å; I119-Q123 PolarHBondContact O-N 3.08Å
120	I	78.5	Confident	79.3	Confident	18 Å²	18	50.1 Å²	50.1	9%	0.092	26%	0.26	C	S	.	.	H	α-helix	trans	-56.6	-46.7	-175	-49	-165.1	0	0	0	111.9	L83 W85 C88 K118 C122 Q123 I124	L83-I120 HydrophobicContact CB-CD1 4.36Å; L83-I120 HydrophobicContact CD2-CB 4.23Å; L83-I120 HydrophobicContact CD2-CD1 3.93Å; L83-I120 HydrophobicContact CD2-CG1 3.57Å; L83-I120 HydrophobicContact CD2-CG2 4.23Å; L83-I120 HydrophobicContact CG-CD1 4.04Å; L83-I120 HydrophobicContact CG-CG1 4.12Å; W85-I120 HydrophobicContact CD2-CG2 3.85Å; W85-I120 HydrophobicContact CE3-CG2 3.26Å; W85-I120 HydrophobicContact CH2-CG2 3.47Å; W85-I120 VanDerWaalsContact CH2-CG2 3.47Å; W85-I120 HydrophobicContact CZ2-CG2 4.01Å; W85-I120 HydrophobicContact CZ3-CG2 3.09Å; C88-I120 HydrophobicContact CB-CB 4.33Å; C88-I120 HydrophobicContact CB-CD1 4.4Å; C88-I120 HydrophobicContact CB-CG2 4.08Å; K118-I120 PolarHBondContact O-N 2.93Å; I120-C122 PolarHBondContact O-N 2.04Å; I120-Q123 WeakPolarHBondContact O-CB 3.5Å; I120-Q123 PolarHBondContact O-N 2.82Å; I120-Q123 VanDerWaalsContact O-N 3.08Å; I120-I124 HydrophobicContact CG2-CD1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.15Å; I120-I124 PolarHBondContact O-N 2.87Å
121	G	82.7	Confident	79	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-57.6	-34.3	178.2	0	0	0	0	0	113.2	C96 C100 I119 I124 G125	C96-G121 WeakPolarHBondContact O-CA 3.3Å; C100-G121 WeakPolarHBondContact CA-O 3.45Å; C100-G121 PolarHBondContact N-O 2.89Å; I119-G121 PolarHBondContact O-N 2.86Å; G121-I124 PolarHBondContact O-N 2.89Å; G121-G125 PolarHBondContact O-N 3.21Å
122	C	86.4	Confident	78.7	Confident	13 Å²	13	49.5 Å²	49.5	9%	0.088	26%	0.257	C	S	.	.	H	α-helix	trans	-66	-45.5	176.2	-156.8	0	0	0	0	110.9	T103 C115 I119 I120 I124 G125 C126	T103-C122 WeakPolarHBondContact CG2-O 3.28Å; T103-C122 WeakPolarHBondContact OG1-CA 3.18Å; T103-C122 PolarHBondContact OG1-SG 2.8Å; C115-C122 WeakPolarHBondContact CA-SG 3.22Å; C115-C122 HydrophobicContact CB-CB 3.76Å; C115-C122 WeakPolarHBondContact CB-SG 3.35Å; C115-C122 VanDerWaalsContact SG-C 3.55Å; C115-C122 WeakPolarHBondContact SG-CB 2.97Å; C115-C122 PolarHBondContact SG-O 2.88Å; C115-C122 CovalentContact SG-SG 2.02Å; C115-C122 PolarHBondContact SG-SG 3.38Å; I119-C122 HydrophobicContact CB-CB 3.89Å; I119-C122 HydrophobicContact CG2-CB 3.64Å; I119-C122 WeakPolarHBondContact O-CB 3.49Å; I119-C122 PolarHBondContact O-N 2.87Å; I120-C122 PolarHBondContact O-N 2.04Å; C122-I124 PolarHBondContact O-N 3.43Å; C122-G125 PolarHBondContact O-N 2.87Å; C122-G125 VanDerWaalsContact O-N 3.15Å; C122-C126 PolarHBondContact O-N 2.81Å
123	Q	81.3	Confident	78.5	Confident	5 Å²	5	46.5 Å²	46.5	2%	0.023	25%	0.245	C	C	.	.	H	α-helix	trans	-61.9	-41.6	177.7	-64.1	-65.6	-26.2	0	0	112.2	C115 I119 I120 G125 C126 F127	C115-Q123 PolarHBondContact O-NE2 2.89Å; I119-Q123 PolarHBondContact O-N 3.08Å; I120-Q123 WeakPolarHBondContact O-CB 3.5Å; I120-Q123 PolarHBondContact O-N 2.82Å; I120-Q123 VanDerWaalsContact O-N 3.08Å; Q123-G125 VanDerWaalsContact C-N 3.34Å; Q123-G125 PolarHBondContact O-N 2.96Å; Q123-C126 PolarHBondContact O-N 2.82Å; Q123-F127 PolarHBondContact O-N 2.9Å; Q123-F127 VanDerWaalsContact O-N 3.14Å
124	I	82.8	Confident	77.6	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-57.6	-49.4	173.1	-59.8	169.8	0	0	0	109.9	L61 F62 F71 W85 F89 I120 G121 C122 C126 F127 L128	L61-I124 HydrophobicContact CD2-CG2 3.59Å; F62-I124 HydrophobicContact CE2-CD1 4.32Å; F62-I124 HydrophobicContact CZ-CD1 3.81Å; F71-I124 HydrophobicContact CE1-CG2 4.41Å; F71-I124 HydrophobicContact CZ-CG2 4.32Å; W85-I124 HydrophobicContact CH2-CD1 4.48Å; W85-I124 HydrophobicContact CH2-CG1 3.84Å; W85-I124 HydrophobicContact CZ3-CD1 3.68Å; W85-I124 HydrophobicContact CZ3-CG1 3.51Å; F89-I124 HydrophobicContact CZ-CD1 4.09Å; I120-I124 HydrophobicContact CG2-CD1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.15Å; I120-I124 PolarHBondContact O-N 2.87Å; G121-I124 PolarHBondContact O-N 2.89Å; C122-I124 PolarHBondContact O-N 3.43Å; I124-C126 VanDerWaalsContact C-N 3.33Å; I124-C126 PolarHBondContact O-N 2.8Å; I124-F127 PolarHBondContact O-N 3.09Å; I124-L128 HydrophobicContact CG2-CD1 3.86Å; I124-L128 HydrophobicContact CG2-CG 4.26Å; I124-L128 WeakPolarHBondContact O-CG 3.32Å; I124-L128 PolarHBondContact O-N 3.29Å
125	G	85.9	Confident	76.2	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.6	-41.6	179.5	0	0	0	0	0	113	G121 C122 Q123 L128 I129	G121-G125 PolarHBondContact O-N 3.21Å; C122-G125 PolarHBondContact O-N 2.87Å; C122-G125 VanDerWaalsContact O-N 3.15Å; Q123-G125 VanDerWaalsContact C-N 3.34Å; Q123-G125 PolarHBondContact O-N 2.96Å; G125-L128 PolarHBondContact O-N 3.02Å; G125-I129 PolarHBondContact O-N 3.01Å
126	C	84.3	Confident	74.7	Confident	4 Å²	4	50.9 Å²	50.9	3%	0.027	26%	0.258	C	S	.	.	H	α-helix	trans	-63.8	-44.4	178.4	-74.5	0	0	0	0	113	T103 C111 L112 C115 C122 Q123 I124 I129 E130	T103-C126 HydrophobicContact CG2-CB 4.33Å; T103-C126 WeakPolarHBondContact CG2-SG 3.27Å; C111-C126 HydrophobicContact CB-CB 3.9Å; C111-C126 WeakPolarHBondContact CB-SG 3.46Å; C111-C126 PolarHBondContact O-SG 2.87Å; C111-C126 VanDerWaalsContact O-SG 3.36Å; C111-C126 WeakPolarHBondContact SG-CA 3.45Å; C111-C126 WeakPolarHBondContact SG-CB 3.35Å; C111-C126 CovalentContact SG-SG 2.04Å; C111-C126 PolarHBondContact SG-SG 2.99Å; L112-C126 HydrophobicContact CD2-CB 4.27Å; C115-C126 PolarHBondContact SG-SG 2.86Å; C122-C126 PolarHBondContact O-N 2.81Å; Q123-C126 PolarHBondContact O-N 2.82Å; I124-C126 VanDerWaalsContact C-N 3.33Å; I124-C126 PolarHBondContact O-N 2.8Å; C126-I129 WeakPolarHBondContact O-CG2 3.44Å; C126-I129 PolarHBondContact O-N 3.39Å; C126-E130 WeakPolarHBondContact O-CB 3.26Å; C126-E130 PolarHBondContact O-N 3.14Å
127	F	81.3	Confident	73.4	Confident	42 Å²	42	51 Å²	51	18%	0.184	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-42.3	176.6	176.1	-95.8	0	0	0	112.1	F71 W75 Q123 I124 I129 E130 Q131	F71-F127 HydrophobicContact CE2-CD1 4.03Å; F71-F127 AromaticContact CE2-CE1 3.79Å; F71-F127 HydrophobicContact CE2-CE1 3.79Å; F71-F127 HydrophobicContact CZ-CD1 4.03Å; F71-F127 HydrophobicContact CZ-CE1 4.15Å; W75-F127 HydrophobicContact CE3-CD1 4.17Å; W75-F127 HydrophobicContact CE3-CD2 4.4Å; W75-F127 HydrophobicContact CE3-CE1 4.25Å; W75-F127 HydrophobicContact CE3-CE2 4.5Å; W75-F127 HydrophobicContact CE3-CG 4.2Å; W75-F127 HydrophobicContact CE3-CZ 4.4Å; W75-F127 HydrophobicContact CH2-CB 3.41Å; W75-F127 VanDerWaalsContact CH2-CB 3.41Å; W75-F127 HydrophobicContact CH2-CD1 4.38Å; W75-F127 HydrophobicContact CH2-CD2 4.01Å; W75-F127 AromaticContact CH2-CG 3.73Å; W75-F127 HydrophobicContact CH2-CG 3.73Å; W75-F127 HydrophobicContact CZ3-CB 3.36Å; W75-F127 AromaticContact CZ3-CD1 3.45Å; W75-F127 HydrophobicContact CZ3-CD1 3.45Å; W75-F127 VanDerWaalsContact CZ3-CD1 3.45Å; W75-F127 AromaticContact CZ3-CD2 3.61Å; W75-F127 HydrophobicContact CZ3-CD2 3.61Å; W75-F127 AromaticContact CZ3-CE1 3.97Å; W75-F127 HydrophobicContact CZ3-CE1 3.97Å; W75-F127 HydrophobicContact CZ3-CE2 4.13Å; W75-F127 AromaticContact CZ3-CG 3.21Å; W75-F127 HydrophobicContact CZ3-CG 3.21Å; W75-F127 HydrophobicContact CZ3-CZ 4.27Å; Q123-F127 PolarHBondContact O-N 2.9Å; Q123-F127 VanDerWaalsContact O-N 3.14Å; I124-F127 PolarHBondContact O-N 3.09Å; F127-I129 VanDerWaalsContact C-N 3.35Å; F127-I129 PolarHBondContact O-N 2.9Å; F127-E130 PolarHBondContact O-N 3.43Å; F127-Q131 HydrophobicContact CD1-CG 4.16Å; F127-Q131 HydrophobicContact CE1-CG 3.94Å; F127-Q131 HydrophobicContact CE2-CG 4.42Å; F127-Q131 VanDerWaalsContact CZ-CD 3.46Å; F127-Q131 HydrophobicContact CZ-CG 4.09Å; F127-Q131 WeakPolarHBondContact O-CB 3.41Å; F127-Q131 WeakPolarHBondContact O-CG 3.17Å; F127-Q131 PolarHBondContact O-N 2.61Å
128	L	83.1	Confident	72.2	Confident	9 Å²	9	48.6 Å²	48.6	5%	0.047	26%	0.258	C	S	.	.	H	α-helix	trans	-63.6	-40	178.1	-70.1	178.9	0	0	0	112	N57 F71 I124 G125 T132	N57-L128 HydrophobicContact CB-CD1 3.97Å; N57-L128 HydrophobicContact CB-CD2 4.05Å; N57-L128 HydrophobicContact CB-CG 4.44Å; F71-L128 HydrophobicContact CE2-CD2 4.33Å; I124-L128 HydrophobicContact CG2-CD1 3.86Å; I124-L128 HydrophobicContact CG2-CG 4.26Å; I124-L128 WeakPolarHBondContact O-CG 3.32Å; I124-L128 PolarHBondContact O-N 3.29Å; G125-L128 PolarHBondContact O-N 3.02Å; L128-T132 VanDerWaalsContact O-CG2 3.23Å; L128-T132 WeakPolarHBondContact O-CG2 3.33Å; L128-T132 PolarHBondContact O-N 2.9Å; L128-T132 PolarHBondContact O-OG1 2.92Å
129	I	84	Confident	70.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-67.5	-41.8	177.6	-167	68.8	0	0	0	111.4	R47 A50 C54 P108 G125 C126 F127 T132 C133	R47-I129 VanDerWaalsContact NH1-CD1 3.35Å; A50-I129 HydrophobicContact CB-CD1 4.33Å; C54-I129 HydrophobicContact CB-CB 4.23Å; C54-I129 HydrophobicContact CB-CD1 3.56Å; P108-I129 HydrophobicContact CG-CG1 4.13Å; G125-I129 PolarHBondContact O-N 3.01Å; C126-I129 WeakPolarHBondContact O-CG2 3.44Å; C126-I129 PolarHBondContact O-N 3.39Å; F127-I129 VanDerWaalsContact C-N 3.35Å; F127-I129 PolarHBondContact O-N 2.9Å; I129-T132 WeakPolarHBondContact CA-OG1 3.25Å; I129-T132 PolarHBondContact O-N 2.83Å; I129-T132 PolarHBondContact O-OG1 3.08Å; I129-C133 PolarHBondContact O-N 2.87Å; I129-C133 VanDerWaalsContact O-N 3.07Å; I129-C133 PolarHBondContact O-SG 2.81Å
130	E	77.8	Confident	68.2	Low	93 Å²	93	45.5 Å²	45.5	44%	0.435	25%	0.254	S	S	.	.	H	α-helix	trans	-58.9	-50.5	175.5	-170.7	173.3	-153.5	0	0	111	C126 F127 T132 C133 E134	C126-E130 WeakPolarHBondContact O-CB 3.26Å; C126-E130 PolarHBondContact O-N 3.14Å; F127-E130 PolarHBondContact O-N 3.43Å; E130-T132 VanDerWaalsContact C-N 3.32Å; E130-T132 PolarHBondContact O-N 2.97Å; E130-C133 WeakPolarHBondContact O-CB 3.48Å; E130-C133 PolarHBondContact O-N 3.03Å; E130-E134 PolarHBondContact O-N 2.98Å
131	Q	73.2	Confident	66.1	Low	78 Å²	78	49.6 Å²	49.6	36%	0.364	28%	0.284	S	S	.	.	H	α-helix	trans	-59.6	-38	175.9	-75.5	-164.9	-34.4	0	0	113.6	F127 C133 E134 N135	F127-Q131 HydrophobicContact CD1-CG 4.16Å; F127-Q131 HydrophobicContact CE1-CG 3.94Å; F127-Q131 HydrophobicContact CE2-CG 4.42Å; F127-Q131 VanDerWaalsContact CZ-CD 3.46Å; F127-Q131 HydrophobicContact CZ-CG 4.09Å; F127-Q131 WeakPolarHBondContact O-CB 3.41Å; F127-Q131 WeakPolarHBondContact O-CG 3.17Å; F127-Q131 PolarHBondContact O-N 2.61Å; Q131-C133 VanDerWaalsContact C-N 3.28Å; Q131-C133 PolarHBondContact O-N 2.79Å; Q131-E134 PolarHBondContact O-N 2.86Å; Q131-N135 WeakPolarHBondContact O-CB 3.41Å; Q131-N135 PolarHBondContact O-N 2.85Å; Q131-N135 VanDerWaalsContact O-N 3.08Å; Q131-N135 PolarHBondContact O-ND2 3Å
132	T	72.5	Confident	63.6	Low	6 Å²	6	56.7 Å²	56.7	4%	0.037	32%	0.322	C	S	.	.	H	α-helix	trans	-70	-27.1	178	56.5	0	0	0	0	113	R53 L128 I129 E130	R53-T132 HydrophobicContact CB-CG2 4.06Å; R53-T132 PolarHBondContact NH1-O 3.33Å; L128-T132 VanDerWaalsContact O-CG2 3.23Å; L128-T132 WeakPolarHBondContact O-CG2 3.33Å; L128-T132 PolarHBondContact O-N 2.9Å; L128-T132 PolarHBondContact O-OG1 2.92Å; I129-T132 WeakPolarHBondContact CA-OG1 3.25Å; I129-T132 PolarHBondContact O-N 2.83Å; I129-T132 PolarHBondContact O-OG1 3.08Å; E130-T132 VanDerWaalsContact C-N 3.32Å; E130-T132 PolarHBondContact O-N 2.97Å
133	C	68.3	Low	61.1	Low	41 Å²	41	58.3 Å²	58.3	28%	0.277	33%	0.333	S	S	.	.	H	α-helix	trans	-77.7	-34.1	175.2	-75.3	0	0	0	0	112.2	I129 E130 Q131	I129-C133 PolarHBondContact O-N 2.87Å; I129-C133 VanDerWaalsContact O-N 3.07Å; I129-C133 PolarHBondContact O-SG 2.81Å; E130-C133 WeakPolarHBondContact O-CB 3.48Å; E130-C133 PolarHBondContact O-N 3.03Å; Q131-C133 VanDerWaalsContact C-N 3.28Å; Q131-C133 PolarHBondContact O-N 2.79Å
134	E	57.7	Low	58.7	Low	128 Å²	128	63.4 Å²	63.4	60%	0.598	36%	0.361	S	S	*	.	H	α-helix	trans	-78.7	-24.7	176.6	-69	-174.6	163.1	0	0	114.5	E130 Q131	E130-E134 PolarHBondContact O-N 2.98Å; Q131-E134 PolarHBondContact O-N 2.86Å
135	N	51.4	Low	56.3	Low	103 Å²	103	73 Å²	73	55%	0.551	40%	0.398	S	S	*	.	S	Bend	trans	-115.7	63.9	-176.7	-62.9	-73.9	0	0	0	110.9	R53 Q131	R53-N135 PolarHBondContact NH2-O 2.98Å; Q131-N135 WeakPolarHBondContact O-CB 3.41Å; Q131-N135 PolarHBondContact O-N 2.85Å; Q131-N135 VanDerWaalsContact O-N 3.08Å; Q131-N135 PolarHBondContact O-ND2 3Å
136	Q	48.8	Very low	53.9	Low	81 Å²	81	78.8 Å²	78.8	38%	0.379	43%	0.429	S	S	.	.			trans	-74.1	132.9	177.4	-60.4	-166.6	12	0	0	111	G138 E139	Q136-G138 PolarHBondContact O-N 2.89Å; Q136-G138 VanDerWaalsContact O-N 3.07Å; Q136-E139 HydrophobicContact CB-CG 4.12Å; Q136-E139 WeakPolarHBondContact CB-OE2 3.45Å; Q136-E139 PolarHBondContact N-OE2 2.79Å; Q136-E139 PolarHBondContact O-N 2.73Å
137	P	45.1	Very low	51.3	Low	77 Å²	77	85.2 Å²	85.2	50%	0.5	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	116	173.8	-17.5	28.3	0	0	0	109.1	R53 Y299	R53-P137 VanDerWaalsContact CZ-CD 3.47Å; R53-P137 VanDerWaalsContact NH1-CD 3.29Å; P137-Y299 WeakPolarHBondContact CG-O 3.45Å
138	G	41	Very low	48.9	Very low	60 Å²	60	89 Å²	89	62%	0.619	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.5	-8.8	-176.8	0	0	0	0	0	114.6	Q136 C140	Q136-G138 PolarHBondContact O-N 2.89Å; Q136-G138 VanDerWaalsContact O-N 3.07Å; G138-C140 PolarHBondContact O-N 2.78Å
139	E	35.5	Very low	46.5	Very low	108 Å²	108	94 Å²	94	51%	0.505	51%	0.509	S	S	.	.	S	Bend	trans	-67.4	124.8	157.5	-78.2	172.7	149.6	0	0	107.8	Q136 S141	Q136-E139 HydrophobicContact CB-CG 4.12Å; Q136-E139 WeakPolarHBondContact CB-OE2 3.45Å; Q136-E139 PolarHBondContact N-OE2 2.79Å; Q136-E139 PolarHBondContact O-N 2.73Å; E139-S141 PolarHBondContact O-N 2.71Å
140	C	30.8	Very low	44.2	Very low	90 Å²	90	101.1 Å²	101.1	61%	0.608	55%	0.547	S	S	*	.			trans	-54.7	117.4	167.5	-66	0	0	0	0	106.1	G138 N142	G138-C140 PolarHBondContact O-N 2.78Å; C140-N142 PolarHBondContact O-N 2.97Å; C140-N142 VanDerWaalsContact O-N 3.11Å
141	S	33.3	Very low	41.9	Very low	104 Å²	104	103.1 Å²	103.1	73%	0.727	56%	0.56	S	S	*	*			trans	-43.6	130.7	168.9	-90.9	0	0	0	0	106.8	E139 S143	E139-S141 PolarHBondContact O-N 2.71Å; S141-S143 PolarHBondContact O-N 3.16Å
142	N	31.2	Very low	39.8	Very low	149 Å²	149	109.1 Å²	109.1	80%	0.797	58%	0.579	S	S	*	*			trans	-68.3	60.1	172	-129.5	-0.9	0	0	0	107.5	C140 N144	C140-N142 PolarHBondContact O-N 2.97Å; C140-N142 VanDerWaalsContact O-N 3.11Å; N142-N144 PolarHBondContact O-N 2.78Å
143	S	33.4	Very low	37.7	Very low	46 Å²	46	114.3 Å²	114.3	32%	0.322	61%	0.611	S	S	.	*			trans	-78.5	81.2	179.5	70.9	0	0	0	0	105.5	S141 Y145 L146	S141-S143 PolarHBondContact O-N 3.16Å; S143-Y145 PolarHBondContact O-N 2.6Å; S143-L146 PolarHBondContact O-N 3.49Å; S143-L146 VanDerWaalsContact O-N 3.07Å
144	N	30.7	Very low	36	Very low	113 Å²	113	118 Å²	118	60%	0.604	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.5	-11.6	155.8	-79.3	-28.5	0	0	0	111.7	N142 L146 M147	N142-N144 PolarHBondContact O-N 2.78Å; N144-L146 VanDerWaalsContact C-N 3.28Å; N144-L146 PolarHBondContact O-N 3Å; N144-M147 PolarHBondContact O-N 3.12Å
145	Y	32.6	Very low	34.7	Very low	200 Å²	200	117.3 Å²	117.3	78%	0.784	64%	0.644	S	S	*	*	H	α-helix	trans	-59.2	-27.1	169.7	-63.9	-71.4	0	0	0	115	S143	S143-Y145 PolarHBondContact O-N 2.6Å
146	L	36.2	Very low	33.7	Very low	123 Å²	123	118.9 Å²	118.9	64%	0.644	65%	0.651	S	S	*	*	H	α-helix	trans	-84.1	-22.7	178.5	-78.7	166.4	0	0	0	114	S143 N144	S143-L146 PolarHBondContact O-N 3.49Å; S143-L146 VanDerWaalsContact O-N 3.07Å; N144-L146 VanDerWaalsContact C-N 3.28Å; N144-L146 PolarHBondContact O-N 3Å
147	M	29.2	Very low	32.8	Very low	139 Å²	139	122.9 Å²	122.9	69%	0.685	68%	0.675	S	S	*	*	H	α-helix	trans	-78.7	-21.9	174.9	-103.6	-160.6	-71.5	0	0	112.8	N144 D149	N144-M147 PolarHBondContact O-N 3.12Å; M147-D149 VanDerWaalsContact C-N 3.32Å
148	N	31.1	Very low	32	Very low	120 Å²	120	126.7 Å²	126.7	64%	0.642	69%	0.686	S	S	*	*	H	α-helix	trans	-77.3	-19.5	179.3	-119.2	8.7	0	0	0	113.5
149	D	32.7	Very low	31.3	Very low	116 Å²	116	130.6 Å²	130.6	62%	0.62	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-16.1	178.5	-75.9	-23.1	0	0	0	113.6	M147	M147-D149 VanDerWaalsContact C-N 3.32Å
150	L	35.8	Very low	31	Very low	149 Å²	149	132.7 Å²	132.7	78%	0.78	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-20.3	175.3	-84.7	151.5	0	0	0	113.5
151	N	29.8	Very low	30.8	Very low	134 Å²	134	138.1 Å²	138.1	72%	0.717	72%	0.724	S	S	*	*	S	Bend	trans	-93.3	0.1	177.5	-78.8	-8.8	0	0	0	113.9	T153	N151-T153 PolarHBondContact O-N 3.42Å
152	R	29.3	Very low	30.5	Very low	205 Å²	205	139.1 Å²	139.1	77%	0.774	73%	0.726	S	S	*	*			trans	-77.9	85.7	162.1	-80	-172.3	-177.6	-134.2	1	108.6
153	T	28.8	Very low	30.2	Very low	114 Å²	114	140.6 Å²	140.6	70%	0.699	73%	0.728	S	S	*	*			trans	-46.7	127.7	160.8	39.4	0	0	0	0	108.8	N151 S155	N151-T153 PolarHBondContact O-N 3.42Å; T153-S155 VanDerWaalsContact C-N 3.34Å; T153-S155 PolarHBondContact O-N 2.88Å
154	P	32.7	Very low	29.8	Very low	120 Å²	120	148.6 Å²	148.6	78%	0.779	75%	0.753	S	S	*	*			trans	-71.9	91.6	-174.1	26.3	-31.3	0	0	0	109.1	I156	P154-I156 PolarHBondContact O-N 3.12Å
155	S	28.4	Very low	29.6	Very low	113 Å²	113	151 Å²	151	79%	0.79	77%	0.766	S	S	*	*			trans	-68	91.6	163.1	-66.6	0	0	0	0	107.9	T153 N157	T153-S155 VanDerWaalsContact C-N 3.34Å; T153-S155 PolarHBondContact O-N 2.88Å; S155-N157 PolarHBondContact O-N 3.05Å; S155-N157 VanDerWaalsContact O-N 3.12Å
156	I	31	Very low	29.2	Very low	136 Å²	136	145 Å²	145	70%	0.697	77%	0.765	S	S	*	*			trans	-16.6	106.5	153.6	-64.7	165.1	0	0	0	111	P154	P154-I156 PolarHBondContact O-N 3.12Å
157	N	29.6	Very low	28.8	Very low	165 Å²	165	149.1 Å²	149.1	88%	0.882	77%	0.772	S	S	*	*			trans	-143.3	109.1	143.7	-97.6	-32.8	0	0	0	107.8	S155	S155-N157 PolarHBondContact O-N 3.05Å; S155-N157 VanDerWaalsContact O-N 3.12Å
158	Q	28	Very low	28.5	Very low	157 Å²	157	152.3 Å²	152.3	73%	0.734	78%	0.782	S	S	*	*			trans	-59.8	163.3	175.5	-66.1	162.9	-6.9	0	0	109.9
159	N	27.7	Very low	28.2	Very low	141 Å²	141	155.5 Å²	155.5	75%	0.754	79%	0.786	S	S	*	*			trans	93.3	74.7	171.4	-44.3	-21.4	0	0	0	114.2
160	N	28.6	Very low	27.9	Very low	153 Å²	153	155.2 Å²	155.2	82%	0.818	79%	0.791	S	S	*	*				-170	104.4	109.3	-85.4	-22	0	0	0	109.9	T162	N160-T162 PolarHBondContact O-N 3.32Å
161	Q	26.3	Very low	27.5	Very low	203 Å²	203	154.3 Å²	154.3	95%	0.949	79%	0.791	S	S	*	*			trans	-64.9	97.6	174.2	-67.7	172.7	-17	0	0	109.6
162	T	27.6	Very low	27.4	Very low	126 Å²	126	153.7 Å²	153.7	77%	0.773	79%	0.791	S	S	*	*			trans	-126.6	89	160	25.1	0	0	0	0	109.3	N160	N160-T162 PolarHBondContact O-N 3.32Å
163	Q	25.3	Very low	27.3	Very low	180 Å²	180	151.1 Å²	151.1	84%	0.841	79%	0.793	S	S	*	*			trans	53.6	82.3	130.8	-143.2	168.8	1.9	0	0	117.8
164	Y	24.4	Very low	27.1	Very low	214 Å²	214	153 Å²	153	84%	0.839	80%	0.799	S	S	*	*				21.5	117.1	128.1	-78.6	-94.8	0	0	0	119
165	N	27.1	Very low	27	Very low	164 Å²	164	150 Å²	150	88%	0.877	78%	0.78	S	S	*	*				-161.7	76	126.8	-96.2	-24.9	0	0	0	110	R167	N165-R167 PolarHBondContact O-N 3.11Å; N165-R167 VanDerWaalsContact O-N 3.14Å
166	G	24.6	Very low	27.1	Very low	74 Å²	74	149 Å²	149	76%	0.763	78%	0.778	S	S	*	*			trans	-70.9	99.6	172.3	0	0	0	0	0	111.3	K168	G166-K168 PolarHBondContact O-N 3.21Å
167	R	27	Very low	26.8	Very low	209 Å²	209	149.6 Å²	149.6	79%	0.789	78%	0.783	S	S	*	*			trans	-74.4	96.5	165.5	-77.3	-178.9	174.6	-179.8	-0.8	109	N165 Y169	N165-R167 PolarHBondContact O-N 3.11Å; N165-R167 VanDerWaalsContact O-N 3.14Å; R167-Y169 HydrophobicContact CB-CE2 4.24Å; R167-Y169 PolarHBondContact O-N 2.93Å
168	K	23.7	Very low	26.7	Very low	206 Å²	206	148.3 Å²	148.3	90%	0.896	78%	0.777	S	S	*	*			trans	-68.5	112.8	165.8	-85	178.3	172.4	177.8	0	108.9	G166	G166-K168 PolarHBondContact O-N 3.21Å
169	Y	23.7	Very low	26.8	Very low	186 Å²	186	145.6 Å²	145.6	73%	0.729	77%	0.774	S	S	*	*			trans	-84.3	133.2	170.2	-70.8	-85.5	0	0	0	110.2	R167	R167-Y169 HydrophobicContact CB-CE2 4.24Å; R167-Y169 PolarHBondContact O-N 2.93Å
170	P	26.3	Very low	27.1	Very low	111 Å²	111	147.8 Å²	147.8	72%	0.721	78%	0.779	S	S	*	*			trans	-76.8	129.8	178.5	28.7	-30.7	0	0	0	111.5	V172	P170-V172 PolarHBondContact O-N 2.84Å
171	V	27.8	Very low	27.1	Very low	129 Å²	129	147.4 Å²	147.4	78%	0.782	78%	0.777	S	S	*	*			trans	-75	100.5	175.7	179.4	0	0	0	0	108.4
172	V	28	Very low	27.2	Very low	121 Å²	121	144.7 Å²	144.7	73%	0.733	77%	0.768	S	S	*	*			trans	-94.2	114.6	176.3	-179	0	0	0	0	108.4	P170	P170-V172 PolarHBondContact O-N 2.84Å
173	N	27	Very low	27.5	Very low	152 Å²	152	142.1 Å²	142.1	81%	0.813	76%	0.755	S	S	*	*			trans	-105.3	30.3	-157.5	-142.1	25.2	0	0	0	113.7
174	D	23.4	Very low	27.8	Very low	152 Å²	152	142.7 Å²	142.7	81%	0.813	76%	0.755	S	S	*	*			trans	-116.4	18.9	-162.2	-140.9	9.5	0	0	0	115.4
175	C	30.9	Very low	28.2	Very low	58 Å²	58	137 Å²	137	39%	0.392	74%	0.742	S	S	.	*			trans	-118.7	36.8	-170.3	-147	0	0	0	0	113.3
176	A	31	Very low	28.4	Very low	91 Å²	91	133.8 Å²	133.8	75%	0.752	73%	0.73	S	S	*	*	S	Bend	trans	-85.2	-20.9	171.6	0	0	0	0	0	113.1
177	N	25.6	Very low	28.9	Very low	149 Å²	149	134.9 Å²	134.9	80%	0.797	72%	0.718	S	S	*	*	S	Bend	trans	-105.1	-5.5	-167	-79.1	-10	0	0	0	116.5
178	N	26	Very low	29.1	Very low	139 Å²	139	131.9 Å²	131.9	74%	0.743	71%	0.713	S	S	*	*	S	Bend	trans	-109.1	6.1	-174.1	-79.7	-15.7	0	0	0	115.5	Q180	N178-Q180 PolarHBondContact O-N 2.83Å
179	C	31.6	Very low	29.7	Very low	100 Å²	100	128.1 Å²	128.1	68%	0.676	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	21.9	-177.8	-73.1	0	0	0	0	114.7
180	Q	32.4	Very low	30.2	Very low	186 Å²	186	123.7 Å²	123.7	87%	0.869	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.5	6	-173	-144.5	155	-12.3	0	0	114.8	N178	N178-Q180 PolarHBondContact O-N 2.83Å
181	L	30.3	Very low	30.7	Very low	146 Å²	146	122.3 Å²	122.3	76%	0.764	70%	0.695	S	S	*	*	S	Bend	trans	-132.9	129.2	176.6	-132	76.3	0	0	0	109.5	C183	L181-C183 PolarHBondContact O-N 2.81Å
182	D	28.6	Very low	30.9	Very low	145 Å²	145	125.8 Å²	125.8	78%	0.775	70%	0.699	S	S	*	*			trans	-24.4	123.6	177.9	-62.2	-51.1	0	0	0	113.7	K184	D182-K184 PolarHBondContact O-N 2.8Å
183	C	32.4	Very low	31	Very low	73 Å²	73	129 Å²	129	49%	0.493	70%	0.699	S	S	.	*			trans	-55.2	89.8	170.6	-71.6	0	0	0	0	109.3	L181 V185	L181-C183 PolarHBondContact O-N 2.81Å; C183-V185 PolarHBondContact O-N 3.38Å
184	K	32.7	Very low	31.1	Very low	191 Å²	191	131.8 Å²	131.8	83%	0.83	70%	0.704	S	S	*	*			trans	-70.8	13.7	179.6	-89.6	-175.4	175.9	-178.8	0	113.6	D182	D182-K184 PolarHBondContact O-N 2.8Å
185	V	31.9	Very low	31.5	Very low	96 Å²	96	127.8 Å²	127.8	58%	0.582	69%	0.687	S	S	*	*	S	Bend	trans	-122.2	116	173.5	-168.6	0	0	0	0	108.4	C183 L187	C183-V185 PolarHBondContact O-N 3.38Å; V185-L187 PolarHBondContact O-N 3.45Å
186	P	30.7	Very low	31.6	Very low	96 Å²	96	130.7 Å²	130.7	62%	0.623	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	133.7	172.4	-16.4	27.8	0	0	0	108.7
187	L	35.7	Very low	31.8	Very low	96 Å²	96	131.9 Å²	131.9	50%	0.503	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	98.6	13	171.1	-50	148.9	0	0	0	117.9	V185	V185-L187 PolarHBondContact O-N 3.45Å
188	Q	32.5	Very low	31.9	Very low	146 Å²	146	132.1 Å²	132.1	68%	0.682	70%	0.696	S	S	*	*			trans	-105.8	141.8	162.9	-87.2	-178.5	-3.7	0	0	111.9
189	T	35.3	Very low	32.1	Very low	127 Å²	127	130.9 Å²	130.9	78%	0.779	70%	0.698	S	S	*	*			trans	-117.1	134.5	170.1	42.7	0	0	0	0	110.3
190	C	35.1	Very low	31.9	Very low	93 Å²	93	131.1 Å²	131.1	63%	0.628	70%	0.697	S	S	*	*			trans	-88.3	123.3	175.1	-69.2	0	0	0	0	110.3	K192	C190-K192 PolarHBondContact O-N 2.77Å
191	C	35.9	Very low	31.8	Very low	82 Å²	82	129.3 Å²	129.3	55%	0.554	69%	0.693	S	S	*	*			trans	-78.8	111.7	173.4	-60.2	0	0	0	0	110.2	Y193	C191-Y193 VanDerWaalsContact C-N 3.32Å; C191-Y193 PolarHBondContact O-N 2.98Å; C191-Y193 VanDerWaalsContact O-N 3.11Å
192	K	31.9	Very low	32.1	Very low	203 Å²	203	126.4 Å²	126.4	88%	0.883	69%	0.685	S	S	*	*			trans	-80.2	77.4	168	-100.5	-176.1	178.1	173.9	0	109.7	C190	C190-K192 PolarHBondContact O-N 2.77Å
193	Y	30.1	Very low	32.6	Very low	187 Å²	187	126.3 Å²	126.3	73%	0.733	68%	0.683	S	S	*	*	S	Bend	trans	-132.9	160.7	156.9	-101.4	-91.3	0	0	0	109	C191 C195	C191-Y193 VanDerWaalsContact C-N 3.32Å; C191-Y193 PolarHBondContact O-N 2.98Å; C191-Y193 VanDerWaalsContact O-N 3.11Å; Y193-C195 PolarHBondContact O-N 2.9Å
194	K	30.1	Very low	33.2	Very low	211 Å²	211	129.8 Å²	129.8	92%	0.917	69%	0.687	S	S	*	*	S	Bend	trans	-63.4	52.2	173.9	-68.4	178.6	172.7	179.1	0	111.5
195	C	30.8	Very low	34.5	Very low	68 Å²	68	123.7 Å²	123.7	46%	0.459	66%	0.663	S	S	.	*			trans	-75.5	131.3	-166	-75.8	0	0	0	0	110.5	Y193 Q197	Y193-C195 PolarHBondContact O-N 2.9Å; C195-Q197 PolarHBondContact O-N 3.43Å
196	P	34	Very low	36.1	Very low	119 Å²	119	127.8 Å²	127.8	77%	0.773	67%	0.673	S	S	*	*			trans	-61.2	114.7	134.4	1	17.3	0	0	0	106.2	L198	P196-L198 PolarHBondContact O-N 3.45Å
197	Q	33.8	Very low	38	Very low	117 Å²	117	126 Å²	126	55%	0.547	66%	0.658	S	S	.	*			trans	-67	97.6	-168	-165.2	169.8	16.2	0	0	111	C195 S199	C195-Q197 PolarHBondContact O-N 3.43Å; Q197-S199 PolarHBondContact O-N 2.93Å
198	L	28.6	Very low	39.9	Very low	153 Å²	153	122 Å²	122	80%	0.801	64%	0.638	S	S	*	*			trans	-89.6	96.1	161.4	-88.3	145.9	0	0	0	107.3	P196 T200	P196-L198 PolarHBondContact O-N 3.45Å; L198-T200 PolarHBondContact O-N 2.8Å; L198-T200 PolarHBondContact O-OG1 3.05Å
199	S	28.9	Very low	42.3	Very low	113 Å²	113	115.1 Å²	115.1	79%	0.79	61%	0.606	S	S	*	*			trans	-65.8	82.5	164.3	57.3	0	0	0	0	107.9	Q197	Q197-S199 PolarHBondContact O-N 2.93Å
200	T	29.4	Very low	44.4	Very low	106 Å²	106	111.3 Å²	111.3	65%	0.65	58%	0.583	S	S	*	*			trans	-81.8	128.3	170.8	-33.5	0	0	0	0	106.1	L198 S202	L198-T200 PolarHBondContact O-N 2.8Å; L198-T200 PolarHBondContact O-OG1 3.05Å; T200-S202 PolarHBondContact O-N 2.89Å
201	D	29.7	Very low	46.4	Very low	148 Å²	148	111.3 Å²	111.3	79%	0.791	57%	0.57	S	S	*	*			trans	-47.9	131.9	168.8	-69.9	-46.3	0	0	0	108.1	I203	D201-I203 PolarHBondContact O-N 2.81Å
202	S	35.5	Very low	48.3	Very low	85 Å²	85	107.6 Å²	107.6	59%	0.594	55%	0.545	S	S	*	.			trans	-47.7	108.2	173	178.7	0	0	0	0	106.6	T200 Y204	T200-S202 PolarHBondContact O-N 2.89Å; S202-Y204 PolarHBondContact O-N 2.82Å
203	I	39.6	Very low	50.1	Low	143 Å²	143	104.3 Å²	104.3	73%	0.733	54%	0.536	S	S	*	.			trans	-65.5	96.9	172.8	-60.7	172.3	0	0	0	102.2	D201 N205	D201-I203 PolarHBondContact O-N 2.81Å; I203-N205 PolarHBondContact O-N 3.21Å
204	Y	46	Very low	52.1	Low	146 Å²	146	99.7 Å²	99.7	57%	0.573	52%	0.523	S	S	*	.			trans	-51.8	95.3	165.8	-108.5	-94.3	0	0	0	104.2	S202 K206	S202-Y204 PolarHBondContact O-N 2.82Å; Y204-K206 VanDerWaalsContact C-N 3.26Å; Y204-K206 PolarHBondContact O-N 2.86Å
205	N	59	Low	54.1	Low	62 Å²	62	90 Å²	90	33%	0.332	48%	0.481	S	S	.	.			trans	-67.2	102.7	178.1	-178	-6.4	0	0	0	103.9	I203 L207 V208 R302	I203-N205 PolarHBondContact O-N 3.21Å; N205-L207 PolarHBondContact O-N 3.47Å; N205-L207 WeakPolarHBondContact OD1-CB 3.12Å; N205-L207 VanDerWaalsContact OD1-CG 3.3Å; N205-L207 WeakPolarHBondContact OD1-CG 3.08Å; N205-L207 PolarHBondContact OD1-N 3.31Å; N205-L207 VanDerWaalsContact OD1-N 3.1Å; N205-V208 HydrophobicContact CB-CG2 3.86Å; N205-V208 PolarHBondContact O-N 3.19Å; N205-R302 PolarHBondContact O-NH2 3.14Å; N205-R302 VanDerWaalsContact O-NH2 3.1Å
206	K	65.8	Low	56	Low	183 Å²	183	90.3 Å²	90.3	80%	0.796	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-15.3	-176.4	-66.2	-178.6	-179.8	177.6	0	111	Y204 M242	Y204-K206 VanDerWaalsContact C-N 3.26Å; Y204-K206 PolarHBondContact O-N 2.86Å; K206-M242 WeakPolarHBondContact O-CE 3.49Å
207	L	71.3	Confident	57.9	Low	58 Å²	58	87.2 Å²	87.2	30%	0.304	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-17.9	176.3	-50.2	173.7	0	0	0	113.7	N205 M242 Y299	N205-L207 PolarHBondContact O-N 3.47Å; N205-L207 WeakPolarHBondContact OD1-CB 3.12Å; N205-L207 VanDerWaalsContact OD1-CG 3.3Å; N205-L207 WeakPolarHBondContact OD1-CG 3.08Å; N205-L207 PolarHBondContact OD1-N 3.31Å; N205-L207 VanDerWaalsContact OD1-N 3.1Å; L207-M242 WeakPolarHBondContact O-CE 3.21Å; L207-Y299 HydrophobicContact CB-CD1 4.2Å; L207-Y299 HydrophobicContact CB-CD2 3.47Å; L207-Y299 VanDerWaalsContact CB-CD2 3.47Å; L207-Y299 HydrophobicContact CB-CE1 4.49Å; L207-Y299 HydrophobicContact CB-CE2 3.79Å; L207-Y299 HydrophobicContact CB-CG 3.68Å; L207-Y299 HydrophobicContact CD1-CD1 4Å; L207-Y299 HydrophobicContact CD1-CD2 4.46Å; L207-Y299 HydrophobicContact CD1-CE1 3.74Å; L207-Y299 HydrophobicContact CD1-CE2 4.22Å; L207-Y299 HydrophobicContact CD1-CG 4.34Å; L207-Y299 HydrophobicContact CG-CE2 4.44Å
208	V	75.6	Confident	59.7	Low	13 Å²	13	86.8 Å²	86.8	8%	0.079	46%	0.46	C	S	.	.	S	Bend	trans	-78.8	134.7	175.6	-178.2	0	0	0	0	109.8	N205 M242 T301 R302	N205-V208 HydrophobicContact CB-CG2 3.86Å; N205-V208 PolarHBondContact O-N 3.19Å; V208-M242 WeakPolarHBondContact O-CE 3.26Å; V208-T301 VanDerWaalsContact CG1-C 3.48Å; V208-R302 HydrophobicContact CG1-CG 3.8Å; V208-R302 PolarHBondContact O-NH1 3.18Å; V208-R302 PolarHBondContact O-NH2 3.44Å
209	P	81.8	Confident	61.5	Low	0 Å²	0	82.8 Å²	82.8	0%	0	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-56.2	143.4	179.8	-29.8	35.9	0	0	0	114.7	Y235 M242 I245 A295 S297 R302	P209-Y235 HydrophobicContact CB-CE1 4.35Å; P209-M242 HydrophobicContact CB-CE 4.47Å; P209-M242 VanDerWaalsContact N-CE 3.33Å; P209-I245 HydrophobicContact CB-CD1 4.43Å; P209-I245 HydrophobicContact CG-CD1 4.17Å; P209-I245 HydrophobicContact CG-CG1 4.17Å; P209-I245 HydrophobicContact CG-CG2 4.34Å; P209-A295 HydrophobicContact CB-CB 3.74Å; P209-A295 HydrophobicContact CG-CB 4.48Å; P209-S297 VanDerWaalsContact CD-OG 3.22Å; P209-S297 WeakPolarHBondContact CD-OG 3.12Å; P209-R302 VanDerWaalsContact O-CD 3.29Å; P209-R302 WeakPolarHBondContact O-CD 3.27Å; P209-R302 VanDerWaalsContact O-CG 3.28Å; P209-R302 WeakPolarHBondContact O-CG 3.2Å; P209-R302 PolarHBondContact O-NH1 3.16Å
210	P	78.8	Confident	63.1	Low	47 Å²	47	79.2 Å²	79.2	31%	0.305	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-56.7	143.3	174.2	23.8	-32.1	0	0	0	110.8	P212 Y235 I238	P210-P212 WeakPolarHBondContact O-CD 3.47Å; P210-Y235 HydrophobicContact CG-CE1 4.14Å; P210-Y235 PolarHBondContact O-OH 2.87Å; P210-I238 HydrophobicContact CG-CD1 4.13Å
211	R	79.1	Confident	64.4	Low	94 Å²	94	80.2 Å²	80.2	36%	0.355	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-67	127.5	172.3	-174.5	-177.7	-68.5	-129.6	10.6	107	I213 R302 F304	R211-I213 PolarHBondContact O-N 3.22Å; R211-R302 HydrophobicContact CB-CB 3.88Å; R211-R302 PolarHBondContact NE-O 3.12Å; R211-R302 PolarHBondContact NH2-O 2.92Å; R211-F304 WeakPolarHBondContact CD-O 3.4Å; R211-F304 PolarHBondContact NH1-O 3.09Å
212	P	74	Confident	65.8	Low	4 Å²	4	79 Å²	79	3%	0.026	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-62.6	127.4	179.7	13.5	-19.6	0	0	0	110.6	P210 Y235 I293 G305	P210-P212 WeakPolarHBondContact O-CD 3.47Å; P212-Y235 WeakPolarHBondContact CB-OH 3.22Å; P212-Y235 WeakPolarHBondContact CD-OH 3.38Å; P212-Y235 WeakPolarHBondContact CG-OH 3.24Å; P212-I293 HydrophobicContact CB-CG2 3.76Å; P212-I293 HydrophobicContact CG-CG2 3.64Å; P212-I293 WeakPolarHBondContact CG-O 3.4Å; P212-G305 WeakPolarHBondContact O-CA 3.45Å
213	I	69.7	Low	67.1	Low	134 Å²	134	78.3 Å²	78.3	69%	0.687	42%	0.416	S	S	*	.			trans	-82.3	-46.1	-172.9	-58.8	171.4	0	0	0	110.2	R211 Q234	R211-I213 PolarHBondContact O-N 3.22Å; I213-Q234 VanDerWaalsContact N-OE1 3.09Å
214	L	71.8	Confident	68.5	Low	89 Å²	89	74.8 Å²	74.8	47%	0.466	41%	0.408	S	S	.	.			trans	-150	127.5	179.9	-179.7	64.1	0	0	0	110.9	N216 Q234	L214-N216 PolarHBondContact O-N 2.84Å; L214-Q234 PolarHBondContact O-NE2 3.4Å
215	L	72.2	Confident	69.9	Low	7 Å²	7	71.3 Å²	71.3	4%	0.037	40%	0.399	C	S	.	.			trans	-83.8	117.3	175.1	-176.8	63	0	0	0	109.9	S217 L229 W231 L249 F291 I293 T308	L215-S217 PolarHBondContact O-N 2.97Å; L215-L229 HydrophobicContact CD2-CD1 4.11Å; L215-L229 HydrophobicContact CD2-CD2 4.31Å; L215-L229 HydrophobicContact CG-CD2 4.46Å; L215-W231 HydrophobicContact CD1-CB 3.85Å; L215-W231 HydrophobicContact CD1-CD2 4.22Å; L215-W231 HydrophobicContact CD1-CE3 3.56Å; L215-W231 HydrophobicContact CD1-CG 4.4Å; L215-W231 HydrophobicContact CD1-CZ3 4.39Å; L215-L249 HydrophobicContact CD2-CD1 4.03Å; L215-F291 HydrophobicContact CD2-CB 3.99Å; L215-I293 HydrophobicContact CB-CG2 4.38Å; L215-I293 HydrophobicContact CD1-CD1 4.45Å; L215-I293 HydrophobicContact CD1-CG2 4.04Å; L215-I293 HydrophobicContact CD2-CG2 4.39Å; L215-T308 HydrophobicContact CB-CG2 3.67Å; L215-T308 HydrophobicContact CD2-CG2 3.83Å; L215-T308 HydrophobicContact CG-CG2 3.98Å
216	N	72.2	Confident	70.9	Confident	75 Å²	75	70.6 Å²	70.6	40%	0.401	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	121.7	178.1	-69.6	-14.5	0	0	0	109.8	L214 S230	L214-N216 PolarHBondContact O-N 2.84Å; N216-S230 PolarHBondContact O-N 2.96Å; N216-S230 VanDerWaalsContact O-N 3.08Å
217	S	74.3	Confident	71.9	Confident	55 Å²	55	61.9 Å²	61.9	39%	0.385	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	129	172.9	62.8	0	0	0	0	110.4	L215 L229	L215-S217 PolarHBondContact O-N 2.97Å; S217-L229 VanDerWaalsContact CB-CD2 3.44Å
218	I	70.6	Confident	72.6	Confident	108 Å²	108	64.6 Å²	64.6	55%	0.554	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	120.7	176.8	-57.1	173	0	0	0	107	K228	I218-K228 PolarHBondContact N-O 2.57Å; I218-K228 PolarHBondContact O-N 2.95Å
219	V	66.3	Low	73.1	Confident	69 Å²	69	64 Å²	64	42%	0.418	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	131.7	174.5	-172.5	0	0	0	0	108.4	S221 Y311	V219-S221 PolarHBondContact O-N 3.35Å; V219-Y311 HydrophobicContact CG1-CE2 4.36Å; V219-Y311 HydrophobicContact CG2-CD2 4.36Å; V219-Y311 HydrophobicContact CG2-CE2 3.59Å
220	S	62	Low	73.4	Confident	38 Å²	38	65.6 Å²	65.6	27%	0.266	37%	0.374	S	S	.	.			trans	-64	131.3	177.5	-170.2	0	0	0	0	110.3	T222 N223 I226	S220-T222 PolarHBondContact O-N 3.26Å; S220-T222 PolarHBondContact OG-OG1 3.29Å; S220-N223 CarbonylContact O-C 3.59Å; S220-N223 PolarHBondContact O-N 3.09Å; S220-I226 WeakPolarHBondContact CB-O 3.32Å; S220-I226 PolarHBondContact N-O 2.97Å
221	S	56.4	Low	73.7	Confident	127 Å²	127	63.4 Å²	63.4	89%	0.888	36%	0.36	S	S	*	.	S	Bend	trans	-65.9	-26.2	176.5	57.4	0	0	0	0	112.7	V219	V219-S221 PolarHBondContact O-N 3.35Å
222	T	60	Low	73.8	Confident	123 Å²	123	60.6 Å²	60.6	76%	0.755	35%	0.354	S	S	*	.	S	Bend	trans	-81.1	-29.9	-177.8	56.1	0	0	0	0	113.5	S220	S220-T222 PolarHBondContact O-N 3.26Å; S220-T222 PolarHBondContact OG-OG1 3.29Å
223	N	63.1	Low	73.9	Confident	69 Å²	69	63.3 Å²	63.3	37%	0.369	37%	0.373	S	S	.	.			trans	-151.3	113	-176.5	-170.5	-10.8	0	0	0	109.9	S220 N225 I226	S220-N223 CarbonylContact O-C 3.59Å; S220-N223 PolarHBondContact O-N 3.09Å; N223-N225 PolarHBondContact O-N 3.37Å; N223-N225 WeakPolarHBondContact OD1-CB 3.38Å; N223-N225 PolarHBondContact OD1-N 2.8Å; N223-I226 HydrophobicContact CB-CD1 4.02Å; N223-I226 HydrophobicContact CB-CG1 4.11Å; N223-I226 PolarHBondContact O-N 2.97Å
224	A	67.6	Low	74.3	Confident	69 Å²	69	59.4 Å²	59.4	57%	0.57	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-7.2	175.7	0	0	0	0	0	113.2	Y311	A224-Y311 PolarHBondContact O-OH 3.06Å
225	N	75.4	Confident	74.7	Confident	73 Å²	73	55.7 Å²	55.7	39%	0.39	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	5.6	172.6	-65.9	-10.6	0	0	0	113.3	N223 F283	N223-N225 PolarHBondContact O-N 3.37Å; N223-N225 WeakPolarHBondContact OD1-CB 3.38Å; N223-N225 PolarHBondContact OD1-N 2.8Å; N225-F283 WeakPolarHBondContact O-CD2 3.06Å; N225-F283 WeakPolarHBondContact O-CE2 3.18Å
226	I	81	Confident	74.6	Confident	47 Å²	47	61.9 Å²	61.9	24%	0.241	36%	0.361	C	S	.	.			trans	-120.5	122.7	177.1	-56.9	176.6	0	0	0	109.4	S220 N223 L280 E281	S220-I226 WeakPolarHBondContact CB-O 3.32Å; S220-I226 PolarHBondContact N-O 2.97Å; N223-I226 HydrophobicContact CB-CD1 4.02Å; N223-I226 HydrophobicContact CB-CG1 4.11Å; N223-I226 PolarHBondContact O-N 2.97Å; I226-L280 WeakPolarHBondContact CA-O 3.45Å; I226-E281 HydrophobicContact CG1-CB 4.4Å
227	I	85.8	Confident	74.4	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	131.9	173.6	-160.4	175.4	0	0	0	109.5	L229 L280 F283 Y311	I227-L229 HydrophobicContact CD1-CD2 4.33Å; I227-L229 HydrophobicContact CG1-CD2 4.48Å; I227-L280 HydrophobicContact CG2-CB 3.76Å; I227-L280 HydrophobicContact CG2-CD1 4.32Å; I227-L280 HydrophobicContact CG2-CG 4.32Å; I227-L280 PolarHBondContact N-O 3.32Å; I227-L280 PolarHBondContact O-N 2.88Å; I227-F283 HydrophobicContact CB-CE2 4.34Å; I227-F283 HydrophobicContact CB-CZ 4.21Å; I227-F283 HydrophobicContact CG2-CE1 4.48Å; I227-F283 HydrophobicContact CG2-CE2 4Å; I227-F283 HydrophobicContact CG2-CZ 3.45Å; I227-F283 VanDerWaalsContact CG2-CZ 3.45Å; I227-Y311 HydrophobicContact CB-CE1 4.36Å; I227-Y311 HydrophobicContact CD1-CD1 4.07Å; I227-Y311 HydrophobicContact CD1-CD2 3.61Å; I227-Y311 HydrophobicContact CD1-CE1 4.38Å; I227-Y311 HydrophobicContact CD1-CE2 3.95Å; I227-Y311 HydrophobicContact CD1-CG 3.66Å; I227-Y311 HydrophobicContact CG1-CE2 4.46Å
228	K	86.1	Confident	74.1	Confident	114 Å²	114	65 Å²	65	50%	0.496	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	114.7	173.9	-176.3	165.4	-173.4	179.8	0	108.9	I218 N279	I218-K228 PolarHBondContact N-O 2.57Å; I218-K228 PolarHBondContact O-N 2.95Å; K228-N279 WeakPolarHBondContact CD-OD1 3.43Å; K228-N279 VanDerWaalsContact CG-OD1 3.24Å; K228-N279 WeakPolarHBondContact CG-OD1 3.47Å
229	L	87.8	Confident	73.9	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	128.2	172.4	-60.3	178.2	0	0	0	108.3	L215 S217 I227 W231 L249 G277 A278 L280 F291	L215-L229 HydrophobicContact CD2-CD1 4.11Å; L215-L229 HydrophobicContact CD2-CD2 4.31Å; L215-L229 HydrophobicContact CG-CD2 4.46Å; S217-L229 VanDerWaalsContact CB-CD2 3.44Å; I227-L229 HydrophobicContact CD1-CD2 4.33Å; I227-L229 HydrophobicContact CG1-CD2 4.48Å; L229-W231 HydrophobicContact CB-CE3 4.3Å; L229-W231 HydrophobicContact CB-CZ3 3.87Å; L229-L249 HydrophobicContact CD1-CD1 4.16Å; L229-L249 HydrophobicContact CD1-CD2 4.04Å; L229-G277 CarbonylContact O-C 3.56Å; L229-G277 WeakPolarHBondContact O-CA 3.48Å; L229-A278 PolarHBondContact N-O 3.18Å; L229-A278 PolarHBondContact O-N 3.13Å; L229-L280 HydrophobicContact CD1-CD1 3.56Å; L229-L280 HydrophobicContact CD1-CG 4.31Å; L229-L280 HydrophobicContact CG-CD1 4.35Å; L229-F291 HydrophobicContact CD1-CB 4.09Å; L229-F291 HydrophobicContact CD1-CD1 4.08Å; L229-F291 HydrophobicContact CD1-CD2 4.09Å; L229-F291 HydrophobicContact CD1-CG 3.8Å; L229-F291 HydrophobicContact CD2-CD2 4.46Å
230	S	87.6	Confident	74	Confident	34 Å²	34	65.6 Å²	65.6	24%	0.238	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	131.1	175.2	-172.9	0	0	0	0	110.7	N216 S232	N216-S230 PolarHBondContact O-N 2.96Å; N216-S230 VanDerWaalsContact O-N 3.08Å; S230-S232 PolarHBondContact OG-OG 2.85Å
231	W	84.4	Confident	74.3	Confident	1 Å²	1	67.6 Å²	67.6	0%	0.004	40%	0.397	C	S	.	.			trans	-121.9	6.4	179.9	48.7	92.9	0	0	0	112.8	L215 L229 S233 Q234 Y235 F247 T273 E275 F276 A278 I293	L215-W231 HydrophobicContact CD1-CB 3.85Å; L215-W231 HydrophobicContact CD1-CD2 4.22Å; L215-W231 HydrophobicContact CD1-CE3 3.56Å; L215-W231 HydrophobicContact CD1-CG 4.4Å; L215-W231 HydrophobicContact CD1-CZ3 4.39Å; L229-W231 HydrophobicContact CB-CE3 4.3Å; L229-W231 HydrophobicContact CB-CZ3 3.87Å; W231-S233 VanDerWaalsContact C-N 3.29Å; W231-S233 PolarHBondContact O-N 2.86Å; W231-Q234 PolarHBondContact O-N 2.86Å; W231-Y235 VanDerWaalsContact O-CD2 3.3Å; W231-Y235 WeakPolarHBondContact O-CD2 3.38Å; W231-F247 AromaticContact CD1-CD1 3.74Å; W231-F247 AromaticContact CD1-CE1 3.59Å; W231-F247 AromaticContact CD1-CE2 3.87Å; W231-F247 AromaticContact CD1-CG 3.94Å; W231-F247 AromaticContact CD1-CZ 3.67Å; W231-F247 HydrophobicContact CZ2-CB 4.24Å; W231-F247 HydrophobicContact CZ2-CG 4.44Å; W231-F247 AromaticContact NE1-CD1 3.54Å; W231-F247 AromaticContact NE1-CD2 3.19Å; W231-F247 AromaticContact NE1-CE1 3.77Å; W231-F247 AromaticContact NE1-CE2 3.44Å; W231-F247 AromaticContact NE1-CG 3.25Å; W231-F247 AromaticContact NE1-CZ 3.72Å; W231-T273 HydrophobicContact CZ2-CG2 4.03Å; W231-E275 VanDerWaalsContact CZ2-O 3.26Å; W231-E275 WeakPolarHBondContact CZ2-O 3.5Å; W231-E275 PolarHBondContact NE1-O 2.85Å; W231-F276 VanDerWaalsContact CE2-C 3.5Å; W231-F276 PolarHBondContact N-O 3.04Å; W231-F276 VanDerWaalsContact N-O 3.11Å; W231-A278 HydrophobicContact CH2-CB 3.93Å; W231-A278 HydrophobicContact CZ3-CB 4.26Å; W231-I293 HydrophobicContact CB-CD1 4.15Å; W231-I293 HydrophobicContact CD2-CD1 3.3Å; W231-I293 VanDerWaalsContact CE2-CD1 3.41Å; W231-I293 HydrophobicContact CE3-CD1 3.81Å; W231-I293 HydrophobicContact CG-CD1 3.49Å; W231-I293 VanDerWaalsContact CG-CD1 3.49Å; W231-I293 HydrophobicContact CH2-CD1 4.33Å; W231-I293 HydrophobicContact CZ2-CD1 3.94Å; W231-I293 HydrophobicContact CZ3-CD1 4.27Å
232	S	80.5	Confident	75.1	Confident	35 Å²	35	62.2 Å²	62.2	25%	0.245	36%	0.358	C	S	.	.	H	α-helix	trans	-51	-43.9	-179.2	58.6	0	0	0	0	113.4	S230 Q234 Y235 Q236 F276	S230-S232 PolarHBondContact OG-OG 2.85Å; S232-Q234 PolarHBondContact O-N 2.78Å; S232-Y235 CarbonylContact O-C 3.53Å; S232-Y235 PolarHBondContact O-N 3.12Å; S232-Q236 WeakPolarHBondContact O-CG 3.11Å; S232-Q236 PolarHBondContact O-N 2.87Å; S232-F276 PolarHBondContact N-O 3.12Å
233	S	77.4	Confident	76	Confident	61 Å²	61	59.9 Å²	59.9	43%	0.427	34%	0.341	S	S	.	.	H	α-helix	trans	-52.6	-32.3	-175.4	58.6	0	0	0	0	115.3	W231	W231-S233 VanDerWaalsContact C-N 3.29Å; W231-S233 PolarHBondContact O-N 2.86Å
234	Q	78.2	Confident	77.2	Confident	53 Å²	53	57.1 Å²	57.1	25%	0.248	33%	0.327	C	S	.	.	H	α-helix	trans	-82.6	-17.4	-179.5	-73	167.4	48.7	0	0	113.5	I213 L214 W231 S232	I213-Q234 VanDerWaalsContact N-OE1 3.09Å; L214-Q234 PolarHBondContact O-NE2 3.4Å; W231-Q234 PolarHBondContact O-N 2.86Å; S232-Q234 PolarHBondContact O-N 2.78Å
235	Y	79.5	Confident	78.2	Confident	11 Å²	11	53.9 Å²	53.9	4%	0.043	30%	0.3	C	S	.	.	H	α-helix	trans	-117.4	2.6	-173.4	-57	-94.1	0	0	0	112.5	P209 P210 P212 W231 S232 I238 I245 F247 A295	P209-Y235 HydrophobicContact CB-CE1 4.35Å; P210-Y235 HydrophobicContact CG-CE1 4.14Å; P210-Y235 PolarHBondContact O-OH 2.87Å; P212-Y235 WeakPolarHBondContact CB-OH 3.22Å; P212-Y235 WeakPolarHBondContact CD-OH 3.38Å; P212-Y235 WeakPolarHBondContact CG-OH 3.24Å; W231-Y235 VanDerWaalsContact O-CD2 3.3Å; W231-Y235 WeakPolarHBondContact O-CD2 3.38Å; S232-Y235 CarbonylContact O-C 3.53Å; S232-Y235 PolarHBondContact O-N 3.12Å; Y235-I238 HydrophobicContact CD1-CD1 3.17Å; Y235-I238 HydrophobicContact CE1-CD1 4.09Å; Y235-I238 HydrophobicContact CG-CD1 3.76Å; Y235-I238 PolarHBondContact O-N 2.8Å; Y235-I245 HydrophobicContact CD1-CD1 4.01Å; Y235-F247 HydrophobicContact CD1-CE1 4.05Å; Y235-F247 HydrophobicContact CD1-CZ 4.19Å; Y235-F247 AromaticContact CD2-CE1 3.91Å; Y235-F247 HydrophobicContact CD2-CE1 3.91Å; Y235-F247 HydrophobicContact CD2-CZ 4.08Å; Y235-F247 AromaticContact CE1-CE1 3.96Å; Y235-F247 HydrophobicContact CE1-CE1 3.96Å; Y235-F247 AromaticContact CE2-CE1 3.76Å; Y235-F247 HydrophobicContact CE2-CE1 3.76Å; Y235-F247 HydrophobicContact CE2-CZ 4.4Å; Y235-F247 HydrophobicContact CG-CE1 4.1Å; Y235-F247 HydrophobicContact CG-CZ 4.02Å; Y235-F247 AromaticContact CZ-CE1 3.83Å; Y235-A295 HydrophobicContact CE1-CB 3.5Å; Y235-A295 WeakPolarHBondContact OH-CB 3.21Å
236	Q	70	Confident	79	Confident	137 Å²	137	50.6 Å²	50.6	64%	0.64	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-41.8	177.3	-84.8	171.1	1.9	0	0	113.3	S232 I238	S232-Q236 WeakPolarHBondContact O-CG 3.11Å; S232-Q236 PolarHBondContact O-N 2.87Å; Q236-I238 VanDerWaalsContact C-N 3.32Å; Q236-I238 PolarHBondContact O-N 3.38Å
237	N	69.2	Low	79.6	Confident	165 Å²	165	48.4 Å²	48.4	88%	0.882	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	19.2	-176.8	-71.2	-18.2	0	0	0	113.5
238	I	68	Low	79.9	Confident	31 Å²	31	48.3 Å²	48.3	16%	0.159	27%	0.271	C	S	.	.			trans	-79.1	137.1	-178.7	-74.5	179.4	0	0	0	110.5	P210 Y235 Q236 M242 I245	P210-I238 HydrophobicContact CG-CD1 4.13Å; Y235-I238 HydrophobicContact CD1-CD1 3.17Å; Y235-I238 HydrophobicContact CE1-CD1 4.09Å; Y235-I238 HydrophobicContact CG-CD1 3.76Å; Y235-I238 PolarHBondContact O-N 2.8Å; Q236-I238 VanDerWaalsContact C-N 3.32Å; Q236-I238 PolarHBondContact O-N 3.38Å; I238-M242 HydrophobicContact CG2-CB 3.63Å; I238-M242 HydrophobicContact CG2-CG 3.93Å; I238-M242 HydrophobicContact CG2-SD 3.58Å; I238-M242 VanDerWaalsContact CG2-SD 3.58Å; I238-I245 HydrophobicContact CD1-CD1 3.93Å; I238-I245 HydrophobicContact CG2-CD1 4.25Å
239	T	65.1	Low	80.3	Confident	81 Å²	81	43 Å²	43	50%	0.497	25%	0.247	S	C	.	.			trans	-64.3	144.6	177.4	50.9	0	0	0	0	110.9	T241 M242	T239-T241 WeakPolarHBondContact CB-OG1 3.28Å; T239-T241 PolarHBondContact O-N 2.84Å; T239-T241 PolarHBondContact OG1-OG1 2.96Å; T239-M242 PolarHBondContact O-N 3.28Å
240	S	68.1	Low	80.6	Confident	108 Å²	108	43.2 Å²	43.2	76%	0.755	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-15.2	174.6	-171.2	0	0	0	0	113.9
241	T	68.9	Low	80.9	Confident	79 Å²	79	42.7 Å²	42.7	49%	0.485	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-20.1	178.1	54.7	0	0	0	0	114.2	T239 Y299	T239-T241 WeakPolarHBondContact CB-OG1 3.28Å; T239-T241 PolarHBondContact O-N 2.84Å; T239-T241 PolarHBondContact OG1-OG1 2.96Å; T241-Y299 WeakPolarHBondContact O-CE2 3.26Å
242	M	72.5	Confident	81.3	Confident	14 Å²	14	43.7 Å²	43.7	7%	0.069	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-18	-179.4	-52	179.6	78.9	0	0	112.6	K206 L207 V208 P209 I238 T239 S297	K206-M242 WeakPolarHBondContact O-CE 3.49Å; L207-M242 WeakPolarHBondContact O-CE 3.21Å; V208-M242 WeakPolarHBondContact O-CE 3.26Å; P209-M242 HydrophobicContact CB-CE 4.47Å; P209-M242 VanDerWaalsContact N-CE 3.33Å; I238-M242 HydrophobicContact CG2-CB 3.63Å; I238-M242 HydrophobicContact CG2-CG 3.93Å; I238-M242 HydrophobicContact CG2-SD 3.58Å; I238-M242 VanDerWaalsContact CG2-SD 3.58Å; T239-M242 PolarHBondContact O-N 3.28Å; M242-S297 WeakPolarHBondContact O-CB 3.44Å
243	N	80.2	Confident	82	Confident	74 Å²	74	44.7 Å²	44.7	40%	0.396	25%	0.249	S	C	.	.			trans	-73.9	147.2	178	-75.4	-19	0	0	0	110.7
244	P	87.9	Confident	82.9	Confident	11 Å²	11	41.8 Å²	41.8	7%	0.071	23%	0.228	C	C	.	.	S	Bend	cis	-82	152.4	1.8	32.8	-36	0	0	0	113.9	A56 L59 R60 H274	A56-P244 HydrophobicContact CB-CG 4.39Å; A56-P244 WeakPolarHBondContact O-CG 3.37Å; L59-P244 HydrophobicContact CB-CB 3.74Å; L59-P244 HydrophobicContact CB-CG 3.57Å; L59-P244 HydrophobicContact CD1-CB 4.08Å; R60-P244 HydrophobicContact CB-CG 3.93Å; P244-H274 VanDerWaalsContact CB-NE2 3.3Å; P244-H274 WeakPolarHBondContact CB-NE2 3.4Å
245	I	88.9	Confident	83.8	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.23	C	C	.	.			trans	-117.5	118.7	-179	-58.5	177.5	0	0	0	110.1	P209 Y235 I238 F247 H274 A295 V296	P209-I245 HydrophobicContact CB-CD1 4.43Å; P209-I245 HydrophobicContact CG-CD1 4.17Å; P209-I245 HydrophobicContact CG-CG1 4.17Å; P209-I245 HydrophobicContact CG-CG2 4.34Å; Y235-I245 HydrophobicContact CD1-CD1 4.01Å; I238-I245 HydrophobicContact CD1-CD1 3.93Å; I238-I245 HydrophobicContact CG2-CD1 4.25Å; I245-F247 HydrophobicContact CB-CZ 4.32Å; I245-F247 HydrophobicContact CG2-CD1 4.26Å; I245-F247 HydrophobicContact CG2-CE1 3.74Å; I245-F247 HydrophobicContact CG2-CE2 4.18Å; I245-F247 HydrophobicContact CG2-CZ 3.7Å; I245-H274 VanDerWaalsContact C-CD2 3.47Å; I245-H274 PolarHBondContact N-CD2 3.2Å; I245-H274 PolarHBondContact N-NE2 3.26Å; I245-H274 PolarHBondContact O-CD2 2.91Å; I245-H274 PolarHBondContact O-NE2 3.16Å; I245-A295 HydrophobicContact CG2-CB 3.88Å; I245-V296 CarbonylContact C-O 3.54Å; I245-V296 WeakPolarHBondContact CA-O 3.09Å
246	V	92	Very high	84.5	Confident	4 Å²	4	41.3 Å²	41.3	2%	0.024	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	126.7	170.9	178.7	0	0	0	0	109.8	A52 K55 A56 L59 V296	A52-V246 HydrophobicContact CB-CB 4.29Å; A52-V246 HydrophobicContact CB-CG1 3.96Å; K55-V246 HydrophobicContact CB-CG2 4.03Å; A56-V246 HydrophobicContact CB-CG2 4.09Å; L59-V246 HydrophobicContact CD1-CG2 3.88Å; V246-V296 PolarHBondContact N-O 2.77Å; V246-V296 WeakPolarHBondContact O-CB 3.49Å; V246-V296 PolarHBondContact O-N 3.19Å
247	F	92.9	Very high	85.6	Confident	1 Å²	1	38.8 Å²	38.8	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	136.8	175.2	-59.5	-74.2	0	0	0	111.2	W231 Y235 I245 M272 T273 E275 F276 I293 A294 A295	W231-F247 AromaticContact CD1-CD1 3.74Å; W231-F247 AromaticContact CD1-CE1 3.59Å; W231-F247 AromaticContact CD1-CE2 3.87Å; W231-F247 AromaticContact CD1-CG 3.94Å; W231-F247 AromaticContact CD1-CZ 3.67Å; W231-F247 HydrophobicContact CZ2-CB 4.24Å; W231-F247 HydrophobicContact CZ2-CG 4.44Å; W231-F247 AromaticContact NE1-CD1 3.54Å; W231-F247 AromaticContact NE1-CD2 3.19Å; W231-F247 AromaticContact NE1-CE1 3.77Å; W231-F247 AromaticContact NE1-CE2 3.44Å; W231-F247 AromaticContact NE1-CG 3.25Å; W231-F247 AromaticContact NE1-CZ 3.72Å; Y235-F247 HydrophobicContact CD1-CE1 4.05Å; Y235-F247 HydrophobicContact CD1-CZ 4.19Å; Y235-F247 AromaticContact CD2-CE1 3.91Å; Y235-F247 HydrophobicContact CD2-CE1 3.91Å; Y235-F247 HydrophobicContact CD2-CZ 4.08Å; Y235-F247 AromaticContact CE1-CE1 3.96Å; Y235-F247 HydrophobicContact CE1-CE1 3.96Å; Y235-F247 AromaticContact CE2-CE1 3.76Å; Y235-F247 HydrophobicContact CE2-CE1 3.76Å; Y235-F247 HydrophobicContact CE2-CZ 4.4Å; Y235-F247 HydrophobicContact CG-CE1 4.1Å; Y235-F247 HydrophobicContact CG-CZ 4.02Å; Y235-F247 AromaticContact CZ-CE1 3.83Å; I245-F247 HydrophobicContact CB-CZ 4.32Å; I245-F247 HydrophobicContact CG2-CD1 4.26Å; I245-F247 HydrophobicContact CG2-CE1 3.74Å; I245-F247 HydrophobicContact CG2-CE2 4.18Å; I245-F247 HydrophobicContact CG2-CZ 3.7Å; F247-M272 CarbonylContact O-C 3.39Å; F247-M272 VanDerWaalsContact O-CA 3.31Å; F247-M272 WeakPolarHBondContact O-CA 3.15Å; F247-T273 WeakPolarHBondContact CA-O 3.37Å; F247-T273 HydrophobicContact CB-CG2 4.45Å; F247-T273 PolarHBondContact N-O 2.81Å; F247-T273 PolarHBondContact O-N 2.78Å; F247-E275 WeakPolarHBondContact CD2-O 3.35Å; F247-F276 AromaticContact CE2-CD1 3.76Å; F247-F276 HydrophobicContact CE2-CD1 3.76Å; F247-F276 AromaticContact CE2-CE1 3.82Å; F247-F276 HydrophobicContact CE2-CE1 3.82Å; F247-F276 AromaticContact CZ-CD1 3.85Å; F247-F276 HydrophobicContact CZ-CD1 3.85Å; F247-F276 AromaticContact CZ-CE1 3.77Å; F247-F276 HydrophobicContact CZ-CE1 3.77Å; F247-I293 HydrophobicContact CB-CD1 4.01Å; F247-I293 HydrophobicContact CB-CG1 4.3Å; F247-I293 HydrophobicContact CD1-CD1 3.84Å; F247-I293 HydrophobicContact CD1-CG1 4.29Å; F247-I293 HydrophobicContact CG-CD1 4.16Å; F247-A294 CarbonylContact C-O 3.59Å; F247-A294 VanDerWaalsContact CA-O 3.3Å; F247-A294 WeakPolarHBondContact CA-O 3.32Å; F247-A295 HydrophobicContact CD1-CB 3.97Å; F247-A295 HydrophobicContact CE1-CB 3.83Å
248	I	93.3	Very high	86.7	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	113.9	172.6	-55.7	167.7	0	0	0	107.2	L48 F49 A52 Q250 T269 M272 I293 A294 V296 F304	L48-I248 HydrophobicContact CD2-CD1 4.33Å; L48-I248 HydrophobicContact CD2-CG2 3.69Å; L48-I248 HydrophobicContact CG-CD1 4.15Å; L48-I248 HydrophobicContact CG-CG2 4.22Å; F49-I248 HydrophobicContact CD1-CD1 3.61Å; F49-I248 HydrophobicContact CE1-CD1 3.93Å; A52-I248 HydrophobicContact CB-CD1 3.76Å; A52-I248 HydrophobicContact CB-CG1 3.99Å; I248-Q250 HydrophobicContact CG2-CG 4.25Å; I248-T269 HydrophobicContact CG2-CG2 3.97Å; I248-M272 HydrophobicContact CG1-CG 4.31Å; I248-I293 CarbonylContact O-C 3.59Å; I248-I293 VanDerWaalsContact O-CA 3.29Å; I248-I293 WeakPolarHBondContact O-CA 3.47Å; I248-A294 HydrophobicContact CB-CB 4.46Å; I248-A294 PolarHBondContact N-O 2.83Å; I248-A294 PolarHBondContact O-N 3.34Å; I248-V296 HydrophobicContact CD1-CG2 3.74Å; I248-V296 HydrophobicContact CG1-CG2 4.23Å; I248-F304 HydrophobicContact CB-CE1 4.15Å; I248-F304 HydrophobicContact CB-CZ 4.39Å; I248-F304 HydrophobicContact CG2-CE1 3.92Å; I248-F304 HydrophobicContact CG2-CZ 3.91Å
249	L	93.1	Very high	87.9	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	125.3	175.4	-178.2	63.7	0	0	0	109.3	L215 L229 L270 I271 A278 F291	L215-L249 HydrophobicContact CD2-CD1 4.03Å; L229-L249 HydrophobicContact CD1-CD1 4.16Å; L229-L249 HydrophobicContact CD1-CD2 4.04Å; L249-L270 HydrophobicContact CD2-CD2 4.08Å; L249-L270 PolarHBondContact O-N 3.44Å; L249-I271 HydrophobicContact CB-CD1 4.47Å; L249-I271 HydrophobicContact CB-CG1 3.74Å; L249-I271 HydrophobicContact CD2-CD1 4.09Å; L249-I271 HydrophobicContact CD2-CG1 4.01Å; L249-I271 HydrophobicContact CG-CG1 4.44Å; L249-I271 PolarHBondContact N-O 2.83Å; L249-I271 PolarHBondContact O-N 2.91Å; L249-A278 HydrophobicContact CD2-CB 4.2Å; L249-F291 HydrophobicContact CD1-CB 4.18Å
250	Q	94	Very high	89.2	Confident	6 Å²	6	35.5 Å²	35.5	3%	0.028	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	152.8	175.1	-61.8	-167	-36.8	0	0	111.5	I248 W267 K268 T269 F291 R292 F304	I248-Q250 HydrophobicContact CG2-CG 4.25Å; Q250-W267 HydrophobicContact CB-CB 4.46Å; Q250-W267 HydrophobicContact CB-CE3 3.97Å; Q250-K268 CarbonylContact C-O 3.52Å; Q250-K268 WeakPolarHBondContact CA-O 3.44Å; Q250-K268 WeakPolarHBondContact CB-O 3.41Å; Q250-T269 PolarHBondContact NE2-OG1 2.8Å; Q250-F291 VanDerWaalsContact O-CA 3.29Å; Q250-F291 WeakPolarHBondContact O-CA 3.47Å; Q250-R292 HydrophobicContact CB-CG 4.02Å; Q250-R292 PolarHBondContact N-O 2.8Å; Q250-R292 PolarHBondContact O-N 2.87Å; Q250-F304 HydrophobicContact CG-CE1 3.66Å; Q250-F304 HydrophobicContact CG-CZ 3.8Å
251	I	94	Very high	90.3	Very high	22 Å²	22	36.5 Å²	36.5	11%	0.113	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.4	178.8	-168.2	174.2	0	0	0	109.9	K268 L270 Y289 Q290 F291	I251-K268 HydrophobicContact CG2-CB 4.46Å; I251-K268 PolarHBondContact N-O 3.44Å; I251-K268 PolarHBondContact O-N 2.84Å; I251-L270 HydrophobicContact CG2-CB 4.27Å; I251-L270 HydrophobicContact CG2-CD1 4.32Å; I251-Y289 HydrophobicContact CD1-CD1 3.65Å; I251-Y289 HydrophobicContact CD1-CE1 4.39Å; I251-Y289 HydrophobicContact CD1-CG 4.48Å; I251-Y289 HydrophobicContact CG1-CD1 4.31Å; I251-Q290 CarbonylContact C-O 3.57Å; I251-Q290 WeakPolarHBondContact CA-O 3.31Å; I251-F291 HydrophobicContact CB-CD1 4.09Å; I251-F291 HydrophobicContact CB-CE1 4.04Å; I251-F291 HydrophobicContact CD1-CD1 4.31Å; I251-F291 HydrophobicContact CD1-CE1 3.43Å; I251-F291 VanDerWaalsContact CD1-CE1 3.43Å; I251-F291 HydrophobicContact CD1-CZ 3.99Å; I251-F291 HydrophobicContact CG1-CD1 3.93Å; I251-F291 HydrophobicContact CG1-CE1 3.52Å; I251-F291 HydrophobicContact CG1-CZ 4.26Å
252	R	94.3	Very high	91.4	Very high	22 Å²	22	37.1 Å²	37.1	8%	0.083	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	150.6	162.6	67	176.1	178.6	-176.9	2.4	110.5	E261 S265 W267 Y289 Q290	R252-E261 IonicContact CZ-OE1 3.2Å; R252-E261 IonicContact NH1-OE1 3.93Å; R252-E261 PolarHBondContact NH1-OE1 3.18Å; R252-E261 IonicContact NH2-OE1 2.87Å; R252-E261 PolarHBondContact NH2-OE1 3.32Å; R252-E261 VanDerWaalsContact NH2-OE1 3.11Å; R252-S265 WeakPolarHBondContact CB-O 3.37Å; R252-W267 HydrophobicContact CB-CD2 4.08Å; R252-W267 HydrophobicContact CB-CE3 3.89Å; R252-W267 HydrophobicContact CB-CZ3 4.16Å; R252-W267 VanDerWaalsContact CD-CZ2 3.48Å; R252-W267 HydrophobicContact CG-CD2 4.13Å; R252-W267 HydrophobicContact CG-CE3 3.94Å; R252-W267 HydrophobicContact CG-CH2 3.74Å; R252-W267 HydrophobicContact CG-CZ2 3.92Å; R252-W267 HydrophobicContact CG-CZ3 3.75Å; R252-W267 VanDerWaalsContact NE-CZ2 3.3Å; R252-Y289 WeakPolarHBondContact O-CA 3.37Å; R252-Q290 HydrophobicContact CG-CB 3.88Å; R252-Q290 PolarHBondContact N-O 2.99Å; R252-Q290 PolarHBondContact O-N 2.8Å
253	I	95.1	Very high	92.3	Very high	56 Å²	56	42.5 Å²	42.5	29%	0.287	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	133.8	-170.3	-51.5	177.5	0	0	0	109.2	A264 S265 R287 L288 Y289	I253-A264 CarbonylContact O-C 3.6Å; I253-A264 WeakPolarHBondContact O-CA 3.48Å; I253-S265 PolarHBondContact N-OG 3.28Å; I253-S265 PolarHBondContact O-N 3.49Å; I253-R287 HydrophobicContact CG2-CB 4.03Å; I253-R287 HydrophobicContact CG2-CG 3.98Å; I253-L288 CarbonylContact C-O 3.55Å; I253-L288 WeakPolarHBondContact CA-O 2.96Å; I253-Y289 HydrophobicContact CD1-CD1 4.33Å; I253-Y289 HydrophobicContact CD1-CE1 3.95Å; I253-Y289 HydrophobicContact CG1-CD1 3.84Å; I253-Y289 HydrophobicContact CG1-CE1 3.91Å; I253-Y289 HydrophobicContact CG2-CD1 4.38Å; I253-Y289 HydrophobicContact CG2-CE1 4.1Å
254	C	96	Very high	93	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.3	172	-161.4	0	0	0	0	108.4	C256 F259 D260 A264 R287 L288	C254-C256 HydrophobicContact CB-CB 3.92Å; C254-C256 WeakPolarHBondContact CB-SG 3.27Å; C254-C256 PolarHBondContact O-N 3.18Å; C254-C256 VanDerWaalsContact O-N 3.09Å; C254-C256 WeakPolarHBondContact SG-CB 3.24Å; C254-C256 CovalentContact SG-SG 2.04Å; C254-C256 PolarHBondContact SG-SG 2.05Å; C254-F259 HydrophobicContact CB-CD2 3.81Å; C254-F259 HydrophobicContact CB-CE2 3.78Å; C254-D260 PolarHBondContact SG-O 2.02Å; C254-A264 HydrophobicContact CB-CB 4.4Å; C254-R287 CarbonylContact O-C 3.51Å; C254-R287 WeakPolarHBondContact O-CA 3.27Å; C254-L288 HydrophobicContact CB-CB 4.29Å; C254-L288 PolarHBondContact N-O 2.76Å; C254-L288 PolarHBondContact O-N 2.85Å
255	I	95.8	Very high	93.3	Very high	55 Å²	55	42.1 Å²	42.1	28%	0.282	22%	0.222	S	C	.	.			trans	-85.5	72.9	172.9	-59.7	169.3	0	0	0	108.3	G286 R287 L354 P355 H416	I255-G286 CarbonylContact C-O 3.58Å; I255-G286 WeakPolarHBondContact CA-O 3.49Å; I255-R287 HydrophobicContact CG1-CG 4.16Å; I255-L354 HydrophobicContact CG2-CD1 3.83Å; I255-L354 HydrophobicContact CG2-CD2 3.59Å; I255-L354 HydrophobicContact CG2-CG 4.25Å; I255-P355 HydrophobicContact CD1-CG 3.68Å; I255-H416 WeakPolarHBondContact O-CB 3.44Å; I255-H416 PolarHBondContact O-N 3.34Å; I255-H416 VanDerWaalsContact O-N 3.17Å
256	C	95.1	Very high	93.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-144	147.9	-159.8	-48.2	0	0	0	0	111.4	C254 V258 G286 L288 W415 H416	C254-C256 HydrophobicContact CB-CB 3.92Å; C254-C256 WeakPolarHBondContact CB-SG 3.27Å; C254-C256 PolarHBondContact O-N 3.18Å; C254-C256 VanDerWaalsContact O-N 3.09Å; C254-C256 WeakPolarHBondContact SG-CB 3.24Å; C254-C256 CovalentContact SG-SG 2.04Å; C254-C256 PolarHBondContact SG-SG 2.05Å; C256-V258 VanDerWaalsContact CB-O 3.22Å; C256-V258 WeakPolarHBondContact CB-O 3.1Å; C256-G286 PolarHBondContact N-O 2.78Å; C256-L288 HydrophobicContact CB-CD1 4.33Å; C256-L288 WeakPolarHBondContact O-CD1 3.35Å; C256-W415 PolarHBondContact O-NE1 3.01Å; C256-H416 HydrophobicContact CB-CB 4.2Å
257	Q	92.9	Very high	93.4	Very high	84 Å²	84	49.8 Å²	49.8	39%	0.393	26%	0.264	S	S	.	.	S	Bend	trans	-76.6	-42.5	171.1	-176.1	-178.3	8.7	0	0	111.3	W415 H416	Q257-W415 HydrophobicContact CB-CH2 3.89Å; Q257-W415 HydrophobicContact CB-CZ2 3.73Å; Q257-W415 HydrophobicContact CB-CZ3 4.37Å; Q257-W415 HydrophobicContact CG-CH2 3.81Å; Q257-W415 HydrophobicContact CG-CZ2 4.08Å; Q257-W415 HydrophobicContact CG-CZ3 4.39Å; Q257-H416 WeakPolarHBondContact CB-O 3.23Å; Q257-H416 PolarHBondContact N-O 3.28Å
258	V	93	Very high	93.4	Very high	109 Å²	109	57 Å²	57	66%	0.661	30%	0.295	S	S	*	.	S	Bend	trans	-119.8	139.6	171.3	179.4	0	0	0	0	107	C256 D260	C256-V258 VanDerWaalsContact CB-O 3.22Å; C256-V258 WeakPolarHBondContact CB-O 3.1Å; V258-D260 PolarHBondContact O-N 3.49Å
259	F	93.1	Very high	93.3	Very high	45 Å²	45	59.2 Å²	59.2	20%	0.197	31%	0.309	C	S	.	.			trans	-64.1	122.1	-175.8	-171.7	-89.1	0	0	0	110.8	C254 E261 A264 L288 Q290 A310	C254-F259 HydrophobicContact CB-CD2 3.81Å; C254-F259 HydrophobicContact CB-CE2 3.78Å; F259-E261 HydrophobicContact CE1-CB 4.24Å; F259-A264 HydrophobicContact CE2-CB 4.28Å; F259-A264 HydrophobicContact CZ-CB 3.81Å; F259-L288 HydrophobicContact CB-CD1 3.93Å; F259-L288 HydrophobicContact CD2-CB 4.01Å; F259-L288 VanDerWaalsContact N-CD1 3.26Å; F259-Q290 HydrophobicContact CD2-CG 4.14Å; F259-Q290 VanDerWaalsContact CE1-CD 3.44Å; F259-Q290 HydrophobicContact CE1-CG 4.47Å; F259-Q290 VanDerWaalsContact CE1-OE1 3.26Å; F259-Q290 HydrophobicContact CE2-CB 4.4Å; F259-Q290 HydrophobicContact CE2-CG 3.72Å; F259-Q290 HydrophobicContact CZ-CG 3.93Å; F259-A310 HydrophobicContact CB-CB 3.55Å; F259-A310 HydrophobicContact CD2-CB 3.68Å; F259-A310 HydrophobicContact CG-CB 3.72Å
260	D	92.9	Very high	93.2	Very high	54 Å²	54	62.6 Å²	62.6	29%	0.289	33%	0.326	S	S	.	.			trans	-124.2	119.8	173.3	-173	-23.4	0	0	0	108.7	C254 V258 S262 Y263 A264 H416	C254-D260 PolarHBondContact SG-O 2.02Å; V258-D260 PolarHBondContact O-N 3.49Å; D260-S262 PolarHBondContact O-N 3.27Å; D260-S262 WeakPolarHBondContact OD1-CB 3.34Å; D260-S262 PolarHBondContact OD1-N 3.33Å; D260-S262 PolarHBondContact OD1-OG 3.1Å; D260-S262 PolarHBondContact OD2-OG 3.02Å; D260-Y263 HydrophobicContact CB-CD2 4.21Å; D260-Y263 PolarHBondContact O-N 3.29Å; D260-A264 PolarHBondContact O-N 3.11Å; D260-H416 IonicContact OD2-NE2 2.81Å; D260-H416 PolarHBondContact OD2-NE2 3.22Å
261	E	91.1	Very high	93.1	Very high	129 Å²	129	65.3 Å²	65.3	60%	0.603	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-64.1	-26.4	-178.5	-176.9	157.8	-146.5	0	0	112.9	R252 F259 Y263 A264	R252-E261 IonicContact CZ-OE1 3.2Å; R252-E261 IonicContact NH1-OE1 3.93Å; R252-E261 PolarHBondContact NH1-OE1 3.18Å; R252-E261 IonicContact NH2-OE1 2.87Å; R252-E261 PolarHBondContact NH2-OE1 3.32Å; R252-E261 VanDerWaalsContact NH2-OE1 3.11Å; F259-E261 HydrophobicContact CE1-CB 4.24Å; E261-Y263 VanDerWaalsContact C-N 3.27Å; E261-Y263 PolarHBondContact O-N 3.42Å; E261-A264 PolarHBondContact O-N 2.98Å
262	S	92.1	Very high	93	Very high	91 Å²	91	66.1 Å²	66.1	64%	0.636	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-69.3	-24.2	178.1	67	0	0	0	0	113.6	D260	D260-S262 PolarHBondContact O-N 3.27Å; D260-S262 WeakPolarHBondContact OD1-CB 3.34Å; D260-S262 PolarHBondContact OD1-N 3.33Å; D260-S262 PolarHBondContact OD1-OG 3.1Å; D260-S262 PolarHBondContact OD2-OG 3.02Å
263	Y	91.5	Very high	92.9	Very high	128 Å²	128	66.5 Å²	66.5	50%	0.502	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-105.6	2.4	177	-68.8	-88.7	0	0	0	112.9	D260 E261 H416	D260-Y263 HydrophobicContact CB-CD2 4.21Å; D260-Y263 PolarHBondContact O-N 3.29Å; E261-Y263 VanDerWaalsContact C-N 3.27Å; E261-Y263 PolarHBondContact O-N 3.42Å; Y263-H416 AromaticContact CD2-CE1 3.53Å; Y263-H416 AromaticContact CD2-ND1 3.66Å; Y263-H416 AromaticContact CD2-NE2 3.84Å; Y263-H416 AromaticContact CE2-CE1 3.2Å; Y263-H416 WeakPolarHBondContact CE2-CE1 3.36Å; Y263-H416 AromaticContact CE2-ND1 3.48Å; Y263-H416 WeakPolarHBondContact CE2-ND1 3.39Å; Y263-H416 AromaticContact CE2-NE2 3.92Å; Y263-H416 AromaticContact CZ-CE1 3.77Å; Y263-H416 AromaticContact CZ-ND1 3.67Å
264	A	93.8	Very high	92.5	Very high	22 Å²	22	66.7 Å²	66.7	18%	0.182	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-77.3	145.3	176.7	0	0	0	0	0	110.9	I253 C254 F259 D260 E261	I253-A264 CarbonylContact O-C 3.6Å; I253-A264 WeakPolarHBondContact O-CA 3.48Å; C254-A264 HydrophobicContact CB-CB 4.4Å; F259-A264 HydrophobicContact CE2-CB 4.28Å; F259-A264 HydrophobicContact CZ-CB 3.81Å; D260-A264 PolarHBondContact O-N 3.11Å; E261-A264 PolarHBondContact O-N 2.98Å
265	S	93.9	Very high	92.2	Very high	54 Å²	54	72.7 Å²	72.7	38%	0.378	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-61	161.7	170.4	76.5	0	0	0	0	111.1	R252 I253	R252-S265 WeakPolarHBondContact CB-O 3.37Å; I253-S265 PolarHBondContact N-OG 3.28Å; I253-S265 PolarHBondContact O-N 3.49Å
266	T	91.9	Very high	91.8	Very high	112 Å²	112	73.9 Å²	73.9	69%	0.687	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-60.9	158.9	163.4	56.9	0	0	0	0	110.6	K268	T266-K268 PolarHBondContact O-N 3.35Å
267	W	92	Very high	91.4	Very high	55 Å²	55	75.1 Å²	75.1	21%	0.208	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-68.7	127.8	177.4	-71.1	102.5	0	0	0	111	Q250 R252 Q290 R292	Q250-W267 HydrophobicContact CB-CB 4.46Å; Q250-W267 HydrophobicContact CB-CE3 3.97Å; R252-W267 HydrophobicContact CB-CD2 4.08Å; R252-W267 HydrophobicContact CB-CE3 3.89Å; R252-W267 HydrophobicContact CB-CZ3 4.16Å; R252-W267 VanDerWaalsContact CD-CZ2 3.48Å; R252-W267 HydrophobicContact CG-CD2 4.13Å; R252-W267 HydrophobicContact CG-CE3 3.94Å; R252-W267 HydrophobicContact CG-CH2 3.74Å; R252-W267 HydrophobicContact CG-CZ2 3.92Å; R252-W267 HydrophobicContact CG-CZ3 3.75Å; R252-W267 VanDerWaalsContact NE-CZ2 3.3Å; W267-Q290 HydrophobicContact CH2-CB 4.03Å; W267-Q290 WeakPolarHBondContact CZ3-O 3.4Å; W267-R292 HydrophobicContact CD2-CG 3.96Å; W267-R292 VanDerWaalsContact CD2-NE 3.32Å; W267-R292 VanDerWaalsContact CE2-CD 3.47Å; W267-R292 HydrophobicContact CE3-CG 3.67Å; W267-R292 VanDerWaalsContact CG-NE 3.32Å; W267-R292 HydrophobicContact CH2-CB 3.83Å; W267-R292 HydrophobicContact CH2-CG 3.84Å; W267-R292 HydrophobicContact CZ2-CB 4.29Å; W267-R292 HydrophobicContact CZ2-CG 4.13Å; W267-R292 HydrophobicContact CZ3-CB 3.95Å; W267-R292 HydrophobicContact CZ3-CG 3.61Å
268	K	92.7	Very high	91.2	Very high	153 Å²	153	71.8 Å²	71.8	67%	0.665	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	136.8	176.5	-174.9	177	178.3	-178.8	0	110.3	Q250 I251 T266 L270	Q250-K268 CarbonylContact C-O 3.52Å; Q250-K268 WeakPolarHBondContact CA-O 3.44Å; Q250-K268 WeakPolarHBondContact CB-O 3.41Å; I251-K268 HydrophobicContact CG2-CB 4.46Å; I251-K268 PolarHBondContact N-O 3.44Å; I251-K268 PolarHBondContact O-N 2.84Å; T266-K268 PolarHBondContact O-N 3.35Å; K268-L270 PolarHBondContact O-N 3.41Å
269	T	91.6	Very high	91	Very high	46 Å²	46	71.9 Å²	71.9	28%	0.282	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	121.6	173.7	-53.8	0	0	0	0	110.9	L48 I248 Q250 M272	L48-T269 HydrophobicContact CD1-CG2 4.25Å; L48-T269 WeakPolarHBondContact CD1-OG1 3.28Å; L48-T269 VanDerWaalsContact CD2-OG1 3.31Å; L48-T269 WeakPolarHBondContact CD2-OG1 3.48Å; I248-T269 HydrophobicContact CG2-CG2 3.97Å; Q250-T269 PolarHBondContact NE2-OG1 2.8Å; T269-M272 HydrophobicContact CG2-CE 4.43Å; T269-M272 HydrophobicContact CG2-CG 4.37Å
270	L	90.9	Very high	90.8	Very high	72 Å²	72	70.9 Å²	70.9	38%	0.377	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-53.4	177.6	-171.6	62.8	0	0	0	110	L249 I251 K268 L280 F291	L249-L270 HydrophobicContact CD2-CD2 4.08Å; L249-L270 PolarHBondContact O-N 3.44Å; I251-L270 HydrophobicContact CG2-CB 4.27Å; I251-L270 HydrophobicContact CG2-CD1 4.32Å; K268-L270 PolarHBondContact O-N 3.41Å; L270-L280 HydrophobicContact CD2-CD1 3.82Å; L270-L280 HydrophobicContact CD2-CD2 3.57Å; L270-L280 HydrophobicContact CD2-CG 4.36Å; L270-F291 HydrophobicContact CD2-CE1 4.3Å
271	I	91.8	Very high	90.5	Very high	63 Å²	63	75.3 Å²	75.3	32%	0.323	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	157.2	178.6	58.5	172.5	0	0	0	111.6	L249 T273 A278	L249-I271 HydrophobicContact CB-CD1 4.47Å; L249-I271 HydrophobicContact CB-CG1 3.74Å; L249-I271 HydrophobicContact CD2-CD1 4.09Å; L249-I271 HydrophobicContact CD2-CG1 4.01Å; L249-I271 HydrophobicContact CG-CG1 4.44Å; L249-I271 PolarHBondContact N-O 2.83Å; L249-I271 PolarHBondContact O-N 2.91Å; I271-T273 HydrophobicContact CD1-CG2 4.08Å; I271-A278 HydrophobicContact CD1-CB 3.76Å
272	M	92	Very high	90	Very high	38 Å²	38	73.3 Å²	73.3	19%	0.187	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	125.8	162.3	-65.4	-178.5	-174.6	0	0	108.2	L48 R51 K55 F247 I248 T269	L48-M272 HydrophobicContact CD1-CE 3.1Å; L48-M272 HydrophobicContact CG-CE 3.69Å; R51-M272 HydrophobicContact CB-CE 4.25Å; R51-M272 HydrophobicContact CB-SD 4.42Å; K55-M272 HydrophobicContact CD-SD 4.41Å; F247-M272 CarbonylContact O-C 3.39Å; F247-M272 VanDerWaalsContact O-CA 3.31Å; F247-M272 WeakPolarHBondContact O-CA 3.15Å; I248-M272 HydrophobicContact CG1-CG 4.31Å; T269-M272 HydrophobicContact CG2-CE 4.43Å; T269-M272 HydrophobicContact CG2-CG 4.37Å
273	T	91.2	Very high	89.9	Confident	31 Å²	31	70.4 Å²	70.4	19%	0.19	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	155.2	-172.9	-172.4	0	0	0	0	111.9	W231 F247 I271 E275	W231-T273 HydrophobicContact CZ2-CG2 4.03Å; F247-T273 WeakPolarHBondContact CA-O 3.37Å; F247-T273 HydrophobicContact CB-CG2 4.45Å; F247-T273 PolarHBondContact N-O 2.81Å; F247-T273 PolarHBondContact O-N 2.78Å; I271-T273 HydrophobicContact CD1-CG2 4.08Å; T273-E275 HydrophobicContact CG2-CB 4.24Å; T273-E275 WeakPolarHBondContact OG1-CB 3.39Å; T273-E275 WeakPolarHBondContact OG1-CG 3.36Å; T273-E275 PolarHBondContact OG1-N 3.04Å
274	H	87.7	Confident	89.8	Confident	59 Å²	59	69.1 Å²	69.1	27%	0.273	37%	0.372	S	S	.	.	S	Bend	trans	-94.1	-2.1	166.7	-167.2	-85	0	0	0	111.6	L59 P244 I245	L59-H274 HydrophobicContact CD1-CB 4.02Å; L59-H274 WeakPolarHBondContact CD1-CD2 3.38Å; P244-H274 VanDerWaalsContact CB-NE2 3.3Å; P244-H274 WeakPolarHBondContact CB-NE2 3.4Å; I245-H274 VanDerWaalsContact C-CD2 3.47Å; I245-H274 PolarHBondContact N-CD2 3.2Å; I245-H274 PolarHBondContact N-NE2 3.26Å; I245-H274 PolarHBondContact O-CD2 2.91Å; I245-H274 PolarHBondContact O-NE2 3.16Å
275	E	88.8	Confident	89.8	Confident	126 Å²	126	69.9 Å²	69.9	59%	0.589	38%	0.375	S	S	*	.	S	Bend	trans	-72.7	149.5	176.8	-62.8	-57.9	147.3	0	0	112	W231 F247 T273 G277	W231-E275 VanDerWaalsContact CZ2-O 3.26Å; W231-E275 WeakPolarHBondContact CZ2-O 3.5Å; W231-E275 PolarHBondContact NE1-O 2.85Å; F247-E275 WeakPolarHBondContact CD2-O 3.35Å; T273-E275 HydrophobicContact CG2-CB 4.24Å; T273-E275 WeakPolarHBondContact OG1-CB 3.39Å; T273-E275 WeakPolarHBondContact OG1-CG 3.36Å; T273-E275 PolarHBondContact OG1-N 3.04Å; E275-G277 VanDerWaalsContact C-N 3.26Å; E275-G277 PolarHBondContact O-N 2.97Å
276	F	87.6	Confident	89.7	Confident	80 Å²	80	67.3 Å²	67.3	35%	0.351	36%	0.357	S	S	.	.	S	Bend	trans	-88	17.8	-178.4	-66.9	-78.7	0	0	0	114.4	W231 S232 F247	W231-F276 VanDerWaalsContact CE2-C 3.5Å; W231-F276 PolarHBondContact N-O 3.04Å; W231-F276 VanDerWaalsContact N-O 3.11Å; S232-F276 PolarHBondContact N-O 3.12Å; F247-F276 AromaticContact CE2-CD1 3.76Å; F247-F276 HydrophobicContact CE2-CD1 3.76Å; F247-F276 AromaticContact CE2-CE1 3.82Å; F247-F276 HydrophobicContact CE2-CE1 3.82Å; F247-F276 AromaticContact CZ-CD1 3.85Å; F247-F276 HydrophobicContact CZ-CD1 3.85Å; F247-F276 AromaticContact CZ-CE1 3.77Å; F247-F276 HydrophobicContact CZ-CE1 3.77Å
277	G	86.7	Confident	89.9	Confident	26 Å²	26	63.3 Å²	63.3	27%	0.268	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.6	169.1	179	0	0	0	0	0	113.6	L229 E275	L229-G277 CarbonylContact O-C 3.56Å; L229-G277 WeakPolarHBondContact O-CA 3.48Å; E275-G277 VanDerWaalsContact C-N 3.26Å; E275-G277 PolarHBondContact O-N 2.97Å
278	A	88.8	Confident	90	Very high	15 Å²	15	60.9 Å²	60.9	12%	0.124	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	143.8	174.1	0	0	0	0	0	110.6	L229 W231 L249 I271 L280	L229-A278 PolarHBondContact N-O 3.18Å; L229-A278 PolarHBondContact O-N 3.13Å; W231-A278 HydrophobicContact CH2-CB 3.93Å; W231-A278 HydrophobicContact CZ3-CB 4.26Å; L249-A278 HydrophobicContact CD2-CB 4.2Å; I271-A278 HydrophobicContact CD1-CB 3.76Å; A278-L280 HydrophobicContact CB-CD2 4.31Å
279	N	89	Confident	90	Very high	110 Å²	110	54.1 Å²	54.1	59%	0.588	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.8	169.2	-62.1	-33.8	0	0	0	107.9	K228	K228-N279 WeakPolarHBondContact CD-OD1 3.43Å; K228-N279 VanDerWaalsContact CG-OD1 3.24Å; K228-N279 WeakPolarHBondContact CG-OD1 3.47Å
280	L	88.7	Confident	90.1	Very high	24 Å²	24	53 Å²	53	13%	0.126	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.3	178.7	-48	178.4	0	0	0	109.6	I226 I227 L229 L270 A278 F283 F291	I226-L280 WeakPolarHBondContact CA-O 3.45Å; I227-L280 HydrophobicContact CG2-CB 3.76Å; I227-L280 HydrophobicContact CG2-CD1 4.32Å; I227-L280 HydrophobicContact CG2-CG 4.32Å; I227-L280 PolarHBondContact N-O 3.32Å; I227-L280 PolarHBondContact O-N 2.88Å; L229-L280 HydrophobicContact CD1-CD1 3.56Å; L229-L280 HydrophobicContact CD1-CG 4.31Å; L229-L280 HydrophobicContact CG-CD1 4.35Å; L270-L280 HydrophobicContact CD2-CD1 3.82Å; L270-L280 HydrophobicContact CD2-CD2 3.57Å; L270-L280 HydrophobicContact CD2-CG 4.36Å; A278-L280 HydrophobicContact CB-CD2 4.31Å; L280-F283 HydrophobicContact CB-CZ 4.04Å; L280-F291 HydrophobicContact CD1-CD1 3.77Å; L280-F291 HydrophobicContact CD1-CE1 3.16Å; L280-F291 HydrophobicContact CD1-CE2 4.23Å; L280-F291 HydrophobicContact CD1-CG 4.5Å; L280-F291 HydrophobicContact CD1-CZ 3.44Å; L280-F291 VanDerWaalsContact CD1-CZ 3.44Å
281	E	86.1	Confident	90.2	Very high	148 Å²	148	49.6 Å²	49.6	69%	0.692	26%	0.264	S	S	*	.			trans	-134.4	-179.9	-177.8	62.4	-174.3	179.2	0	0	110.3	I226	I226-E281 HydrophobicContact CG1-CB 4.4Å
282	A	82.1	Confident	90.1	Very high	87 Å²	87	48.2 Å²	48.2	72%	0.719	26%	0.255	S	S	*	.			trans	64.7	49.4	178	0	0	0	0	0	115.3
283	F	88.4	Confident	90	Very high	30 Å²	30	46.5 Å²	46.5	13%	0.132	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-75.4	126.1	170.1	-57.5	-70.8	0	0	0	111.2	N225 I227 L280 Y289 F291 Y311	N225-F283 WeakPolarHBondContact O-CD2 3.06Å; N225-F283 WeakPolarHBondContact O-CE2 3.18Å; I227-F283 HydrophobicContact CB-CE2 4.34Å; I227-F283 HydrophobicContact CB-CZ 4.21Å; I227-F283 HydrophobicContact CG2-CE1 4.48Å; I227-F283 HydrophobicContact CG2-CE2 4Å; I227-F283 HydrophobicContact CG2-CZ 3.45Å; I227-F283 VanDerWaalsContact CG2-CZ 3.45Å; L280-F283 HydrophobicContact CB-CZ 4.04Å; F283-Y289 HydrophobicContact CB-CE2 4.02Å; F283-Y289 AromaticContact CD1-CD2 3.51Å; F283-Y289 HydrophobicContact CD1-CD2 3.51Å; F283-Y289 AromaticContact CD1-CE2 3.57Å; F283-Y289 HydrophobicContact CD1-CE2 3.57Å; F283-Y289 HydrophobicContact CD1-CG 4.02Å; F283-Y289 HydrophobicContact CE1-CD2 4.16Å; F283-Y289 HydrophobicContact CE1-CG 4.28Å; F283-Y289 HydrophobicContact CG-CD2 4.47Å; F283-Y289 HydrophobicContact CG-CE2 4.28Å; F283-F291 HydrophobicContact CE1-CZ 4.24Å; F283-Y311 HydrophobicContact CD1-CD1 4.14Å; F283-Y311 HydrophobicContact CD1-CE1 4.18Å; F283-Y311 HydrophobicContact CD2-CD1 4.44Å; F283-Y311 AromaticContact CD2-CE1 3.69Å; F283-Y311 HydrophobicContact CD2-CE1 3.69Å; F283-Y311 AromaticContact CE1-CD1 3.95Å; F283-Y311 HydrophobicContact CE1-CD1 3.95Å; F283-Y311 HydrophobicContact CE1-CE1 4.1Å; F283-Y311 HydrophobicContact CE2-CD1 4.28Å; F283-Y311 AromaticContact CE2-CE1 3.61Å; F283-Y311 HydrophobicContact CE2-CE1 3.61Å; F283-Y311 HydrophobicContact CG-CD1 4.39Å; F283-Y311 AromaticContact CG-CE1 3.99Å; F283-Y311 HydrophobicContact CG-CE1 3.99Å; F283-Y311 HydrophobicContact CZ-CD1 4.04Å; F283-Y311 AromaticContact CZ-CE1 3.84Å; F283-Y311 HydrophobicContact CZ-CE1 3.84Å
284	E	91.1	Very high	89.9	Confident	100 Å²	100	45 Å²	45	47%	0.467	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-90.4	153.4	-177.7	-52.4	173.6	105.4	0	0	111.5	R287 Y289	E284-R287 IonicContact OE1-NH2 2.97Å; E284-R287 VanDerWaalsContact OE2-CD 3.3Å; E284-R287 WeakPolarHBondContact OE2-CD 3.39Å; E284-R287 IonicContact OE2-CZ 3.3Å; E284-R287 IonicContact OE2-NE 2.73Å; E284-R287 PolarHBondContact OE2-NE 2.93Å; E284-R287 IonicContact OE2-NH2 3.65Å; E284-Y289 PolarHBondContact N-OH 3.09Å
285	P	92	Very high	90	Very high	39 Å²	39	42.2 Å²	42.2	25%	0.253	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	150	175.6	-23.6	34	0	0	0	113.3	R287 I316 P318 D353	P285-R287 PolarHBondContact O-N 3.06Å; P285-R287 PolarHBondContact O-NH1 3.49Å; P285-I316 HydrophobicContact CB-CB 4.44Å; P285-I316 HydrophobicContact CB-CG2 4.37Å; P285-P318 HydrophobicContact CB-CB 4.29Å; P285-D353 HydrophobicContact CB-CB 4.37Å
286	G	93.5	Very high	90	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	11.3	176.2	0	0	0	0	0	115.8	I255 C256 I316 W415	I255-G286 CarbonylContact C-O 3.58Å; I255-G286 WeakPolarHBondContact CA-O 3.49Å; C256-G286 PolarHBondContact N-O 2.78Å; G286-I316 PolarHBondContact N-O 3.34Å; G286-W415 PolarHBondContact O-NE1 3.09Å
287	R	95	Very high	89.9	Confident	28 Å²	28	32.4 Å²	32.4	11%	0.106	18%	0.18	C	C	.	.			trans	-118.1	142.5	-179.5	-69.8	173.9	-168.4	60	-9.5	112.2	I253 C254 I255 E284 P285 Y289 D353	I253-R287 HydrophobicContact CG2-CB 4.03Å; I253-R287 HydrophobicContact CG2-CG 3.98Å; C254-R287 CarbonylContact O-C 3.51Å; C254-R287 WeakPolarHBondContact O-CA 3.27Å; I255-R287 HydrophobicContact CG1-CG 4.16Å; E284-R287 IonicContact OE1-NH2 2.97Å; E284-R287 VanDerWaalsContact OE2-CD 3.3Å; E284-R287 WeakPolarHBondContact OE2-CD 3.39Å; E284-R287 IonicContact OE2-CZ 3.3Å; E284-R287 IonicContact OE2-NE 2.73Å; E284-R287 PolarHBondContact OE2-NE 2.93Å; E284-R287 IonicContact OE2-NH2 3.65Å; P285-R287 PolarHBondContact O-N 3.06Å; P285-R287 PolarHBondContact O-NH1 3.49Å; R287-Y289 HydrophobicContact CB-CE2 3.72Å; R287-Y289 WeakPolarHBondContact CD-OH 3.32Å; R287-D353 PolarHBondContact NH1-O 3.48Å; R287-D353 PolarHBondContact NH2-O 3.27Å
288	L	94	Very high	89.6	Confident	4 Å²	4	31.9 Å²	31.9	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	136.5	171.8	-69.1	172.5	0	0	0	109.4	I253 C254 C256 F259 A310 Y311 P312 P315	I253-L288 CarbonylContact C-O 3.55Å; I253-L288 WeakPolarHBondContact CA-O 2.96Å; C254-L288 HydrophobicContact CB-CB 4.29Å; C254-L288 PolarHBondContact N-O 2.76Å; C254-L288 PolarHBondContact O-N 2.85Å; C256-L288 HydrophobicContact CB-CD1 4.33Å; C256-L288 WeakPolarHBondContact O-CD1 3.35Å; F259-L288 HydrophobicContact CB-CD1 3.93Å; F259-L288 HydrophobicContact CD2-CB 4.01Å; F259-L288 VanDerWaalsContact N-CD1 3.26Å; L288-A310 HydrophobicContact CB-CB 4.42Å; L288-Y311 CarbonylContact C-O 3.57Å; L288-Y311 WeakPolarHBondContact CA-O 3.43Å; L288-P312 WeakPolarHBondContact CD2-O 2.98Å; L288-P315 HydrophobicContact CD2-CB 4.02Å; L288-P315 HydrophobicContact CD2-CG 3.88Å; L288-P315 HydrophobicContact CG-CB 4.41Å; L288-P315 HydrophobicContact CG-CG 4.17Å
289	Y	93.6	Very high	89.1	Confident	11 Å²	11	34.9 Å²	34.9	4%	0.043	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.1	-172.7	-57.4	-90.3	0	0	0	109.9	I251 R252 I253 F283 E284 R287 A310 Y311	I251-Y289 HydrophobicContact CD1-CD1 3.65Å; I251-Y289 HydrophobicContact CD1-CE1 4.39Å; I251-Y289 HydrophobicContact CD1-CG 4.48Å; I251-Y289 HydrophobicContact CG1-CD1 4.31Å; R252-Y289 WeakPolarHBondContact O-CA 3.37Å; I253-Y289 HydrophobicContact CD1-CD1 4.33Å; I253-Y289 HydrophobicContact CD1-CE1 3.95Å; I253-Y289 HydrophobicContact CG1-CD1 3.84Å; I253-Y289 HydrophobicContact CG1-CE1 3.91Å; I253-Y289 HydrophobicContact CG2-CD1 4.38Å; I253-Y289 HydrophobicContact CG2-CE1 4.1Å; F283-Y289 HydrophobicContact CB-CE2 4.02Å; F283-Y289 AromaticContact CD1-CD2 3.51Å; F283-Y289 HydrophobicContact CD1-CD2 3.51Å; F283-Y289 AromaticContact CD1-CE2 3.57Å; F283-Y289 HydrophobicContact CD1-CE2 3.57Å; F283-Y289 HydrophobicContact CD1-CG 4.02Å; F283-Y289 HydrophobicContact CE1-CD2 4.16Å; F283-Y289 HydrophobicContact CE1-CG 4.28Å; F283-Y289 HydrophobicContact CG-CD2 4.47Å; F283-Y289 HydrophobicContact CG-CE2 4.28Å; E284-Y289 PolarHBondContact N-OH 3.09Å; R287-Y289 HydrophobicContact CB-CE2 3.72Å; R287-Y289 WeakPolarHBondContact CD-OH 3.32Å; Y289-A310 WeakPolarHBondContact O-CA 3.25Å; Y289-Y311 WeakPolarHBondContact CD2-O 3.49Å; Y289-Y311 PolarHBondContact N-O 3.34Å; Y289-Y311 PolarHBondContact O-N 3.02Å
290	Q	92.8	Very high	88.5	Confident	21 Å²	21	29.8 Å²	29.8	10%	0.098	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	147.6	169.3	-77.2	-173.2	-19.2	0	0	110.2	I251 R252 F259 W267 T308 A310	I251-Q290 CarbonylContact C-O 3.57Å; I251-Q290 WeakPolarHBondContact CA-O 3.31Å; R252-Q290 HydrophobicContact CG-CB 3.88Å; R252-Q290 PolarHBondContact N-O 2.99Å; R252-Q290 PolarHBondContact O-N 2.8Å; F259-Q290 HydrophobicContact CD2-CG 4.14Å; F259-Q290 VanDerWaalsContact CE1-CD 3.44Å; F259-Q290 HydrophobicContact CE1-CG 4.47Å; F259-Q290 VanDerWaalsContact CE1-OE1 3.26Å; F259-Q290 HydrophobicContact CE2-CB 4.4Å; F259-Q290 HydrophobicContact CE2-CG 3.72Å; F259-Q290 HydrophobicContact CZ-CG 3.93Å; W267-Q290 HydrophobicContact CH2-CB 4.03Å; W267-Q290 WeakPolarHBondContact CZ3-O 3.4Å; Q290-T308 WeakPolarHBondContact CG-O 3.19Å; Q290-T308 PolarHBondContact NE2-O 3.46Å; Q290-A310 HydrophobicContact CG-CB 4.07Å
291	F	93	Very high	88.1	Confident	1 Å²	1	30.4 Å²	30.4	0%	0.004	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.4	-176.9	-55.9	-78.5	0	0	0	110.5	L215 L229 L249 Q250 I251 L270 L280 F283 G307 T308	L215-F291 HydrophobicContact CD2-CB 3.99Å; L229-F291 HydrophobicContact CD1-CB 4.09Å; L229-F291 HydrophobicContact CD1-CD1 4.08Å; L229-F291 HydrophobicContact CD1-CD2 4.09Å; L229-F291 HydrophobicContact CD1-CG 3.8Å; L229-F291 HydrophobicContact CD2-CD2 4.46Å; L249-F291 HydrophobicContact CD1-CB 4.18Å; Q250-F291 VanDerWaalsContact O-CA 3.29Å; Q250-F291 WeakPolarHBondContact O-CA 3.47Å; I251-F291 HydrophobicContact CB-CD1 4.09Å; I251-F291 HydrophobicContact CB-CE1 4.04Å; I251-F291 HydrophobicContact CD1-CD1 4.31Å; I251-F291 HydrophobicContact CD1-CE1 3.43Å; I251-F291 VanDerWaalsContact CD1-CE1 3.43Å; I251-F291 HydrophobicContact CD1-CZ 3.99Å; I251-F291 HydrophobicContact CG1-CD1 3.93Å; I251-F291 HydrophobicContact CG1-CE1 3.52Å; I251-F291 HydrophobicContact CG1-CZ 4.26Å; L270-F291 HydrophobicContact CD2-CE1 4.3Å; L280-F291 HydrophobicContact CD1-CD1 3.77Å; L280-F291 HydrophobicContact CD1-CE1 3.16Å; L280-F291 HydrophobicContact CD1-CE2 4.23Å; L280-F291 HydrophobicContact CD1-CG 4.5Å; L280-F291 HydrophobicContact CD1-CZ 3.44Å; L280-F291 VanDerWaalsContact CD1-CZ 3.44Å; F283-F291 HydrophobicContact CE1-CZ 4.24Å; F291-G307 CarbonylContact O-C 3.58Å; F291-G307 VanDerWaalsContact O-CA 3.3Å; F291-G307 WeakPolarHBondContact O-CA 3.39Å; F291-T308 HydrophobicContact CB-CG2 4.09Å; F291-T308 PolarHBondContact N-OG1 3.11Å; F291-T308 PolarHBondContact O-N 2.72Å
292	R	90.8	Very high	87.6	Confident	34 Å²	34	25.8 Å²	25.8	13%	0.128	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	152.9	168.7	71.9	-179.9	-176.3	172	2.7	109.9	E45 Q250 W267 F304	E45-R292 IonicContact OE1-CZ 2.8Å; E45-R292 IonicContact OE1-NH1 3.47Å; E45-R292 IonicContact OE1-NH2 3.32Å; E45-R292 PolarHBondContact OE1-NH2 2.81Å; Q250-R292 HydrophobicContact CB-CG 4.02Å; Q250-R292 PolarHBondContact N-O 2.8Å; Q250-R292 PolarHBondContact O-N 2.87Å; W267-R292 HydrophobicContact CD2-CG 3.96Å; W267-R292 VanDerWaalsContact CD2-NE 3.32Å; W267-R292 VanDerWaalsContact CE2-CD 3.47Å; W267-R292 HydrophobicContact CE3-CG 3.67Å; W267-R292 VanDerWaalsContact CG-NE 3.32Å; W267-R292 HydrophobicContact CH2-CB 3.83Å; W267-R292 HydrophobicContact CH2-CG 3.84Å; W267-R292 HydrophobicContact CZ2-CB 4.29Å; W267-R292 HydrophobicContact CZ2-CG 4.13Å; W267-R292 HydrophobicContact CZ3-CB 3.95Å; W267-R292 HydrophobicContact CZ3-CG 3.61Å; R292-F304 HydrophobicContact CG-CB 4.32Å; R292-F304 HydrophobicContact CG-CD1 3.86Å; R292-F304 HydrophobicContact CG-CG 4.25Å
293	I	90.3	Very high	87.6	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.01	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145.1	-175.6	-173	170.7	0	0	0	110.7	P212 L215 W231 F247 I248 G305	P212-I293 HydrophobicContact CB-CG2 3.76Å; P212-I293 HydrophobicContact CG-CG2 3.64Å; P212-I293 WeakPolarHBondContact CG-O 3.4Å; L215-I293 HydrophobicContact CB-CG2 4.38Å; L215-I293 HydrophobicContact CD1-CD1 4.45Å; L215-I293 HydrophobicContact CD1-CG2 4.04Å; L215-I293 HydrophobicContact CD2-CG2 4.39Å; W231-I293 HydrophobicContact CB-CD1 4.15Å; W231-I293 HydrophobicContact CD2-CD1 3.3Å; W231-I293 VanDerWaalsContact CE2-CD1 3.41Å; W231-I293 HydrophobicContact CE3-CD1 3.81Å; W231-I293 HydrophobicContact CG-CD1 3.49Å; W231-I293 VanDerWaalsContact CG-CD1 3.49Å; W231-I293 HydrophobicContact CH2-CD1 4.33Å; W231-I293 HydrophobicContact CZ2-CD1 3.94Å; W231-I293 HydrophobicContact CZ3-CD1 4.27Å; F247-I293 HydrophobicContact CB-CD1 4.01Å; F247-I293 HydrophobicContact CB-CG1 4.3Å; F247-I293 HydrophobicContact CD1-CD1 3.84Å; F247-I293 HydrophobicContact CD1-CG1 4.29Å; F247-I293 HydrophobicContact CG-CD1 4.16Å; I248-I293 CarbonylContact O-C 3.59Å; I248-I293 VanDerWaalsContact O-CA 3.29Å; I248-I293 WeakPolarHBondContact O-CA 3.47Å; I293-G305 PolarHBondContact O-N 3.26Å
294	A	88.8	Confident	87.4	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	146.2	166.7	0	0	0	0	0	109.6	F49 F247 I248 F304	F49-A294 HydrophobicContact CE1-CB 3.9Å; F247-A294 CarbonylContact C-O 3.59Å; F247-A294 VanDerWaalsContact CA-O 3.3Å; F247-A294 WeakPolarHBondContact CA-O 3.32Å; I248-A294 HydrophobicContact CB-CB 4.46Å; I248-A294 PolarHBondContact N-O 2.83Å; I248-A294 PolarHBondContact O-N 3.34Å; A294-F304 HydrophobicContact CB-CD1 3.48Å; A294-F304 VanDerWaalsContact CB-CD1 3.48Å; A294-F304 HydrophobicContact CB-CE1 3.59Å; A294-F304 HydrophobicContact CB-CG 3.96Å; A294-F304 HydrophobicContact CB-CZ 4.17Å
295	A	88.9	Confident	87	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.008	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.8	175.3	0	0	0	0	0	110.1	P209 Y235 I245 F247 T301	P209-A295 HydrophobicContact CB-CB 3.74Å; P209-A295 HydrophobicContact CG-CB 4.48Å; Y235-A295 HydrophobicContact CE1-CB 3.5Å; Y235-A295 WeakPolarHBondContact OH-CB 3.21Å; I245-A295 HydrophobicContact CG2-CB 3.88Å; F247-A295 HydrophobicContact CD1-CB 3.97Å; F247-A295 HydrophobicContact CE1-CB 3.83Å; A295-T301 PolarHBondContact O-OG1 2.89Å; A295-T301 VanDerWaalsContact O-OG1 3.09Å
296	V	88.5	Confident	86.5	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	122.2	-171.8	-168.3	0	0	0	0	109.7	F49 A52 R53 I245 V246 I248	F49-V296 HydrophobicContact CD1-CG2 4.11Å; A52-V296 HydrophobicContact CB-CB 3.79Å; A52-V296 HydrophobicContact CB-CG1 3.86Å; A52-V296 HydrophobicContact CB-CG2 3.78Å; R53-V296 HydrophobicContact CB-CG1 4.4Å; R53-V296 HydrophobicContact CG-CG1 3.47Å; R53-V296 VanDerWaalsContact CG-CG1 3.47Å; I245-V296 CarbonylContact C-O 3.54Å; I245-V296 WeakPolarHBondContact CA-O 3.09Å; V246-V296 PolarHBondContact N-O 2.77Å; V246-V296 WeakPolarHBondContact O-CB 3.49Å; V246-V296 PolarHBondContact O-N 3.19Å; I248-V296 HydrophobicContact CD1-CG2 3.74Å; I248-V296 HydrophobicContact CG1-CG2 4.23Å
297	S	86.8	Confident	86.1	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	177.7	169.8	70	0	0	0	0	110.1	R53 P209 M242 Y299 G300	R53-S297 WeakPolarHBondContact CG-O 3.45Å; P209-S297 VanDerWaalsContact CD-OG 3.22Å; P209-S297 WeakPolarHBondContact CD-OG 3.12Å; M242-S297 WeakPolarHBondContact O-CB 3.44Å; S297-Y299 PolarHBondContact O-N 2.74Å; S297-Y299 PolarHBondContact OG-N 3.41Å; S297-Y299 VanDerWaalsContact OG-N 3.13Å; S297-G300 PolarHBondContact N-O 2.98Å; S297-G300 PolarHBondContact O-N 2.9Å; S297-G300 PolarHBondContact OG-O 2.71Å
298	I	80.4	Confident	85.9	Confident	14 Å²	14	21.8 Å²	21.8	7%	0.072	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-31.5	169.9	65	174	0	0	0	112.7	R53 A56 N57 G300	R53-I298 PolarHBondContact NE-O 3.1Å; A56-I298 HydrophobicContact CB-CG2 3.83Å; N57-I298 HydrophobicContact CB-CG2 4.32Å; N57-I298 VanDerWaalsContact OD1-CG2 3.27Å; N57-I298 WeakPolarHBondContact OD1-CG2 3.35Å; I298-G300 VanDerWaalsContact C-N 3.25Å; I298-G300 PolarHBondContact O-N 3.09Å
299	Y	78.1	Confident	85.6	Confident	78 Å²	78	28.3 Å²	28.3	31%	0.306	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-7.1	-178.5	-54.2	-70.6	0	0	0	112.9	P137 L207 T241 S297	P137-Y299 WeakPolarHBondContact CG-O 3.45Å; L207-Y299 HydrophobicContact CB-CD1 4.2Å; L207-Y299 HydrophobicContact CB-CD2 3.47Å; L207-Y299 VanDerWaalsContact CB-CD2 3.47Å; L207-Y299 HydrophobicContact CB-CE1 4.49Å; L207-Y299 HydrophobicContact CB-CE2 3.79Å; L207-Y299 HydrophobicContact CB-CG 3.68Å; L207-Y299 HydrophobicContact CD1-CD1 4Å; L207-Y299 HydrophobicContact CD1-CD2 4.46Å; L207-Y299 HydrophobicContact CD1-CE1 3.74Å; L207-Y299 HydrophobicContact CD1-CE2 4.22Å; L207-Y299 HydrophobicContact CD1-CG 4.34Å; L207-Y299 HydrophobicContact CG-CE2 4.44Å; T241-Y299 WeakPolarHBondContact O-CE2 3.26Å; S297-Y299 PolarHBondContact O-N 2.74Å; S297-Y299 PolarHBondContact OG-N 3.41Å; S297-Y299 VanDerWaalsContact OG-N 3.13Å
300	G	75.5	Confident	85.5	Confident	3 Å²	3	29.1 Å²	29.1	3%	0.031	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	119.2	-162.4	-179.7	0	0	0	0	0	113.4	S297 I298	S297-G300 PolarHBondContact N-O 2.98Å; S297-G300 PolarHBondContact O-N 2.9Å; S297-G300 PolarHBondContact OG-O 2.71Å; I298-G300 VanDerWaalsContact C-N 3.25Å; I298-G300 PolarHBondContact O-N 3.09Å
301	T	80.9	Confident	85.3	Confident	38 Å²	38	29.2 Å²	29.2	23%	0.233	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	154.8	-175	179.8	0	0	0	0	110.4	F49 V208 A295 G303	F49-T301 HydrophobicContact CB-CG2 4.07Å; F49-T301 HydrophobicContact CD1-CG2 3.71Å; F49-T301 HydrophobicContact CD2-CG2 3.93Å; F49-T301 HydrophobicContact CE1-CG2 4.09Å; F49-T301 HydrophobicContact CE2-CG2 4.28Å; F49-T301 HydrophobicContact CG-CG2 3.63Å; F49-T301 HydrophobicContact CZ-CG2 4.36Å; V208-T301 VanDerWaalsContact CG1-C 3.48Å; A295-T301 PolarHBondContact O-OG1 2.89Å; A295-T301 VanDerWaalsContact O-OG1 3.09Å; T301-G303 VanDerWaalsContact C-N 3.32Å; T301-G303 PolarHBondContact OG1-N 2.85Å
302	R	76.2	Confident	85.1	Confident	51 Å²	51	30.5 Å²	30.5	19%	0.192	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	6.7	166	-69.9	-172.2	179.9	105.7	8.9	112.8	N205 V208 P209 R211	N205-R302 PolarHBondContact O-NH2 3.14Å; N205-R302 VanDerWaalsContact O-NH2 3.1Å; V208-R302 HydrophobicContact CG1-CG 3.8Å; V208-R302 PolarHBondContact O-NH1 3.18Å; V208-R302 PolarHBondContact O-NH2 3.44Å; P209-R302 VanDerWaalsContact O-CD 3.29Å; P209-R302 WeakPolarHBondContact O-CD 3.27Å; P209-R302 VanDerWaalsContact O-CG 3.28Å; P209-R302 WeakPolarHBondContact O-CG 3.2Å; P209-R302 PolarHBondContact O-NH1 3.16Å; R211-R302 HydrophobicContact CB-CB 3.88Å; R211-R302 PolarHBondContact NE-O 3.12Å; R211-R302 PolarHBondContact NH2-O 2.92Å
303	G	80.4	Confident	84.8	Confident	13 Å²	13	39.6 Å²	39.6	13%	0.134	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	86.4	-174.7	-178	0	0	0	0	0	113.3	T301	T301-G303 VanDerWaalsContact C-N 3.32Å; T301-G303 PolarHBondContact OG1-N 2.85Å
304	F	85.4	Confident	84.6	Confident	13 Å²	13	45.9 Å²	45.9	6%	0.057	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	141.3	179.8	-69.2	-77.8	0	0	0	112.4	E45 L48 F49 R211 I248 Q250 R292 A294	E45-F304 HydrophobicContact CG-CE2 4.4Å; L48-F304 HydrophobicContact CD2-CZ 3.96Å; F49-F304 HydrophobicContact CE1-CD2 4.27Å; F49-F304 AromaticContact CE1-CE2 3.75Å; F49-F304 HydrophobicContact CE1-CE2 3.75Å; F49-F304 HydrophobicContact CE1-CZ 4Å; F49-F304 AromaticContact CZ-CD2 3.76Å; F49-F304 HydrophobicContact CZ-CD2 3.76Å; F49-F304 AromaticContact CZ-CE2 3.47Å; F49-F304 HydrophobicContact CZ-CE2 3.47Å; F49-F304 VanDerWaalsContact CZ-CE2 3.47Å; F49-F304 HydrophobicContact CZ-CZ 4.21Å; R211-F304 WeakPolarHBondContact CD-O 3.4Å; R211-F304 PolarHBondContact NH1-O 3.09Å; I248-F304 HydrophobicContact CB-CE1 4.15Å; I248-F304 HydrophobicContact CB-CZ 4.39Å; I248-F304 HydrophobicContact CG2-CE1 3.92Å; I248-F304 HydrophobicContact CG2-CZ 3.91Å; Q250-F304 HydrophobicContact CG-CE1 3.66Å; Q250-F304 HydrophobicContact CG-CZ 3.8Å; R292-F304 HydrophobicContact CG-CB 4.32Å; R292-F304 HydrophobicContact CG-CD1 3.86Å; R292-F304 HydrophobicContact CG-CG 4.25Å; A294-F304 HydrophobicContact CB-CD1 3.48Å; A294-F304 VanDerWaalsContact CB-CD1 3.48Å; A294-F304 HydrophobicContact CB-CE1 3.59Å; A294-F304 HydrophobicContact CB-CG 3.96Å; A294-F304 HydrophobicContact CB-CZ 4.17Å
305	G	81.3	Confident	84.6	Confident	11 Å²	11	46.8 Å²	46.8	11%	0.113	24%	0.243	C	C	.	.			trans	-73.5	-178.3	167.7	0	0	0	0	0	113	P212 I293	P212-G305 WeakPolarHBondContact O-CA 3.45Å; I293-G305 PolarHBondContact O-N 3.26Å
306	L	82.9	Confident	84.6	Confident	127 Å²	127	51.9 Å²	51.9	67%	0.665	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-65.5	147.1	174.4	-64.2	175.6	0	0	0	110.8
307	G	85.3	Confident	84.8	Confident	31 Å²	31	59.8 Å²	59.8	32%	0.32	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-65	147.4	172.1	0	0	0	0	0	111.4	F291	F291-G307 CarbonylContact O-C 3.58Å; F291-G307 VanDerWaalsContact O-CA 3.3Å; F291-G307 WeakPolarHBondContact O-CA 3.39Å
308	T	89.5	Confident	85.1	Confident	4 Å²	4	59.9 Å²	59.9	3%	0.025	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-62.7	163.6	168.3	60.8	0	0	0	0	110.9	L215 Q290 F291	L215-T308 HydrophobicContact CB-CG2 3.67Å; L215-T308 HydrophobicContact CD2-CG2 3.83Å; L215-T308 HydrophobicContact CG-CG2 3.98Å; Q290-T308 WeakPolarHBondContact CG-O 3.19Å; Q290-T308 PolarHBondContact NE2-O 3.46Å; F291-T308 HydrophobicContact CB-CG2 4.09Å; F291-T308 PolarHBondContact N-OG1 3.11Å; F291-T308 PolarHBondContact O-N 2.72Å
309	N	88.8	Confident	85.7	Confident	142 Å²	142	62.6 Å²	62.6	76%	0.759	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-55.8	150.5	160.2	-65.7	-32.9	0	0	0	110.3
310	A	90.5	Very high	86.4	Confident	28 Å²	28	62.5 Å²	62.5	23%	0.231	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-65.1	139.9	178.4	0	0	0	0	0	111.1	F259 L288 Y289 Q290	F259-A310 HydrophobicContact CB-CB 3.55Å; F259-A310 HydrophobicContact CD2-CB 3.68Å; F259-A310 HydrophobicContact CG-CB 3.72Å; L288-A310 HydrophobicContact CB-CB 4.42Å; Y289-A310 WeakPolarHBondContact O-CA 3.25Å; Q290-A310 HydrophobicContact CG-CB 4.07Å
311	Y	89.5	Confident	87.3	Confident	23 Å²	23	62.6 Å²	62.6	9%	0.09	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-127.4	144.9	-178.5	-178.4	-93.8	0	0	0	111.2	V219 A224 I227 F283 L288 Y289	V219-Y311 HydrophobicContact CG1-CE2 4.36Å; V219-Y311 HydrophobicContact CG2-CD2 4.36Å; V219-Y311 HydrophobicContact CG2-CE2 3.59Å; A224-Y311 PolarHBondContact O-OH 3.06Å; I227-Y311 HydrophobicContact CB-CE1 4.36Å; I227-Y311 HydrophobicContact CD1-CD1 4.07Å; I227-Y311 HydrophobicContact CD1-CD2 3.61Å; I227-Y311 HydrophobicContact CD1-CE1 4.38Å; I227-Y311 HydrophobicContact CD1-CE2 3.95Å; I227-Y311 HydrophobicContact CD1-CG 3.66Å; I227-Y311 HydrophobicContact CG1-CE2 4.46Å; F283-Y311 HydrophobicContact CD1-CD1 4.14Å; F283-Y311 HydrophobicContact CD1-CE1 4.18Å; F283-Y311 HydrophobicContact CD2-CD1 4.44Å; F283-Y311 AromaticContact CD2-CE1 3.69Å; F283-Y311 HydrophobicContact CD2-CE1 3.69Å; F283-Y311 AromaticContact CE1-CD1 3.95Å; F283-Y311 HydrophobicContact CE1-CD1 3.95Å; F283-Y311 HydrophobicContact CE1-CE1 4.1Å; F283-Y311 HydrophobicContact CE2-CD1 4.28Å; F283-Y311 AromaticContact CE2-CE1 3.61Å; F283-Y311 HydrophobicContact CE2-CE1 3.61Å; F283-Y311 HydrophobicContact CG-CD1 4.39Å; F283-Y311 AromaticContact CG-CE1 3.99Å; F283-Y311 HydrophobicContact CG-CE1 3.99Å; F283-Y311 HydrophobicContact CZ-CD1 4.04Å; F283-Y311 AromaticContact CZ-CE1 3.84Å; F283-Y311 HydrophobicContact CZ-CE1 3.84Å; L288-Y311 CarbonylContact C-O 3.57Å; L288-Y311 WeakPolarHBondContact CA-O 3.43Å; Y289-Y311 WeakPolarHBondContact CD2-O 3.49Å; Y289-Y311 PolarHBondContact N-O 3.34Å; Y289-Y311 PolarHBondContact O-N 3.02Å
312	P	89	Confident	87.7	Confident	28 Å²	28	61.8 Å²	61.8	18%	0.182	33%	0.328	C	S	.	.	S	Bend	cis	-62.6	161.8	-15.7	31.2	-38.6	0	0	0	111	L288 D314 P315	L288-P312 WeakPolarHBondContact CD2-O 2.98Å; P312-D314 VanDerWaalsContact C-N 3.26Å; P312-D314 PolarHBondContact O-N 3.01Å; P312-P315 HydrophobicContact CG-CB 4.2Å
313	R	84.6	Confident	88.5	Confident	224 Å²	224	61.4 Å²	61.4	85%	0.845	33%	0.332	S	S	*	.	S	Bend	trans	-61.8	-39.8	176.5	-174.8	179.1	-176.7	173.8	0.7	111.3
314	D	85.7	Confident	89.2	Confident	134 Å²	134	60.8 Å²	60.8	72%	0.717	33%	0.326	S	S	*	.	S	Bend	trans	-120	100.4	176.5	-62.4	-52.9	0	0	0	108.4	P312	P312-D314 VanDerWaalsContact C-N 3.26Å; P312-D314 PolarHBondContact O-N 3.01Å
315	P	88.1	Confident	89.4	Confident	20 Å²	20	64.1 Å²	64.1	13%	0.13	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-70.2	141.3	-179.2	27.9	-32	0	0	0	111.5	L288 P312 R317 W415	L288-P315 HydrophobicContact CD2-CB 4.02Å; L288-P315 HydrophobicContact CD2-CG 3.88Å; L288-P315 HydrophobicContact CG-CB 4.41Å; L288-P315 HydrophobicContact CG-CG 4.17Å; P312-P315 HydrophobicContact CG-CB 4.2Å; P315-R317 PolarHBondContact O-N 3.48Å; P315-W415 HydrophobicContact CG-CZ2 4.14Å
316	I	89.7	Confident	89.7	Confident	107 Å²	107	68.3 Å²	68.3	55%	0.549	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-59.7	126.3	173.2	-60.5	172.6	0	0	0	107.8	P285 G286	P285-I316 HydrophobicContact CB-CB 4.44Å; P285-I316 HydrophobicContact CB-CG2 4.37Å; G286-I316 PolarHBondContact N-O 3.34Å
317	R	91.7	Very high	89.9	Confident	166 Å²	166	62.9 Å²	62.9	63%	0.626	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-59.5	124.2	177.2	-178.9	-175.8	-66.3	-171.1	-0.8	109.2	P315 W415	P315-R317 PolarHBondContact O-N 3.48Å; R317-W415 HydrophobicContact CB-CH2 4.44Å; R317-W415 HydrophobicContact CB-CZ3 4.43Å; R317-W415 HydrophobicContact CG-CH2 4.44Å; R317-W415 HydrophobicContact CG-CZ3 3.95Å
318	P	94.7	Very high	89.8	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.019	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-70	144.9	176.8	28.1	-31.1	0	0	0	110.4	P285 D353 L354 W415 L421	P285-P318 HydrophobicContact CB-CB 4.29Å; P318-D353 HydrophobicContact CB-CB 3.8Å; P318-L354 HydrophobicContact CB-CD1 4.18Å; P318-L354 HydrophobicContact CB-CD2 4.09Å; P318-L354 HydrophobicContact CB-CG 3.8Å; P318-L354 HydrophobicContact CG-CD1 3.76Å; P318-L354 HydrophobicContact CG-CD2 4.25Å; P318-L354 HydrophobicContact CG-CG 3.95Å; P318-W415 HydrophobicContact CG-CD2 3.89Å; P318-W415 HydrophobicContact CG-CE3 4.18Å; P318-W415 HydrophobicContact CG-CG 4.04Å; P318-L421 HydrophobicContact CB-CD1 4.46Å; P318-L421 HydrophobicContact CG-CD1 3.86Å
319	S	92.4	Very high	89	Confident	71 Å²	71	68.2 Å²	68.2	50%	0.497	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-72.7	148.9	172.3	-58.7	0	0	0	0	110.1	D353	S319-D353 WeakPolarHBondContact CB-OD2 3.05Å; S319-D353 PolarHBondContact N-OD2 3.36Å
320	P	92.5	Very high	87.7	Confident	75 Å²	75	63.7 Å²	63.7	49%	0.487	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-56.3	150.4	168.7	-21.3	32.2	0	0	0	111.4	L421 E422	P320-L421 HydrophobicContact CB-CB 4.41Å; P320-E422 WeakPolarHBondContact CB-O 3.08Å
321	P	94.8	Very high	86.3	Confident	5 Å²	5	67.7 Å²	67.7	3%	0.032	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-58	153.6	177.4	22.1	-30.5	0	0	0	111.4	L356 A411 L421 S423	P321-L356 HydrophobicContact CB-CD2 3.69Å; P321-L356 HydrophobicContact CG-CD2 4.18Å; P321-A411 HydrophobicContact CB-CB 4.23Å; P321-A411 HydrophobicContact CG-CB 4.18Å; P321-A411 WeakPolarHBondContact CG-O 3.34Å; P321-L421 VanDerWaalsContact CD-O 3.27Å; P321-L421 WeakPolarHBondContact CD-O 3.47Å; P321-S423 VanDerWaalsContact O-CA 3.3Å; P321-S423 WeakPolarHBondContact O-CA 3.38Å; P321-S423 WeakPolarHBondContact O-CB 3.39Å
322	G	89.4	Confident	85.2	Confident	21 Å²	21	70.3 Å²	70.3	22%	0.216	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-62.2	163	169.1	0	0	0	0	0	112.1	P349 Q351 S423	G322-P349 VanDerWaalsContact O-CB 3.25Å; G322-P349 WeakPolarHBondContact O-CB 2.96Å; G322-P349 WeakPolarHBondContact O-CG 3.41Å; G322-Q351 PolarHBondContact N-O 2.97Å; G322-Q351 VanDerWaalsContact N-O 3.11Å; G322-S423 VanDerWaalsContact O-CB 3.23Å; G322-S423 WeakPolarHBondContact O-CB 3.28Å
323	P	91.9	Very high	83.8	Confident	43 Å²	43	75.8 Å²	75.8	28%	0.279	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-65	147.1	174.9	27.8	-34.2	0	0	0	111.2	Q424	P323-Q424 WeakPolarHBondContact CB-O 3.48Å
324	P	94.6	Very high	82.4	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.006	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-53.5	149	166.6	-24.7	34.3	0	0	0	111.3	V327 Y359 V409 A411 N426	P324-V327 HydrophobicContact CB-CG2 4.48Å; P324-Y359 HydrophobicContact CG-CD1 3.99Å; P324-Y359 HydrophobicContact CG-CE1 4.11Å; P324-V409 HydrophobicContact CB-CG1 4.07Å; P324-V409 WeakPolarHBondContact CD-O 3.35Å; P324-V409 HydrophobicContact CG-CB 4.34Å; P324-V409 HydrophobicContact CG-CG1 3.83Å; P324-A411 HydrophobicContact CG-CB 4.11Å; P324-N426 WeakPolarHBondContact O-CB 3.13Å; P324-N426 PolarHBondContact O-ND2 2.91Å
325	R	90.2	Very high	80.8	Confident	83 Å²	83	67.8 Å²	67.8	31%	0.313	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	161.6	-177.3	-60.1	-163.3	-53.8	-78	-10.9	112.1	V327 W346 Q347 P348 P349	R325-V327 PolarHBondContact O-N 3.37Å; R325-V327 VanDerWaalsContact O-N 3.12Å; R325-W346 CarbonylContact O-C 3.58Å; R325-Q347 HydrophobicContact CB-CB 4.16Å; R325-Q347 PolarHBondContact N-O 3.37Å; R325-Q347 PolarHBondContact O-N 2.97Å; R325-P348 PolarHBondContact NH1-O 3.41Å; R325-P348 PolarHBondContact NH2-O 2.93Å; R325-P349 PolarHBondContact NH1-O 3.42Å; R325-P349 VanDerWaalsContact NH1-O 3.14Å
326	N	88.1	Confident	78.9	Confident	99 Å²	99	73.2 Å²	73.2	53%	0.529	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	47	45.2	171.5	-61.7	-4.3	0	0	0	113.1	T328 Q347	N326-T328 PolarHBondContact O-N 3.49Å; N326-T328 PolarHBondContact O-OG1 3.08Å; N326-Q347 HydrophobicContact CB-CG 4.31Å; N326-Q347 PolarHBondContact ND2-OE1 3.44Å
327	V	87.1	Confident	77.2	Confident	13 Å²	13	72.1 Å²	72.1	8%	0.079	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	117.3	174.3	-175.5	0	0	0	0	107.5	P324 R325 L344 K345 W346 V409 N426 I428	P324-V327 HydrophobicContact CB-CG2 4.48Å; R325-V327 PolarHBondContact O-N 3.37Å; R325-V327 VanDerWaalsContact O-N 3.12Å; V327-L344 HydrophobicContact CG1-CD1 3.78Å; V327-L344 HydrophobicContact CG1-CD2 4.45Å; V327-L344 HydrophobicContact CG1-CG 4.26Å; V327-K345 CarbonylContact C-O 3.5Å; V327-K345 WeakPolarHBondContact CA-O 3Å; V327-W346 HydrophobicContact CG2-CB 3.92Å; V327-V409 HydrophobicContact CG1-CG2 3.74Å; V327-V409 HydrophobicContact CG2-CB 4.15Å; V327-V409 HydrophobicContact CG2-CG2 4.06Å; V327-N426 HydrophobicContact CG2-CB 3.71Å; V327-I428 HydrophobicContact CB-CG2 4.03Å; V327-I428 HydrophobicContact CG1-CD1 3.89Å; V327-I428 HydrophobicContact CG1-CG1 4.04Å; V327-I428 HydrophobicContact CG1-CG2 4.09Å
328	T	82.5	Confident	75.5	Confident	69 Å²	69	65.1 Å²	65.1	42%	0.423	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	141	-170.2	45.4	0	0	0	0	110.6	N326 K345	N326-T328 PolarHBondContact O-N 3.49Å; N326-T328 PolarHBondContact O-OG1 3.08Å; T328-K345 PolarHBondContact N-O 3.31Å; T328-K345 PolarHBondContact O-N 2.93Å; T328-K345 PolarHBondContact OG1-O 3.46Å
329	D	73.6	Confident	74	Confident	77 Å²	77	69.5 Å²	69.5	41%	0.412	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	108.3	168.5	65.2	-54.1	0	0	0	109	W332 L342	D329-W332 HydrophobicContact CB-CZ2 4.22Å; D329-W332 WeakPolarHBondContact OD2-CZ2 3.21Å; D329-W332 PolarHBondContact OD2-NE1 2.87Å; D329-W332 VanDerWaalsContact OD2-NE1 3.16Å; D329-L342 HydrophobicContact CB-CD1 3.53Å; D329-L342 HydrophobicContact CB-CD2 4.17Å; D329-L342 HydrophobicContact CB-CG 4.44Å
330	S	61.1	Low	72.9	Confident	48 Å²	48	66.1 Å²	66.1	34%	0.336	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-52.8	-169.4	63.3	0	0	0	0	113.5	L343 K345	S330-L343 PolarHBondContact N-O 2.58Å; S330-L343 WeakPolarHBondContact OG-CB 3.38Å; S330-L343 WeakPolarHBondContact OG-CD2 3.44Å; S330-L343 VanDerWaalsContact OG-CG 3.25Å; S330-L343 WeakPolarHBondContact OG-CG 3.34Å; S330-L343 PolarHBondContact OG-O 3.11Å; S330-K345 VanDerWaalsContact OG-CE 3.27Å; S330-K345 WeakPolarHBondContact OG-CE 3.34Å
331	M	61.1	Low	72.3	Confident	112 Å²	112	63.7 Å²	63.7	55%	0.552	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	140.2	-174.2	-69.8	-179.9	64.2	0	0	111.3	L343	M331-L343 HydrophobicContact CB-CB 4.07Å; M331-L343 HydrophobicContact CB-CD2 4.27Å; M331-L343 HydrophobicContact CG-CD2 4.46Å; M331-L343 PolarHBondContact O-N 3.17Å; M331-L343 HydrophobicContact SD-CD2 4.3Å
332	W	67.3	Low	71.6	Confident	78 Å²	78	63.5 Å²	63.5	30%	0.295	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	137.3	-178.5	-63	76.8	0	0	0	110	D329 V340 N341 L342 L430 T432	D329-W332 HydrophobicContact CB-CZ2 4.22Å; D329-W332 WeakPolarHBondContact OD2-CZ2 3.21Å; D329-W332 PolarHBondContact OD2-NE1 2.87Å; D329-W332 VanDerWaalsContact OD2-NE1 3.16Å; W332-V340 HydrophobicContact CE3-CG1 3.46Å; W332-V340 VanDerWaalsContact CE3-CG1 3.46Å; W332-V340 HydrophobicContact CZ3-CG1 3.76Å; W332-N341 CarbonylContact C-O 3.51Å; W332-N341 WeakPolarHBondContact CA-O 3.38Å; W332-L342 HydrophobicContact CD2-CD1 4Å; W332-L342 HydrophobicContact CE3-CB 4.41Å; W332-L342 HydrophobicContact CE3-CD1 4.49Å; W332-L342 HydrophobicContact CG-CD1 4.42Å; W332-L342 HydrophobicContact CH2-CD2 4.38Å; W332-L342 HydrophobicContact CZ2-CD1 4Å; W332-L342 HydrophobicContact CZ2-CD2 4.41Å; W332-L342 HydrophobicContact CZ3-CB 4.49Å; W332-L430 HydrophobicContact CH2-CB 4.3Å; W332-L430 HydrophobicContact CH2-CD1 3.68Å; W332-L430 HydrophobicContact CZ3-CD1 4.31Å; W332-T432 HydrophobicContact CH2-CG2 4.39Å; W332-T432 HydrophobicContact CZ3-CG2 3.91Å
333	R	57.8	Low	71.5	Confident	142 Å²	142	63.8 Å²	63.8	54%	0.536	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	120.2	168.7	-74.6	-169.8	-175.5	119.8	0.8	109.7	Y335 N341	R333-Y335 HydrophobicContact CB-CE2 4.14Å; R333-N341 HydrophobicContact CB-CB 4.37Å; R333-N341 PolarHBondContact N-O 3.46Å; R333-N341 PolarHBondContact O-N 3.41Å
334	L	57.2	Low	71.4	Confident	85 Å²	85	61.8 Å²	61.8	45%	0.445	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	124.2	176.7	-65.8	138.2	0	0	0	107.9	V340 I435	L334-V340 HydrophobicContact CD2-CG1 4.42Å; L334-V340 HydrophobicContact CD2-CG2 3.87Å; L334-I435 HydrophobicContact CD2-CD1 4.05Å; L334-I435 HydrophobicContact CD2-CG1 3.89Å
335	Y	51.4	Low	71.2	Confident	106 Å²	106	65.2 Å²	65.2	42%	0.416	34%	0.337	S	S	.	.			trans	-97.4	152.5	176.5	-66.6	-88.8	0	0	0	110.6	R333 S337 G338 K339 N341	R333-Y335 HydrophobicContact CB-CE2 4.14Å; Y335-S337 WeakPolarHBondContact CB-OG 3.38Å; Y335-S337 PolarHBondContact O-N 3.18Å; Y335-G338 PolarHBondContact O-N 2.93Å; Y335-K339 PolarHBondContact N-O 2.79Å; Y335-N341 HydrophobicContact CE2-CB 4.08Å; Y335-N341 VanDerWaalsContact CE2-ND2 3.32Å; Y335-N341 WeakPolarHBondContact CE2-ND2 3.37Å
336	S	47.7	Very low	71.4	Confident	133 Å²	133	61.7 Å²	61.7	93%	0.93	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-20.3	173.7	52.9	0	0	0	0	113.4	G338	S336-G338 PolarHBondContact O-N 3.06Å
337	S	54.2	Low	71.6	Confident	84 Å²	84	60.8 Å²	60.8	59%	0.587	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-5.8	172.5	60.5	0	0	0	0	114.4	Y335 K339	Y335-S337 WeakPolarHBondContact CB-OG 3.38Å; Y335-S337 PolarHBondContact O-N 3.18Å; S337-K339 VanDerWaalsContact C-N 3.28Å
338	G	55.2	Low	72	Confident	20 Å²	20	62.9 Å²	62.9	21%	0.206	33%	0.33	C	S	.	.	S	Bend	trans	87.3	-6	-175.2	0	0	0	0	0	114	Y335 S336 P401 I435	Y335-G338 PolarHBondContact O-N 2.93Å; S336-G338 PolarHBondContact O-N 3.06Å; G338-P401 WeakPolarHBondContact O-CD 3.45Å; G338-P401 WeakPolarHBondContact O-CG 3.48Å; G338-I435 VanDerWaalsContact CA-CD1 3.46Å; G338-I435 WeakPolarHBondContact O-CD1 3.27Å
339	K	64.7	Low	72.6	Confident	94 Å²	94	60.4 Å²	60.4	41%	0.409	32%	0.315	S	S	.	.			trans	-84.7	147.1	-177.5	-63.2	-170.2	178	179.7	0	112.2	Y335 S337 N398	Y335-K339 PolarHBondContact N-O 2.79Å; S337-K339 VanDerWaalsContact C-N 3.28Å; K339-N398 HydrophobicContact CD-CB 4.03Å; K339-N398 WeakPolarHBondContact CD-OD1 3.43Å; K339-N398 PolarHBondContact NZ-OD1 2.94Å
340	V	69.6	Low	73.4	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130.6	-178.5	-170.2	0	0	0	0	110.1	W332 L334 N398 L399 P401	W332-V340 HydrophobicContact CE3-CG1 3.46Å; W332-V340 VanDerWaalsContact CE3-CG1 3.46Å; W332-V340 HydrophobicContact CZ3-CG1 3.76Å; L334-V340 HydrophobicContact CD2-CG1 4.42Å; L334-V340 HydrophobicContact CD2-CG2 3.87Å; V340-N398 PolarHBondContact O-N 2.84Å; V340-L399 HydrophobicContact CB-CB 4.26Å; V340-L399 PolarHBondContact N-O 3.24Å; V340-L399 WeakPolarHBondContact O-CB 3.44Å; V340-L399 PolarHBondContact O-N 3.29Å; V340-P401 HydrophobicContact CG2-CB 4.29Å
341	N	78.6	Confident	74.7	Confident	25 Å²	25	67.2 Å²	67.2	13%	0.134	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	135.4	169.6	-68.7	6.7	0	0	0	109.5	W332 R333 Y335 I395 L396 D397 N398	W332-N341 CarbonylContact C-O 3.51Å; W332-N341 WeakPolarHBondContact CA-O 3.38Å; R333-N341 HydrophobicContact CB-CB 4.37Å; R333-N341 PolarHBondContact N-O 3.46Å; R333-N341 PolarHBondContact O-N 3.41Å; Y335-N341 HydrophobicContact CE2-CB 4.08Å; Y335-N341 VanDerWaalsContact CE2-ND2 3.32Å; Y335-N341 WeakPolarHBondContact CE2-ND2 3.37Å; N341-I395 HydrophobicContact CB-CG2 4.1Å; N341-L396 CarbonylContact C-O 3.55Å; N341-L396 VanDerWaalsContact CA-O 3.27Å; N341-L396 WeakPolarHBondContact CA-O 3.33Å; N341-D397 VanDerWaalsContact OD1-CA 3.26Å; N341-D397 WeakPolarHBondContact OD1-CA 3.3Å; N341-N398 PolarHBondContact OD1-N 2.84Å
342	L	80.9	Confident	76.2	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	128.2	-177.2	165.2	60.6	0	0	0	110.4	D329 W332 I395 L396 L399 I407 L430	D329-L342 HydrophobicContact CB-CD1 3.53Å; D329-L342 HydrophobicContact CB-CD2 4.17Å; D329-L342 HydrophobicContact CB-CG 4.44Å; W332-L342 HydrophobicContact CD2-CD1 4Å; W332-L342 HydrophobicContact CE3-CB 4.41Å; W332-L342 HydrophobicContact CE3-CD1 4.49Å; W332-L342 HydrophobicContact CG-CD1 4.42Å; W332-L342 HydrophobicContact CH2-CD2 4.38Å; W332-L342 HydrophobicContact CZ2-CD1 4Å; W332-L342 HydrophobicContact CZ2-CD2 4.41Å; W332-L342 HydrophobicContact CZ3-CB 4.49Å; L342-I395 CarbonylContact O-C 3.57Å; L342-I395 VanDerWaalsContact O-CA 3.27Å; L342-I395 WeakPolarHBondContact O-CA 3.45Å; L342-L396 HydrophobicContact CB-CB 4.48Å; L342-L396 PolarHBondContact N-O 2.85Å; L342-L396 PolarHBondContact O-N 3.19Å; L342-L399 HydrophobicContact CB-CD1 3.96Å; L342-I407 HydrophobicContact CD2-CD1 4.16Å; L342-L430 HydrophobicContact CD2-CD1 4.21Å; L342-L430 HydrophobicContact CD2-CD2 3.79Å; L342-L430 HydrophobicContact CD2-CG 4.49Å
343	L	86.6	Confident	77.5	Confident	28 Å²	28	61.7 Å²	61.7	15%	0.147	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	107.7	167.6	-179.1	63.8	0	0	0	110.1	S330 M331 K345 E393 I395	S330-L343 PolarHBondContact N-O 2.58Å; S330-L343 WeakPolarHBondContact OG-CB 3.38Å; S330-L343 WeakPolarHBondContact OG-CD2 3.44Å; S330-L343 VanDerWaalsContact OG-CG 3.25Å; S330-L343 WeakPolarHBondContact OG-CG 3.34Å; S330-L343 PolarHBondContact OG-O 3.11Å; M331-L343 HydrophobicContact CB-CB 4.07Å; M331-L343 HydrophobicContact CB-CD2 4.27Å; M331-L343 HydrophobicContact CG-CD2 4.46Å; M331-L343 PolarHBondContact O-N 3.17Å; M331-L343 HydrophobicContact SD-CD2 4.3Å; L343-K345 VanDerWaalsContact CD2-CE 3.49Å; L343-K345 HydrophobicContact CG-CG 4.36Å; L343-E393 HydrophobicContact CD1-CB 4.36Å; L343-I395 HydrophobicContact CD1-CG1 3.78Å
344	L	89.7	Confident	79.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	133.2	173.9	-169.1	70.7	0	0	0	109.8	V327 W346 I361 E393 C394 I407 V409 I428	V327-L344 HydrophobicContact CG1-CD1 3.78Å; V327-L344 HydrophobicContact CG1-CD2 4.45Å; V327-L344 HydrophobicContact CG1-CG 4.26Å; L344-W346 HydrophobicContact CB-CZ3 4.42Å; L344-W346 HydrophobicContact CD2-CE3 4.23Å; L344-W346 HydrophobicContact CD2-CZ3 4.12Å; L344-W346 HydrophobicContact CG-CE3 4.15Å; L344-W346 HydrophobicContact CG-CZ3 4.24Å; L344-I361 HydrophobicContact CD2-CG2 4.01Å; L344-E393 CarbonylContact O-C 3.49Å; L344-E393 WeakPolarHBondContact O-CA 3.48Å; L344-E393 WeakPolarHBondContact O-CB 3.23Å; L344-C394 PolarHBondContact N-O 3.02Å; L344-C394 PolarHBondContact O-N 2.95Å; L344-I407 HydrophobicContact CD1-CD1 4.18Å; L344-I407 HydrophobicContact CD2-CG2 3.92Å; L344-V409 HydrophobicContact CD2-CG2 3.84Å; L344-I428 HydrophobicContact CD1-CD1 3.77Å
345	K	91.8	Very high	81.1	Confident	74 Å²	74	54.7 Å²	54.7	32%	0.322	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	148	173.8	-57.5	-167.6	-174.9	-132.6	0	110.7	V327 T328 S330 L343 E393	V327-K345 CarbonylContact C-O 3.5Å; V327-K345 WeakPolarHBondContact CA-O 3Å; T328-K345 PolarHBondContact N-O 3.31Å; T328-K345 PolarHBondContact O-N 2.93Å; T328-K345 PolarHBondContact OG1-O 3.46Å; S330-K345 VanDerWaalsContact OG-CE 3.27Å; S330-K345 WeakPolarHBondContact OG-CE 3.34Å; L343-K345 VanDerWaalsContact CD2-CE 3.49Å; L343-K345 HydrophobicContact CG-CG 4.36Å; K345-E393 HydrophobicContact CB-CB 4.45Å; K345-E393 VanDerWaalsContact CE-OE2 3.26Å; K345-E393 WeakPolarHBondContact CE-OE2 3.43Å; K345-E393 HydrophobicContact CG-CB 3.87Å; K345-E393 IonicContact NZ-OE2 2.89Å; K345-E393 PolarHBondContact NZ-OE2 3.43Å
346	W	92.9	Very high	83.2	Confident	8 Å²	8	51.6 Å²	51.6	3%	0.03	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	175.9	175.2	60.2	95	0	0	0	110.6	R325 V327 L344 Y359 I361 I387 T392 C394 V409	R325-W346 CarbonylContact O-C 3.58Å; V327-W346 HydrophobicContact CG2-CB 3.92Å; L344-W346 HydrophobicContact CB-CZ3 4.42Å; L344-W346 HydrophobicContact CD2-CE3 4.23Å; L344-W346 HydrophobicContact CD2-CZ3 4.12Å; L344-W346 HydrophobicContact CG-CE3 4.15Å; L344-W346 HydrophobicContact CG-CZ3 4.24Å; W346-Y359 HydrophobicContact CZ2-CD2 4.01Å; W346-Y359 HydrophobicContact CZ2-CG 4.07Å; W346-Y359 AromaticContact NE1-CD1 3.54Å; W346-Y359 AromaticContact NE1-CD2 3.45Å; W346-Y359 AromaticContact NE1-CE1 3.65Å; W346-Y359 AromaticContact NE1-CE2 3.57Å; W346-Y359 AromaticContact NE1-CG 3.44Å; W346-Y359 AromaticContact NE1-CZ 3.68Å; W346-I361 HydrophobicContact CH2-CD1 3.91Å; W346-I361 HydrophobicContact CH2-CG1 4.25Å; W346-I361 HydrophobicContact CZ2-CD1 4.29Å; W346-I361 HydrophobicContact CZ3-CG1 4.46Å; W346-I387 HydrophobicContact CH2-CG1 4.3Å; W346-I387 HydrophobicContact CH2-CG2 4.35Å; W346-I387 HydrophobicContact CZ2-CB 4.41Å; W346-I387 HydrophobicContact CZ2-CG2 4.16Å; W346-T392 PolarHBondContact N-O 3.14Å; W346-T392 VanDerWaalsContact O-CB 3.26Å; W346-T392 WeakPolarHBondContact O-CB 3.3Å; W346-T392 PolarHBondContact O-OG1 2.76Å; W346-C394 HydrophobicContact CH2-CB 3.96Å; W346-C394 HydrophobicContact CZ3-CB 4.18Å; W346-V409 HydrophobicContact CD2-CG1 4.14Å; W346-V409 HydrophobicContact CG-CG1 4.29Å
347	Q	93.8	Very high	85.4	Confident	81 Å²	81	47.7 Å²	47.7	38%	0.379	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	152.5	171	-68.9	-178.5	-9.6	0	0	110	R325 N326	R325-Q347 HydrophobicContact CB-CB 4.16Å; R325-Q347 PolarHBondContact N-O 3.37Å; R325-Q347 PolarHBondContact O-N 2.97Å; N326-Q347 HydrophobicContact CB-CG 4.31Å; N326-Q347 PolarHBondContact ND2-OE1 3.44Å
348	P	94.6	Very high	87.4	Confident	57 Å²	57	46.6 Å²	46.6	37%	0.37	25%	0.253	S	S	.	.			trans	-60.1	159.8	175.6	-23	34.7	0	0	0	112.8	R325 Y359 T392	R325-P348 PolarHBondContact NH1-O 3.41Å; R325-P348 PolarHBondContact NH2-O 2.93Å; P348-Y359 WeakPolarHBondContact CA-OH 3.04Å; P348-Y359 WeakPolarHBondContact CB-OH 3.46Å; P348-T392 HydrophobicContact CG-CG2 3.99Å
349	P	94.7	Very high	89.4	Confident	17 Å²	17	45.7 Å²	45.7	11%	0.11	24%	0.244	C	C	.	.			trans	-56	159.5	171.8	-23.8	36.1	0	0	0	113.7	G322 R325 L356 A411	G322-P349 VanDerWaalsContact O-CB 3.25Å; G322-P349 WeakPolarHBondContact O-CB 2.96Å; G322-P349 WeakPolarHBondContact O-CG 3.41Å; R325-P349 PolarHBondContact NH1-O 3.42Å; R325-P349 VanDerWaalsContact NH1-O 3.14Å; P349-L356 HydrophobicContact CG-CD1 4.27Å; P349-A411 HydrophobicContact CG-CB 3.68Å
350	V	90.3	Very high	90.6	Very high	124 Å²	124	42.5 Å²	42.5	75%	0.752	23%	0.231	S	C	*	.	S	Bend	trans	-74.9	-40.7	179.1	-175.6	0	0	0	0	110.4
351	Q	87.9	Confident	91.8	Very high	143 Å²	143	42.5 Å²	42.5	67%	0.668	23%	0.231	S	C	*	.			trans	-134.1	140.6	-174.7	-174.1	176.4	20.4	0	0	109	G322	G322-Q351 PolarHBondContact N-O 2.97Å; G322-Q351 VanDerWaalsContact N-O 3.11Å
352	S	94	Very high	92.2	Very high	42 Å²	42	41.9 Å²	41.9	29%	0.294	23%	0.228	S	C	.	.			trans	-153.3	129.3	169.6	-173	0	0	0	0	108	L354	S352-L354 VanDerWaalsContact C-N 3.27Å; S352-L354 WeakPolarHBondContact CB-O 3.25Å; S352-L354 PolarHBondContact OG-O 3.22Å
353	D	93.6	Very high	92.4	Very high	33 Å²	33	42.6 Å²	42.6	18%	0.176	23%	0.231	C	C	.	.	S	Bend	trans	-70	-31.6	177.9	-67.8	-12.4	0	0	0	111	P285 R287 P318 S319	P285-D353 HydrophobicContact CB-CB 4.37Å; R287-D353 PolarHBondContact NH1-O 3.48Å; R287-D353 PolarHBondContact NH2-O 3.27Å; P318-D353 HydrophobicContact CB-CB 3.8Å; S319-D353 WeakPolarHBondContact CB-OD2 3.05Å; S319-D353 PolarHBondContact N-OD2 3.36Å
354	L	96.1	Very high	92.1	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.026	23%	0.234	C	C	.	.	S	Bend	trans	-115	152.5	-179.9	-62.1	-168.2	0	0	0	111.7	I255 P318 S352 S413 W415 L421	I255-L354 HydrophobicContact CG2-CD1 3.83Å; I255-L354 HydrophobicContact CG2-CD2 3.59Å; I255-L354 HydrophobicContact CG2-CG 4.25Å; P318-L354 HydrophobicContact CB-CD1 4.18Å; P318-L354 HydrophobicContact CB-CD2 4.09Å; P318-L354 HydrophobicContact CB-CG 3.8Å; P318-L354 HydrophobicContact CG-CD1 3.76Å; P318-L354 HydrophobicContact CG-CD2 4.25Å; P318-L354 HydrophobicContact CG-CG 3.95Å; S352-L354 VanDerWaalsContact C-N 3.27Å; S352-L354 WeakPolarHBondContact CB-O 3.25Å; S352-L354 PolarHBondContact OG-O 3.22Å; L354-S413 PolarHBondContact O-OG 2.94Å; L354-W415 HydrophobicContact CD1-CB 3.72Å; L354-W415 HydrophobicContact CD1-CG 4.06Å; L354-L421 HydrophobicContact CD1-CD1 4.04Å
355	P	95.2	Very high	91.3	Very high	74 Å²	74	44 Å²	44	48%	0.481	24%	0.24	S	C	.	.			trans	-59.6	140.1	170.8	25.1	-32.5	0	0	0	111	I255 S413	I255-P355 HydrophobicContact CD1-CG 3.68Å; P355-S413 WeakPolarHBondContact O-CB 2.93Å; P355-S413 PolarHBondContact O-OG 2.67Å
356	L	96	Very high	90.2	Very high	41 Å²	41	42.2 Å²	42.2	22%	0.215	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	143	177.7	-57.8	177.7	0	0	0	109.9	P321 P349 Y359 A389 A411	P321-L356 HydrophobicContact CB-CD2 3.69Å; P321-L356 HydrophobicContact CG-CD2 4.18Å; P349-L356 HydrophobicContact CG-CD1 4.27Å; L356-Y359 HydrophobicContact CD1-CE1 4.27Å; L356-Y359 VanDerWaalsContact CD1-OH 3.29Å; L356-Y359 WeakPolarHBondContact CD1-OH 3.34Å; L356-A389 HydrophobicContact CB-CB 3.63Å; L356-A389 VanDerWaalsContact O-CB 3.26Å; L356-A389 WeakPolarHBondContact O-CB 3.26Å; L356-A411 HydrophobicContact CD2-CB 4.09Å
357	T	93.4	Very high	88.4	Confident	52 Å²	52	44.7 Å²	44.7	32%	0.319	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-47	176.7	51.8	0	0	0	0	110.9	A389 T412	T357-A389 WeakPolarHBondContact O-CB 3.4Å; T357-A389 PolarHBondContact O-N 3Å; T357-A389 VanDerWaalsContact O-N 3.1Å; T357-T412 PolarHBondContact N-O 3.01Å; T357-T412 PolarHBondContact OG1-O 3.46Å
358	E	95.5	Very high	86.3	Confident	61 Å²	61	42.2 Å²	42.2	29%	0.285	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	165.3	-175.8	60.1	-174.4	-144.1	0	0	112.4	T386 I387 T412	E358-T386 HydrophobicContact CB-CG2 3.78Å; E358-T386 HydrophobicContact CG-CG2 3.95Å; E358-T386 WeakPolarHBondContact OE2-CG2 3.48Å; E358-I387 CarbonylContact C-O 3.51Å; E358-I387 WeakPolarHBondContact CA-O 3.29Å; E358-I387 WeakPolarHBondContact CB-O 3.38Å; E358-T412 HydrophobicContact CG-CG2 4.34Å; E358-T412 PolarHBondContact N-O 3.43Å; E358-T412 PolarHBondContact O-N 2.69Å
359	Y	96.7	Very high	83.6	Confident	1 Å²	1	44.5 Å²	44.5	0%	0.004	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.5	165.1	-63.5	-78	0	0	0	109.5	P324 W346 P348 L356 T386 I387 A389 R391 T392 K410 A411	P324-Y359 HydrophobicContact CG-CD1 3.99Å; P324-Y359 HydrophobicContact CG-CE1 4.11Å; W346-Y359 HydrophobicContact CZ2-CD2 4.01Å; W346-Y359 HydrophobicContact CZ2-CG 4.07Å; W346-Y359 AromaticContact NE1-CD1 3.54Å; W346-Y359 AromaticContact NE1-CD2 3.45Å; W346-Y359 AromaticContact NE1-CE1 3.65Å; W346-Y359 AromaticContact NE1-CE2 3.57Å; W346-Y359 AromaticContact NE1-CG 3.44Å; W346-Y359 AromaticContact NE1-CZ 3.68Å; P348-Y359 WeakPolarHBondContact CA-OH 3.04Å; P348-Y359 WeakPolarHBondContact CB-OH 3.46Å; L356-Y359 HydrophobicContact CD1-CE1 4.27Å; L356-Y359 VanDerWaalsContact CD1-OH 3.29Å; L356-Y359 WeakPolarHBondContact CD1-OH 3.34Å; Y359-T386 WeakPolarHBondContact O-CA 3.2Å; Y359-I387 PolarHBondContact N-O 2.86Å; Y359-I387 PolarHBondContact O-N 3.44Å; Y359-A389 WeakPolarHBondContact CE2-O 3.17Å; Y359-R391 WeakPolarHBondContact CD2-O 3.32Å; Y359-R391 WeakPolarHBondContact CE2-O 3.46Å; Y359-T392 HydrophobicContact CE2-CG2 4.41Å; Y359-K410 CarbonylContact C-O 3.53Å; Y359-K410 WeakPolarHBondContact CA-O 3.32Å; Y359-A411 HydrophobicContact CD1-CB 3.94Å; Y359-A411 HydrophobicContact CE1-CB 3.8Å
360	L	91.9	Very high	80.9	Confident	27 Å²	27	50 Å²	50	14%	0.141	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	115.4	175.9	-173.6	68.5	0	0	0	109.3	T362 T384 V409 K410	L360-T362 HydrophobicContact CD2-CG2 4.47Å; L360-T362 HydrophobicContact CG-CG2 4.28Å; L360-T384 HydrophobicContact CD1-CG2 3.32Å; L360-T384 HydrophobicContact CG-CG2 4.19Å; L360-V409 WeakPolarHBondContact O-CA 3.25Å; L360-K410 HydrophobicContact CB-CB 4.33Å; L360-K410 HydrophobicContact CD2-CD 4.46Å; L360-K410 PolarHBondContact N-O 3.36Å; L360-K410 PolarHBondContact O-N 3.42Å
361	I	93	Very high	78.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	118.4	177.7	-55.7	91.4	0	0	0	108.1	L344 W346 W363 T384 R385 I387 L396 I407 Q408 V409	L344-I361 HydrophobicContact CD2-CG2 4.01Å; W346-I361 HydrophobicContact CH2-CD1 3.91Å; W346-I361 HydrophobicContact CH2-CG1 4.25Å; W346-I361 HydrophobicContact CZ2-CD1 4.29Å; W346-I361 HydrophobicContact CZ3-CG1 4.46Å; I361-W363 HydrophobicContact CG2-CE3 4.2Å; I361-T384 CarbonylContact O-C 3.59Å; I361-T384 WeakPolarHBondContact O-CA 3.49Å; I361-R385 PolarHBondContact N-O 3.41Å; I361-R385 PolarHBondContact O-N 2.9Å; I361-I387 HydrophobicContact CD1-CB 3.98Å; I361-I387 HydrophobicContact CD1-CG1 3.36Å; I361-L396 HydrophobicContact CG2-CD2 4.23Å; I361-I407 HydrophobicContact CG2-CG2 4.01Å; I361-Q408 CarbonylContact C-O 3.5Å; I361-Q408 WeakPolarHBondContact CA-O 3.45Å; I361-V409 HydrophobicContact CG1-CG1 4.19Å; I361-V409 HydrophobicContact CG1-CG2 4.33Å
362	T	87.8	Confident	76.3	Confident	12 Å²	12	50.4 Å²	50.4	7%	0.074	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.3	174.2	59.9	0	0	0	0	109.3	L360 F383 T384 I407 Q408	L360-T362 HydrophobicContact CD2-CG2 4.47Å; L360-T362 HydrophobicContact CG-CG2 4.28Å; T362-F383 CarbonylContact C-O 3.43Å; T362-F383 VanDerWaalsContact CA-O 3.24Å; T362-F383 WeakPolarHBondContact CA-O 3.41Å; T362-T384 HydrophobicContact CG2-CG2 4.06Å; T362-I407 CarbonylContact O-C 3.56Å; T362-I407 WeakPolarHBondContact O-CA 3.26Å; T362-Q408 PolarHBondContact N-O 2.86Å; T362-Q408 PolarHBondContact O-N 2.99Å; T362-Q408 WeakPolarHBondContact OG1-CB 3.27Å
363	W	85.9	Confident	74	Confident	15 Å²	15	54.5 Å²	54.5	6%	0.057	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	142.4	174.2	70.9	100.3	0	0	0	111.6	I361 F383 R385 L396 K406 I407	I361-W363 HydrophobicContact CG2-CE3 4.2Å; W363-F383 HydrophobicContact CD2-CB 3.57Å; W363-F383 AromaticContact CE2-CG 3.83Å; W363-F383 HydrophobicContact CE3-CB 3.95Å; W363-F383 HydrophobicContact CG-CB 4.17Å; W363-F383 HydrophobicContact CH2-CB 3.72Å; W363-F383 HydrophobicContact CZ2-CB 3.34Å; W363-F383 HydrophobicContact CZ2-CD1 4.47Å; W363-F383 AromaticContact CZ2-CG 3.96Å; W363-F383 HydrophobicContact CZ2-CG 3.96Å; W363-F383 HydrophobicContact CZ3-CB 4.01Å; W363-F383 PolarHBondContact N-O 3.25Å; W363-F383 AromaticContact NE1-CD2 3.64Å; W363-F383 AromaticContact NE1-CG 3.76Å; W363-F383 PolarHBondContact O-N 3.4Å; W363-R385 HydrophobicContact CH2-CB 4.04Å; W363-R385 HydrophobicContact CZ3-CB 3.64Å; W363-L396 HydrophobicContact CD2-CD1 4.29Å; W363-L396 HydrophobicContact CD2-CD2 3.98Å; W363-L396 HydrophobicContact CE3-CD2 3.71Å; W363-L396 HydrophobicContact CG-CD1 4.3Å; W363-L396 HydrophobicContact CH2-CD2 3.97Å; W363-L396 HydrophobicContact CZ2-CD2 4.2Å; W363-L396 HydrophobicContact CZ3-CD2 3.72Å; W363-K406 WeakPolarHBondContact CA-O 3.41Å; W363-I407 HydrophobicContact CB-CB 4.49Å; W363-I407 HydrophobicContact CB-CG1 3.85Å
364	S	79.7	Confident	71.5	Confident	29 Å²	29	55.9 Å²	55.9	20%	0.203	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	158.1	177	61.8	0	0	0	0	109.8	D366 Y405 K406	S364-D366 PolarHBondContact O-N 3.1Å; S364-Y405 VanDerWaalsContact O-CA 3.3Å; S364-Y405 WeakPolarHBondContact O-CA 3.26Å; S364-Y405 WeakPolarHBondContact O-CD1 3.49Å; S364-K406 PolarHBondContact N-O 3.46Å; S364-K406 VanDerWaalsContact N-O 3.09Å; S364-K406 PolarHBondContact O-N 3.04Å
365	I	72.7	Confident	68.9	Low	27 Å²	27	66.7 Å²	66.7	14%	0.138	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	130.9	172	-62.8	174.5	0	0	0	107.7	H367 K400 T403 Y405	I365-H367 WeakPolarHBondContact CG2-NE2 3.43Å; I365-H367 PolarHBondContact O-CD2 2.97Å; I365-H367 PolarHBondContact O-N 2.93Å; I365-H367 VanDerWaalsContact O-N 3.14Å; I365-K400 HydrophobicContact CD1-CD 4.23Å; I365-T403 HydrophobicContact CB-CG2 4.43Å; I365-T403 HydrophobicContact CD1-CG2 4.18Å; I365-T403 HydrophobicContact CG1-CG2 3.95Å; I365-T403 HydrophobicContact CG2-CG2 3.77Å; I365-Y405 HydrophobicContact CG1-CD1 4.1Å; I365-Y405 HydrophobicContact CG1-CE1 3.53Å
366	D	68.7	Low	66.3	Low	38 Å²	38	66 Å²	66	20%	0.203	35%	0.351	C	S	.	.			trans	-80.4	91.7	176.1	-174	27.3	0	0	0	108.9	S364 G368 S404	S364-D366 PolarHBondContact O-N 3.1Å; D366-G368 PolarHBondContact O-N 3.25Å; D366-S404 PolarHBondContact N-O 3Å
367	H	55	Low	63.9	Low	60 Å²	60	70.4 Å²	70.4	28%	0.278	37%	0.374	S	S	.	.			trans	-79.9	99.2	174.2	-65.4	-78.1	0	0	0	108.6	I365 Y369 A379	I365-H367 WeakPolarHBondContact CG2-NE2 3.43Å; I365-H367 PolarHBondContact O-CD2 2.97Å; I365-H367 PolarHBondContact O-N 2.93Å; I365-H367 VanDerWaalsContact O-N 3.14Å; H367-Y369 PolarHBondContact O-N 3.33Å; H367-A379 HydrophobicContact CB-CB 4.46Å; H367-A379 WeakPolarHBondContact CD2-CA 3.38Å; H367-A379 WeakPolarHBondContact CD2-CB 3.49Å; H367-A379 VanDerWaalsContact NE2-CA 3.3Å; H367-A379 WeakPolarHBondContact NE2-CA 3.47Å
368	G	48.7	Very low	61.7	Low	29 Å²	29	72.4 Å²	72.4	30%	0.299	38%	0.38	S	S	.	.	S	Bend	trans	-47	-26.8	-178.1	0	0	0	0	0	114.8	D366 K697	D366-G368 PolarHBondContact O-N 3.25Å; G368-K697 WeakPolarHBondContact O-CE 3.37Å; G368-K697 PolarHBondContact O-NZ 3Å
369	Y	38	Very low	59.4	Low	105 Å²	105	71.4 Å²	71.4	41%	0.412	38%	0.382	S	S	.	.	S	Bend	trans	-166.6	162.1	157.4	-91.7	-79.5	0	0	0	106.5	H367 H371 K697 V707	H367-Y369 PolarHBondContact O-N 3.33Å; Y369-H371 PolarHBondContact O-N 3.01Å; Y369-K697 VanDerWaalsContact CD2-NZ 3.29Å; Y369-V707 PolarHBondContact OH-O 3.05Å
370	L	39.3	Very low	57.2	Low	133 Å²	133	78.3 Å²	78.3	70%	0.696	42%	0.418	S	S	*	.			trans	-51.8	115	164	-79.5	138.2	0	0	0	108.2	T372	L370-T372 PolarHBondContact O-N 2.84Å
371	H	37.7	Very low	55.8	Low	135 Å²	135	80.8 Å²	80.8	63%	0.625	43%	0.431	S	S	*	.			trans	-50.5	134.7	157.6	-77.8	-81.1	0	0	0	106.8	Y369 D373	Y369-H371 PolarHBondContact O-N 3.01Å; H371-D373 CarbonylContact O-C 3.59Å; H371-D373 PolarHBondContact O-N 2.84Å
372	T	43.1	Very low	54.9	Low	140 Å²	140	86 Å²	86	86%	0.859	46%	0.455	S	S	*	.	S	Bend	trans	-52	-12.7	-176.3	42	0	0	0	0	114.2	L370 G374	L370-T372 PolarHBondContact O-N 2.84Å; T372-G374 PolarHBondContact O-N 3.21Å
373	D	45	Very low	54.5	Low	127 Å²	127	90 Å²	90	68%	0.679	47%	0.471	S	S	*	.	S	Bend	trans	-90.9	83.1	170.7	-52.4	-18.4	0	0	0	107.8	H371 R375	H371-D373 CarbonylContact O-C 3.59Å; H371-D373 PolarHBondContact O-N 2.84Å; D373-R375 PolarHBondContact O-N 2.04Å
374	G	42.2	Very low	54.5	Low	62 Å²	62	93 Å²	93	64%	0.639	49%	0.491	S	S	*	.	S	Bend	trans	-60.7	53.9	-171.3	0	0	0	0	0	117	T372	T372-G374 PolarHBondContact O-N 3.21Å
375	R	40.4	Very low	54.9	Low	233 Å²	233	95.1 Å²	95.1	88%	0.879	50%	0.495	S	S	*	.			trans	-147.7	19.3	-175	-68.7	-166.8	176.8	-173.7	-0	114.8	D373 L377	D373-R375 PolarHBondContact O-N 2.04Å; R375-L377 PolarHBondContact O-N 3.27Å
376	T	42	Very low	55.7	Low	59 Å²	59	97.3 Å²	97.3	36%	0.362	51%	0.51	S	S	.	.			trans	-76.1	86.4	165.2	52.5	0	0	0	0	108.8	E378 A379	T376-E378 PolarHBondContact O-N 2.79Å; T376-A379 WeakPolarHBondContact O-CB 3.45Å; T376-A379 PolarHBondContact O-N 3.09Å
377	L	44.8	Very low	56.8	Low	134 Å²	134	96.6 Å²	96.6	70%	0.702	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-50.1	-27.4	172.9	-168.9	72	0	0	0	111.6	R375 A379 L380	R375-L377 PolarHBondContact O-N 3.27Å; L377-A379 PolarHBondContact O-N 2.96Å; L377-L380 HydrophobicContact CD1-CD1 4.45Å; L377-L380 PolarHBondContact O-N 2.87Å
378	E	46.6	Very low	58.6	Low	94 Å²	94	98 Å²	98	44%	0.439	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-59	-29.4	174.7	-62.1	-160.5	149.6	0	0	113.8	T376 L380 I381 K400	T376-E378 PolarHBondContact O-N 2.79Å; E378-L380 PolarHBondContact O-N 3.22Å; E378-I381 PolarHBondContact O-N 3.39Å; E378-I381 VanDerWaalsContact O-N 3.12Å; E378-K400 IonicContact OE1-NZ 2.94Å; E378-K400 PolarHBondContact OE1-NZ 3.2Å; E378-K400 IonicContact OE2-NZ 3.35Å; E378-K400 PolarHBondContact OE2-NZ 2.67Å
379	A	47.2	Very low	60.6	Low	39 Å²	39	97.7 Å²	97.7	32%	0.322	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-68.8	-14.8	179.7	0	0	0	0	0	114.2	H367 T376 L377	H367-A379 HydrophobicContact CB-CB 4.46Å; H367-A379 WeakPolarHBondContact CD2-CA 3.38Å; H367-A379 WeakPolarHBondContact CD2-CB 3.49Å; H367-A379 VanDerWaalsContact NE2-CA 3.3Å; H367-A379 WeakPolarHBondContact NE2-CA 3.47Å; T376-A379 WeakPolarHBondContact O-CB 3.45Å; T376-A379 PolarHBondContact O-N 3.09Å; L377-A379 PolarHBondContact O-N 2.96Å
380	L	51.4	Low	63.1	Low	146 Å²	146	101.2 Å²	101.2	76%	0.764	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-94.7	-5.4	177.5	-64	168.1	0	0	0	112.4	L377 E378 Q382	L377-L380 HydrophobicContact CD1-CD1 4.45Å; L377-L380 PolarHBondContact O-N 2.87Å; E378-L380 PolarHBondContact O-N 3.22Å; L380-Q382 PolarHBondContact O-N 2.86Å
381	I	61.8	Low	65.7	Low	80 Å²	80	103.2 Å²	103.2	41%	0.41	53%	0.528	S	S	.	.			trans	-86.6	101.4	-174.9	-52.8	177.5	0	0	0	109.3	E378 F383	E378-I381 PolarHBondContact O-N 3.39Å; E378-I381 VanDerWaalsContact O-N 3.12Å; I381-F383 HydrophobicContact CG2-CD2 4.39Å; I381-F383 HydrophobicContact CG2-CE1 4.08Å; I381-F383 HydrophobicContact CG2-CE2 3.75Å; I381-F383 HydrophobicContact CG2-CZ 3.58Å
382	Q	74.7	Confident	68.3	Low	108 Å²	108	99.1 Å²	99.1	51%	0.505	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	129	167.1	-177.1	177.2	61.3	0	0	109.5	L380	L380-Q382 PolarHBondContact O-N 2.86Å
383	F	79.6	Confident	70.7	Confident	96 Å²	96	96.9 Å²	96.9	42%	0.421	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	143	172	-59.7	-85.2	0	0	0	109.4	T362 W363 I381	T362-F383 CarbonylContact C-O 3.43Å; T362-F383 VanDerWaalsContact CA-O 3.24Å; T362-F383 WeakPolarHBondContact CA-O 3.41Å; W363-F383 HydrophobicContact CD2-CB 3.57Å; W363-F383 AromaticContact CE2-CG 3.83Å; W363-F383 HydrophobicContact CE3-CB 3.95Å; W363-F383 HydrophobicContact CG-CB 4.17Å; W363-F383 HydrophobicContact CH2-CB 3.72Å; W363-F383 HydrophobicContact CZ2-CB 3.34Å; W363-F383 HydrophobicContact CZ2-CD1 4.47Å; W363-F383 AromaticContact CZ2-CG 3.96Å; W363-F383 HydrophobicContact CZ2-CG 3.96Å; W363-F383 HydrophobicContact CZ3-CB 4.01Å; W363-F383 PolarHBondContact N-O 3.25Å; W363-F383 AromaticContact NE1-CD2 3.64Å; W363-F383 AromaticContact NE1-CG 3.76Å; W363-F383 PolarHBondContact O-N 3.4Å; I381-F383 HydrophobicContact CG2-CD2 4.39Å; I381-F383 HydrophobicContact CG2-CE1 4.08Å; I381-F383 HydrophobicContact CG2-CE2 3.75Å; I381-F383 HydrophobicContact CG2-CZ 3.58Å
384	T	86	Confident	72.8	Confident	78 Å²	78	91.3 Å²	91.3	48%	0.479	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	139.9	-179.2	-59.5	0	0	0	0	109.5	L360 I361 T362	L360-T384 HydrophobicContact CD1-CG2 3.32Å; L360-T384 HydrophobicContact CG-CG2 4.19Å; I361-T384 CarbonylContact O-C 3.59Å; I361-T384 WeakPolarHBondContact O-CA 3.49Å; T362-T384 HydrophobicContact CG2-CG2 4.06Å
385	R	87.1	Confident	75	Confident	74 Å²	74	91.6 Å²	91.6	28%	0.279	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	135.3	175.4	-175.4	170.1	-65.8	-166.5	2.2	109.9	I361 W363 I387 I395 D397	I361-R385 PolarHBondContact N-O 3.41Å; I361-R385 PolarHBondContact O-N 2.9Å; W363-R385 HydrophobicContact CH2-CB 4.04Å; W363-R385 HydrophobicContact CZ3-CB 3.64Å; R385-I387 HydrophobicContact CG-CD1 4.04Å; R385-I387 HydrophobicContact CG-CG1 4.37Å; R385-I395 PolarHBondContact NH1-O 3.43Å; R385-D397 IonicContact CZ-OD1 3.64Å; R385-D397 VanDerWaalsContact CZ-OD1 3.3Å; R385-D397 IonicContact NH1-OD1 4Å; R385-D397 PolarHBondContact NH1-OD1 3.16Å; R385-D397 IonicContact NH2-OD1 3.54Å; R385-D397 PolarHBondContact NH2-OD1 2.84Å; R385-D397 IonicContact NH2-OD2 3.6Å
386	T	89.6	Confident	77.1	Confident	73 Å²	73	80.5 Å²	80.5	45%	0.448	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132.9	177.7	-54	0	0	0	0	109.4	E358 Y359	E358-T386 HydrophobicContact CB-CG2 3.78Å; E358-T386 HydrophobicContact CG-CG2 3.95Å; E358-T386 WeakPolarHBondContact OE2-CG2 3.48Å; Y359-T386 WeakPolarHBondContact O-CA 3.2Å
387	I	93.1	Very high	79	Confident	24 Å²	24	80.3 Å²	80.3	12%	0.123	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	135	-177.9	-60.8	-65.8	0	0	0	108.4	W346 E358 Y359 I361 R385 R391 C394	W346-I387 HydrophobicContact CH2-CG1 4.3Å; W346-I387 HydrophobicContact CH2-CG2 4.35Å; W346-I387 HydrophobicContact CZ2-CB 4.41Å; W346-I387 HydrophobicContact CZ2-CG2 4.16Å; E358-I387 CarbonylContact C-O 3.51Å; E358-I387 WeakPolarHBondContact CA-O 3.29Å; E358-I387 WeakPolarHBondContact CB-O 3.38Å; Y359-I387 PolarHBondContact N-O 2.86Å; Y359-I387 PolarHBondContact O-N 3.44Å; I361-I387 HydrophobicContact CD1-CB 3.98Å; I361-I387 HydrophobicContact CD1-CG1 3.36Å; R385-I387 HydrophobicContact CG-CD1 4.04Å; R385-I387 HydrophobicContact CG-CG1 4.37Å; I387-R391 HydrophobicContact CG2-CB 3.67Å; I387-C394 HydrophobicContact CD1-CB 3.81Å; I387-C394 HydrophobicContact CG1-CB 4.02Å
388	N	92.5	Very high	80.4	Confident	89 Å²	89	78 Å²	78	48%	0.476	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	144.3	176.7	-179.2	-74.6	0	0	0	111.5	E390 R391	N388-E390 PolarHBondContact O-N 3.38Å; N388-E390 VanDerWaalsContact O-N 3.09Å; N388-E390 WeakPolarHBondContact OD1-CB 3.4Å; N388-E390 WeakPolarHBondContact OD1-CG 3.45Å; N388-E390 PolarHBondContact OD1-N 3.44Å; N388-R391 PolarHBondContact O-N 3.38Å
389	A	91	Very high	81.9	Confident	23 Å²	23	73.6 Å²	73.6	19%	0.19	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-23.9	-177.1	0	0	0	0	0	115.9	L356 T357 Y359 R391	L356-A389 HydrophobicContact CB-CB 3.63Å; L356-A389 VanDerWaalsContact O-CB 3.26Å; L356-A389 WeakPolarHBondContact O-CB 3.26Å; T357-A389 WeakPolarHBondContact O-CB 3.4Å; T357-A389 PolarHBondContact O-N 3Å; T357-A389 VanDerWaalsContact O-N 3.1Å; Y359-A389 WeakPolarHBondContact CE2-O 3.17Å; A389-R391 PolarHBondContact O-N 2.98Å
390	E	91	Very high	83	Confident	178 Å²	178	75.7 Å²	75.7	83%	0.832	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-19.4	176.4	-65	179.2	-179.2	0	0	113	N388	N388-E390 PolarHBondContact O-N 3.38Å; N388-E390 VanDerWaalsContact O-N 3.09Å; N388-E390 WeakPolarHBondContact OD1-CB 3.4Å; N388-E390 WeakPolarHBondContact OD1-CG 3.45Å; N388-E390 PolarHBondContact OD1-N 3.44Å
391	R	92.2	Very high	83.9	Confident	175 Å²	175	71.2 Å²	71.2	66%	0.66	35%	0.354	S	S	*	.			trans	-104.9	135.6	-178.3	-63.2	-176.8	-176	-178.3	1.6	110.8	Y359 I387 N388 A389	Y359-R391 WeakPolarHBondContact CD2-O 3.32Å; Y359-R391 WeakPolarHBondContact CE2-O 3.46Å; I387-R391 HydrophobicContact CG2-CB 3.67Å; N388-R391 PolarHBondContact O-N 3.38Å; A389-R391 PolarHBondContact O-N 2.98Å
392	T	93.2	Very high	84.1	Confident	49 Å²	49	70.7 Å²	70.7	30%	0.301	36%	0.361	S	S	.	.			trans	-122.5	22.4	-179	66.2	0	0	0	0	112.9	W346 P348 Y359	W346-T392 PolarHBondContact N-O 3.14Å; W346-T392 VanDerWaalsContact O-CB 3.26Å; W346-T392 WeakPolarHBondContact O-CB 3.3Å; W346-T392 PolarHBondContact O-OG1 2.76Å; P348-T392 HydrophobicContact CG-CG2 3.99Å; Y359-T392 HydrophobicContact CE2-CG2 4.41Å
393	E	93.4	Very high	83.9	Confident	93 Å²	93	66.7 Å²	66.7	44%	0.435	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	149.1	173.8	60.9	176.6	-147.4	0	0	111.4	L343 L344 K345	L343-E393 HydrophobicContact CD1-CB 4.36Å; L344-E393 CarbonylContact O-C 3.49Å; L344-E393 WeakPolarHBondContact O-CA 3.48Å; L344-E393 WeakPolarHBondContact O-CB 3.23Å; K345-E393 HydrophobicContact CB-CB 4.45Å; K345-E393 VanDerWaalsContact CE-OE2 3.26Å; K345-E393 WeakPolarHBondContact CE-OE2 3.43Å; K345-E393 HydrophobicContact CG-CB 3.87Å; K345-E393 IonicContact NZ-OE2 2.89Å; K345-E393 PolarHBondContact NZ-OE2 3.43Å
394	C	89.9	Confident	83.6	Confident	10 Å²	10	63.6 Å²	63.6	7%	0.068	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	153.2	173	74.7	0	0	0	0	111.5	L344 W346 I387	L344-C394 PolarHBondContact N-O 3.02Å; L344-C394 PolarHBondContact O-N 2.95Å; W346-C394 HydrophobicContact CH2-CB 3.96Å; W346-C394 HydrophobicContact CZ3-CB 4.18Å; I387-C394 HydrophobicContact CD1-CB 3.81Å; I387-C394 HydrophobicContact CG1-CB 4.02Å
395	I	86.7	Confident	83.3	Confident	69 Å²	69	60.1 Å²	60.1	35%	0.354	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	125.7	174.4	-61	170.7	0	0	0	108.3	N341 L342 L343 R385 D397	N341-I395 HydrophobicContact CB-CG2 4.1Å; L342-I395 CarbonylContact O-C 3.57Å; L342-I395 VanDerWaalsContact O-CA 3.27Å; L342-I395 WeakPolarHBondContact O-CA 3.45Å; L343-I395 HydrophobicContact CD1-CG1 3.78Å; R385-I395 PolarHBondContact NH1-O 3.43Å; I395-D397 HydrophobicContact CG2-CB 4.46Å
396	L	86.3	Confident	82.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	113.8	165.5	-59	-175.1	0	0	0	108.7	N341 L342 I361 W363 L399 I407	N341-L396 CarbonylContact C-O 3.55Å; N341-L396 VanDerWaalsContact CA-O 3.27Å; N341-L396 WeakPolarHBondContact CA-O 3.33Å; L342-L396 HydrophobicContact CB-CB 4.48Å; L342-L396 PolarHBondContact N-O 2.85Å; L342-L396 PolarHBondContact O-N 3.19Å; I361-L396 HydrophobicContact CG2-CD2 4.23Å; W363-L396 HydrophobicContact CD2-CD1 4.29Å; W363-L396 HydrophobicContact CD2-CD2 3.98Å; W363-L396 HydrophobicContact CE3-CD2 3.71Å; W363-L396 HydrophobicContact CG-CD1 4.3Å; W363-L396 HydrophobicContact CH2-CD2 3.97Å; W363-L396 HydrophobicContact CZ2-CD2 4.2Å; W363-L396 HydrophobicContact CZ3-CD2 3.72Å; L396-L399 HydrophobicContact CB-CD1 4.21Å; L396-L399 HydrophobicContact CB-CD2 4.48Å; L396-I407 HydrophobicContact CD1-CD1 3.3Å; L396-I407 HydrophobicContact CD1-CG1 4.02Å
397	D	80.2	Confident	82.8	Confident	54 Å²	54	55.7 Å²	55.7	29%	0.289	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	155.1	-170.1	41.7	-67.7	0	0	0	112.6	N341 R385 I395 L399	N341-D397 VanDerWaalsContact OD1-CA 3.26Å; N341-D397 WeakPolarHBondContact OD1-CA 3.3Å; R385-D397 IonicContact CZ-OD1 3.64Å; R385-D397 VanDerWaalsContact CZ-OD1 3.3Å; R385-D397 IonicContact NH1-OD1 4Å; R385-D397 PolarHBondContact NH1-OD1 3.16Å; R385-D397 IonicContact NH2-OD1 3.54Å; R385-D397 PolarHBondContact NH2-OD1 2.84Å; R385-D397 IonicContact NH2-OD2 3.6Å; I395-D397 HydrophobicContact CG2-CB 4.46Å; D397-L399 VanDerWaalsContact C-N 3.33Å; D397-L399 PolarHBondContact O-N 3.31Å
398	N	75.7	Confident	82.6	Confident	86 Å²	86	56.4 Å²	56.4	46%	0.46	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.6	31.9	178.5	-56.1	-76	0	0	0	115.2	K339 V340 N341	K339-N398 HydrophobicContact CD-CB 4.03Å; K339-N398 WeakPolarHBondContact CD-OD1 3.43Å; K339-N398 PolarHBondContact NZ-OD1 2.94Å; V340-N398 PolarHBondContact O-N 2.84Å; N341-N398 PolarHBondContact OD1-N 2.84Å
399	L	77.8	Confident	82.7	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	141.3	172.8	-55	178.5	0	0	0	110.2	V340 L342 L396 D397 Y405 L430 T432	V340-L399 HydrophobicContact CB-CB 4.26Å; V340-L399 PolarHBondContact N-O 3.24Å; V340-L399 WeakPolarHBondContact O-CB 3.44Å; V340-L399 PolarHBondContact O-N 3.29Å; L342-L399 HydrophobicContact CB-CD1 3.96Å; L396-L399 HydrophobicContact CB-CD1 4.21Å; L396-L399 HydrophobicContact CB-CD2 4.48Å; D397-L399 VanDerWaalsContact C-N 3.33Å; D397-L399 PolarHBondContact O-N 3.31Å; L399-Y405 HydrophobicContact CB-CE2 4.01Å; L399-Y405 HydrophobicContact CD2-CD1 4.4Å; L399-Y405 HydrophobicContact CD2-CE1 4.01Å; L399-Y405 HydrophobicContact CD2-CE2 4.25Å; L399-L430 HydrophobicContact CD1-CD1 4.31Å; L399-T432 HydrophobicContact CB-CG2 4.12Å; L399-T432 HydrophobicContact CD1-CG2 4.44Å
400	K	69.9	Low	82.8	Confident	83 Å²	83	53.4 Å²	53.4	36%	0.361	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-69.6	142.1	176.5	-66.9	-176.2	-178.8	-176	0	109.4	I365 E378 T403 Y405 T432	I365-K400 HydrophobicContact CD1-CD 4.23Å; E378-K400 IonicContact OE1-NZ 2.94Å; E378-K400 PolarHBondContact OE1-NZ 3.2Å; E378-K400 IonicContact OE2-NZ 3.35Å; E378-K400 PolarHBondContact OE2-NZ 2.67Å; K400-T403 HydrophobicContact CB-CG2 4.49Å; K400-T403 WeakPolarHBondContact CB-OG1 3.19Å; K400-Y405 PolarHBondContact N-OH 3.09Å; K400-T432 WeakPolarHBondContact O-CB 3.48Å; K400-T432 WeakPolarHBondContact O-CG2 3.39Å; K400-T432 PolarHBondContact O-OG1 2.81Å
401	P	70.3	Confident	83	Confident	51 Å²	51	44.9 Å²	44.9	33%	0.331	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	161.7	174.6	31.9	-34.7	0	0	0	110.9	G338 V340 T403 T432 I435	G338-P401 WeakPolarHBondContact O-CD 3.45Å; G338-P401 WeakPolarHBondContact O-CG 3.48Å; V340-P401 HydrophobicContact CG2-CB 4.29Å; P401-T403 PolarHBondContact O-N 3.34Å; P401-T403 PolarHBondContact O-OG1 3.35Å; P401-T432 VanDerWaalsContact CA-OG1 3.32Å; P401-T432 WeakPolarHBondContact CA-OG1 3.5Å; P401-I435 HydrophobicContact CB-CD1 4.3Å; P401-I435 HydrophobicContact CB-CG1 4.49Å
402	A	66.8	Low	83.1	Confident	69 Å²	69	36.6 Å²	36.6	57%	0.57	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.5	33.6	179.6	0	0	0	0	0	114.8	T432 Q433	A402-T432 VanDerWaalsContact CA-O 3.3Å; A402-T432 WeakPolarHBondContact CA-O 3.22Å; A402-T432 PolarHBondContact N-O 2.78Å; A402-T432 PolarHBondContact N-OG1 3.47Å; A402-Q433 PolarHBondContact N-O 2.82Å; A402-Q433 VanDerWaalsContact N-O 3.09Å
403	T	69	Low	83.2	Confident	25 Å²	25	34.3 Å²	34.3	15%	0.153	19%	0.186	C	C	.	.			trans	-125.6	136.6	-172.8	-58.1	0	0	0	0	110.2	I365 K400 P401 Y405 T432	I365-T403 HydrophobicContact CB-CG2 4.43Å; I365-T403 HydrophobicContact CD1-CG2 4.18Å; I365-T403 HydrophobicContact CG1-CG2 3.95Å; I365-T403 HydrophobicContact CG2-CG2 3.77Å; K400-T403 HydrophobicContact CB-CG2 4.49Å; K400-T403 WeakPolarHBondContact CB-OG1 3.19Å; P401-T403 PolarHBondContact O-N 3.34Å; P401-T403 PolarHBondContact O-OG1 3.35Å; T403-Y405 HydrophobicContact CG2-CD2 4.18Å; T403-Y405 HydrophobicContact CG2-CE2 3.67Å; T403-T432 PolarHBondContact N-OG1 2.84Å; T403-T432 PolarHBondContact O-N 2.81Å; T403-T432 PolarHBondContact O-OG1 3.46Å
404	S	73.5	Confident	83.3	Confident	30 Å²	30	34.2 Å²	34.2	21%	0.21	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	134.6	174.7	-59.1	0	0	0	0	110.9	D366 L430 S431	D366-S404 PolarHBondContact N-O 3Å; S404-L430 CarbonylContact C-O 3.56Å; S404-L430 VanDerWaalsContact CA-O 3.28Å; S404-L430 WeakPolarHBondContact CA-O 3.1Å; S404-S431 PolarHBondContact OG-OG 2.81Å
405	Y	79.1	Confident	83.5	Confident	6 Å²	6	34 Å²	34	2%	0.024	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	141.5	178.8	-71.2	-94.1	0	0	0	111	S364 I365 L399 K400 T403 F429 L430 T432	S364-Y405 VanDerWaalsContact O-CA 3.3Å; S364-Y405 WeakPolarHBondContact O-CA 3.26Å; S364-Y405 WeakPolarHBondContact O-CD1 3.49Å; I365-Y405 HydrophobicContact CG1-CD1 4.1Å; I365-Y405 HydrophobicContact CG1-CE1 3.53Å; L399-Y405 HydrophobicContact CB-CE2 4.01Å; L399-Y405 HydrophobicContact CD2-CD1 4.4Å; L399-Y405 HydrophobicContact CD2-CE1 4.01Å; L399-Y405 HydrophobicContact CD2-CE2 4.25Å; K400-Y405 PolarHBondContact N-OH 3.09Å; T403-Y405 HydrophobicContact CG2-CD2 4.18Å; T403-Y405 HydrophobicContact CG2-CE2 3.67Å; Y405-F429 WeakPolarHBondContact O-CA 3.47Å; Y405-L430 HydrophobicContact CD2-CD1 4.03Å; Y405-L430 HydrophobicContact CG-CD1 4.43Å; Y405-L430 PolarHBondContact N-O 2.86Å; Y405-L430 PolarHBondContact O-N 3.25Å; Y405-T432 HydrophobicContact CD2-CG2 4.05Å; Y405-T432 HydrophobicContact CE2-CG2 3.97Å
406	K	80.3	Confident	83.9	Confident	54 Å²	54	32.3 Å²	32.3	24%	0.235	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	120.9	164.6	-179.8	178.6	-178	176.2	0	108.1	W363 S364 Q408 T427 F429	W363-K406 WeakPolarHBondContact CA-O 3.41Å; S364-K406 PolarHBondContact N-O 3.46Å; S364-K406 VanDerWaalsContact N-O 3.09Å; S364-K406 PolarHBondContact O-N 3.04Å; K406-Q408 HydrophobicContact CG-CG 4.4Å; K406-T427 HydrophobicContact CD-CG2 4.44Å; K406-T427 HydrophobicContact CG-CG2 3.92Å; K406-F429 HydrophobicContact CB-CD1 4.02Å; K406-F429 HydrophobicContact CB-CE1 3.7Å; K406-F429 HydrophobicContact CB-CZ 4.29Å; K406-F429 HydrophobicContact CD-CE1 3.95Å; K406-F429 HydrophobicContact CD-CZ 3.87Å; K406-F429 HydrophobicContact CG-CD1 4.32Å; K406-F429 HydrophobicContact CG-CE1 3.68Å; K406-F429 HydrophobicContact CG-CE2 4.43Å; K406-F429 HydrophobicContact CG-CZ 3.74Å
407	I	87	Confident	84	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	137.2	172.1	-60.8	178.8	0	0	0	109	L342 L344 I361 T362 W363 L396 V409 T427 I428 L430	L342-I407 HydrophobicContact CD2-CD1 4.16Å; L344-I407 HydrophobicContact CD1-CD1 4.18Å; L344-I407 HydrophobicContact CD2-CG2 3.92Å; I361-I407 HydrophobicContact CG2-CG2 4.01Å; T362-I407 CarbonylContact O-C 3.56Å; T362-I407 WeakPolarHBondContact O-CA 3.26Å; W363-I407 HydrophobicContact CB-CB 4.49Å; W363-I407 HydrophobicContact CB-CG1 3.85Å; L396-I407 HydrophobicContact CD1-CD1 3.3Å; L396-I407 HydrophobicContact CD1-CG1 4.02Å; I407-V409 HydrophobicContact CG2-CG2 4.22Å; I407-T427 CarbonylContact O-C 3.54Å; I407-T427 VanDerWaalsContact O-CA 3.26Å; I407-T427 WeakPolarHBondContact O-CA 3.38Å; I407-I428 HydrophobicContact CB-CG1 3.98Å; I407-I428 HydrophobicContact CD1-CD1 4.47Å; I407-I428 PolarHBondContact N-O 2.58Å; I407-I428 PolarHBondContact O-N 2.96Å; I407-L430 HydrophobicContact CD1-CD2 2.95Å; I407-L430 HydrophobicContact CD1-CG 4.44Å; I407-L430 HydrophobicContact CG1-CD2 3.41Å; I407-L430 VanDerWaalsContact CG1-CD2 3.41Å
408	Q	89.1	Confident	84.6	Confident	38 Å²	38	37 Å²	37	18%	0.178	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	130.6	170.8	-49.7	-169.7	-79.6	0	0	110.4	I361 T362 K406 P425 N426 T427	I361-Q408 CarbonylContact C-O 3.5Å; I361-Q408 WeakPolarHBondContact CA-O 3.45Å; T362-Q408 PolarHBondContact N-O 2.86Å; T362-Q408 PolarHBondContact O-N 2.99Å; T362-Q408 WeakPolarHBondContact OG1-CB 3.27Å; K406-Q408 HydrophobicContact CG-CG 4.4Å; Q408-P425 HydrophobicContact CB-CB 3.89Å; Q408-P425 HydrophobicContact CG-CB 4.46Å; Q408-N426 CarbonylContact C-O 3.59Å; Q408-N426 WeakPolarHBondContact CA-O 3.37Å; Q408-T427 HydrophobicContact CG-CG2 3.99Å; Q408-T427 PolarHBondContact NE2-OG1 2.76Å
409	V	94.3	Very high	85.3	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	121.8	175.5	-169.9	0	0	0	0	108.3	P324 V327 L344 W346 L360 I361 I407 N426	P324-V409 HydrophobicContact CB-CG1 4.07Å; P324-V409 WeakPolarHBondContact CD-O 3.35Å; P324-V409 HydrophobicContact CG-CB 4.34Å; P324-V409 HydrophobicContact CG-CG1 3.83Å; V327-V409 HydrophobicContact CG1-CG2 3.74Å; V327-V409 HydrophobicContact CG2-CB 4.15Å; V327-V409 HydrophobicContact CG2-CG2 4.06Å; L344-V409 HydrophobicContact CD2-CG2 3.84Å; W346-V409 HydrophobicContact CD2-CG1 4.14Å; W346-V409 HydrophobicContact CG-CG1 4.29Å; L360-V409 WeakPolarHBondContact O-CA 3.25Å; I361-V409 HydrophobicContact CG1-CG1 4.19Å; I361-V409 HydrophobicContact CG1-CG2 4.33Å; I407-V409 HydrophobicContact CG2-CG2 4.22Å; V409-N426 PolarHBondContact N-O 3.02Å; V409-N426 PolarHBondContact O-N 3.5Å
410	K	92.7	Very high	86	Confident	49 Å²	49	38 Å²	38	21%	0.213	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	150.3	173.7	-63.9	173.4	171.8	-176.4	0	110.2	Y359 L360 E422 S423 P425	Y359-K410 CarbonylContact C-O 3.53Å; Y359-K410 WeakPolarHBondContact CA-O 3.32Å; L360-K410 HydrophobicContact CB-CB 4.33Å; L360-K410 HydrophobicContact CD2-CD 4.46Å; L360-K410 PolarHBondContact N-O 3.36Å; L360-K410 PolarHBondContact O-N 3.42Å; K410-E422 IonicContact NZ-OE2 3.89Å; K410-E422 PolarHBondContact NZ-OE2 3.02Å; K410-S423 WeakPolarHBondContact CA-OG 3.1Å; K410-P425 HydrophobicContact CG-CB 3.84Å
411	A	95	Very high	87	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	143.6	167.3	0	0	0	0	0	109.4	P321 P324 P349 L356 Y359 S423	P321-A411 HydrophobicContact CB-CB 4.23Å; P321-A411 HydrophobicContact CG-CB 4.18Å; P321-A411 WeakPolarHBondContact CG-O 3.34Å; P324-A411 HydrophobicContact CG-CB 4.11Å; P349-A411 HydrophobicContact CG-CB 3.68Å; L356-A411 HydrophobicContact CD2-CB 4.09Å; Y359-A411 HydrophobicContact CD1-CB 3.94Å; Y359-A411 HydrophobicContact CE1-CB 3.8Å; A411-S423 PolarHBondContact N-OG 3.06Å; A411-S423 WeakPolarHBondContact O-CB 3.27Å; A411-S423 PolarHBondContact O-N 3.01Å; A411-S423 PolarHBondContact O-OG 3.11Å
412	T	94.5	Very high	88.1	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.8	-178.6	-54	0	0	0	0	110.5	T357 E358 N420 L421 E422	T357-T412 PolarHBondContact N-O 3.01Å; T357-T412 PolarHBondContact OG1-O 3.46Å; E358-T412 HydrophobicContact CG-CG2 4.34Å; E358-T412 PolarHBondContact N-O 3.43Å; E358-T412 PolarHBondContact O-N 2.69Å; T412-N420 HydrophobicContact CG2-CB 3.82Å; T412-L421 WeakPolarHBondContact CA-O 3.15Å; T412-E422 HydrophobicContact CG2-CG 4.38Å
413	S	96.1	Very high	89.3	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.007	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	154.4	168.7	-57.9	0	0	0	0	109.9	L354 P355 N420 L421	L354-S413 PolarHBondContact O-OG 2.94Å; P355-S413 WeakPolarHBondContact O-CB 2.93Å; P355-S413 PolarHBondContact O-OG 2.67Å; S413-N420 CarbonylContact O-C 3.48Å; S413-N420 WeakPolarHBondContact O-CA 3.5Å; S413-L421 PolarHBondContact N-O 2.98Å; S413-L421 PolarHBondContact O-N 3.4Å
414	Y	94.4	Very high	90.2	Very high	90 Å²	90	37.3 Å²	37.3	35%	0.353	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	131.5	178.3	179.4	-104	0	0	0	110.8	H416 N420	Y414-H416 HydrophobicContact CE1-CB 3.97Å; Y414-N420 WeakPolarHBondContact CD2-OD1 3.3Å
415	W	95.4	Very high	90.9	Very high	5 Å²	5	37.4 Å²	37.4	2%	0.019	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	112.8	173.8	-169.7	38.4	0	0	0	110.1	C256 Q257 G286 P315 R317 P318 L354 G417 F418 G419 L421	C256-W415 PolarHBondContact O-NE1 3.01Å; Q257-W415 HydrophobicContact CB-CH2 3.89Å; Q257-W415 HydrophobicContact CB-CZ2 3.73Å; Q257-W415 HydrophobicContact CB-CZ3 4.37Å; Q257-W415 HydrophobicContact CG-CH2 3.81Å; Q257-W415 HydrophobicContact CG-CZ2 4.08Å; Q257-W415 HydrophobicContact CG-CZ3 4.39Å; G286-W415 PolarHBondContact O-NE1 3.09Å; P315-W415 HydrophobicContact CG-CZ2 4.14Å; R317-W415 HydrophobicContact CB-CH2 4.44Å; R317-W415 HydrophobicContact CB-CZ3 4.43Å; R317-W415 HydrophobicContact CG-CH2 4.44Å; R317-W415 HydrophobicContact CG-CZ3 3.95Å; P318-W415 HydrophobicContact CG-CD2 3.89Å; P318-W415 HydrophobicContact CG-CE3 4.18Å; P318-W415 HydrophobicContact CG-CG 4.04Å; L354-W415 HydrophobicContact CD1-CB 3.72Å; L354-W415 HydrophobicContact CD1-CG 4.06Å; W415-G417 PolarHBondContact O-N 2.89Å; W415-F418 HydrophobicContact CB-CB 4.41Å; W415-F418 HydrophobicContact CD2-CB 4.04Å; W415-F418 HydrophobicContact CE3-CB 3.28Å; W415-F418 HydrophobicContact CE3-CD1 4.21Å; W415-F418 HydrophobicContact CE3-CD2 4.26Å; W415-F418 AromaticContact CE3-CG 3.67Å; W415-F418 HydrophobicContact CE3-CG 3.67Å; W415-F418 HydrophobicContact CZ3-CB 3.83Å; W415-F418 HydrophobicContact CZ3-CD2 4.19Å; W415-F418 HydrophobicContact CZ3-CG 4.06Å; W415-F418 PolarHBondContact O-N 3.25Å; W415-G419 PolarHBondContact N-O 3.34Å; W415-G419 PolarHBondContact O-N 3.23Å; W415-L421 HydrophobicContact CB-CD1 4.14Å
416	H	93.9	Very high	91.3	Very high	35 Å²	35	39.1 Å²	39.1	16%	0.162	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-62.8	133.4	-172.6	-177.7	75.2	0	0	0	111.8	I255 C256 Q257 D260 Y263 Y414 F418	I255-H416 WeakPolarHBondContact O-CB 3.44Å; I255-H416 PolarHBondContact O-N 3.34Å; I255-H416 VanDerWaalsContact O-N 3.17Å; C256-H416 HydrophobicContact CB-CB 4.2Å; Q257-H416 WeakPolarHBondContact CB-O 3.23Å; Q257-H416 PolarHBondContact N-O 3.28Å; D260-H416 IonicContact OD2-NE2 2.81Å; D260-H416 PolarHBondContact OD2-NE2 3.22Å; Y263-H416 AromaticContact CD2-CE1 3.53Å; Y263-H416 AromaticContact CD2-ND1 3.66Å; Y263-H416 AromaticContact CD2-NE2 3.84Å; Y263-H416 AromaticContact CE2-CE1 3.2Å; Y263-H416 WeakPolarHBondContact CE2-CE1 3.36Å; Y263-H416 AromaticContact CE2-ND1 3.48Å; Y263-H416 WeakPolarHBondContact CE2-ND1 3.39Å; Y263-H416 AromaticContact CE2-NE2 3.92Å; Y263-H416 AromaticContact CZ-CE1 3.77Å; Y263-H416 AromaticContact CZ-ND1 3.67Å; Y414-H416 HydrophobicContact CE1-CB 3.97Å; H416-F418 VanDerWaalsContact C-N 3.31Å
417	G	90.3	Very high	91.5	Very high	56 Å²	56	37.8 Å²	37.8	58%	0.577	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.7	-28.5	-172.8	0	0	0	0	0	114.5	W415	W415-G417 PolarHBondContact O-N 2.89Å
418	F	90.9	Very high	91.2	Very high	95 Å²	95	39.2 Å²	39.2	42%	0.417	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-46.1	176.4	-177.7	-91.3	0	0	0	112.7	W415 H416 L421	W415-F418 HydrophobicContact CB-CB 4.41Å; W415-F418 HydrophobicContact CD2-CB 4.04Å; W415-F418 HydrophobicContact CE3-CB 3.28Å; W415-F418 HydrophobicContact CE3-CD1 4.21Å; W415-F418 HydrophobicContact CE3-CD2 4.26Å; W415-F418 AromaticContact CE3-CG 3.67Å; W415-F418 HydrophobicContact CE3-CG 3.67Å; W415-F418 HydrophobicContact CZ3-CB 3.83Å; W415-F418 HydrophobicContact CZ3-CD2 4.19Å; W415-F418 HydrophobicContact CZ3-CG 4.06Å; W415-F418 PolarHBondContact O-N 3.25Å; H416-F418 VanDerWaalsContact C-N 3.31Å; F418-L421 HydrophobicContact CD1-CD2 3.83Å; F418-L421 HydrophobicContact CD1-CG 4.44Å; F418-L421 HydrophobicContact CE1-CD2 3.47Å; F418-L421 VanDerWaalsContact CE1-CD2 3.47Å; F418-L421 HydrophobicContact CE1-CG 4.47Å; F418-L421 HydrophobicContact CZ-CD2 4.41Å
419	G	91.4	Very high	90.7	Very high	19 Å²	19	39.7 Å²	39.7	20%	0.196	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	115.1	-153.7	-177.8	0	0	0	0	0	113.8	W415	W415-G419 PolarHBondContact N-O 3.34Å; W415-G419 PolarHBondContact O-N 3.23Å
420	N	92.2	Very high	89.7	Confident	90 Å²	90	40.2 Å²	40.2	48%	0.481	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	138.4	-176.4	-70.5	-21.6	0	0	0	112	T412 S413 Y414	T412-N420 HydrophobicContact CG2-CB 3.82Å; S413-N420 CarbonylContact O-C 3.48Å; S413-N420 WeakPolarHBondContact O-CA 3.5Å; Y414-N420 WeakPolarHBondContact CD2-OD1 3.3Å
421	L	91.8	Very high	88.6	Confident	12 Å²	12	40.9 Å²	40.9	6%	0.063	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	105.4	173.5	-63.3	169.9	0	0	0	108.2	P318 P320 P321 L354 T412 S413 W415 F418	P318-L421 HydrophobicContact CB-CD1 4.46Å; P318-L421 HydrophobicContact CG-CD1 3.86Å; P320-L421 HydrophobicContact CB-CB 4.41Å; P321-L421 VanDerWaalsContact CD-O 3.27Å; P321-L421 WeakPolarHBondContact CD-O 3.47Å; L354-L421 HydrophobicContact CD1-CD1 4.04Å; T412-L421 WeakPolarHBondContact CA-O 3.15Å; S413-L421 PolarHBondContact N-O 2.98Å; S413-L421 PolarHBondContact O-N 3.4Å; W415-L421 HydrophobicContact CB-CD1 4.14Å; F418-L421 HydrophobicContact CD1-CD2 3.83Å; F418-L421 HydrophobicContact CD1-CG 4.44Å; F418-L421 HydrophobicContact CE1-CD2 3.47Å; F418-L421 VanDerWaalsContact CE1-CD2 3.47Å; F418-L421 HydrophobicContact CE1-CG 4.47Å; F418-L421 HydrophobicContact CZ-CD2 4.41Å
422	E	92.1	Very high	87.4	Confident	88 Å²	88	41.1 Å²	41.1	41%	0.411	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	136.9	180	-63.6	-173.3	-173.6	0	0	111.6	P320 K410 T412	P320-E422 WeakPolarHBondContact CB-O 3.08Å; K410-E422 IonicContact NZ-OE2 3.89Å; K410-E422 PolarHBondContact NZ-OE2 3.02Å; T412-E422 HydrophobicContact CG2-CG 4.38Å
423	S	92.2	Very high	85.8	Confident	5 Å²	5	47.1 Å²	47.1	4%	0.035	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-68.1	165.8	170.6	77.4	0	0	0	0	111.8	P321 G322 K410 A411	P321-S423 VanDerWaalsContact O-CA 3.3Å; P321-S423 WeakPolarHBondContact O-CA 3.38Å; P321-S423 WeakPolarHBondContact O-CB 3.39Å; G322-S423 VanDerWaalsContact O-CB 3.23Å; G322-S423 WeakPolarHBondContact O-CB 3.28Å; K410-S423 WeakPolarHBondContact CA-OG 3.1Å; A411-S423 PolarHBondContact N-OG 3.06Å; A411-S423 WeakPolarHBondContact O-CB 3.27Å; A411-S423 PolarHBondContact O-N 3.01Å; A411-S423 PolarHBondContact O-OG 3.11Å
424	Q	87.5	Confident	83.7	Confident	110 Å²	110	51.2 Å²	51.2	51%	0.514	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-58.8	145.9	157.8	-65.9	-57.4	-38.2	0	0	110.1	P323	P323-Q424 WeakPolarHBondContact CB-O 3.48Å
425	P	88.6	Confident	81.4	Confident	32 Å²	32	50.5 Å²	50.5	21%	0.208	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-74.9	136.3	179.5	28.3	-31.7	0	0	0	111.5	Q408 K410	Q408-P425 HydrophobicContact CB-CB 3.89Å; Q408-P425 HydrophobicContact CG-CB 4.46Å; K410-P425 HydrophobicContact CG-CB 3.84Å
426	N	87.1	Confident	78.7	Confident	42 Å²	42	57.7 Å²	57.7	23%	0.225	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	117.3	158.5	-170.6	-44.4	0	0	0	108.3	P324 V327 Q408 V409	P324-N426 WeakPolarHBondContact O-CB 3.13Å; P324-N426 PolarHBondContact O-ND2 2.91Å; V327-N426 HydrophobicContact CG2-CB 3.71Å; Q408-N426 CarbonylContact C-O 3.59Å; Q408-N426 WeakPolarHBondContact CA-O 3.37Å; V409-N426 PolarHBondContact N-O 3.02Å; V409-N426 PolarHBondContact O-N 3.5Å
427	T	84.3	Confident	76	Confident	25 Å²	25	59.7 Å²	59.7	15%	0.153	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.4	-172.2	-56.8	0	0	0	0	110.6	K406 I407 Q408 F429	K406-T427 HydrophobicContact CD-CG2 4.44Å; K406-T427 HydrophobicContact CG-CG2 3.92Å; I407-T427 CarbonylContact O-C 3.54Å; I407-T427 VanDerWaalsContact O-CA 3.26Å; I407-T427 WeakPolarHBondContact O-CA 3.38Å; Q408-T427 HydrophobicContact CG-CG2 3.99Å; Q408-T427 PolarHBondContact NE2-OG1 2.76Å; T427-F429 HydrophobicContact CG2-CD2 4.25Å; T427-F429 HydrophobicContact CG2-CE2 3.5Å; T427-F429 HydrophobicContact CG2-CZ 3.99Å
428	I	81.8	Confident	73.2	Confident	31 Å²	31	61.4 Å²	61.4	16%	0.159	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	154.7	170	66.6	161.4	0	0	0	110.5	V327 L344 I407	V327-I428 HydrophobicContact CB-CG2 4.03Å; V327-I428 HydrophobicContact CG1-CD1 3.89Å; V327-I428 HydrophobicContact CG1-CG1 4.04Å; V327-I428 HydrophobicContact CG1-CG2 4.09Å; L344-I428 HydrophobicContact CD1-CD1 3.77Å; I407-I428 HydrophobicContact CB-CG1 3.98Å; I407-I428 HydrophobicContact CD1-CD1 4.47Å; I407-I428 PolarHBondContact N-O 2.58Å; I407-I428 PolarHBondContact O-N 2.96Å
429	F	77.9	Confident	70.3	Confident	48 Å²	48	66 Å²	66	21%	0.211	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	128.6	177	-66.3	-102.3	0	0	0	108.6	Y405 K406 T427 I696	Y405-F429 WeakPolarHBondContact O-CA 3.47Å; K406-F429 HydrophobicContact CB-CD1 4.02Å; K406-F429 HydrophobicContact CB-CE1 3.7Å; K406-F429 HydrophobicContact CB-CZ 4.29Å; K406-F429 HydrophobicContact CD-CE1 3.95Å; K406-F429 HydrophobicContact CD-CZ 3.87Å; K406-F429 HydrophobicContact CG-CD1 4.32Å; K406-F429 HydrophobicContact CG-CE1 3.68Å; K406-F429 HydrophobicContact CG-CE2 4.43Å; K406-F429 HydrophobicContact CG-CZ 3.74Å; T427-F429 HydrophobicContact CG2-CD2 4.25Å; T427-F429 HydrophobicContact CG2-CE2 3.5Å; T427-F429 HydrophobicContact CG2-CZ 3.99Å; F429-I696 HydrophobicContact CD2-CB 3.94Å; F429-I696 HydrophobicContact CD2-CD1 4.23Å; F429-I696 HydrophobicContact CD2-CG2 3.93Å; F429-I696 HydrophobicContact CE2-CB 3.46Å; F429-I696 VanDerWaalsContact CE2-CB 3.46Å; F429-I696 HydrophobicContact CE2-CD1 4.11Å; F429-I696 HydrophobicContact CE2-CG1 4.19Å; F429-I696 HydrophobicContact CE2-CG2 3.96Å; F429-I696 HydrophobicContact CZ-CB 3.99Å; F429-I696 WeakPolarHBondContact CZ-O 3.28Å
430	L	73.2	Confident	67.3	Low	10 Å²	10	73.2 Å²	73.2	5%	0.052	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	149.1	178.7	65.6	112.9	0	0	0	110.3	W332 L342 L399 S404 Y405 I407 T432	W332-L430 HydrophobicContact CH2-CB 4.3Å; W332-L430 HydrophobicContact CH2-CD1 3.68Å; W332-L430 HydrophobicContact CZ3-CD1 4.31Å; L342-L430 HydrophobicContact CD2-CD1 4.21Å; L342-L430 HydrophobicContact CD2-CD2 3.79Å; L342-L430 HydrophobicContact CD2-CG 4.49Å; L399-L430 HydrophobicContact CD1-CD1 4.31Å; S404-L430 CarbonylContact C-O 3.56Å; S404-L430 VanDerWaalsContact CA-O 3.28Å; S404-L430 WeakPolarHBondContact CA-O 3.1Å; Y405-L430 HydrophobicContact CD2-CD1 4.03Å; Y405-L430 HydrophobicContact CG-CD1 4.43Å; Y405-L430 PolarHBondContact N-O 2.86Å; Y405-L430 PolarHBondContact O-N 3.25Å; I407-L430 HydrophobicContact CD1-CD2 2.95Å; I407-L430 HydrophobicContact CD1-CG 4.44Å; I407-L430 HydrophobicContact CG1-CD2 3.41Å; I407-L430 VanDerWaalsContact CG1-CD2 3.41Å; L430-T432 HydrophobicContact CD1-CG2 3.87Å
431	S	69.5	Low	64.3	Low	63 Å²	63	77.1 Å²	77.1	44%	0.441	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	120.8	170	-62.8	0	0	0	0	108.6	S404	S404-S431 PolarHBondContact OG-OG 2.81Å
432	T	70.1	Confident	61.3	Low	6 Å²	6	84.9 Å²	84.9	4%	0.037	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-71.7	144.7	179.7	63.4	0	0	0	0	110.3	W332 L399 K400 P401 A402 T403 Y405 L430	W332-T432 HydrophobicContact CH2-CG2 4.39Å; W332-T432 HydrophobicContact CZ3-CG2 3.91Å; L399-T432 HydrophobicContact CB-CG2 4.12Å; L399-T432 HydrophobicContact CD1-CG2 4.44Å; K400-T432 WeakPolarHBondContact O-CB 3.48Å; K400-T432 WeakPolarHBondContact O-CG2 3.39Å; K400-T432 PolarHBondContact O-OG1 2.81Å; P401-T432 VanDerWaalsContact CA-OG1 3.32Å; P401-T432 WeakPolarHBondContact CA-OG1 3.5Å; A402-T432 VanDerWaalsContact CA-O 3.3Å; A402-T432 WeakPolarHBondContact CA-O 3.22Å; A402-T432 PolarHBondContact N-O 2.78Å; A402-T432 PolarHBondContact N-OG1 3.47Å; T403-T432 PolarHBondContact N-OG1 2.84Å; T403-T432 PolarHBondContact O-N 2.81Å; T403-T432 PolarHBondContact O-OG1 3.46Å; Y405-T432 HydrophobicContact CD2-CG2 4.05Å; Y405-T432 HydrophobicContact CE2-CG2 3.97Å; L430-T432 HydrophobicContact CD1-CG2 3.87Å
433	Q	61	Low	58.2	Low	127 Å²	127	89.2 Å²	89.2	59%	0.593	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-64.4	151.1	-179.8	-65.5	-172.7	2.5	0	0	112	A402	A402-Q433 PolarHBondContact N-O 2.82Å; A402-Q433 VanDerWaalsContact N-O 3.09Å
434	S	51.9	Low	55	Low	87 Å²	87	94 Å²	94	61%	0.608	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-79.6	126.4	168.6	-177.8	0	0	0	0	109.7	H436	S434-H436 PolarHBondContact O-N 3.07Å
435	I	45.7	Very low	52.1	Low	75 Å²	75	93 Å²	93	39%	0.385	50%	0.499	S	S	.	.			trans	-83.8	97.4	171.2	-59.6	164.6	0	0	0	106.3	L334 G338 P401	L334-I435 HydrophobicContact CD2-CD1 4.05Å; L334-I435 HydrophobicContact CD2-CG1 3.89Å; G338-I435 VanDerWaalsContact CA-CD1 3.46Å; G338-I435 WeakPolarHBondContact O-CD1 3.27Å; P401-I435 HydrophobicContact CB-CD1 4.3Å; P401-I435 HydrophobicContact CB-CG1 4.49Å
436	H	38.9	Very low	49.1	Very low	155 Å²	155	97.5 Å²	97.5	72%	0.718	53%	0.528	S	S	*	.			trans	-60	136.1	177	-144.4	-77.5	0	0	0	109.8	S434 A438	S434-H436 PolarHBondContact O-N 3.07Å; H436-A438 PolarHBondContact O-N 2.8Å
437	P	37.5	Very low	46.2	Very low	77 Å²	77	100.6 Å²	100.6	50%	0.5	55%	0.549	S	S	.	.			trans	-78	89.5	-175.4	30.2	-34.7	0	0	0	111.3	H440	P437-H440 HydrophobicContact CB-CB 4.03Å
438	A	32.2	Very low	43.5	Very low	93 Å²	93	107.2 Å²	107.2	77%	0.769	58%	0.578	S	S	*	*	S	Bend	trans	-77.7	-7.8	145	0	0	0	0	0	111.2	H436	H436-A438 PolarHBondContact O-N 2.8Å
439	F	29.9	Very low	40.8	Very low	190 Å²	190	113 Å²	113	83%	0.833	61%	0.608	S	S	*	*	S	Bend	trans	-104.1	-4.2	-172.1	-93	-84.1	0	0	0	116.1	Q441	F439-Q441 VanDerWaalsContact C-N 3.27Å; F439-Q441 PolarHBondContact O-N 3.03Å
440	H	27.6	Very low	38.4	Very low	171 Å²	171	120 Å²	120	79%	0.792	63%	0.634	S	S	*	*	S	Bend	trans	-82.6	4.6	175	-87.3	-57	0	0	0	115	P437	P437-H440 HydrophobicContact CB-CB 4.03Å
441	Q	28.8	Very low	36	Very low	173 Å²	173	124 Å²	124	81%	0.808	67%	0.668	S	S	*	*	S	Bend	trans	-129.8	62.8	177.5	-66.6	-171.2	-6.3	0	0	111.9	F439	F439-Q441 VanDerWaalsContact C-N 3.27Å; F439-Q441 PolarHBondContact O-N 3.03Å
442	Q	29.5	Very low	34	Very low	174 Å²	174	127.4 Å²	127.4	81%	0.813	69%	0.687	S	S	*	*			trans	-164	45.4	157.6	-109.4	159.8	36.8	0	0	113.5	V444	Q442-V444 HydrophobicContact CG-CG2 4.32Å; Q442-V444 PolarHBondContact O-N 2.98Å
443	I	26.4	Very low	31.9	Very low	180 Å²	180	132.3 Å²	132.3	92%	0.923	72%	0.719	S	S	*	*			trans	-84.9	66.5	146.2	-51.6	174.3	0	0	0	105.6
444	V	26.3	Very low	30.3	Very low	106 Å²	106	133.3 Å²	133.3	64%	0.642	73%	0.728	S	S	*	*			trans	-92.9	115.3	168	178.5	0	0	0	0	105.7	Q442	Q442-V444 HydrophobicContact CG-CG2 4.32Å; Q442-V444 PolarHBondContact O-N 2.98Å
445	S	25.2	Very low	29.1	Very low	87 Å²	87	135.1 Å²	135.1	61%	0.608	74%	0.736	S	S	*	*			trans	-44	144.9	173.6	57.6	0	0	0	0	111.7	V447	S445-V447 PolarHBondContact O-N 2.81Å
446	P	25.8	Very low	28.3	Very low	127 Å²	127	139.7 Å²	139.7	83%	0.825	76%	0.759	S	S	*	*			trans	-61.6	102.9	-170.3	25.1	-33.1	0	0	0	111	Q448	P446-Q448 PolarHBondContact O-N 2.86Å
447	V	27.8	Very low	27.6	Very low	108 Å²	108	141.6 Å²	141.6	66%	0.655	77%	0.766	S	S	*	*			trans	-76.9	111	168.5	177.7	0	0	0	0	106.9	S445 I449	S445-V447 PolarHBondContact O-N 2.81Å; V447-I449 HydrophobicContact CG1-CG1 4.31Å; V447-I449 PolarHBondContact O-N 3.32Å
448	Q	26.5	Very low	27	Very low	163 Å²	163	145.8 Å²	145.8	76%	0.762	78%	0.783	S	S	*	*			trans	-61.8	94.5	175.4	-68.6	170.3	-40.5	0	0	109.7	P446	P446-Q448 PolarHBondContact O-N 2.86Å
449	I	26.3	Very low	26.8	Very low	153 Å²	153	147 Å²	147	79%	0.785	78%	0.782	S	S	*	*			trans	-91.3	108.8	171.6	-59.5	174.9	0	0	0	107.6	V447 A451	V447-I449 HydrophobicContact CG1-CG1 4.31Å; V447-I449 PolarHBondContact O-N 3.32Å; I449-A451 PolarHBondContact O-N 2.68Å
450	Y	26.7	Very low	26.5	Very low	194 Å²	194	146.7 Å²	146.7	76%	0.761	78%	0.781	S	S	*	*			trans	-55.6	119.3	170.6	-69.4	-88.5	0	0	0	109.9	T452	Y450-T452 PolarHBondContact O-N 2.95Å
451	A	23.2	Very low	26.3	Very low	94 Å²	94	146.5 Å²	146.5	78%	0.777	78%	0.78	S	S	*	*			trans	-69	116	169.7	0	0	0	0	0	109.4	I449	I449-A451 PolarHBondContact O-N 2.68Å
452	T	26.8	Very low	26.1	Very low	136 Å²	136	148.5 Å²	148.5	83%	0.834	79%	0.787	S	S	*	*			trans	-105.4	107.9	157	48.5	0	0	0	0	108.5	Y450	Y450-T452 PolarHBondContact O-N 2.95Å
453	P	26.2	Very low	25.6	Very low	108 Å²	108	146.6 Å²	146.6	70%	0.701	79%	0.787	S	S	*	*			trans	-84.7	122.8	-178.8	31.6	-28.8	0	0	0	109.3
454	N	27.9	Very low	25.6	Very low	148 Å²	148	145.6 Å²	145.6	79%	0.791	78%	0.783	S	S	*	*			trans	-152.7	97.5	159.7	-90.3	-26.9	0	0	0	111.4
455	T	27	Very low	25.5	Very low	125 Å²	125	150.2 Å²	150.2	77%	0.767	79%	0.794	S	S	*	*			trans	44.2	90.9	132.1	55.4	0	0	0	0	119.1
456	I	28.4	Very low	25.7	Very low	172 Å²	172	150.3 Å²	150.3	88%	0.882	80%	0.795	S	S	*	*			trans	-133.5	120.6	141.1	-56.7	-179.1	0	0	0	108.6
457	K	24.3	Very low	25.7	Very low	195 Å²	195	154.9 Å²	154.9	85%	0.848	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-73.1	126	-175	-73.3	171.8	174.7	174.2	0	110.3	P459	K457-P459 WeakPolarHBondContact O-CD 3.36Å
458	L	25.1	Very low	25.8	Very low	164 Å²	164	153.5 Å²	153.5	86%	0.859	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-69.2	122.6	173.5	-168.2	74.5	0	0	0	110.6
459	P	26.5	Very low	26.4	Very low	118 Å²	118	152.4 Å²	152.4	77%	0.766	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-71.4	138.2	169.2	-13.1	29.1	0	0	0	110.6	K457	K457-P459 WeakPolarHBondContact O-CD 3.36Å
460	K	25.3	Very low	27.5	Very low	184 Å²	184	150.7 Å²	150.7	80%	0.8	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-74	150.1	-176.7	-69.9	173.2	173.4	-179.5	0	112.5
461	E	22.2	Very low	29	Very low	167 Å²	167	144.5 Å²	144.5	78%	0.78	79%	0.785	S	S	*	*			trans	60.2	90.3	148.3	-73.1	170.4	145.9	0	0	117.8
462	F	23.8	Very low	30.6	Very low	216 Å²	216	145.5 Å²	145.5	95%	0.947	78%	0.777	S	S	*	*			trans	-120.7	97.7	145	-90	-89	0	0	0	109.2	L464	F462-L464 PolarHBondContact O-N 2.68Å
463	T	21	Very low	32.3	Very low	133 Å²	133	140.1 Å²	140.1	82%	0.816	75%	0.745	S	S	*	*			trans	-70.2	100.9	166.4	28.6	0	0	0	0	109.8
464	L	25.6	Very low	33.5	Very low	159 Å²	159	137.6 Å²	137.6	83%	0.832	74%	0.738	S	S	*	*			trans	-100.7	100.6	168.7	-165.1	71.2	0	0	0	109.7	F462	F462-L464 PolarHBondContact O-N 2.68Å
465	K	24.6	Very low	34.4	Very low	203 Å²	203	138.2 Å²	138.2	88%	0.883	74%	0.741	S	S	*	*			trans	-85	108.2	166.8	-71.5	178.9	177.8	177.9	0	108.7
466	S	29.6	Very low	35.1	Very low	90 Å²	90	134.1 Å²	134.1	63%	0.629	72%	0.724	S	S	*	*			trans	-164	105	150.1	47.5	0	0	0	0	110.8	S468	S466-S468 PolarHBondContact O-N 3.38Å
467	K	25.6	Very low	35.6	Very low	222 Å²	222	132.4 Å²	132.4	97%	0.965	72%	0.724	S	S	*	*			trans	-76.7	89	157.1	-74.8	178.8	174	-179.2	0	107
468	S	28.9	Very low	37	Very low	80 Å²	80	126.3 Å²	126.3	56%	0.559	70%	0.698	S	S	*	*			trans	-121.8	117.3	156.2	65.2	0	0	0	0	107.3	S466 D470	S466-S468 PolarHBondContact O-N 3.38Å; S468-D470 PolarHBondContact O-N 2.96Å; S468-D470 PolarHBondContact OG-O 2.98Å
469	S	40.1	Very low	38.6	Very low	139 Å²	139	119.8 Å²	119.8	97%	0.972	67%	0.666	S	S	*	*	S	Bend	trans	-73.4	12.5	168.5	52	0	0	0	0	112.2
470	D	49.2	Very low	40.5	Very low	117 Å²	117	114.8 Å²	114.8	63%	0.626	63%	0.632	S	S	*	*	S	Bend	trans	-124.2	120.8	-178.7	-160.7	11.4	0	0	0	107.9	S468 D472	S468-D470 PolarHBondContact O-N 2.96Å; S468-D470 PolarHBondContact OG-O 2.98Å; D470-D472 PolarHBondContact O-N 3.4Å; D470-D472 VanDerWaalsContact O-N 3.16Å
471	C	57.7	Low	42.5	Very low	65 Å²	65	108.6 Å²	108.6	44%	0.439	61%	0.61	S	S	.	*			trans	-83.4	89.2	-177.7	-173	0	0	0	0	107.6	C592	C471-C592 HydrophobicContact CB-CB 3.73Å; C471-C592 WeakPolarHBondContact CB-SG 3.19Å; C471-C592 PolarHBondContact O-SG 3.46Å; C471-C592 WeakPolarHBondContact SG-CB 3.29Å; C471-C592 CovalentContact SG-SG 2.02Å; C471-C592 PolarHBondContact SG-SG 3.34Å
472	D	57.5	Low	45	Very low	114 Å²	114	103.7 Å²	103.7	61%	0.61	59%	0.589	S	S	*	*			trans	-98.6	123.1	-177.3	-164.5	7.3	0	0	0	111.5	D470	D470-D472 PolarHBondContact O-N 3.4Å; D470-D472 VanDerWaalsContact O-N 3.16Å
473	C	61.6	Low	47.3	Very low	24 Å²	24	99.5 Å²	99.5	16%	0.162	57%	0.57	C	S	.	*			trans	-93.6	96	171.1	-95.9	0	0	0	0	107.2	N475 H551 C590 F591	C473-N475 PolarHBondContact O-N 3.21Å; C473-H551 PolarHBondContact SG-NE2 2.89Å; C473-C590 WeakPolarHBondContact CA-SG 3.38Å; C473-C590 HydrophobicContact CB-CB 4.48Å; C473-C590 WeakPolarHBondContact CB-SG 3.42Å; C473-C590 WeakPolarHBondContact SG-CB 3.4Å; C473-C590 PolarHBondContact SG-O 3.43Å; C473-C590 VanDerWaalsContact SG-O 3.33Å; C473-C590 CovalentContact SG-SG 2.05Å; C473-C590 PolarHBondContact SG-SG 3.5Å; C473-F591 PolarHBondContact SG-N 3.5Å
474	G	52.2	Low	49.6	Very low	54 Å²	54	97 Å²	97	56%	0.557	55%	0.548	S	S	*	.			trans	-39.9	136.5	-172.6	0	0	0	0	0	114.2	G476	G474-G476 PolarHBondContact O-N 2.95Å
475	N	46.3	Very low	51.9	Low	161 Å²	161	90.3 Å²	90.3	86%	0.861	51%	0.513	S	S	*	.			trans	-62.8	70.1	-172.6	-68.5	-49.8	0	0	0	113.7	C473	C473-N475 PolarHBondContact O-N 3.21Å
476	G	40.8	Very low	54.1	Low	39 Å²	39	81 Å²	81	40%	0.402	47%	0.473	S	S	.	.			trans	-86.5	156.4	166.3	0	0	0	0	0	111.1	G474 Q478	G474-G476 PolarHBondContact O-N 2.95Å; G476-Q478 VanDerWaalsContact C-N 3.32Å; G476-Q478 PolarHBondContact O-N 2.99Å
477	P	40.6	Very low	56	Low	136 Å²	136	80.1 Å²	80.1	88%	0.883	46%	0.456	S	S	*	.			trans	-65.7	91.2	169.5	27.2	-32.1	0	0	0	109.2	P479	P477-P479 WeakPolarHBondContact O-CD 3.48Å
478	Q	53.8	Low	57.6	Low	68 Å²	68	72.9 Å²	72.9	32%	0.318	43%	0.425	S	S	.	.			trans	-95.5	115.1	-173.9	-71.5	177.8	17.9	0	0	110.4	G476 L480	G476-Q478 VanDerWaalsContact C-N 3.32Å; G476-Q478 PolarHBondContact O-N 2.99Å; Q478-L480 PolarHBondContact O-N 2.93Å
479	P	57.5	Low	59.1	Low	27 Å²	27	75.5 Å²	75.5	18%	0.175	43%	0.433	C	S	.	.	S	Bend	trans	-69.2	-5.7	168.9	28.2	-32.1	0	0	0	112.5	P477 N499 M500 Y587	P477-P479 WeakPolarHBondContact O-CD 3.48Å; P479-N499 PolarHBondContact O-N 3.49Å; P479-M500 HydrophobicContact CB-CG 4.39Å; P479-Y587 HydrophobicContact CG-CD1 3.39Å; P479-Y587 HydrophobicContact CG-CD2 4.33Å; P479-Y587 HydrophobicContact CG-CE1 3.78Å; P479-Y587 HydrophobicContact CG-CG 3.66Å
480	L	65.9	Low	59.9	Low	12 Å²	12	75.3 Å²	75.3	6%	0.063	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	115.2	-179.8	-55.2	175.7	0	0	0	108.8	Q478 L496 I498 V554 V556	Q478-L480 PolarHBondContact O-N 2.93Å; L480-L496 HydrophobicContact CB-CD1 4.2Å; L480-L496 HydrophobicContact CD2-CD2 4.16Å; L480-I498 HydrophobicContact CD2-CB 4.33Å; L480-I498 HydrophobicContact CD2-CD1 4.31Å; L480-I498 HydrophobicContact CD2-CG1 3.81Å; L480-I498 HydrophobicContact CD2-CG2 3.95Å; L480-V554 HydrophobicContact CD1-CB 4.3Å; L480-V554 HydrophobicContact CD1-CG1 4.1Å; L480-V556 HydrophobicContact CD1-CG2 4.15Å; L480-V556 HydrophobicContact CD2-CG2 3.66Å
481	V	69.2	Low	60.8	Low	55 Å²	55	74 Å²	74	33%	0.333	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	111.4	179.1	-178.1	0	0	0	0	108.9	K483 Q497	V481-K483 PolarHBondContact O-N 2.86Å; V481-Q497 HydrophobicContact CB-CB 4.42Å; V481-Q497 PolarHBondContact N-O 3.35Å; V481-Q497 PolarHBondContact O-N 3.34Å
482	L	73.2	Confident	61.6	Low	64 Å²	64	71 Å²	71	34%	0.335	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	121.4	171.8	-179.4	70.9	0	0	0	109.5	I485 A494 L496 F591	L482-I485 HydrophobicContact CD1-CD1 4.49Å; L482-I485 HydrophobicContact CD1-CG1 4.11Å; L482-I485 HydrophobicContact CD2-CD1 3.75Å; L482-I485 HydrophobicContact CD2-CG1 4.02Å; L482-I485 HydrophobicContact CG-CG1 4.48Å; L482-A494 HydrophobicContact CD1-CB 3.92Å; L482-L496 HydrophobicContact CB-CD1 4.45Å; L482-F591 HydrophobicContact CD1-CD2 4.33Å; L482-F591 HydrophobicContact CD1-CG 4.47Å; L482-F591 HydrophobicContact CD2-CB 3.95Å; L482-F591 HydrophobicContact CD2-CD2 4.18Å; L482-F591 HydrophobicContact CD2-CG 4.36Å
483	K	72.2	Confident	62.5	Low	127 Å²	127	66.6 Å²	66.6	55%	0.552	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	-53.2	-178.5	-77.4	-69.6	-173.5	179.6	0	113.3	V481 I495 Q497	V481-K483 PolarHBondContact O-N 2.86Å; K483-I495 HydrophobicContact CB-CB 4.19Å; K483-I495 HydrophobicContact CB-CG2 4.17Å; K483-I495 PolarHBondContact N-O 3.41Å; K483-Q497 HydrophobicContact CG-CB 4.22Å
484	K	69	Low	63.3	Low	80 Å²	80	65.5 Å²	65.5	35%	0.348	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	147.3	-178.3	-177.7	171.3	178.6	178	0	110.2	I495	K484-I495 PolarHBondContact O-N 2.83Å
485	I	75.6	Confident	64.5	Low	20 Å²	20	64.9 Å²	64.9	10%	0.103	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	133.9	167.7	-60.3	174.7	0	0	0	107.7	L482 L492 K493 A494 F591 C592 T593 P594	L482-I485 HydrophobicContact CD1-CD1 4.49Å; L482-I485 HydrophobicContact CD1-CG1 4.11Å; L482-I485 HydrophobicContact CD2-CD1 3.75Å; L482-I485 HydrophobicContact CD2-CG1 4.02Å; L482-I485 HydrophobicContact CG-CG1 4.48Å; I485-L492 HydrophobicContact CG2-CD1 3.62Å; I485-L492 HydrophobicContact CG2-CD2 4.36Å; I485-L492 HydrophobicContact CG2-CG 3.97Å; I485-K493 WeakPolarHBondContact CA-O 3.2Å; I485-A494 HydrophobicContact CG1-CB 3.97Å; I485-F591 HydrophobicContact CD1-CD2 4.13Å; I485-F591 HydrophobicContact CD1-CE2 4.38Å; I485-C592 WeakPolarHBondContact CD1-O 3.28Å; I485-T593 HydrophobicContact CD1-CG2 4.18Å; I485-P594 HydrophobicContact CG2-CG 4.43Å
486	F	70.7	Confident	65.9	Low	7 Å²	7	57.4 Å²	57.4	3%	0.031	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	154	-172.8	65	-77	0	0	0	110.2	E488 K493 I495 I542	F486-E488 HydrophobicContact CD2-CB 3.83Å; F486-E488 HydrophobicContact CE2-CB 3.77Å; F486-E488 HydrophobicContact CE2-CG 4.46Å; F486-K493 HydrophobicContact CD1-CB 4.25Å; F486-K493 WeakPolarHBondContact CD1-O 3.34Å; F486-K493 HydrophobicContact CD2-CB 4.4Å; F486-K493 HydrophobicContact CE1-CB 3.66Å; F486-K493 HydrophobicContact CE2-CB 3.88Å; F486-K493 HydrophobicContact CE2-CD 3.95Å; F486-K493 HydrophobicContact CE2-CG 4.39Å; F486-K493 HydrophobicContact CZ-CB 3.48Å; F486-K493 VanDerWaalsContact CZ-CB 3.48Å; F486-K493 HydrophobicContact CZ-CD 3.9Å; F486-K493 HydrophobicContact CZ-CG 4.3Å; F486-K493 PolarHBondContact N-O 3.08Å; F486-K493 PolarHBondContact O-N 2.88Å; F486-K493 VanDerWaalsContact O-O 3.1Å; F486-I495 HydrophobicContact CD1-CD1 4.32Å; F486-I495 HydrophobicContact CD1-CG1 4.02Å; F486-I495 HydrophobicContact CE1-CD1 3.89Å; F486-I495 HydrophobicContact CE1-CG1 3.42Å; F486-I495 VanDerWaalsContact CE1-CG1 3.42Å; F486-I495 HydrophobicContact CZ-CG1 4.34Å; F486-I542 HydrophobicContact CZ-CG2 4.21Å
487	Y	68	Low	67.6	Low	72 Å²	72	57.4 Å²	57.4	28%	0.282	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.7	177.8	-168.4	-106.3	0	0	0	108.6	H490 L492 F548 N601	Y487-H490 VanDerWaalsContact OH-CA 3.31Å; Y487-H490 WeakPolarHBondContact OH-CA 3.48Å; Y487-H490 PolarHBondContact OH-O 2.85Å; Y487-L492 HydrophobicContact CD2-CB 4.24Å; Y487-L492 HydrophobicContact CD2-CD1 4.35Å; Y487-F548 HydrophobicContact CD2-CE1 4.31Å; Y487-F548 HydrophobicContact CD2-CE2 4.22Å; Y487-F548 AromaticContact CD2-CZ 3.48Å; Y487-F548 HydrophobicContact CD2-CZ 3.48Å; Y487-F548 VanDerWaalsContact CD2-CZ 3.48Å; Y487-F548 AromaticContact CE2-CE2 3.97Å; Y487-F548 HydrophobicContact CE2-CE2 3.97Å; Y487-F548 AromaticContact CE2-CZ 3.66Å; Y487-F548 HydrophobicContact CE2-CZ 3.66Å; Y487-F548 HydrophobicContact CG-CZ 4.21Å; Y487-N601 PolarHBondContact O-OD1 2.81Å
488	E	59.3	Low	69.1	Low	69 Å²	69	51.2 Å²	51.2	32%	0.322	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	132.9	-175	-176.8	-174.6	-116.4	0	0	109	F486 H490 K491 K493	F486-E488 HydrophobicContact CD2-CB 3.83Å; F486-E488 HydrophobicContact CE2-CB 3.77Å; F486-E488 HydrophobicContact CE2-CG 4.46Å; E488-H490 VanDerWaalsContact C-N 3.31Å; E488-H490 PolarHBondContact O-N 2.85Å; E488-K491 PolarHBondContact N-O 2.85Å; E488-K491 PolarHBondContact O-N 2.86Å; E488-K493 IonicContact OE2-NZ 3.36Å; E488-K493 PolarHBondContact OE2-NZ 3.5Å
489	N	60.4	Low	69.7	Low	135 Å²	135	51.8 Å²	51.8	72%	0.722	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	46.2	178.3	-61.2	9.8	0	0	0	113.7	K491	N489-K491 PolarHBondContact O-N 2.63Å; N489-K491 VanDerWaalsContact O-N 3.15Å
490	H	57.4	Low	69.6	Low	135 Å²	135	52.5 Å²	52.5	63%	0.625	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	11.5	-178.6	-54.4	-71.1	0	0	0	115.8	Y487 E488	Y487-H490 VanDerWaalsContact OH-CA 3.31Å; Y487-H490 WeakPolarHBondContact OH-CA 3.48Å; Y487-H490 PolarHBondContact OH-O 2.85Å; E488-H490 VanDerWaalsContact C-N 3.31Å; E488-H490 PolarHBondContact O-N 2.85Å
491	K	69.2	Low	69	Low	89 Å²	89	58.9 Å²	58.9	39%	0.387	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	135.9	177	-65.4	-172.4	179.6	-168.1	0	110.3	E488 N489 N545	E488-K491 PolarHBondContact N-O 2.85Å; E488-K491 PolarHBondContact O-N 2.86Å; N489-K491 PolarHBondContact O-N 2.63Å; N489-K491 VanDerWaalsContact O-N 3.15Å; K491-N545 PolarHBondContact NZ-OD1 3.48Å
492	L	73.4	Confident	68.3	Low	3 Å²	3	58.6 Å²	58.6	2%	0.016	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	126.7	168	-171.3	67.8	0	0	0	108.5	I485 Y487 L546 H547 F548 T593 V599	I485-L492 HydrophobicContact CG2-CD1 3.62Å; I485-L492 HydrophobicContact CG2-CD2 4.36Å; I485-L492 HydrophobicContact CG2-CG 3.97Å; Y487-L492 HydrophobicContact CD2-CB 4.24Å; Y487-L492 HydrophobicContact CD2-CD1 4.35Å; L492-L546 HydrophobicContact CB-CB 4.04Å; L492-L546 WeakPolarHBondContact CB-O 3.31Å; L492-L546 HydrophobicContact CD2-CB 4.01Å; L492-L546 HydrophobicContact CG-CB 4.1Å; L492-L546 WeakPolarHBondContact O-CB 3.48Å; L492-L546 PolarHBondContact O-N 3.33Å; L492-H547 WeakPolarHBondContact CD2-O 3.44Å; L492-F548 HydrophobicContact CD1-CD1 4.11Å; L492-F548 HydrophobicContact CD1-CE1 3.67Å; L492-F548 HydrophobicContact CD1-CZ 4.2Å; L492-F548 HydrophobicContact CD2-CD1 3.98Å; L492-F548 HydrophobicContact CD2-CE1 4.3Å; L492-F548 HydrophobicContact CD2-CG 4.25Å; L492-F548 HydrophobicContact CG-CE1 4.48Å; L492-T593 HydrophobicContact CD2-CG2 3.86Å; L492-V599 HydrophobicContact CD1-CG1 4.13Å; L492-V599 HydrophobicContact CD1-CG2 3.98Å
493	K	76.9	Confident	67.1	Low	22 Å²	22	65.8 Å²	65.8	10%	0.096	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	149	-178.1	-57.8	-171.9	-171	-177.3	0	111	I485 F486 E488 I542 L543 E544	I485-K493 WeakPolarHBondContact CA-O 3.2Å; F486-K493 HydrophobicContact CD1-CB 4.25Å; F486-K493 WeakPolarHBondContact CD1-O 3.34Å; F486-K493 HydrophobicContact CD2-CB 4.4Å; F486-K493 HydrophobicContact CE1-CB 3.66Å; F486-K493 HydrophobicContact CE2-CB 3.88Å; F486-K493 HydrophobicContact CE2-CD 3.95Å; F486-K493 HydrophobicContact CE2-CG 4.39Å; F486-K493 HydrophobicContact CZ-CB 3.48Å; F486-K493 VanDerWaalsContact CZ-CB 3.48Å; F486-K493 HydrophobicContact CZ-CD 3.9Å; F486-K493 HydrophobicContact CZ-CG 4.3Å; F486-K493 PolarHBondContact N-O 3.08Å; F486-K493 PolarHBondContact O-N 2.88Å; F486-K493 VanDerWaalsContact O-O 3.1Å; E488-K493 IonicContact OE2-NZ 3.36Å; E488-K493 PolarHBondContact OE2-NZ 3.5Å; K493-I542 HydrophobicContact CB-CG2 4.04Å; K493-I542 HydrophobicContact CD-CG2 3.98Å; K493-I542 HydrophobicContact CG-CG2 4.46Å; K493-L543 CarbonylContact C-O 3.54Å; K493-L543 WeakPolarHBondContact CA-O 3.47Å; K493-E544 HydrophobicContact CD-CG 4.11Å; K493-E544 WeakPolarHBondContact CE-OE1 3.29Å; K493-E544 HydrophobicContact CG-CG 4.11Å; K493-E544 IonicContact NZ-OE1 3.93Å; K493-E544 PolarHBondContact NZ-OE1 3.02Å
494	A	78.7	Confident	66.3	Low	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	134	177.7	0	0	0	0	0	110.7	L482 I485 I542 L543 L546 F591	L482-A494 HydrophobicContact CD1-CB 3.92Å; I485-A494 HydrophobicContact CG1-CB 3.97Å; A494-I542 CarbonylContact O-C 3.51Å; A494-I542 WeakPolarHBondContact O-CA 3.45Å; A494-L543 HydrophobicContact CB-CB 4.3Å; A494-L543 HydrophobicContact CB-CD1 4.49Å; A494-L543 PolarHBondContact N-O 3.06Å; A494-L543 PolarHBondContact O-N 2.93Å; A494-L546 HydrophobicContact CB-CD1 3.52Å; A494-F591 HydrophobicContact CB-CE2 4.06Å; A494-F591 HydrophobicContact CB-CZ 4.28Å
495	I	76.7	Confident	65.8	Low	41 Å²	41	65.2 Å²	65.2	21%	0.21	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	111.6	174.5	-51.5	-175	0	0	0	108.3	K483 K484 F486 I540	K483-I495 HydrophobicContact CB-CB 4.19Å; K483-I495 HydrophobicContact CB-CG2 4.17Å; K483-I495 PolarHBondContact N-O 3.41Å; K484-I495 PolarHBondContact O-N 2.83Å; F486-I495 HydrophobicContact CD1-CD1 4.32Å; F486-I495 HydrophobicContact CD1-CG1 4.02Å; F486-I495 HydrophobicContact CE1-CD1 3.89Å; F486-I495 HydrophobicContact CE1-CG1 3.42Å; F486-I495 VanDerWaalsContact CE1-CG1 3.42Å; F486-I495 HydrophobicContact CZ-CG1 4.34Å; I495-I540 HydrophobicContact CG2-CG2 3.4Å
496	L	76.7	Confident	65.1	Low	5 Å²	5	64.3 Å²	64.3	3%	0.026	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	123.4	177.3	-169.5	75	0	0	0	109.6	L480 L482 I540 V541 L543 V554	L480-L496 HydrophobicContact CB-CD1 4.2Å; L480-L496 HydrophobicContact CD2-CD2 4.16Å; L482-L496 HydrophobicContact CB-CD1 4.45Å; L496-I540 WeakPolarHBondContact O-CA 3.47Å; L496-V541 HydrophobicContact CB-CG1 3.73Å; L496-V541 HydrophobicContact CD2-CG1 4.22Å; L496-V541 HydrophobicContact CG-CG1 4.44Å; L496-V541 PolarHBondContact N-O 3.2Å; L496-V541 PolarHBondContact O-N 2.66Å; L496-L543 HydrophobicContact CB-CD1 4.26Å; L496-L543 HydrophobicContact CB-CG 4.39Å; L496-L543 HydrophobicContact CD2-CD1 4.31Å; L496-V554 HydrophobicContact CD2-CG1 4Å
497	Q	76.3	Confident	65	Low	39 Å²	39	64 Å²	64	18%	0.182	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130.9	172.7	179	175.3	-19	0	0	109.7	V481 K483 N499 K539 I540	V481-Q497 HydrophobicContact CB-CB 4.42Å; V481-Q497 PolarHBondContact N-O 3.35Å; V481-Q497 PolarHBondContact O-N 3.34Å; K483-Q497 HydrophobicContact CG-CB 4.22Å; Q497-N499 PolarHBondContact NE2-OD1 2.71Å; Q497-K539 CarbonylContact C-O 3.56Å; Q497-K539 WeakPolarHBondContact CA-O 3.33Å; Q497-I540 HydrophobicContact CB-CG1 4.42Å; Q497-I540 HydrophobicContact CG-CG1 4.36Å
498	I	71.5	Confident	65.1	Low	5 Å²	5	60.9 Å²	60.9	3%	0.026	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	106.3	-178.1	-51.4	179.4	0	0	0	108.4	L480 M500 I510 L534 K539 V541 V556	L480-I498 HydrophobicContact CD2-CB 4.33Å; L480-I498 HydrophobicContact CD2-CD1 4.31Å; L480-I498 HydrophobicContact CD2-CG1 3.81Å; L480-I498 HydrophobicContact CD2-CG2 3.95Å; I498-M500 HydrophobicContact CB-CE 4.5Å; I498-M500 HydrophobicContact CG2-CE 3.34Å; I498-M500 HydrophobicContact CG2-CG 3.73Å; I498-M500 HydrophobicContact CG2-SD 3.6Å; I498-M500 VanDerWaalsContact CG2-SD 3.6Å; I498-M500 PolarHBondContact O-N 3.21Å; I498-I510 HydrophobicContact CD1-CD1 3.42Å; I498-I510 VanDerWaalsContact CD1-CD1 3.42Å; I498-I510 HydrophobicContact CD1-CG1 3.89Å; I498-L534 HydrophobicContact CD1-CD2 4.1Å; I498-K539 PolarHBondContact N-O 3.31Å; I498-V541 HydrophobicContact CD1-CG1 4.33Å; I498-V556 HydrophobicContact CD1-CG2 4.37Å
499	N	65.8	Low	66.1	Low	81 Å²	81	58.2 Å²	58.2	43%	0.433	29%	0.293	S	S	.	.			trans	-93.5	85.9	179.3	-73.6	-18.4	0	0	0	110	P479 Q497	P479-N499 PolarHBondContact O-N 3.49Å; Q497-N499 PolarHBondContact NE2-OD1 2.71Å
500	M	56.7	Low	66.9	Low	41 Å²	41	51.8 Å²	51.8	20%	0.202	26%	0.259	C	S	.	.			trans	-119.5	142.6	175.1	-64.8	175	-47.8	0	0	110.6	P479 I498 I502 A508 V558 Y587	P479-M500 HydrophobicContact CB-CG 4.39Å; I498-M500 HydrophobicContact CB-CE 4.5Å; I498-M500 HydrophobicContact CG2-CE 3.34Å; I498-M500 HydrophobicContact CG2-CG 3.73Å; I498-M500 HydrophobicContact CG2-SD 3.6Å; I498-M500 VanDerWaalsContact CG2-SD 3.6Å; I498-M500 PolarHBondContact O-N 3.21Å; M500-I502 HydrophobicContact CB-CD1 4.03Å; M500-I502 HydrophobicContact CB-CG1 4.14Å; M500-I502 HydrophobicContact CE-CD1 3.93Å; M500-I502 HydrophobicContact SD-CD1 4.33Å; M500-A508 HydrophobicContact CE-CB 4.46Å; M500-V558 HydrophobicContact CE-CG2 3.76Å; M500-V558 HydrophobicContact SD-CG2 3.69Å; M500-Y587 HydrophobicContact CG-CD2 4.47Å; M500-Y587 HydrophobicContact CG-CE2 3.95Å; M500-Y587 HydrophobicContact SD-CD2 3.62Å; M500-Y587 HydrophobicContact SD-CE2 3.41Å; M500-Y587 WeakPolarHBondContact SD-CE2 3.2Å
501	T	53.1	Low	68	Low	147 Å²	147	46.8 Å²	46.8	90%	0.902	24%	0.236	S	C	*	.			trans	-105	77.2	177.4	-21.7	0	0	0	0	108.8
502	I	53.2	Low	68.6	Low	48 Å²	48	43.2 Å²	43.2	25%	0.246	22%	0.22	C	C	.	.			trans	-101.4	121.4	179.8	-54.5	160.7	0	0	0	108.3	M500 T504 S506 V558	M500-I502 HydrophobicContact CB-CD1 4.03Å; M500-I502 HydrophobicContact CB-CG1 4.14Å; M500-I502 HydrophobicContact CE-CD1 3.93Å; M500-I502 HydrophobicContact SD-CD1 4.33Å; I502-T504 VanDerWaalsContact C-N 3.27Å; I502-T504 PolarHBondContact O-N 2.97Å; I502-S506 WeakPolarHBondContact CG2-OG 3.14Å; I502-V558 HydrophobicContact CD1-CB 4.22Å; I502-V558 HydrophobicContact CD1-CG1 3.36Å; I502-V558 HydrophobicContact CD1-CG2 4.16Å
503	K	49	Very low	68.6	Low	216 Å²	216	46.6 Å²	46.6	94%	0.939	23%	0.233	S	C	*	.	S	Bend	trans	-74.3	-17	-175.1	-67.5	-175.4	177.7	-179	0	113.5
504	T	55.5	Low	68.5	Low	76 Å²	76	47.5 Å²	47.5	47%	0.466	24%	0.239	S	C	.	.	S	Bend	trans	-113.3	154.2	-177.6	53.2	0	0	0	0	111.5	I502 S506	I502-T504 VanDerWaalsContact C-N 3.27Å; I502-T504 PolarHBondContact O-N 2.97Å; T504-S506 PolarHBondContact O-N 3.2Å; T504-S506 VanDerWaalsContact O-N 3.08Å; T504-S506 PolarHBondContact O-OG 3.04Å
505	E	58.7	Low	68	Low	118 Å²	118	52.8 Å²	52.8	55%	0.551	26%	0.264	S	S	*	.			trans	-62.3	114.1	169.5	-69.1	-160.7	152.6	0	0	109.2	K537 T562	E505-K537 IonicContact OE1-NZ 2.79Å; E505-T562 HydrophobicContact CB-CG2 4.01Å
506	S	60.6	Low	67.7	Low	2 Å²	2	55.1 Å²	55.1	1%	0.014	28%	0.279	C	S	.	.			trans	-125.1	158.8	-175.2	45.1	0	0	0	0	110.5	I502 T504 S536 Y559	I502-S506 WeakPolarHBondContact CG2-OG 3.14Å; T504-S506 PolarHBondContact O-N 3.2Å; T504-S506 VanDerWaalsContact O-N 3.08Å; T504-S506 PolarHBondContact O-OG 3.04Å; S506-S536 WeakPolarHBondContact O-CB 3.48Å; S506-S536 PolarHBondContact O-N 2.98Å; S506-S536 WeakPolarHBondContact OG-CB 3.3Å; S506-S536 PolarHBondContact OG-OG 2.7Å; S506-Y559 WeakPolarHBondContact CA-O 3.23Å; S506-Y559 WeakPolarHBondContact CB-O 3.46Å
507	T	67.3	Low	67.2	Low	1 Å²	1	56 Å²	56	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	128.7	170.4	41.7	0	0	0	0	109	L534 K535 Y559 A561 L563	T507-L534 WeakPolarHBondContact CA-O 3.29Å; T507-K535 HydrophobicContact CG2-CG 4.42Å; T507-Y559 PolarHBondContact N-O 2.9Å; T507-Y559 VanDerWaalsContact N-O 3.09Å; T507-Y559 PolarHBondContact O-N 3.41Å; T507-A561 PolarHBondContact N-O 3.41Å; T507-A561 PolarHBondContact OG1-O 3.03Å; T507-L563 PolarHBondContact OG1-N 3.43Å
508	A	72	Confident	66.6	Low	5 Å²	5	59.3 Å²	59.3	4%	0.041	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.5	178.2	0	0	0	0	0	109.5	M500 L534 V556 R557 V558	M500-A508 HydrophobicContact CE-CB 4.46Å; A508-L534 HydrophobicContact CB-CB 4.39Å; A508-L534 PolarHBondContact N-O 3.37Å; A508-L534 PolarHBondContact O-N 3.06Å; A508-V556 HydrophobicContact CB-CG1 4.07Å; A508-R557 CarbonylContact C-O 3.59Å; A508-R557 VanDerWaalsContact CA-O 3.32Å; A508-R557 WeakPolarHBondContact CA-O 3.44Å; A508-V558 HydrophobicContact CB-CG2 4.2Å
509	L	78.6	Confident	65.6	Low	13 Å²	13	65.5 Å²	65.5	7%	0.068	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	116.8	169.8	178.3	67.2	0	0	0	108.7	Q511 L533 V556 R557 Y559 I568	L509-Q511 HydrophobicContact CD2-CG 4.44Å; L509-Q511 HydrophobicContact CG-CG 4.16Å; L509-L533 HydrophobicContact CB-CD1 4.17Å; L509-L533 HydrophobicContact CD1-CD1 4.09Å; L509-V556 CarbonylContact O-C 3.54Å; L509-V556 WeakPolarHBondContact O-CA 3.3Å; L509-R557 PolarHBondContact N-O 2.9Å; L509-R557 PolarHBondContact O-N 2.92Å; L509-Y559 HydrophobicContact CB-CE2 4.18Å; L509-I568 HydrophobicContact CD2-CG2 4.26Å
510	I	78.9	Confident	65	Low	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	123.4	-177.9	-59	151.2	0	0	0	107.9	I498 T531 I532 L534 V541 L543 V554 R555 V556	I498-I510 HydrophobicContact CD1-CD1 3.42Å; I498-I510 VanDerWaalsContact CD1-CD1 3.42Å; I498-I510 HydrophobicContact CD1-CG1 3.89Å; I510-T531 CarbonylContact O-C 3.57Å; I510-T531 VanDerWaalsContact O-CA 3.3Å; I510-T531 WeakPolarHBondContact O-CA 3.38Å; I510-I532 HydrophobicContact CB-CG2 3.83Å; I510-I532 HydrophobicContact CD1-CG2 4.22Å; I510-I532 HydrophobicContact CG2-CG2 4.3Å; I510-I532 PolarHBondContact N-O 3.45Å; I510-I532 PolarHBondContact O-N 3.44Å; I510-L534 HydrophobicContact CD1-CB 3.78Å; I510-L534 HydrophobicContact CD1-CD2 3.85Å; I510-L534 HydrophobicContact CD1-CG 4.35Å; I510-V541 HydrophobicContact CD1-CB 4.15Å; I510-V541 HydrophobicContact CD1-CG1 4.05Å; I510-V541 HydrophobicContact CD1-CG2 4.12Å; I510-L543 HydrophobicContact CG2-CD2 4.31Å; I510-V554 HydrophobicContact CG2-CG1 4.07Å; I510-R555 WeakPolarHBondContact CA-O 3.3Å; I510-V556 HydrophobicContact CB-CG2 4.48Å; I510-V556 HydrophobicContact CG1-CB 4.47Å; I510-V556 HydrophobicContact CG1-CG1 4.01Å; I510-V556 HydrophobicContact CG1-CG2 3.95Å; I510-V556 HydrophobicContact CG2-CG2 4.27Å
511	Q	79.7	Confident	64.5	Low	30 Å²	30	70.8 Å²	70.8	14%	0.14	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	130.1	179.6	-50.5	-174.1	-59.2	0	0	109.2	L509 S530 T531 V554 R555	L509-Q511 HydrophobicContact CD2-CG 4.44Å; L509-Q511 HydrophobicContact CG-CG 4.16Å; Q511-S530 CarbonylContact C-O 3.52Å; Q511-S530 VanDerWaalsContact CA-O 3.29Å; Q511-S530 WeakPolarHBondContact CA-O 3.16Å; Q511-T531 HydrophobicContact CB-CG2 4.1Å; Q511-T531 HydrophobicContact CG-CG2 3.64Å; Q511-V554 CarbonylContact O-C 3.51Å; Q511-V554 WeakPolarHBondContact O-CA 3.29Å; Q511-R555 PolarHBondContact N-O 2.71Å; Q511-R555 PolarHBondContact O-N 3.11Å
512	W	81	Confident	64	Low	15 Å²	15	70 Å²	70	6%	0.057	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	140.1	174.4	67.2	100.1	0	0	0	111.7	P529 S530 I532 L543 E544 G553 V554	W512-P529 WeakPolarHBondContact O-CA 3.32Å; W512-S530 VanDerWaalsContact CE3-O 3.3Å; W512-S530 PolarHBondContact N-O 2.96Å; W512-S530 PolarHBondContact O-N 3.08Å; W512-I532 HydrophobicContact CH2-CB 4.28Å; W512-I532 HydrophobicContact CH2-CG2 4.34Å; W512-I532 HydrophobicContact CZ3-CB 3.95Å; W512-I532 HydrophobicContact CZ3-CG2 3.66Å; W512-L543 HydrophobicContact CD2-CB 4.34Å; W512-L543 HydrophobicContact CD2-CD2 3.98Å; W512-L543 HydrophobicContact CE3-CD2 3.67Å; W512-L543 HydrophobicContact CH2-CD2 4.42Å; W512-L543 HydrophobicContact CZ2-CB 4.41Å; W512-L543 HydrophobicContact CZ3-CD2 3.92Å; W512-E544 WeakPolarHBondContact CZ2-O 3.12Å; W512-E544 PolarHBondContact NE1-O 3.34Å; W512-G553 VanDerWaalsContact CA-O 3.24Å; W512-G553 WeakPolarHBondContact CA-O 3.3Å; W512-V554 HydrophobicContact CB-CG2 4.16Å
513	Y	74.6	Confident	63.5	Low	74 Å²	74	73.1 Å²	73.1	29%	0.29	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	147.2	-178	54.4	-88.2	0	0	0	111.1	Y552 G553	Y513-Y552 WeakPolarHBondContact O-CA 3.19Å; Y513-Y552 WeakPolarHBondContact O-CD1 3.46Å; Y513-G553 PolarHBondContact N-O 2.83Å; Y513-G553 PolarHBondContact O-N 2.93Å
514	L	74.8	Confident	63.2	Low	41 Å²	41	69.4 Å²	69.4	22%	0.215	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	130.9	176.7	-180	66.1	0	0	0	109.8	C517 C550 Y552	L514-C517 VanDerWaalsContact CD1-SG 3.55Å; L514-C550 HydrophobicContact CD1-CB 3.55Å; L514-Y552 HydrophobicContact CB-CD1 4.41Å; L514-Y552 HydrophobicContact CB-CE1 3.87Å; L514-Y552 HydrophobicContact CD1-CD2 4.31Å; L514-Y552 HydrophobicContact CD1-CE1 4.05Å; L514-Y552 HydrophobicContact CD1-CE2 3.76Å
515	Q	68.5	Low	62.7	Low	111 Å²	111	72.2 Å²	72.2	52%	0.519	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-50	178.4	-166.9	170.4	-2.1	0	0	112	H551	Q515-H551 WeakPolarHBondContact CB-O 3.1Å; Q515-H551 PolarHBondContact N-O 3.29Å; Q515-H551 PolarHBondContact OE1-CE1 2.92Å; Q515-H551 PolarHBondContact OE1-ND1 2.94Å
516	V	69.2	Low	61.9	Low	90 Å²	90	73.7 Å²	73.7	55%	0.545	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	152.3	178.4	61.7	0	0	0	0	110.7	C550 H551	V516-C550 CarbonylContact O-C 3.6Å; V516-C550 WeakPolarHBondContact O-CA 3.49Å; V516-H551 HydrophobicContact CG1-CB 3.85Å; V516-H551 PolarHBondContact N-O 2.99Å; V516-H551 PolarHBondContact O-N 2.8Å
517	C	67.2	Low	61.6	Low	22 Å²	22	76 Å²	76	15%	0.149	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	148.6	170.3	-59.1	0	0	0	0	110.8	L514 D519 C550	L514-C517 VanDerWaalsContact CD1-SG 3.55Å; C517-D519 VanDerWaalsContact C-N 3.32Å; C517-D519 PolarHBondContact O-N 2.98Å; C517-C550 HydrophobicContact CB-CB 4.05Å; C517-C550 WeakPolarHBondContact CB-SG 3.34Å; C517-C550 WeakPolarHBondContact SG-CB 3.44Å; C517-C550 CovalentContact SG-SG 2.04Å; C517-C550 PolarHBondContact SG-SG 3.09Å
518	V	63	Low	61.2	Low	110 Å²	110	83.3 Å²	83.3	67%	0.667	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-33.9	-178.7	176.1	0	0	0	0	112.1	N549	V518-N549 PolarHBondContact N-O 2.66Å
519	D	51.5	Low	60.9	Low	135 Å²	135	86.4 Å²	86.4	72%	0.722	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	8.4	-171.3	-65.2	-49.1	0	0	0	114.8	C517 N549	C517-D519 VanDerWaalsContact C-N 3.32Å; C517-D519 PolarHBondContact O-N 2.98Å; D519-N549 PolarHBondContact OD2-ND2 2.93Å; D519-N549 VanDerWaalsContact OD2-ND2 3.12Å
520	S	52.5	Low	60.7	Low	57 Å²	57	87.3 Å²	87.3	40%	0.399	48%	0.48	S	S	.	.			trans	-106.5	99.6	179.1	72.1	0	0	0	0	112	N522	S520-N522 PolarHBondContact O-N 2.95Å
521	N	45.6	Very low	60.4	Low	175 Å²	175	91.1 Å²	91.1	94%	0.936	50%	0.503	S	S	*	.			trans	-70.2	4.6	158.1	-86	-17.3	0	0	0	112.6
522	N	43.5	Very low	60.2	Low	131 Å²	131	92.7 Å²	92.7	70%	0.701	51%	0.512	S	S	*	.	S	Bend	trans	-83.2	132.9	177.8	-85.7	-33.3	0	0	0	110.5	S520 I524	S520-N522 PolarHBondContact O-N 2.95Å; N522-I524 PolarHBondContact O-N 2.7Å
523	P	42.5	Very low	60	Low	113 Å²	113	94.9 Å²	94.9	73%	0.734	53%	0.525	S	S	*	.			trans	-58.3	130	172.3	27.6	-32.3	0	0	0	107.8	L525	P523-L525 PolarHBondContact O-N 2.87Å
524	I	42.4	Very low	59.6	Low	139 Å²	139	92.2 Å²	92.2	71%	0.713	52%	0.515	S	S	*	.			trans	-9.8	94.9	170.9	-55.8	164.1	0	0	0	110.5	N522 D526	N522-I524 PolarHBondContact O-N 2.7Å; I524-D526 PolarHBondContact O-N 2.89Å; I524-D526 VanDerWaalsContact O-N 3.09Å
525	L	45.4	Very low	59.4	Low	135 Å²	135	96.5 Å²	96.5	71%	0.707	53%	0.532	S	S	*	.			trans	-61.6	114.9	162.7	-167.6	75.6	0	0	0	103.6	P523 T527	P523-L525 PolarHBondContact O-N 2.87Å; L525-T527 HydrophobicContact CD2-CG2 4.27Å; L525-T527 PolarHBondContact O-N 2.93Å
526	D	41.9	Very low	58.9	Low	148 Å²	148	93.5 Å²	93.5	79%	0.791	52%	0.523	S	S	*	.			trans	-60.3	76.6	176.3	-80.9	-37.3	0	0	0	109.1	I524 L528	I524-D526 PolarHBondContact O-N 2.89Å; I524-D526 VanDerWaalsContact O-N 3.09Å; D526-L528 PolarHBondContact O-N 3.2Å; D526-L528 VanDerWaalsContact O-N 3.14Å
527	T	53.7	Low	58.6	Low	51 Å²	51	97.1 Å²	97.1	31%	0.313	53%	0.532	S	S	.	.			trans	-75.2	105.6	171.2	57.4	0	0	0	0	105.3	L525	L525-T527 HydrophobicContact CD2-CG2 4.27Å; L525-T527 PolarHBondContact O-N 2.93Å
528	L	58.3	Low	58.4	Low	154 Å²	154	100.5 Å²	100.5	81%	0.806	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-48.1	134.1	173.8	-87	114.8	0	0	0	109.7	D526 S530	D526-L528 PolarHBondContact O-N 3.2Å; D526-L528 VanDerWaalsContact O-N 3.14Å; L528-S530 PolarHBondContact O-N 3.36Å
529	P	66.2	Low	58.5	Low	71 Å²	71	101.3 Å²	101.3	46%	0.461	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-54.2	130.5	177.3	18.3	-29.3	0	0	0	109.9	W512	W512-P529 WeakPolarHBondContact O-CA 3.32Å
530	S	74.7	Confident	59.4	Low	31 Å²	31	99.3 Å²	99.3	22%	0.217	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	141.1	172.5	-68.6	0	0	0	0	109.1	Q511 W512 L528	Q511-S530 CarbonylContact C-O 3.52Å; Q511-S530 VanDerWaalsContact CA-O 3.29Å; Q511-S530 WeakPolarHBondContact CA-O 3.16Å; W512-S530 VanDerWaalsContact CE3-O 3.3Å; W512-S530 PolarHBondContact N-O 2.96Å; W512-S530 PolarHBondContact O-N 3.08Å; L528-S530 PolarHBondContact O-N 3.36Å
531	T	72.3	Confident	60.6	Low	80 Å²	80	96.8 Å²	96.8	49%	0.491	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	145.7	-175	67.6	0	0	0	0	110.8	I510 Q511	I510-T531 CarbonylContact O-C 3.57Å; I510-T531 VanDerWaalsContact O-CA 3.3Å; I510-T531 WeakPolarHBondContact O-CA 3.38Å; Q511-T531 HydrophobicContact CB-CG2 4.1Å; Q511-T531 HydrophobicContact CG-CG2 3.64Å
532	I	76.2	Confident	62.3	Low	63 Å²	63	92.2 Å²	92.2	32%	0.323	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	145	174.4	-165.3	167.3	0	0	0	109.9	I510 W512 V541	I510-I532 HydrophobicContact CB-CG2 3.83Å; I510-I532 HydrophobicContact CD1-CG2 4.22Å; I510-I532 HydrophobicContact CG2-CG2 4.3Å; I510-I532 PolarHBondContact N-O 3.45Å; I510-I532 PolarHBondContact O-N 3.44Å; W512-I532 HydrophobicContact CH2-CB 4.28Å; W512-I532 HydrophobicContact CH2-CG2 4.34Å; W512-I532 HydrophobicContact CZ3-CB 3.95Å; W512-I532 HydrophobicContact CZ3-CG2 3.66Å; I532-V541 HydrophobicContact CD1-CG2 4.02Å; I532-V541 HydrophobicContact CG2-CG2 3.63Å
533	L	75.2	Confident	64.1	Low	62 Å²	62	86 Å²	86	33%	0.325	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	130.1	177.3	-160.3	77.7	0	0	0	110.2	L509 I568	L509-L533 HydrophobicContact CB-CD1 4.17Å; L509-L533 HydrophobicContact CD1-CD1 4.09Å; L533-I568 HydrophobicContact CD1-CD1 3.15Å; L533-I568 HydrophobicContact CD2-CD1 3.85Å; L533-I568 HydrophobicContact CG-CD1 4.14Å
534	L	68.1	Low	65.8	Low	17 Å²	17	83.7 Å²	83.7	9%	0.089	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.7	-177.8	-159.3	75.5	0	0	0	110	I498 T507 A508 I510 D538 V541	I498-L534 HydrophobicContact CD1-CD2 4.1Å; T507-L534 WeakPolarHBondContact CA-O 3.29Å; A508-L534 HydrophobicContact CB-CB 4.39Å; A508-L534 PolarHBondContact N-O 3.37Å; A508-L534 PolarHBondContact O-N 3.06Å; I510-L534 HydrophobicContact CD1-CB 3.78Å; I510-L534 HydrophobicContact CD1-CD2 3.85Å; I510-L534 HydrophobicContact CD1-CG 4.35Å; L534-D538 HydrophobicContact CD1-CB 3.62Å; L534-D538 HydrophobicContact CD2-CB 4.29Å; L534-D538 WeakPolarHBondContact CD2-O 3.2Å; L534-D538 HydrophobicContact CG-CB 3.82Å; L534-V541 HydrophobicContact CD1-CB 4.33Å; L534-V541 HydrophobicContact CD1-CG2 4.43Å
535	K	69.2	Low	67.5	Low	131 Å²	131	81 Å²	81	57%	0.57	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.7	145.3	172.8	-65.5	-177.5	179.2	-176.8	0	108.9	T507 K537 D538	T507-K535 HydrophobicContact CG2-CG 4.42Å; K535-K537 PolarHBondContact O-N 3.37Å; K535-D538 PolarHBondContact O-N 3.11Å
536	S	57.9	Low	69.1	Low	48 Å²	48	75.2 Å²	75.2	34%	0.336	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-24	-174.4	-177.6	0	0	0	0	115.9	S506 D538	S506-S536 WeakPolarHBondContact O-CB 3.48Å; S506-S536 PolarHBondContact O-N 2.98Å; S506-S536 WeakPolarHBondContact OG-CB 3.3Å; S506-S536 PolarHBondContact OG-OG 2.7Å; S536-D538 VanDerWaalsContact C-N 3.35Å
537	K	63.1	Low	70.8	Confident	167 Å²	167	72.7 Å²	72.7	73%	0.726	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-30.3	176.7	-66.4	-174.7	-178.6	175.6	0	113.2	E505 K535	E505-K537 IonicContact OE1-NZ 2.79Å; K535-K537 PolarHBondContact O-N 3.37Å
538	D	63.4	Low	71.9	Confident	93 Å²	93	73.3 Å²	73.3	50%	0.497	37%	0.373	S	S	.	.			trans	-86.2	117.2	-179	-59.1	-40.5	0	0	0	109.2	L534 K535 S536	L534-D538 HydrophobicContact CD1-CB 3.62Å; L534-D538 HydrophobicContact CD2-CB 4.29Å; L534-D538 WeakPolarHBondContact CD2-O 3.2Å; L534-D538 HydrophobicContact CG-CB 3.82Å; K535-D538 PolarHBondContact O-N 3.11Å; S536-D538 VanDerWaalsContact C-N 3.35Å
539	K	65.5	Low	72.8	Confident	127 Å²	127	68.3 Å²	68.3	55%	0.552	35%	0.347	S	S	*	.			trans	-95.7	-5.7	177.8	-63.9	-170.9	180	-176.5	0	113.4	Q497 I498	Q497-K539 CarbonylContact C-O 3.56Å; Q497-K539 WeakPolarHBondContact CA-O 3.33Å; I498-K539 PolarHBondContact N-O 3.31Å
540	I	70.3	Confident	73.2	Confident	92 Å²	92	65.2 Å²	65.2	47%	0.472	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	131.9	-173.6	-59.6	176.5	0	0	0	108.4	I495 L496 Q497	I495-I540 HydrophobicContact CG2-CG2 3.4Å; L496-I540 WeakPolarHBondContact O-CA 3.47Å; Q497-I540 HydrophobicContact CB-CG1 4.42Å; Q497-I540 HydrophobicContact CG-CG1 4.36Å
541	V	78.2	Confident	73.4	Confident	5 Å²	5	65.2 Å²	65.2	3%	0.03	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	144.4	175.4	68.5	0	0	0	0	109.8	L496 I498 I510 I532 L534 L543	L496-V541 HydrophobicContact CB-CG1 3.73Å; L496-V541 HydrophobicContact CD2-CG1 4.22Å; L496-V541 HydrophobicContact CG-CG1 4.44Å; L496-V541 PolarHBondContact N-O 3.2Å; L496-V541 PolarHBondContact O-N 2.66Å; I498-V541 HydrophobicContact CD1-CG1 4.33Å; I510-V541 HydrophobicContact CD1-CB 4.15Å; I510-V541 HydrophobicContact CD1-CG1 4.05Å; I510-V541 HydrophobicContact CD1-CG2 4.12Å; I532-V541 HydrophobicContact CD1-CG2 4.02Å; I532-V541 HydrophobicContact CG2-CG2 3.63Å; L534-V541 HydrophobicContact CD1-CB 4.33Å; L534-V541 HydrophobicContact CD1-CG2 4.43Å; V541-L543 HydrophobicContact CG1-CD2 3.97Å; V541-L543 HydrophobicContact CG2-CD2 4.35Å
542	I	79.8	Confident	73.7	Confident	79 Å²	79	61.7 Å²	61.7	41%	0.405	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	117.8	173.3	-58.2	176.3	0	0	0	107.8	F486 K493 A494 E544	F486-I542 HydrophobicContact CZ-CG2 4.21Å; K493-I542 HydrophobicContact CB-CG2 4.04Å; K493-I542 HydrophobicContact CD-CG2 3.98Å; K493-I542 HydrophobicContact CG-CG2 4.46Å; A494-I542 CarbonylContact O-C 3.51Å; A494-I542 WeakPolarHBondContact O-CA 3.45Å; I542-E544 HydrophobicContact CG2-CG 4.44Å
543	L	81.6	Confident	73.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	134.7	175.5	-48.3	179.5	0	0	0	108.8	K493 A494 L496 I510 W512 V541 L546 V554 F591	K493-L543 CarbonylContact C-O 3.54Å; K493-L543 WeakPolarHBondContact CA-O 3.47Å; A494-L543 HydrophobicContact CB-CB 4.3Å; A494-L543 HydrophobicContact CB-CD1 4.49Å; A494-L543 PolarHBondContact N-O 3.06Å; A494-L543 PolarHBondContact O-N 2.93Å; L496-L543 HydrophobicContact CB-CD1 4.26Å; L496-L543 HydrophobicContact CB-CG 4.39Å; L496-L543 HydrophobicContact CD2-CD1 4.31Å; I510-L543 HydrophobicContact CG2-CD2 4.31Å; W512-L543 HydrophobicContact CD2-CB 4.34Å; W512-L543 HydrophobicContact CD2-CD2 3.98Å; W512-L543 HydrophobicContact CE3-CD2 3.67Å; W512-L543 HydrophobicContact CH2-CD2 4.42Å; W512-L543 HydrophobicContact CZ2-CB 4.41Å; W512-L543 HydrophobicContact CZ3-CD2 3.92Å; V541-L543 HydrophobicContact CG1-CD2 3.97Å; V541-L543 HydrophobicContact CG2-CD2 4.35Å; L543-L546 HydrophobicContact CB-CD1 4.32Å; L543-V554 HydrophobicContact CD1-CG2 4.42Å; L543-F591 HydrophobicContact CD1-CE1 3.58Å; L543-F591 HydrophobicContact CD1-CZ 3.83Å
544	E	79.7	Confident	74	Confident	64 Å²	64	56 Å²	56	30%	0.299	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	-179.5	-179.5	-55.2	-161.8	151.8	0	0	111.8	K493 W512 I542 L546	K493-E544 HydrophobicContact CD-CG 4.11Å; K493-E544 WeakPolarHBondContact CE-OE1 3.29Å; K493-E544 HydrophobicContact CG-CG 4.11Å; K493-E544 IonicContact NZ-OE1 3.93Å; K493-E544 PolarHBondContact NZ-OE1 3.02Å; W512-E544 WeakPolarHBondContact CZ2-O 3.12Å; W512-E544 PolarHBondContact NE1-O 3.34Å; I542-E544 HydrophobicContact CG2-CG 4.44Å; E544-L546 VanDerWaalsContact C-N 3.27Å; E544-L546 PolarHBondContact O-N 3.28Å
545	N	76.5	Confident	74.3	Confident	84 Å²	84	58.8 Å²	58.8	45%	0.449	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	58	37	-178.4	-54	-31.4	0	0	0	113.2	K491	K491-N545 PolarHBondContact NZ-OD1 3.48Å
546	L	79.2	Confident	74.5	Confident	12 Å²	12	52.5 Å²	52.5	6%	0.063	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	155.6	178.9	-52.7	176.3	0	0	0	111.5	L492 A494 L543 E544 Y552 F591 T593	L492-L546 HydrophobicContact CB-CB 4.04Å; L492-L546 WeakPolarHBondContact CB-O 3.31Å; L492-L546 HydrophobicContact CD2-CB 4.01Å; L492-L546 HydrophobicContact CG-CB 4.1Å; L492-L546 WeakPolarHBondContact O-CB 3.48Å; L492-L546 PolarHBondContact O-N 3.33Å; A494-L546 HydrophobicContact CB-CD1 3.52Å; L543-L546 HydrophobicContact CB-CD1 4.32Å; E544-L546 VanDerWaalsContact C-N 3.27Å; E544-L546 PolarHBondContact O-N 3.28Å; L546-Y552 WeakPolarHBondContact CA-OH 3.44Å; L546-Y552 HydrophobicContact CB-CE2 4.37Å; L546-Y552 HydrophobicContact CD2-CD1 3.95Å; L546-Y552 HydrophobicContact CD2-CD2 4.38Å; L546-Y552 HydrophobicContact CD2-CE1 3.7Å; L546-Y552 HydrophobicContact CD2-CE2 4.14Å; L546-Y552 HydrophobicContact CD2-CG 4.29Å; L546-F591 HydrophobicContact CD1-CE2 4.09Å; L546-F591 HydrophobicContact CD1-CZ 4.02Å; L546-F591 HydrophobicContact CD2-CZ 4.04Å; L546-T593 HydrophobicContact CB-CG2 4.37Å; L546-T593 HydrophobicContact CD1-CG2 4.47Å
547	H	78.5	Confident	75.2	Confident	96 Å²	96	53.2 Å²	53.2	44%	0.444	25%	0.25	S	C	.	.			trans	-113	154	175.8	-64.3	73.9	0	0	0	110.4	L492 C550 Y552 T593	L492-H547 WeakPolarHBondContact CD2-O 3.44Å; H547-C550 VanDerWaalsContact CB-SG 3.6Å; H547-Y552 PolarHBondContact N-OH 3.18Å; H547-Y552 PolarHBondContact ND1-OH 2.91Å; H547-Y552 VanDerWaalsContact ND1-OH 3.16Å; H547-T593 VanDerWaalsContact O-CB 3.25Å; H547-T593 WeakPolarHBondContact O-CB 3.35Å; H547-T593 WeakPolarHBondContact O-CG2 3.35Å; H547-T593 PolarHBondContact O-OG1 3.02Å
548	F	76.7	Confident	75.5	Confident	64 Å²	64	45.7 Å²	45.7	28%	0.281	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	148.7	178.7	-63	-83.9	0	0	0	111.7	Y487 L492 C550 C596 V599	Y487-F548 HydrophobicContact CD2-CE1 4.31Å; Y487-F548 HydrophobicContact CD2-CE2 4.22Å; Y487-F548 AromaticContact CD2-CZ 3.48Å; Y487-F548 HydrophobicContact CD2-CZ 3.48Å; Y487-F548 VanDerWaalsContact CD2-CZ 3.48Å; Y487-F548 AromaticContact CE2-CE2 3.97Å; Y487-F548 HydrophobicContact CE2-CE2 3.97Å; Y487-F548 AromaticContact CE2-CZ 3.66Å; Y487-F548 HydrophobicContact CE2-CZ 3.66Å; Y487-F548 HydrophobicContact CG-CZ 4.21Å; L492-F548 HydrophobicContact CD1-CD1 4.11Å; L492-F548 HydrophobicContact CD1-CE1 3.67Å; L492-F548 HydrophobicContact CD1-CZ 4.2Å; L492-F548 HydrophobicContact CD2-CD1 3.98Å; L492-F548 HydrophobicContact CD2-CE1 4.3Å; L492-F548 HydrophobicContact CD2-CG 4.25Å; L492-F548 HydrophobicContact CG-CE1 4.48Å; F548-C550 PolarHBondContact O-N 3.1Å; F548-C550 PolarHBondContact O-SG 2.79Å; F548-C596 HydrophobicContact CD1-CB 4.16Å; F548-C596 HydrophobicContact CE1-CB 4.21Å; F548-C596 HydrophobicContact CG-CB 4.36Å; F548-C596 HydrophobicContact CZ-CB 4.49Å; F548-V599 HydrophobicContact CD1-CG2 4.04Å; F548-V599 HydrophobicContact CE1-CB 4.29Å; F548-V599 HydrophobicContact CE1-CG2 3.75Å
549	N	76	Confident	75.6	Confident	49 Å²	49	42.7 Å²	42.7	26%	0.262	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	41	173.4	-141.5	20	0	0	0	113.9	V518 D519 T593 P594	V518-N549 PolarHBondContact N-O 2.66Å; D519-N549 PolarHBondContact OD2-ND2 2.93Å; D519-N549 VanDerWaalsContact OD2-ND2 3.12Å; N549-T593 VanDerWaalsContact CA-O 3.23Å; N549-T593 WeakPolarHBondContact CA-O 3.41Å; N549-T593 PolarHBondContact N-O 3.44Å; N549-T593 PolarHBondContact N-OG1 3.1Å; N549-P594 PolarHBondContact N-O 2.86Å
550	C	74.9	Confident	75.3	Confident	5 Å²	5	41.2 Å²	41.2	3%	0.034	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	154.4	-173.5	-59.5	0	0	0	0	112.9	L514 V516 C517 H547 F548 Y552 C592 T593	L514-C550 HydrophobicContact CD1-CB 3.55Å; V516-C550 CarbonylContact O-C 3.6Å; V516-C550 WeakPolarHBondContact O-CA 3.49Å; C517-C550 HydrophobicContact CB-CB 4.05Å; C517-C550 WeakPolarHBondContact CB-SG 3.34Å; C517-C550 WeakPolarHBondContact SG-CB 3.44Å; C517-C550 CovalentContact SG-SG 2.04Å; C517-C550 PolarHBondContact SG-SG 3.09Å; H547-C550 VanDerWaalsContact CB-SG 3.6Å; F548-C550 PolarHBondContact O-N 3.1Å; F548-C550 PolarHBondContact O-SG 2.79Å; C550-Y552 HydrophobicContact CB-CD2 4.23Å; C550-Y552 HydrophobicContact CB-CE2 3.75Å; C550-C592 WeakPolarHBondContact O-CA 3.24Å; C550-T593 PolarHBondContact N-OG1 3.1Å; C550-T593 PolarHBondContact O-N 3.5Å; C550-T593 PolarHBondContact O-OG1 3Å; C550-T593 VanDerWaalsContact O-OG1 3.11Å
551	H	79.4	Confident	74.9	Confident	31 Å²	31	39.1 Å²	39.1	14%	0.144	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	126.8	174.7	-174.7	-110.2	0	0	0	110.2	C473 Q515 V516 C590	C473-H551 PolarHBondContact SG-NE2 2.89Å; Q515-H551 WeakPolarHBondContact CB-O 3.1Å; Q515-H551 PolarHBondContact N-O 3.29Å; Q515-H551 PolarHBondContact OE1-CE1 2.92Å; Q515-H551 PolarHBondContact OE1-ND1 2.94Å; V516-H551 HydrophobicContact CG1-CB 3.85Å; V516-H551 PolarHBondContact N-O 2.99Å; V516-H551 PolarHBondContact O-N 2.8Å; H551-C590 WeakPolarHBondContact NE2-CB 3.4Å; H551-C590 PolarHBondContact NE2-SG 2.68Å
552	Y	78.6	Confident	73.8	Confident	7 Å²	7	43.1 Å²	43.1	3%	0.027	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	135.6	-177.1	-81.5	-92.1	0	0	0	111.3	Y513 L514 L546 H547 C550 C590 F591 T593	Y513-Y552 WeakPolarHBondContact O-CA 3.19Å; Y513-Y552 WeakPolarHBondContact O-CD1 3.46Å; L514-Y552 HydrophobicContact CB-CD1 4.41Å; L514-Y552 HydrophobicContact CB-CE1 3.87Å; L514-Y552 HydrophobicContact CD1-CD2 4.31Å; L514-Y552 HydrophobicContact CD1-CE1 4.05Å; L514-Y552 HydrophobicContact CD1-CE2 3.76Å; L546-Y552 WeakPolarHBondContact CA-OH 3.44Å; L546-Y552 HydrophobicContact CB-CE2 4.37Å; L546-Y552 HydrophobicContact CD2-CD1 3.95Å; L546-Y552 HydrophobicContact CD2-CD2 4.38Å; L546-Y552 HydrophobicContact CD2-CE1 3.7Å; L546-Y552 HydrophobicContact CD2-CE2 4.14Å; L546-Y552 HydrophobicContact CD2-CG 4.29Å; H547-Y552 PolarHBondContact N-OH 3.18Å; H547-Y552 PolarHBondContact ND1-OH 2.91Å; H547-Y552 VanDerWaalsContact ND1-OH 3.16Å; C550-Y552 HydrophobicContact CB-CD2 4.23Å; C550-Y552 HydrophobicContact CB-CE2 3.75Å; Y552-C590 CarbonylContact O-C 3.6Å; Y552-C590 WeakPolarHBondContact O-CA 3.37Å; Y552-C590 VanDerWaalsContact O-CB 3.28Å; Y552-C590 WeakPolarHBondContact O-CB 3.26Å; Y552-F591 HydrophobicContact CD2-CE2 4.36Å; Y552-F591 HydrophobicContact CD2-CZ 4.34Å; Y552-F591 HydrophobicContact CG-CE1 4.41Å; Y552-F591 HydrophobicContact CG-CE2 4.45Å; Y552-F591 HydrophobicContact CG-CZ 4.02Å; Y552-F591 PolarHBondContact N-O 3.42Å; Y552-F591 PolarHBondContact O-N 3.14Å; Y552-T593 HydrophobicContact CD2-CG2 4.03Å; Y552-T593 HydrophobicContact CE2-CG2 4.04Å
553	G	78.4	Confident	72.7	Confident	3 Å²	3	40.9 Å²	40.9	3%	0.031	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	139.1	168.5	0	0	0	0	0	110.9	W512 Y513	W512-G553 VanDerWaalsContact CA-O 3.24Å; W512-G553 WeakPolarHBondContact CA-O 3.3Å; Y513-G553 PolarHBondContact N-O 2.83Å; Y513-G553 PolarHBondContact O-N 2.93Å
554	V	79	Confident	71.7	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.7	177.1	-175.8	0	0	0	0	109.7	L480 L496 I510 Q511 W512 L543 V556 I588 G589 F591	L480-V554 HydrophobicContact CD1-CB 4.3Å; L480-V554 HydrophobicContact CD1-CG1 4.1Å; L496-V554 HydrophobicContact CD2-CG1 4Å; I510-V554 HydrophobicContact CG2-CG1 4.07Å; Q511-V554 CarbonylContact O-C 3.51Å; Q511-V554 WeakPolarHBondContact O-CA 3.29Å; W512-V554 HydrophobicContact CB-CG2 4.16Å; L543-V554 HydrophobicContact CD1-CG2 4.42Å; V554-V556 HydrophobicContact CG1-CG2 4.22Å; V554-I588 WeakPolarHBondContact O-CA 3.31Å; V554-G589 PolarHBondContact N-O 3.16Å; V554-G589 PolarHBondContact O-N 2.73Å; V554-F591 HydrophobicContact CG2-CD1 3.65Å; V554-F591 HydrophobicContact CG2-CE1 3.55Å
555	R	74.2	Confident	70.6	Confident	75 Å²	75	46.7 Å²	46.7	28%	0.283	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	125.3	175.5	-172.2	-179.2	-68.8	152.5	-6.5	109.6	I510 Q511 V586 Y587 I588	I510-R555 WeakPolarHBondContact CA-O 3.3Å; Q511-R555 PolarHBondContact N-O 2.71Å; Q511-R555 PolarHBondContact O-N 3.11Å; R555-V586 HydrophobicContact CG-CG1 3.81Å; R555-Y587 CarbonylContact C-O 3.55Å; R555-Y587 WeakPolarHBondContact CA-O 3.39Å; R555-I588 HydrophobicContact CG-CG1 4.33Å
556	V	74.5	Confident	69.7	Low	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	118.3	177.4	-175.4	0	0	0	0	108.7	L480 I498 A508 L509 I510 V554 V558 V586 Y587	L480-V556 HydrophobicContact CD1-CG2 4.15Å; L480-V556 HydrophobicContact CD2-CG2 3.66Å; I498-V556 HydrophobicContact CD1-CG2 4.37Å; A508-V556 HydrophobicContact CB-CG1 4.07Å; L509-V556 CarbonylContact O-C 3.54Å; L509-V556 WeakPolarHBondContact O-CA 3.3Å; I510-V556 HydrophobicContact CB-CG2 4.48Å; I510-V556 HydrophobicContact CG1-CB 4.47Å; I510-V556 HydrophobicContact CG1-CG1 4.01Å; I510-V556 HydrophobicContact CG1-CG2 3.95Å; I510-V556 HydrophobicContact CG2-CG2 4.27Å; V554-V556 HydrophobicContact CG1-CG2 4.22Å; V556-V558 HydrophobicContact CG1-CG2 4.2Å; V556-V586 CarbonylContact O-C 3.47Å; V556-V586 WeakPolarHBondContact O-CA 3.2Å; V556-Y587 PolarHBondContact N-O 3.18Å; V556-Y587 PolarHBondContact O-N 3.22Å
557	R	73	Confident	68.5	Low	62 Å²	62	57.8 Å²	57.8	23%	0.234	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.1	172.7	-62.8	-163.5	175.8	88.1	-5.7	109.4	A508 L509 Y559 V586	A508-R557 CarbonylContact C-O 3.59Å; A508-R557 VanDerWaalsContact CA-O 3.32Å; A508-R557 WeakPolarHBondContact CA-O 3.44Å; L509-R557 PolarHBondContact N-O 2.9Å; L509-R557 PolarHBondContact O-N 2.92Å; R557-Y559 HydrophobicContact CB-CE2 4.09Å; R557-V586 HydrophobicContact CG-CG1 4.18Å; R557-V586 HydrophobicContact CG-CG2 3.97Å
558	V	69.3	Low	67.5	Low	9 Å²	9	53.7 Å²	53.7	6%	0.055	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	126.3	-179.6	-169	0	0	0	0	110.8	M500 I502 A508 V556 I585	M500-V558 HydrophobicContact CE-CG2 3.76Å; M500-V558 HydrophobicContact SD-CG2 3.69Å; I502-V558 HydrophobicContact CD1-CB 4.22Å; I502-V558 HydrophobicContact CD1-CG1 3.36Å; I502-V558 HydrophobicContact CD1-CG2 4.16Å; A508-V558 HydrophobicContact CB-CG2 4.2Å; V556-V558 HydrophobicContact CG1-CG2 4.2Å; V558-I585 PolarHBondContact N-O 3.27Å
559	Y	64.7	Low	66.4	Low	30 Å²	30	54.4 Å²	54.4	12%	0.118	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.6	177.5	-60	-83.7	0	0	0	110.3	S506 T507 L509 R557 A561 L563	S506-Y559 WeakPolarHBondContact CA-O 3.23Å; S506-Y559 WeakPolarHBondContact CB-O 3.46Å; T507-Y559 PolarHBondContact N-O 2.9Å; T507-Y559 VanDerWaalsContact N-O 3.09Å; T507-Y559 PolarHBondContact O-N 3.41Å; L509-Y559 HydrophobicContact CB-CE2 4.18Å; R557-Y559 HydrophobicContact CB-CE2 4.09Å; Y559-A561 PolarHBondContact O-N 3.33Å; Y559-L563 HydrophobicContact CD1-CD1 4.2Å; Y559-L563 HydrophobicContact CD2-CD1 4.41Å; Y559-L563 HydrophobicContact CG-CD1 3.82Å
560	P	58.5	Low	65.4	Low	97 Å²	97	57.2 Å²	57.2	63%	0.63	30%	0.3	S	S	*	.	S	Bend	trans	-73.5	22.9	-174.7	28.4	-33.8	0	0	0	115.3
561	A	61.6	Low	64.3	Low	48 Å²	48	59 Å²	59	40%	0.397	31%	0.309	S	S	.	.	S	Bend	trans	-146.3	161.1	175.5	0	0	0	0	0	111.3	T507 Y559 L563	T507-A561 PolarHBondContact N-O 3.41Å; T507-A561 PolarHBondContact OG1-O 3.03Å; Y559-A561 PolarHBondContact O-N 3.33Å; A561-L563 PolarHBondContact O-N 3.21Å; A561-L563 VanDerWaalsContact O-N 3.16Å
562	T	55.5	Low	63	Low	89 Å²	89	61.7 Å²	61.7	55%	0.546	32%	0.321	S	S	.	.			trans	-77	95	170.9	54.6	0	0	0	0	110	E505	E505-T562 HydrophobicContact CB-CG2 4.01Å
563	L	58.1	Low	61.6	Low	31 Å²	31	65.3 Å²	65.3	16%	0.162	35%	0.347	C	S	.	.			trans	-97.7	137.3	178.6	-65	162.3	0	0	0	110.3	T507 Y559 A561 I568 M571	T507-L563 PolarHBondContact OG1-N 3.43Å; Y559-L563 HydrophobicContact CD1-CD1 4.2Å; Y559-L563 HydrophobicContact CD2-CD1 4.41Å; Y559-L563 HydrophobicContact CG-CD1 3.82Å; A561-L563 PolarHBondContact O-N 3.21Å; A561-L563 VanDerWaalsContact O-N 3.16Å; L563-I568 HydrophobicContact CB-CD1 4.07Å; L563-I568 HydrophobicContact CB-CG1 3.8Å; L563-I568 HydrophobicContact CD1-CG1 4.27Å; L563-M571 HydrophobicContact CD1-SD 4.41Å
564	D	59.8	Low	60.1	Low	119 Å²	119	69.8 Å²	69.8	64%	0.636	37%	0.37	S	S	*	.			trans	-79.3	155	165.8	-82.3	-20.6	0	0	0	110.8	K566 Y567 I568	D564-K566 PolarHBondContact O-N 3.22Å; D564-Y567 PolarHBondContact O-N 2.89Å; D564-I568 PolarHBondContact O-N 3.35Å
565	A	56.1	Low	58.5	Low	67 Å²	67	73 Å²	73	55%	0.554	39%	0.39	S	S	*	.	H	α-helix	trans	-51.2	-36.7	-177.7	0	0	0	0	0	113.5	Y567 I568 T569	A565-Y567 PolarHBondContact O-N 3.48Å; A565-I568 PolarHBondContact O-N 3.26Å; A565-T569 PolarHBondContact O-N 2.93Å; A565-T569 VanDerWaalsContact O-N 3.08Å; A565-T569 PolarHBondContact O-OG1 2.9Å; A565-T569 VanDerWaalsContact O-OG1 3.12Å
566	K	57.4	Low	56.9	Low	179 Å²	179	78.3 Å²	78.3	78%	0.778	42%	0.417	S	S	*	.	H	α-helix	trans	-61.7	-41.4	177.9	-119.8	-178.2	-178	-179.1	0	112.8	D564 T569 M570	D564-K566 PolarHBondContact O-N 3.22Å; K566-T569 WeakPolarHBondContact CA-OG1 3.3Å; K566-T569 PolarHBondContact O-OG1 2.98Å; K566-M570 WeakPolarHBondContact O-CB 3.28Å; K566-M570 PolarHBondContact O-N 2.78Å; K566-M570 VanDerWaalsContact O-N 3.1Å
567	Y	55.2	Low	55.5	Low	150 Å²	150	84.1 Å²	84.1	59%	0.588	45%	0.452	S	S	*	.	H	α-helix	trans	-70.6	-34.5	178.9	-107.4	-86.7	0	0	0	111.6	D564 A565 M570 M571	D564-Y567 PolarHBondContact O-N 2.89Å; A565-Y567 PolarHBondContact O-N 3.48Å; Y567-M570 PolarHBondContact O-N 3.06Å; Y567-M571 WeakPolarHBondContact O-CB 3.39Å; Y567-M571 WeakPolarHBondContact O-CG 3.47Å; Y567-M571 PolarHBondContact O-N 3.43Å
568	I	56.3	Low	53.8	Low	10 Å²	10	86.4 Å²	86.4	5%	0.051	47%	0.466	C	S	.	.	H	α-helix	trans	-67.5	-46.5	177.5	-62.3	173.3	0	0	0	110.5	L509 L533 L563 D564 A565 M570 M571 E572	L509-I568 HydrophobicContact CD2-CG2 4.26Å; L533-I568 HydrophobicContact CD1-CD1 3.15Å; L533-I568 HydrophobicContact CD2-CD1 3.85Å; L533-I568 HydrophobicContact CG-CD1 4.14Å; L563-I568 HydrophobicContact CB-CD1 4.07Å; L563-I568 HydrophobicContact CB-CG1 3.8Å; L563-I568 HydrophobicContact CD1-CG1 4.27Å; D564-I568 PolarHBondContact O-N 3.35Å; A565-I568 PolarHBondContact O-N 3.26Å; I568-M570 VanDerWaalsContact C-N 3.26Å; I568-M570 PolarHBondContact O-N 3.25Å; I568-M571 PolarHBondContact O-N 3.34Å; I568-E572 WeakPolarHBondContact O-CG 3.47Å; I568-E572 PolarHBondContact O-N 3.47Å
569	T	54.8	Low	52.3	Low	79 Å²	79	94.5 Å²	94.5	49%	0.485	51%	0.509	S	S	.	.	H	α-helix	trans	-61.4	-35.4	174.3	42.8	0	0	0	0	112.6	A565 K566 S573	A565-T569 PolarHBondContact O-N 2.93Å; A565-T569 VanDerWaalsContact O-N 3.08Å; A565-T569 PolarHBondContact O-OG1 2.9Å; A565-T569 VanDerWaalsContact O-OG1 3.12Å; K566-T569 WeakPolarHBondContact CA-OG1 3.3Å; K566-T569 PolarHBondContact O-OG1 2.98Å; T569-S573 WeakPolarHBondContact O-CB 3.27Å; T569-S573 PolarHBondContact O-N 2.83Å; T569-S573 VanDerWaalsContact O-N 3.09Å; T569-S573 PolarHBondContact O-OG 3.01Å
570	M	54.6	Low	51	Low	109 Å²	109	99.5 Å²	99.5	54%	0.537	53%	0.533	S	S	.	.	H	α-helix	trans	-68.1	-44.3	175.4	-172.8	176.9	-178.5	0	0	111.2	K566 Y567 I568 S573 L574	K566-M570 WeakPolarHBondContact O-CB 3.28Å; K566-M570 PolarHBondContact O-N 2.78Å; K566-M570 VanDerWaalsContact O-N 3.1Å; Y567-M570 PolarHBondContact O-N 3.06Å; I568-M570 VanDerWaalsContact C-N 3.26Å; I568-M570 PolarHBondContact O-N 3.25Å; M570-S573 PolarHBondContact O-N 3.5Å; M570-L574 HydrophobicContact CE-CD1 4.15Å; M570-L574 HydrophobicContact CG-CD1 3.8Å; M570-L574 VanDerWaalsContact O-CD1 3.31Å; M570-L574 WeakPolarHBondContact O-CD1 3.34Å; M570-L574 PolarHBondContact O-N 3.21Å
571	M	51.6	Low	50	Low	43 Å²	43	104.1 Å²	104.1	21%	0.212	55%	0.546	C	S	.	.	H	α-helix	trans	-64.1	-42.2	175.1	-77.7	-167.2	82.2	0	0	112.1	L563 Y567 I568 S573 L574 V575 F582	L563-M571 HydrophobicContact CD1-SD 4.41Å; Y567-M571 WeakPolarHBondContact O-CB 3.39Å; Y567-M571 WeakPolarHBondContact O-CG 3.47Å; Y567-M571 PolarHBondContact O-N 3.43Å; I568-M571 PolarHBondContact O-N 3.34Å; M571-S573 VanDerWaalsContact C-N 3.27Å; M571-S573 PolarHBondContact O-N 3.44Å; M571-L574 PolarHBondContact O-N 3.49Å; M571-V575 WeakPolarHBondContact O-CB 3.32Å; M571-V575 WeakPolarHBondContact O-CG2 3.34Å; M571-V575 PolarHBondContact O-N 3.24Å; M571-F582 HydrophobicContact CE-CD1 4.05Å; M571-F582 HydrophobicContact CE-CD2 3.93Å; M571-F582 HydrophobicContact CE-CE1 3.52Å; M571-F582 HydrophobicContact CE-CE2 3.38Å; M571-F582 HydrophobicContact CE-CG 4.24Å; M571-F582 HydrophobicContact CE-CZ 3.16Å
572	E	51.7	Low	49.1	Very low	87 Å²	87	108.1 Å²	108.1	41%	0.407	56%	0.555	S	S	.	*	H	α-helix	trans	-61.3	-37.1	175.9	-75.5	-171.6	153.6	0	0	111.8	I568	I568-E572 WeakPolarHBondContact O-CG 3.47Å; I568-E572 PolarHBondContact O-N 3.47Å
573	S	49.6	Very low	48.4	Very low	83 Å²	83	111.7 Å²	111.7	58%	0.58	57%	0.571	S	S	*	*	H	α-helix	trans	-70.8	-38.1	176.3	-55.2	0	0	0	0	112.5	T569 M570 M571	T569-S573 WeakPolarHBondContact O-CB 3.27Å; T569-S573 PolarHBondContact O-N 2.83Å; T569-S573 VanDerWaalsContact O-N 3.09Å; T569-S573 PolarHBondContact O-OG 3.01Å; M570-S573 PolarHBondContact O-N 3.5Å; M571-S573 VanDerWaalsContact C-N 3.27Å; M571-S573 PolarHBondContact O-N 3.44Å
574	L	46	Very low	47.8	Very low	97 Å²	97	111.2 Å²	111.2	51%	0.508	57%	0.573	S	S	.	*	H	α-helix	trans	-71.3	-34.8	177.2	-97.6	113.4	0	0	0	112.8	M570 M571 H576 V577 Q578	M570-L574 HydrophobicContact CE-CD1 4.15Å; M570-L574 HydrophobicContact CG-CD1 3.8Å; M570-L574 VanDerWaalsContact O-CD1 3.31Å; M570-L574 WeakPolarHBondContact O-CD1 3.34Å; M570-L574 PolarHBondContact O-N 3.21Å; M571-L574 PolarHBondContact O-N 3.49Å; L574-H576 VanDerWaalsContact C-N 3.29Å; L574-H576 PolarHBondContact O-N 3.03Å; L574-V577 PolarHBondContact O-N 3.39Å; L574-V577 VanDerWaalsContact O-N 3.11Å; L574-Q578 PolarHBondContact O-N 3.07Å
575	V	45.6	Very low	47.4	Very low	70 Å²	70	109.9 Å²	109.9	42%	0.424	57%	0.565	S	S	.	*	H	α-helix	trans	-67.4	-28.3	-178.9	170	0	0	0	0	112.1	M571 V577 Q578	M571-V575 WeakPolarHBondContact O-CB 3.32Å; M571-V575 WeakPolarHBondContact O-CG2 3.34Å; M571-V575 PolarHBondContact O-N 3.24Å; V575-V577 PolarHBondContact O-N 3.44Å; V575-V577 VanDerWaalsContact O-N 3.17Å; V575-Q578 PolarHBondContact O-N 3.27Å
576	H	41.1	Very low	47.6	Very low	186 Å²	186	110 Å²	110	86%	0.861	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-13.1	175.4	-138.8	51.8	0	0	0	113.3	L574	L574-H576 VanDerWaalsContact C-N 3.29Å; L574-H576 PolarHBondContact O-N 3.03Å
577	V	45.8	Very low	47.9	Very low	121 Å²	121	104.9 Å²	104.9	73%	0.733	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-24.7	-178.2	-174.6	0	0	0	0	112.3	L574 V575	L574-V577 PolarHBondContact O-N 3.39Å; L574-V577 VanDerWaalsContact O-N 3.11Å; V575-V577 PolarHBondContact O-N 3.44Å; V575-V577 VanDerWaalsContact O-N 3.17Å
578	Q	37.5	Very low	48.4	Very low	110 Å²	110	102.9 Å²	102.9	51%	0.514	53%	0.533	S	S	.	.	S	Bend	trans	-132.4	116	-177.4	-63.4	-176.1	-3.6	0	0	109.6	L574 V575 Q580	L574-Q578 PolarHBondContact O-N 3.07Å; V575-Q578 PolarHBondContact O-N 3.27Å; Q578-Q580 PolarHBondContact O-N 3.39Å
579	N	37.5	Very low	49.2	Very low	179 Å²	179	102.8 Å²	102.8	96%	0.957	54%	0.535	S	S	*	.			trans	-61.6	33.7	175.9	-97.6	-10.8	0	0	0	114	Q581	N579-Q581 PolarHBondContact O-N 3.15Å
580	Q	37.4	Very low	50.4	Low	135 Å²	135	100.4 Å²	100.4	63%	0.631	52%	0.521	S	S	*	.			trans	-84.9	106.9	174.5	-76	-175.9	-26.1	0	0	109.1	Q578 F582	Q578-Q580 PolarHBondContact O-N 3.39Å; Q580-F582 PolarHBondContact O-N 3.37Å
581	Q	37.9	Very low	51.6	Low	195 Å²	195	95.6 Å²	95.6	91%	0.911	50%	0.497	S	S	*	.			trans	-65.1	96.6	177.6	-171.8	167.6	-3.8	0	0	109.5	N579 D583	N579-Q581 PolarHBondContact O-N 3.15Å; Q581-D583 PolarHBondContact O-N 3.14Å
582	F	41	Very low	52.9	Low	132 Å²	132	95.1 Å²	95.1	58%	0.579	50%	0.498	S	S	*	.			trans	-65	131.5	171.7	-109.5	-87.5	0	0	0	109.9	M571 Q580 G584	M571-F582 HydrophobicContact CE-CD1 4.05Å; M571-F582 HydrophobicContact CE-CD2 3.93Å; M571-F582 HydrophobicContact CE-CE1 3.52Å; M571-F582 HydrophobicContact CE-CE2 3.38Å; M571-F582 HydrophobicContact CE-CG 4.24Å; M571-F582 HydrophobicContact CE-CZ 3.16Å; Q580-F582 PolarHBondContact O-N 3.37Å; F582-G584 PolarHBondContact O-N 3.18Å
583	D	40.7	Very low	54.2	Low	164 Å²	164	91.2 Å²	91.2	88%	0.877	48%	0.48	S	S	*	.			trans	-76.3	37.8	-177.5	-146.2	12	0	0	0	112.5	Q581	Q581-D583 PolarHBondContact O-N 3.14Å
584	G	45.4	Very low	55.2	Low	20 Å²	20	89.1 Å²	89.1	21%	0.206	46%	0.464	C	S	.	.			trans	-78.7	125.7	176.5	0	0	0	0	0	109.9	F582 V586	F582-G584 PolarHBondContact O-N 3.18Å; G584-V586 WeakPolarHBondContact O-CG2 3.34Å; G584-V586 PolarHBondContact O-N 3.24Å
585	I	53.3	Low	56.4	Low	92 Å²	92	86.2 Å²	86.2	47%	0.472	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	119.5	177.7	-54.8	175	0	0	0	108.2	V558 Y587	V558-I585 PolarHBondContact N-O 3.27Å; I585-Y587 HydrophobicContact CB-CE2 4.31Å; I585-Y587 HydrophobicContact CG2-CD2 4.06Å; I585-Y587 HydrophobicContact CG2-CE1 4.04Å; I585-Y587 HydrophobicContact CG2-CE2 3.39Å; I585-Y587 VanDerWaalsContact CG2-CZ 3.4Å
586	V	58.9	Low	57.3	Low	68 Å²	68	87.1 Å²	87.1	41%	0.412	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	117.5	178.3	-173.5	0	0	0	0	109.6	R555 V556 R557 G584 I588	R555-V586 HydrophobicContact CG-CG1 3.81Å; V556-V586 CarbonylContact O-C 3.47Å; V556-V586 WeakPolarHBondContact O-CA 3.2Å; R557-V586 HydrophobicContact CG-CG1 4.18Å; R557-V586 HydrophobicContact CG-CG2 3.97Å; G584-V586 WeakPolarHBondContact O-CG2 3.34Å; G584-V586 PolarHBondContact O-N 3.24Å; V586-I588 HydrophobicContact CG1-CG1 4.24Å
587	Y	64.5	Low	58.3	Low	72 Å²	72	83.7 Å²	83.7	28%	0.282	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	137.5	170.6	-61.2	-74.3	0	0	0	110.2	P479 M500 R555 V556 I585	P479-Y587 HydrophobicContact CG-CD1 3.39Å; P479-Y587 HydrophobicContact CG-CD2 4.33Å; P479-Y587 HydrophobicContact CG-CE1 3.78Å; P479-Y587 HydrophobicContact CG-CG 3.66Å; M500-Y587 HydrophobicContact CG-CD2 4.47Å; M500-Y587 HydrophobicContact CG-CE2 3.95Å; M500-Y587 HydrophobicContact SD-CD2 3.62Å; M500-Y587 HydrophobicContact SD-CE2 3.41Å; M500-Y587 WeakPolarHBondContact SD-CE2 3.2Å; R555-Y587 CarbonylContact C-O 3.55Å; R555-Y587 WeakPolarHBondContact CA-O 3.39Å; V556-Y587 PolarHBondContact N-O 3.18Å; V556-Y587 PolarHBondContact O-N 3.22Å; I585-Y587 HydrophobicContact CB-CE2 4.31Å; I585-Y587 HydrophobicContact CG2-CD2 4.06Å; I585-Y587 HydrophobicContact CG2-CE1 4.04Å; I585-Y587 HydrophobicContact CG2-CE2 3.39Å; I585-Y587 VanDerWaalsContact CG2-CZ 3.4Å
588	I	65.8	Low	58.8	Low	108 Å²	108	83.4 Å²	83.4	55%	0.554	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.3	177.5	-54.6	175	0	0	0	107.2	V554 R555 V586	V554-I588 WeakPolarHBondContact O-CA 3.31Å; R555-I588 HydrophobicContact CG-CG1 4.33Å; V586-I588 HydrophobicContact CG1-CG1 4.24Å
589	G	73.1	Confident	59.7	Low	8 Å²	8	79 Å²	79	8%	0.082	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	179.7	173.3	0	0	0	0	0	110.8	V554	V554-G589 PolarHBondContact N-O 3.16Å; V554-G589 PolarHBondContact O-N 2.73Å
590	C	78.9	Confident	60.3	Low	30 Å²	30	75.8 Å²	75.8	20%	0.203	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	163.9	175.2	63.4	0	0	0	0	110.7	C473 H551 Y552	C473-C590 WeakPolarHBondContact CA-SG 3.38Å; C473-C590 HydrophobicContact CB-CB 4.48Å; C473-C590 WeakPolarHBondContact CB-SG 3.42Å; C473-C590 WeakPolarHBondContact SG-CB 3.4Å; C473-C590 PolarHBondContact SG-O 3.43Å; C473-C590 VanDerWaalsContact SG-O 3.33Å; C473-C590 CovalentContact SG-SG 2.05Å; C473-C590 PolarHBondContact SG-SG 3.5Å; H551-C590 WeakPolarHBondContact NE2-CB 3.4Å; H551-C590 PolarHBondContact NE2-SG 2.68Å; Y552-C590 CarbonylContact O-C 3.6Å; Y552-C590 WeakPolarHBondContact O-CA 3.37Å; Y552-C590 VanDerWaalsContact O-CB 3.28Å; Y552-C590 WeakPolarHBondContact O-CB 3.26Å
591	F	79.5	Confident	60.8	Low	8 Å²	8	72.9 Å²	72.9	4%	0.035	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	160.7	168.9	70.9	-85.8	0	0	0	111.8	C473 L482 I485 A494 L543 L546 Y552 V554 T593	C473-F591 PolarHBondContact SG-N 3.5Å; L482-F591 HydrophobicContact CD1-CD2 4.33Å; L482-F591 HydrophobicContact CD1-CG 4.47Å; L482-F591 HydrophobicContact CD2-CB 3.95Å; L482-F591 HydrophobicContact CD2-CD2 4.18Å; L482-F591 HydrophobicContact CD2-CG 4.36Å; I485-F591 HydrophobicContact CD1-CD2 4.13Å; I485-F591 HydrophobicContact CD1-CE2 4.38Å; A494-F591 HydrophobicContact CB-CE2 4.06Å; A494-F591 HydrophobicContact CB-CZ 4.28Å; L543-F591 HydrophobicContact CD1-CE1 3.58Å; L543-F591 HydrophobicContact CD1-CZ 3.83Å; L546-F591 HydrophobicContact CD1-CE2 4.09Å; L546-F591 HydrophobicContact CD1-CZ 4.02Å; L546-F591 HydrophobicContact CD2-CZ 4.04Å; Y552-F591 HydrophobicContact CD2-CE2 4.36Å; Y552-F591 HydrophobicContact CD2-CZ 4.34Å; Y552-F591 HydrophobicContact CG-CE1 4.41Å; Y552-F591 HydrophobicContact CG-CE2 4.45Å; Y552-F591 HydrophobicContact CG-CZ 4.02Å; Y552-F591 PolarHBondContact N-O 3.42Å; Y552-F591 PolarHBondContact O-N 3.14Å; V554-F591 HydrophobicContact CG2-CD1 3.65Å; V554-F591 HydrophobicContact CG2-CE1 3.55Å; F591-T593 HydrophobicContact CD2-CG2 4.44Å; F591-T593 HydrophobicContact CE2-CG2 3.86Å
592	C	80.5	Confident	60.7	Low	33 Å²	33	70.4 Å²	70.4	22%	0.223	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	137.2	179.7	-57.9	0	0	0	0	110.9	C471 I485 C550	C471-C592 HydrophobicContact CB-CB 3.73Å; C471-C592 WeakPolarHBondContact CB-SG 3.19Å; C471-C592 PolarHBondContact O-SG 3.46Å; C471-C592 WeakPolarHBondContact SG-CB 3.29Å; C471-C592 CovalentContact SG-SG 2.02Å; C471-C592 PolarHBondContact SG-SG 3.34Å; I485-C592 WeakPolarHBondContact CD1-O 3.28Å; C550-C592 WeakPolarHBondContact O-CA 3.24Å
593	T	78.9	Confident	60.4	Low	5 Å²	5	70.9 Å²	70.9	3%	0.031	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-93.3	133.8	169.4	56.6	0	0	0	0	110.6	I485 L492 L546 H547 N549 C550 Y552 F591	I485-T593 HydrophobicContact CD1-CG2 4.18Å; L492-T593 HydrophobicContact CD2-CG2 3.86Å; L546-T593 HydrophobicContact CB-CG2 4.37Å; L546-T593 HydrophobicContact CD1-CG2 4.47Å; H547-T593 VanDerWaalsContact O-CB 3.25Å; H547-T593 WeakPolarHBondContact O-CB 3.35Å; H547-T593 WeakPolarHBondContact O-CG2 3.35Å; H547-T593 PolarHBondContact O-OG1 3.02Å; N549-T593 VanDerWaalsContact CA-O 3.23Å; N549-T593 WeakPolarHBondContact CA-O 3.41Å; N549-T593 PolarHBondContact N-O 3.44Å; N549-T593 PolarHBondContact N-OG1 3.1Å; C550-T593 PolarHBondContact N-OG1 3.1Å; C550-T593 PolarHBondContact O-N 3.5Å; C550-T593 PolarHBondContact O-OG1 3Å; C550-T593 VanDerWaalsContact O-OG1 3.11Å; Y552-T593 HydrophobicContact CD2-CG2 4.03Å; Y552-T593 HydrophobicContact CE2-CG2 4.04Å; F591-T593 HydrophobicContact CD2-CG2 4.44Å; F591-T593 HydrophobicContact CE2-CG2 3.86Å
594	P	70.7	Confident	60.1	Low	39 Å²	39	71.7 Å²	71.7	25%	0.253	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-73.4	170.6	179.8	33.5	-38.9	0	0	0	111.7	I485 N549 N598 V599	I485-P594 HydrophobicContact CG2-CG 4.43Å; N549-P594 PolarHBondContact N-O 2.86Å; P594-N598 HydrophobicContact CB-CB 3.92Å; P594-V599 HydrophobicContact CG-CG2 3.52Å
595	S	69.8	Low	59.9	Low	36 Å²	36	75 Å²	75	25%	0.252	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-66.5	159.8	170.4	68.2	0	0	0	0	111.5	S597 N598	S595-S597 PolarHBondContact O-N 2.79Å; S595-S597 VanDerWaalsContact O-N 3.12Å; S595-N598 PolarHBondContact O-N 2.66Å
596	C	64.8	Low	59.7	Low	89 Å²	89	73.4 Å²	73.4	60%	0.601	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-54.6	-33.1	-179.8	-170.8	0	0	0	0	112.6	F548 N598	F548-C596 HydrophobicContact CD1-CB 4.16Å; F548-C596 HydrophobicContact CE1-CB 4.21Å; F548-C596 HydrophobicContact CG-CB 4.36Å; F548-C596 HydrophobicContact CZ-CB 4.49Å; C596-N598 VanDerWaalsContact C-N 3.29Å; C596-N598 PolarHBondContact O-N 3.48Å
597	S	61.4	Low	59.6	Low	113 Å²	113	74.4 Å²	74.4	79%	0.79	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-67.2	-25.6	178.9	-43	0	0	0	0	114.2	S595	S595-S597 PolarHBondContact O-N 2.79Å; S595-S597 VanDerWaalsContact O-N 3.12Å
598	N	57.6	Low	59.7	Low	115 Å²	115	72.1 Å²	72.1	62%	0.615	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-100.3	-2.3	-172.6	-71.7	-4.2	0	0	0	113	P594 S595 C596 I600	P594-N598 HydrophobicContact CB-CB 3.92Å; S595-N598 PolarHBondContact O-N 2.66Å; C596-N598 VanDerWaalsContact C-N 3.29Å; C596-N598 PolarHBondContact O-N 3.48Å; N598-I600 PolarHBondContact O-N 2.94Å
599	V	57.1	Low	60.1	Low	17 Å²	17	70.1 Å²	70.1	10%	0.103	42%	0.416	C	S	.	.			trans	-87.6	113.9	179.2	-176.8	0	0	0	0	110.3	L492 F548 P594 N601	L492-V599 HydrophobicContact CD1-CG1 4.13Å; L492-V599 HydrophobicContact CD1-CG2 3.98Å; F548-V599 HydrophobicContact CD1-CG2 4.04Å; F548-V599 HydrophobicContact CE1-CB 4.29Å; F548-V599 HydrophobicContact CE1-CG2 3.75Å; P594-V599 HydrophobicContact CG-CG2 3.52Å; V599-N601 PolarHBondContact O-N 3.02Å; V599-N601 VanDerWaalsContact O-N 3.16Å
600	I	50.1	Low	60.6	Low	113 Å²	113	72.3 Å²	72.3	58%	0.579	43%	0.428	S	S	*	.			trans	-71.5	107.6	174.2	-56.1	166.7	0	0	0	108	N598 K602	N598-I600 PolarHBondContact O-N 2.94Å; I600-K602 PolarHBondContact O-N 3.41Å
601	N	46.8	Very low	60.9	Low	73 Å²	73	71.1 Å²	71.1	39%	0.39	42%	0.42	S	S	.	.			trans	-54.9	127.8	165.4	-83.3	-31.8	0	0	0	108.2	Y487 V599 E603	Y487-N601 PolarHBondContact O-OD1 2.81Å; V599-N601 PolarHBondContact O-N 3.02Å; V599-N601 VanDerWaalsContact O-N 3.16Å; N601-E603 PolarHBondContact O-N 3.13Å
602	K	35.1	Very low	61	Low	143 Å²	143	74.5 Å²	74.5	62%	0.622	44%	0.442	S	S	*	.	S	Bend	trans	-78	36.9	-173.6	-156.7	-162.3	174	-175.3	0	113.1	I600	I600-K602 PolarHBondContact O-N 3.41Å
603	E	36.1	Very low	61.2	Low	143 Å²	143	79.8 Å²	79.8	67%	0.668	46%	0.461	S	S	*	.			trans	-127.4	105.3	165.6	-70.8	-179.4	138.4	0	0	106.4	N601 L605	N601-E603 PolarHBondContact O-N 3.13Å; E603-L605 HydrophobicContact CB-CB 4.04Å; E603-L605 HydrophobicContact CB-CD1 3.58Å; E603-L605 HydrophobicContact CB-CG 3.82Å; E603-L605 HydrophobicContact CG-CD1 4.15Å; E603-L605 PolarHBondContact O-N 3.17Å; E603-L605 WeakPolarHBondContact OE2-CD1 3.48Å
604	D	33.1	Very low	61.6	Low	180 Å²	180	80.5 Å²	80.5	96%	0.963	47%	0.465	S	S	*	.			trans	-58.6	60	149.4	-94.3	-35.1	0	0	0	108.3	G606	D604-G606 PolarHBondContact O-N 3.16Å
605	L	42.5	Very low	62.5	Low	90 Å²	90	83.9 Å²	83.9	47%	0.471	48%	0.477	S	S	.	.			trans	-74.8	86.2	174.2	-110	158.9	0	0	0	104.2	E603	E603-L605 HydrophobicContact CB-CB 4.04Å; E603-L605 HydrophobicContact CB-CD1 3.58Å; E603-L605 HydrophobicContact CB-CG 3.82Å; E603-L605 HydrophobicContact CG-CD1 4.15Å; E603-L605 PolarHBondContact O-N 3.17Å; E603-L605 WeakPolarHBondContact OE2-CD1 3.48Å
606	G	47.9	Very low	63.5	Low	59 Å²	59	84.5 Å²	84.5	61%	0.608	48%	0.48	S	S	*	.			trans	-43.8	153.7	-176.4	0	0	0	0	0	112.9	D604	D604-G606 PolarHBondContact O-N 3.16Å
607	S	56.5	Low	64.7	Low	88 Å²	88	83.8 Å²	83.8	62%	0.615	47%	0.469	S	S	*	.			trans	-44.5	137.6	178.8	-56.5	0	0	0	0	110.9	S609	S607-S609 PolarHBondContact O-N 2.94Å
608	P	67.9	Low	66.1	Low	24 Å²	24	82.2 Å²	82.2	16%	0.156	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-54.1	144.7	176.4	23	-32.2	0	0	0	109.5	T723 F725 R733 S735	P608-T723 HydrophobicContact CB-CG2 4.48Å; P608-F725 HydrophobicContact CB-CB 4.13Å; P608-F725 HydrophobicContact CG-CB 4.17Å; P608-R733 HydrophobicContact CG-CB 4.1Å; P608-S735 WeakPolarHBondContact O-CA 3.25Å; P608-S735 WeakPolarHBondContact O-CB 3.48Å
609	S	74.8	Confident	67.5	Low	67 Å²	67	80.8 Å²	80.8	47%	0.469	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-64.5	138.2	-176.8	-47.7	0	0	0	0	110.6	S607 P631 T723	S607-S609 PolarHBondContact O-N 2.94Å; S609-P631 WeakPolarHBondContact O-CG 3.46Å; S609-T723 PolarHBondContact O-OG1 3.07Å; S609-T723 VanDerWaalsContact O-OG1 3.07Å
610	P	82.2	Confident	68.6	Low	54 Å²	54	84 Å²	84	35%	0.351	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-64.1	153.5	175.8	23	-31	0	0	0	111.9	D736 V738	P610-D736 WeakPolarHBondContact CB-O 3.39Å; P610-V738 HydrophobicContact CB-CG2 3.62Å
611	P	85	Confident	70	Confident	4 Å²	4	81.5 Å²	81.5	3%	0.026	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-57.9	142.9	174.9	-19.3	31.6	0	0	0	111.2	W628 Y662 V721 T723 V738	P611-W628 HydrophobicContact CB-CB 3.99Å; P611-W628 HydrophobicContact CB-CG 3.96Å; P611-Y662 HydrophobicContact CG-CD1 4.06Å; P611-Y662 HydrophobicContact CG-CE1 4.27Å; P611-V721 HydrophobicContact CB-CG1 4.21Å; P611-V721 HydrophobicContact CG-CB 4.38Å; P611-V721 HydrophobicContact CG-CG1 3.76Å; P611-T723 WeakPolarHBondContact CD-OG1 3.42Å; P611-T723 WeakPolarHBondContact CG-OG1 3.46Å; P611-V738 WeakPolarHBondContact O-CG2 3.49Å
612	T	82.4	Confident	71.9	Confident	80 Å²	80	78.9 Å²	78.9	49%	0.491	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	153.1	-177	-33.8	0	0	0	0	111.3	V614 I629	T612-V614 PolarHBondContact O-N 3.06Å; T612-I629 PolarHBondContact N-O 3.3Å; T612-I629 VanDerWaalsContact N-O 3.13Å; T612-I629 WeakPolarHBondContact O-CB 3.41Å; T612-I629 PolarHBondContact O-N 3.18Å
613	K	83.9	Confident	74.4	Confident	144 Å²	144	73 Å²	73	63%	0.626	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.1	53.5	179	-59	-166.8	-175.1	177.4	0	113.1	Q615 I629	K613-Q615 PolarHBondContact O-N 3.38Å; K613-I629 HydrophobicContact CB-CD1 3.99Å; K613-I629 HydrophobicContact CB-CG1 4.27Å; K613-I629 HydrophobicContact CD-CD1 3.76Å; K613-I629 HydrophobicContact CG-CD1 4.16Å
614	V	87.6	Confident	77	Confident	19 Å²	19	66.7 Å²	66.7	12%	0.115	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	125.1	170.5	-173.1	0	0	0	0	108.2	T612 I626 S627 W628 V721 V738 V740	T612-V614 PolarHBondContact O-N 3.06Å; V614-I626 HydrophobicContact CG1-CG2 3.85Å; V614-S627 CarbonylContact C-O 3.5Å; V614-S627 WeakPolarHBondContact CA-O 2.87Å; V614-W628 HydrophobicContact CG2-CB 3.99Å; V614-V721 HydrophobicContact CG1-CG2 3.93Å; V614-V721 HydrophobicContact CG2-CB 4.4Å; V614-V721 HydrophobicContact CG2-CG2 4.34Å; V614-V738 HydrophobicContact CB-CG1 4.23Å; V614-V738 HydrophobicContact CG2-CB 3.96Å; V614-V738 HydrophobicContact CG2-CG1 3.51Å; V614-V740 HydrophobicContact CB-CG1 3.73Å; V614-V740 HydrophobicContact CG1-CB 4.35Å; V614-V740 HydrophobicContact CG1-CG1 3.67Å; V614-V740 HydrophobicContact CG1-CG2 3.68Å
615	Q	90.3	Very high	79.8	Confident	110 Å²	110	62.4 Å²	62.4	51%	0.514	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	146.4	-176.9	-70.4	-178.5	-10.4	0	0	110.3	K613 I626 S627	K613-Q615 PolarHBondContact O-N 3.38Å; Q615-I626 CarbonylContact O-C 3.5Å; Q615-I626 WeakPolarHBondContact O-CA 3.27Å; Q615-S627 PolarHBondContact N-O 2.96Å; Q615-S627 PolarHBondContact O-N 3.38Å
616	V	91.3	Very high	82.2	Confident	49 Å²	49	58.1 Å²	58.1	30%	0.297	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.6	175.2	-174.1	0	0	0	0	108.3	Y624 I626 V740 F742	V616-Y624 HydrophobicContact CG1-CD1 3.91Å; V616-I626 HydrophobicContact CB-CD1 4.21Å; V616-I626 HydrophobicContact CG1-CD1 3.89Å; V616-I626 HydrophobicContact CG2-CD1 3.77Å; V616-V740 HydrophobicContact CG2-CB 4.32Å; V616-V740 HydrophobicContact CG2-CG2 3.84Å; V616-F742 HydrophobicContact CB-CD1 4.28Å; V616-F742 HydrophobicContact CB-CG 4.46Å; V616-F742 HydrophobicContact CG1-CB 4.17Å; V616-F742 HydrophobicContact CG1-CD1 3.6Å; V616-F742 HydrophobicContact CG1-CD2 3.98Å; V616-F742 HydrophobicContact CG1-CE1 3.87Å; V616-F742 HydrophobicContact CG1-CE2 4.25Å; V616-F742 HydrophobicContact CG1-CG 3.65Å; V616-F742 HydrophobicContact CG1-CZ 4.18Å; V616-F742 HydrophobicContact CG2-CD1 3.81Å; V616-F742 HydrophobicContact CG2-CE1 4.37Å; V616-F742 HydrophobicContact CG2-CG 4.38Å
617	I	90.2	Very high	84.3	Confident	74 Å²	74	56.4 Å²	56.4	38%	0.379	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	119.3	179.8	-56.5	168.3	0	0	0	107.7	Y624 R625	I617-Y624 CarbonylContact O-C 3.36Å; I617-Y624 WeakPolarHBondContact O-CA 3.48Å; I617-R625 HydrophobicContact CB-CB 4.27Å; I617-R625 PolarHBondContact N-O 3Å; I617-R625 PolarHBondContact O-N 3.47Å
618	H	90.5	Very high	85.9	Confident	81 Å²	81	52.5 Å²	52.5	38%	0.375	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	129.6	171.2	-179.8	-127.4	0	0	0	109.8	S621 Y624	H618-S621 PolarHBondContact NE2-O 3.36Å; H618-Y624 HydrophobicContact CB-CD1 4.03Å; H618-Y624 HydrophobicContact CB-CE1 3.73Å; H618-Y624 AromaticContact CD2-CE1 3.6Å; H618-Y624 AromaticContact CD2-CE2 3.81Å; H618-Y624 AromaticContact CD2-CZ 3.41Å; H618-Y624 VanDerWaalsContact CD2-CZ 3.41Å; H618-Y624 AromaticContact CG-CE1 3.94Å
619	I	86.1	Confident	86.7	Confident	84 Å²	84	55.7 Å²	55.7	43%	0.431	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-68.8	-179.8	-62.4	163.6	0	0	0	109.7	N623 R625 V707	I619-N623 PolarHBondContact N-O 3.4Å; I619-R625 HydrophobicContact CD1-CB 3.75Å; I619-R625 HydrophobicContact CG1-CB 4.11Å; I619-V707 HydrophobicContact CD1-CB 4.41Å; I619-V707 HydrophobicContact CD1-CG1 3.69Å; I619-V707 HydrophobicContact CD1-CG2 3.77Å
620	D	79.6	Confident	87	Confident	84 Å²	84	56.2 Å²	56.2	45%	0.449	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	159.3	-179.7	60.5	9.9	0	0	0	109.9	L622 N623	D620-L622 PolarHBondContact O-N 3.28Å; D620-N623 WeakPolarHBondContact O-CB 3.35Å; D620-N623 PolarHBondContact O-N 3.04Å; D620-N623 PolarHBondContact OD1-ND2 3.02Å
621	S	80.6	Confident	86.4	Confident	62 Å²	62	54.3 Å²	54.3	43%	0.434	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	44	-114.2	178	-52.7	0	0	0	0	112.2	H618 I745	H618-S621 PolarHBondContact NE2-O 3.36Å; S621-I745 VanDerWaalsContact O-CD1 3.22Å; S621-I745 WeakPolarHBondContact O-CD1 3.49Å; S621-I745 WeakPolarHBondContact O-CG1 3.43Å
622	L	86.1	Confident	84.9	Confident	17 Å²	17	60.1 Å²	60.1	9%	0.089	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	29.5	177.3	-63.7	162.6	0	0	0	112.2	D620 Q710 L711 P713 I745 M750	D620-L622 PolarHBondContact O-N 3.28Å; L622-Q710 PolarHBondContact O-N 3.08Å; L622-L711 WeakPolarHBondContact CB-O 3.07Å; L622-L711 WeakPolarHBondContact CD1-O 3.42Å; L622-L711 WeakPolarHBondContact CG-O 3.34Å; L622-L711 PolarHBondContact O-N 3.37Å; L622-P713 HydrophobicContact CD1-CB 4.1Å; L622-P713 HydrophobicContact CD1-CG 4.36Å; L622-P713 HydrophobicContact CD2-CB 3.95Å; L622-I745 HydrophobicContact CD2-CG1 4.23Å; L622-M750 HydrophobicContact CD1-CE 4.13Å; L622-M750 HydrophobicContact CD2-CE 4.1Å; L622-M750 HydrophobicContact CG-CE 3.7Å
623	N	88.6	Confident	83.5	Confident	21 Å²	21	59.4 Å²	59.4	11%	0.112	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	128.6	179.1	-54.4	-37.9	0	0	0	110.7	I619 D620 V707 L708 N709 Q710	I619-N623 PolarHBondContact N-O 3.4Å; D620-N623 WeakPolarHBondContact O-CB 3.35Å; D620-N623 PolarHBondContact O-N 3.04Å; D620-N623 PolarHBondContact OD1-ND2 3.02Å; N623-V707 HydrophobicContact CB-CG1 4.5Å; N623-L708 CarbonylContact C-O 3.58Å; N623-L708 VanDerWaalsContact CA-O 3.29Å; N623-L708 WeakPolarHBondContact CA-O 3.16Å; N623-N709 WeakPolarHBondContact OD1-CA 3.42Å; N623-N709 WeakPolarHBondContact OD1-CB 3.45Å; N623-N709 PolarHBondContact OD1-OD1 3.36Å; N623-Q710 PolarHBondContact OD1-N 3.07Å
624	Y	90.6	Very high	81.6	Confident	10 Å²	10	58.1 Å²	58.1	4%	0.039	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	133.4	-176	-70.9	-99.3	0	0	0	110.6	V616 I617 H618 V707 L708 L711 F742 T744 I745	V616-Y624 HydrophobicContact CG1-CD1 3.91Å; I617-Y624 CarbonylContact O-C 3.36Å; I617-Y624 WeakPolarHBondContact O-CA 3.48Å; H618-Y624 HydrophobicContact CB-CD1 4.03Å; H618-Y624 HydrophobicContact CB-CE1 3.73Å; H618-Y624 AromaticContact CD2-CE1 3.6Å; H618-Y624 AromaticContact CD2-CE2 3.81Å; H618-Y624 AromaticContact CD2-CZ 3.41Å; H618-Y624 VanDerWaalsContact CD2-CZ 3.41Å; H618-Y624 AromaticContact CG-CE1 3.94Å; Y624-V707 CarbonylContact O-C 3.42Å; Y624-V707 WeakPolarHBondContact O-CA 3.45Å; Y624-L708 PolarHBondContact N-O 3.49Å; Y624-L708 PolarHBondContact O-N 3.43Å; Y624-L711 HydrophobicContact CD2-CD1 3.84Å; Y624-L711 HydrophobicContact CG-CD1 4.44Å; Y624-F742 AromaticContact CD1-CD2 3.7Å; Y624-F742 HydrophobicContact CD1-CD2 3.7Å; Y624-F742 AromaticContact CD1-CE2 3.33Å; Y624-F742 HydrophobicContact CD1-CE2 3.33Å; Y624-F742 HydrophobicContact CD1-CZ 4.07Å; Y624-F742 AromaticContact CD2-CE2 3.68Å; Y624-F742 HydrophobicContact CD2-CE2 3.68Å; Y624-F742 HydrophobicContact CD2-CZ 4.27Å; Y624-F742 AromaticContact CE1-CD2 3.69Å; Y624-F742 HydrophobicContact CE1-CD2 3.69Å; Y624-F742 AromaticContact CE1-CE2 3.62Å; Y624-F742 HydrophobicContact CE1-CE2 3.62Å; Y624-F742 AromaticContact CE2-CE2 3.97Å; Y624-F742 HydrophobicContact CE2-CE2 3.97Å; Y624-F742 HydrophobicContact CG-CD2 4.2Å; Y624-F742 AromaticContact CG-CE2 3.36Å; Y624-F742 HydrophobicContact CG-CE2 3.36Å; Y624-F742 AromaticContact CG-CZ 3.81Å; Y624-F742 HydrophobicContact CG-CZ 3.81Å; Y624-F742 AromaticContact CZ-CE2 3.94Å; Y624-T744 HydrophobicContact CD2-CG2 4.43Å; Y624-T744 HydrophobicContact CE2-CG2 3.79Å; Y624-T744 VanDerWaalsContact OH-CA 3.28Å; Y624-T744 WeakPolarHBondContact OH-CA 3.29Å; Y624-I745 PolarHBondContact OH-N 3.18Å
625	R	91.9	Very high	79.5	Confident	90 Å²	90	64.2 Å²	64.2	34%	0.34	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	123.7	172.6	-178.4	-178.7	-127.9	-176.4	2.3	109.9	I617 I619 W705 I706 V707	I617-R625 HydrophobicContact CB-CB 4.27Å; I617-R625 PolarHBondContact N-O 3Å; I617-R625 PolarHBondContact O-N 3.47Å; I619-R625 HydrophobicContact CD1-CB 3.75Å; I619-R625 HydrophobicContact CG1-CB 4.11Å; R625-W705 HydrophobicContact CG-CB 4.45Å; R625-W705 HydrophobicContact CG-CE3 4.48Å; R625-W705 VanDerWaalsContact NH2-CD2 3.3Å; R625-W705 VanDerWaalsContact NH2-CE2 3.26Å; R625-I706 CarbonylContact C-O 3.55Å; R625-I706 WeakPolarHBondContact CA-O 3.41Å; R625-V707 HydrophobicContact CB-CG2 4.23Å; R625-V707 HydrophobicContact CG-CG2 4.33Å
626	I	92.4	Very high	77.1	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	124.4	168.5	-45.9	-60.7	0	0	0	107.4	V614 Q615 V616 W628 W705 I706 L708 V719 V721 F742	V614-I626 HydrophobicContact CG1-CG2 3.85Å; Q615-I626 CarbonylContact O-C 3.5Å; Q615-I626 WeakPolarHBondContact O-CA 3.27Å; V616-I626 HydrophobicContact CB-CD1 4.21Å; V616-I626 HydrophobicContact CG1-CD1 3.89Å; V616-I626 HydrophobicContact CG2-CD1 3.77Å; I626-W628 HydrophobicContact CB-CZ3 4.45Å; I626-W628 HydrophobicContact CG2-CE3 4.27Å; I626-W628 HydrophobicContact CG2-CZ3 4.21Å; I626-W628 WeakPolarHBondContact O-CZ3 3.3Å; I626-W705 CarbonylContact O-C 3.53Å; I626-W705 WeakPolarHBondContact O-CA 3.32Å; I626-W705 WeakPolarHBondContact O-CB 3.27Å; I626-I706 HydrophobicContact CB-CG2 3.84Å; I626-I706 HydrophobicContact CG1-CG2 4.28Å; I626-I706 PolarHBondContact N-O 2.89Å; I626-I706 PolarHBondContact O-N 3.21Å; I626-L708 HydrophobicContact CD1-CD1 4.06Å; I626-L708 HydrophobicContact CG1-CD1 3.74Å; I626-L708 HydrophobicContact CG1-CG 3.92Å; I626-V719 HydrophobicContact CD1-CG2 4.08Å; I626-V719 HydrophobicContact CG1-CG1 4.24Å; I626-V719 HydrophobicContact CG1-CG2 4.42Å; I626-V719 HydrophobicContact CG2-CG1 4.16Å; I626-V721 HydrophobicContact CG2-CG2 4.31Å; I626-F742 HydrophobicContact CD1-CE1 3.95Å
627	S	91.1	Very high	74.6	Confident	23 Å²	23	69 Å²	69	16%	0.161	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	143.9	179.1	56.2	0	0	0	0	111.2	V614 Q615 T704	V614-S627 CarbonylContact C-O 3.5Å; V614-S627 WeakPolarHBondContact CA-O 2.87Å; Q615-S627 PolarHBondContact N-O 2.96Å; Q615-S627 PolarHBondContact O-N 3.38Å; S627-T704 CarbonylContact C-O 3.57Å; S627-T704 WeakPolarHBondContact CA-O 3.24Å
628	W	90.5	Very high	72.1	Confident	6 Å²	6	70.2 Å²	70.2	2%	0.023	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	170.9	177.1	55.9	94.7	0	0	0	110.8	P611 V614 I626 Y662 V664 I699 T704 I706 V721	P611-W628 HydrophobicContact CB-CB 3.99Å; P611-W628 HydrophobicContact CB-CG 3.96Å; V614-W628 HydrophobicContact CG2-CB 3.99Å; I626-W628 HydrophobicContact CB-CZ3 4.45Å; I626-W628 HydrophobicContact CG2-CE3 4.27Å; I626-W628 HydrophobicContact CG2-CZ3 4.21Å; I626-W628 WeakPolarHBondContact O-CZ3 3.3Å; W628-Y662 AromaticContact CD1-CD1 4Å; W628-Y662 AromaticContact CD1-CE1 3.87Å; W628-Y662 AromaticContact CE2-CD2 3.97Å; W628-Y662 AromaticContact CE2-CG 3.78Å; W628-Y662 AromaticContact CZ2-CD2 3.94Å; W628-Y662 HydrophobicContact CZ2-CD2 3.94Å; W628-Y662 AromaticContact CZ2-CG 3.87Å; W628-Y662 HydrophobicContact CZ2-CG 3.87Å; W628-Y662 AromaticContact NE1-CD1 3.28Å; W628-Y662 VanDerWaalsContact NE1-CD1 3.28Å; W628-Y662 AromaticContact NE1-CD2 3.39Å; W628-Y662 AromaticContact NE1-CE1 3.45Å; W628-Y662 AromaticContact NE1-CE2 3.56Å; W628-Y662 AromaticContact NE1-CG 3.25Å; W628-Y662 VanDerWaalsContact NE1-CG 3.25Å; W628-Y662 AromaticContact NE1-CZ 3.58Å; W628-V664 HydrophobicContact CH2-CG2 3.61Å; W628-V664 HydrophobicContact CZ2-CG2 4.24Å; W628-V664 HydrophobicContact CZ3-CG2 3.95Å; W628-I699 HydrophobicContact CH2-CD1 3.36Å; W628-I699 HydrophobicContact CZ2-CD1 3.79Å; W628-T704 PolarHBondContact N-O 3.15Å; W628-T704 WeakPolarHBondContact O-CB 3.43Å; W628-T704 PolarHBondContact O-OG1 3.05Å; W628-I706 HydrophobicContact CH2-CB 4.37Å; W628-I706 HydrophobicContact CH2-CG2 4.08Å; W628-I706 HydrophobicContact CZ3-CG2 3.92Å; W628-V721 HydrophobicContact CD2-CG1 3.76Å; W628-V721 HydrophobicContact CE3-CG1 3.93Å; W628-V721 HydrophobicContact CE3-CG2 4.22Å; W628-V721 HydrophobicContact CG-CG1 4.18Å; W628-V721 HydrophobicContact CZ2-CG1 4.43Å; W628-V721 HydrophobicContact CZ3-CG1 4.35Å
629	I	85.4	Confident	69.5	Low	90 Å²	90	70.1 Å²	70.1	46%	0.462	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	132.4	173.6	-58	-178.8	0	0	0	108.3	T612 K613	T612-I629 PolarHBondContact N-O 3.3Å; T612-I629 VanDerWaalsContact N-O 3.13Å; T612-I629 WeakPolarHBondContact O-CB 3.41Å; T612-I629 PolarHBondContact O-N 3.18Å; K613-I629 HydrophobicContact CB-CD1 3.99Å; K613-I629 HydrophobicContact CB-CG1 4.27Å; K613-I629 HydrophobicContact CD-CD1 3.76Å; K613-I629 HydrophobicContact CG-CD1 4.16Å
630	K	80.4	Confident	66.9	Low	78 Å²	78	75.6 Å²	75.6	34%	0.339	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-56	133.6	173.8	175.1	166.9	-175	-179.2	0	110.1	M632 Y662 T704	K630-M632 PolarHBondContact O-N 3.47Å; K630-Y662 WeakPolarHBondContact CA-OH 3.37Å; K630-Y662 WeakPolarHBondContact CB-OH 3.48Å; K630-Y662 WeakPolarHBondContact CG-OH 3.3Å; K630-T704 HydrophobicContact CB-CG2 4.14Å
631	P	70.5	Confident	64.9	Low	14 Å²	14	79.1 Å²	79.1	9%	0.091	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-63.6	133.8	176.2	-5.6	15	0	0	0	110.6	S609 T633 T723	S609-P631 WeakPolarHBondContact O-CG 3.46Å; P631-T633 PolarHBondContact O-N 2.9Å; P631-T723 HydrophobicContact CG-CG2 4.28Å
632	M	53.5	Low	62.8	Low	126 Å²	126	80.8 Å²	80.8	62%	0.621	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-67.6	117.3	172.8	-78.2	-169	167.6	0	0	109.3	K630	K630-M632 PolarHBondContact O-N 3.47Å
633	T	51.6	Low	60.3	Low	65 Å²	65	86.7 Å²	86.7	40%	0.399	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-74	141.1	169.8	54.5	0	0	0	0	108.7	P631 M635 D636	P631-T633 PolarHBondContact O-N 2.9Å; T633-M635 PolarHBondContact O-N 2.04Å; T633-D636 PolarHBondContact O-N 3.36Å
634	T	45.6	Very low	57.8	Low	117 Å²	117	94.8 Å²	94.8	72%	0.718	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-17.5	-178	30	0	0	0	0	114.2	D636 K637	T634-D636 VanDerWaalsContact C-N 3.34Å; T634-D636 PolarHBondContact O-N 3.38Å; T634-K637 PolarHBondContact O-N 2.05Å
635	M	43.5	Very low	55	Low	147 Å²	147	102.1 Å²	102.1	72%	0.724	51%	0.51	S	S	*	.	H	α-helix	trans	-68	-28.1	172.7	-81.8	-74.1	145.7	0	0	113.6	T633 K637 T639	T633-M635 PolarHBondContact O-N 2.04Å; M635-K637 VanDerWaalsContact C-N 3.29Å; M635-K637 PolarHBondContact O-N 3.06Å; M635-T639 PolarHBondContact O-OG1 3.09Å
636	D	40	Very low	52.1	Low	96 Å²	96	103.4 Å²	103.4	51%	0.513	53%	0.533	S	S	.	.	H	α-helix	trans	-78	-14.4	176.5	-76.3	-19.5	0	0	0	112.9	T633 T634	T633-D636 PolarHBondContact O-N 3.36Å; T634-D636 VanDerWaalsContact C-N 3.34Å; T634-D636 PolarHBondContact O-N 3.38Å
637	K	37.4	Very low	49.1	Very low	163 Å²	163	108.5 Å²	108.5	71%	0.709	57%	0.569	S	S	*	*	H	α-helix	trans	-75.9	-28	174.6	-95.2	-173.9	176.6	-179.6	0	112.9	T634 M635	T634-K637 PolarHBondContact O-N 2.05Å; M635-K637 VanDerWaalsContact C-N 3.29Å; M635-K637 PolarHBondContact O-N 3.06Å
638	V	37.8	Very low	46.2	Very low	101 Å²	101	114.8 Å²	114.8	61%	0.612	60%	0.6	S	S	*	*	H	α-helix	trans	-79.9	-27	-179.1	-176.5	0	0	0	0	111.5
639	T	36	Very low	43.1	Very low	78 Å²	78	119.5 Å²	119.5	48%	0.479	63%	0.633	S	S	.	*	H	α-helix	trans	-81.4	-17.4	-176	-17	0	0	0	0	114.3	M635	M635-T639 PolarHBondContact O-OG1 3.09Å
640	R	32.9	Very low	40.3	Very low	200 Å²	200	119.4 Å²	119.4	76%	0.755	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-12.9	179.4	-75.5	-167.3	-165.3	-178.7	4.6	115.4
641	D	35.6	Very low	37.8	Very low	158 Å²	158	121.9 Å²	121.9	85%	0.845	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	6.2	-178.3	-134.4	1.7	0	0	0	114.1
642	V	37.1	Very low	35.9	Very low	97 Å²	97	126.9 Å²	126.9	59%	0.588	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.3	-8.6	-179.3	-172	0	0	0	0	113.8	K644 H645	V642-K644 PolarHBondContact O-N 3.04Å; V642-H645 PolarHBondContact O-N 3.4Å
643	D	34.8	Very low	34.9	Very low	140 Å²	140	127.7 Å²	127.7	75%	0.749	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	34	-178.2	-79.2	-19.3	0	0	0	115.1
644	K	34.3	Very low	34	Very low	191 Å²	191	134 Å²	134	83%	0.83	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	-9.4	164.7	-101.2	-175.4	179.2	180	0	116.1	V642	V642-K644 PolarHBondContact O-N 3.04Å
645	H	33.9	Very low	33.5	Very low	165 Å²	165	136.2 Å²	136.2	76%	0.764	73%	0.733	S	S	*	*	S	Bend	trans	-148.9	101.5	173.5	-72.6	-72	0	0	0	111.8	V642	V642-H645 PolarHBondContact O-N 3.4Å
646	S	31	Very low	33.3	Very low	116 Å²	116	135.7 Å²	135.7	81%	0.811	73%	0.733	S	S	*	*			trans	147.1	94.9	136	57.6	0	0	0	0	111.2	L648	S646-L648 PolarHBondContact O-N 3.02Å
647	S	28.6	Very low	33.8	Very low	108 Å²	108	133 Å²	133	76%	0.755	73%	0.728	S	S	*	*			trans	-55.4	113.4	144.1	49.8	0	0	0	0	108.5
648	L	29.1	Very low	34.7	Very low	155 Å²	155	128.6 Å²	128.6	81%	0.812	71%	0.712	S	S	*	*			trans	172.4	132.1	132.9	-111.8	73	0	0	0	111.4	S646	S646-L648 PolarHBondContact O-N 3.02Å
649	S	26.3	Very low	36	Very low	104 Å²	104	125.7 Å²	125.7	73%	0.727	70%	0.696	S	S	*	*			trans	94.7	127.6	145.8	86.6	0	0	0	0	120
650	S	27.1	Very low	38	Very low	89 Å²	89	122.4 Å²	122.4	62%	0.622	68%	0.676	S	S	*	*			trans	68	94.8	156.7	59.7	0	0	0	0	118.1	V652	S650-V652 PolarHBondContact O-N 2.98Å
651	S	27.7	Very low	40.4	Very low	130 Å²	130	114.9 Å²	114.9	91%	0.909	65%	0.649	S	S	*	*				-18.6	66.4	129.5	-36.3	0	0	0	0	115.5
652	V	30.8	Very low	42.7	Very low	118 Å²	118	107.3 Å²	107.3	72%	0.715	61%	0.608	S	S	*	*			trans	-89.4	111.2	164.5	178	0	0	0	0	106.1	S650 K654	S650-V652 PolarHBondContact O-N 2.98Å; V652-K654 PolarHBondContact O-N 3.08Å
653	N	31.9	Very low	45.1	Very low	143 Å²	143	105 Å²	105	77%	0.765	59%	0.589	S	S	*	*			trans	-39.5	106.1	173.6	-73.7	-31.7	0	0	0	110.2	I655	N653-I655 VanDerWaalsContact C-N 3.26Å; N653-I655 PolarHBondContact O-N 3.07Å
654	K	32.9	Very low	47.6	Very low	199 Å²	199	98.4 Å²	98.4	87%	0.865	55%	0.553	S	S	*	*			trans	-62.3	92.7	167.6	-102.3	179.4	173.7	176.4	0	106.9	V652 N656	V652-K654 PolarHBondContact O-N 3.08Å; K654-N656 PolarHBondContact O-N 3.48Å
655	I	34	Very low	50	Low	163 Å²	163	91 Å²	91	84%	0.836	52%	0.522	S	S	*	.			trans	-71.5	82.1	169.5	-59.4	171.2	0	0	0	106	N653 G657	N653-I655 VanDerWaalsContact C-N 3.26Å; N653-I655 PolarHBondContact O-N 3.07Å; I655-G657 VanDerWaalsContact C-N 3.32Å; I655-G657 PolarHBondContact O-N 3.07Å; I655-G657 VanDerWaalsContact O-N 3.09Å
656	N	41.3	Very low	52.8	Low	136 Å²	136	84.6 Å²	84.6	73%	0.727	49%	0.492	S	S	*	.			trans	-84.9	71.1	-172.8	-153.3	29.3	0	0	0	109.1	K654	K654-N656 PolarHBondContact O-N 3.48Å
657	G	48.7	Very low	55.5	Low	40 Å²	40	79.1 Å²	79.1	41%	0.412	45%	0.453	S	S	.	.			trans	-96.8	6.7	-168.2	0	0	0	0	0	116.7	I655	I655-G657 VanDerWaalsContact C-N 3.32Å; I655-G657 PolarHBondContact O-N 3.07Å; I655-G657 VanDerWaalsContact O-N 3.09Å
658	N	57.6	Low	58.5	Low	70 Å²	70	74.3 Å²	74.3	37%	0.374	42%	0.419	S	S	.	.			trans	-95.9	112.7	177.9	-68.9	-18.2	0	0	0	109.4	Q701 F725	N658-Q701 PolarHBondContact O-OE1 2.97Å; N658-Q701 VanDerWaalsContact O-OE1 3.1Å; N658-F725 HydrophobicContact CB-CE2 3.75Å; N658-F725 HydrophobicContact CB-CZ 3.64Å
659	S	65.6	Low	61.2	Low	39 Å²	39	70.2 Å²	70.2	27%	0.273	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	117.6	177.1	-169.2	0	0	0	0	109.6	Q701 I726	S659-Q701 VanDerWaalsContact CA-OE1 3.23Å; S659-I726 PolarHBondContact N-O 2.76Å; S659-I726 PolarHBondContact O-N 3.21Å
660	T	77	Confident	64.1	Low	10 Å²	10	67.9 Å²	67.9	6%	0.061	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	133.6	163.7	-47.1	0	0	0	0	107.9	Y662 Q701 T723 L724	T660-Y662 HydrophobicContact CG2-CE1 4.25Å; T660-Q701 WeakPolarHBondContact O-CA 3.39Å; T660-Q701 WeakPolarHBondContact O-CB 3.07Å; T660-Q701 PolarHBondContact O-N 3.37Å; T660-Q701 VanDerWaalsContact O-N 3.14Å; T660-T723 HydrophobicContact CG2-CG2 3.54Å; T660-L724 CarbonylContact C-O 3.53Å; T660-L724 WeakPolarHBondContact CA-O 3.22Å
661	K	83	Confident	66.5	Low	41 Å²	41	72.1 Å²	72.1	18%	0.178	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	165.9	169.5	-58.3	-167.3	-178.1	-144.7	0	108.5	V698 I699 D700 L724 I726	K661-V698 HydrophobicContact CB-CG1 4.02Å; K661-V698 HydrophobicContact CD-CG1 4.04Å; K661-I699 CarbonylContact C-O 3.4Å; K661-I699 WeakPolarHBondContact CA-O 3.49Å; K661-I699 VanDerWaalsContact CB-O 3.31Å; K661-I699 WeakPolarHBondContact CB-O 3.11Å; K661-D700 VanDerWaalsContact CD-OD1 3.28Å; K661-D700 WeakPolarHBondContact CD-OD1 3.21Å; K661-D700 WeakPolarHBondContact CE-OD1 3.45Å; K661-D700 IonicContact NZ-OD1 3.63Å; K661-D700 PolarHBondContact NZ-OD1 2.92Å; K661-L724 HydrophobicContact CB-CB 4.13Å; K661-L724 PolarHBondContact N-O 3.3Å; K661-L724 PolarHBondContact O-N 2.86Å; K661-L724 VanDerWaalsContact O-O 3.14Å; K661-I726 HydrophobicContact CD-CD1 3.8Å; K661-I726 HydrophobicContact CG-CD1 4.17Å
662	Y	85	Confident	68.6	Low	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.1	176.4	-55.6	-78.9	0	0	0	110.6	P611 W628 K630 T660 V698 I699 T704 Q722 T723	P611-Y662 HydrophobicContact CG-CD1 4.06Å; P611-Y662 HydrophobicContact CG-CE1 4.27Å; W628-Y662 AromaticContact CD1-CD1 4Å; W628-Y662 AromaticContact CD1-CE1 3.87Å; W628-Y662 AromaticContact CE2-CD2 3.97Å; W628-Y662 AromaticContact CE2-CG 3.78Å; W628-Y662 AromaticContact CZ2-CD2 3.94Å; W628-Y662 HydrophobicContact CZ2-CD2 3.94Å; W628-Y662 AromaticContact CZ2-CG 3.87Å; W628-Y662 HydrophobicContact CZ2-CG 3.87Å; W628-Y662 AromaticContact NE1-CD1 3.28Å; W628-Y662 VanDerWaalsContact NE1-CD1 3.28Å; W628-Y662 AromaticContact NE1-CD2 3.39Å; W628-Y662 AromaticContact NE1-CE1 3.45Å; W628-Y662 AromaticContact NE1-CE2 3.56Å; W628-Y662 AromaticContact NE1-CG 3.25Å; W628-Y662 VanDerWaalsContact NE1-CG 3.25Å; W628-Y662 AromaticContact NE1-CZ 3.58Å; K630-Y662 WeakPolarHBondContact CA-OH 3.37Å; K630-Y662 WeakPolarHBondContact CB-OH 3.48Å; K630-Y662 WeakPolarHBondContact CG-OH 3.3Å; T660-Y662 HydrophobicContact CG2-CE1 4.25Å; Y662-V698 CarbonylContact O-C 3.41Å; Y662-V698 VanDerWaalsContact O-CA 3.31Å; Y662-V698 WeakPolarHBondContact O-CA 3.05Å; Y662-I699 PolarHBondContact N-O 2.89Å; Y662-I699 PolarHBondContact O-N 3.23Å; Y662-T704 HydrophobicContact CE2-CG2 4.16Å; Y662-Q722 CarbonylContact C-O 3.54Å; Y662-Q722 WeakPolarHBondContact CA-O 3.32Å; Y662-T723 HydrophobicContact CE1-CG2 4.24Å
663	R	86.3	Confident	70.8	Confident	49 Å²	49	68.1 Å²	68.1	19%	0.185	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	119.6	169.3	-175.3	-172.9	-66	144.1	-0.6	108.2	M665 I696 K697 V698 V721 Q722 L724 E734	R663-M665 HydrophobicContact CG-CG 4.06Å; R663-M665 HydrophobicContact CG-SD 4.46Å; R663-I696 HydrophobicContact CG-CG2 3.86Å; R663-K697 CarbonylContact C-O 3.57Å; R663-K697 WeakPolarHBondContact CA-O 3.25Å; R663-V698 HydrophobicContact CB-CG2 4.45Å; R663-V698 HydrophobicContact CG-CG2 4.38Å; R663-V721 CarbonylContact O-C 3.47Å; R663-V721 WeakPolarHBondContact O-CA 3.18Å; R663-Q722 HydrophobicContact CB-CB 4.28Å; R663-Q722 PolarHBondContact N-O 3.25Å; R663-Q722 PolarHBondContact O-N 2.98Å; R663-L724 HydrophobicContact CB-CD1 4.05Å; R663-L724 HydrophobicContact CB-CG 4.24Å; R663-E734 IonicContact CZ-OE1 2.7Å; R663-E734 IonicContact CZ-OE2 2.75Å; R663-E734 IonicContact NH1-OE1 2.69Å; R663-E734 PolarHBondContact NH1-OE1 3.01Å; R663-E734 IonicContact NH1-OE2 3.11Å; R663-E734 PolarHBondContact NH1-OE2 3.38Å; R663-E734 IonicContact NH2-OE1 2.88Å; R663-E734 PolarHBondContact NH2-OE1 3.45Å; R663-E734 IonicContact NH2-OE2 2.99Å
664	V	87.8	Confident	72.9	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.6	173.9	-172.1	0	0	0	0	108.6	W628 W666 I696 K697 I699 I706 V719 H720 V721	W628-V664 HydrophobicContact CH2-CG2 3.61Å; W628-V664 HydrophobicContact CZ2-CG2 4.24Å; W628-V664 HydrophobicContact CZ3-CG2 3.95Å; V664-W666 HydrophobicContact CG1-CE3 4.15Å; V664-I696 CarbonylContact O-C 3.56Å; V664-I696 WeakPolarHBondContact O-CA 3.05Å; V664-K697 PolarHBondContact N-O 3Å; V664-K697 PolarHBondContact O-N 2.92Å; V664-I699 HydrophobicContact CB-CD1 4.48Å; V664-I699 HydrophobicContact CG2-CD1 3.55Å; V664-I706 HydrophobicContact CB-CG2 4.47Å; V664-I706 HydrophobicContact CG1-CG2 4.08Å; V664-I706 HydrophobicContact CG2-CG2 4.22Å; V664-V719 HydrophobicContact CG1-CG1 3.67Å; V664-H720 CarbonylContact C-O 3.48Å; V664-H720 VanDerWaalsContact CA-O 3.29Å; V664-H720 WeakPolarHBondContact CA-O 3.46Å; V664-V721 HydrophobicContact CG1-CG2 4.34Å; V664-V721 HydrophobicContact CG2-CG1 4.19Å; V664-V721 HydrophobicContact CG2-CG2 4.41Å
665	M	85.5	Confident	74.9	Confident	36 Å²	36	58.3 Å²	58.3	18%	0.177	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.8	177.5	-47.8	-164.3	-61.2	0	0	109.3	R663 M689 I694 D695 I696 V719 H720	R663-M665 HydrophobicContact CG-CG 4.06Å; R663-M665 HydrophobicContact CG-SD 4.46Å; M665-M689 HydrophobicContact CB-CE 4.46Å; M665-I694 HydrophobicContact CB-CD1 4.19Å; M665-I694 HydrophobicContact SD-CD1 4.38Å; M665-D695 CarbonylContact C-O 3.5Å; M665-D695 VanDerWaalsContact CA-O 3.26Å; M665-D695 WeakPolarHBondContact CA-O 3.42Å; M665-I696 HydrophobicContact CB-CG1 3.93Å; M665-I696 HydrophobicContact CG-CB 4.04Å; M665-I696 HydrophobicContact CG-CD1 4.24Å; M665-I696 HydrophobicContact CG-CG1 3.64Å; M665-I696 HydrophobicContact CG-CG2 3.72Å; M665-I696 HydrophobicContact SD-CB 4.47Å; M665-I696 HydrophobicContact SD-CD1 3.59Å; M665-I696 VanDerWaalsContact SD-CD1 3.59Å; M665-I696 HydrophobicContact SD-CG1 3.69Å; M665-I696 HydrophobicContact SD-CG2 4.11Å; M665-V719 CarbonylContact O-C 3.5Å; M665-V719 VanDerWaalsContact O-CA 3.28Å; M665-V719 WeakPolarHBondContact O-CA 3.44Å; M665-H720 HydrophobicContact CB-CB 4.49Å; M665-H720 HydrophobicContact CE-CB 4.4Å; M665-H720 PolarHBondContact N-O 2.98Å; M665-H720 PolarHBondContact O-N 3.27Å
666	W	91.5	Very high	76.7	Confident	31 Å²	31	54.5 Å²	54.5	12%	0.117	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	145.3	177.1	66.6	93.9	0	0	0	112.2	V664 D695 K697 I706 L708 I718 V719	V664-W666 HydrophobicContact CG1-CE3 4.15Å; W666-D695 HydrophobicContact CD2-CB 3.89Å; W666-D695 HydrophobicContact CE3-CB 4.39Å; W666-D695 HydrophobicContact CG-CB 4.45Å; W666-D695 HydrophobicContact CH2-CB 3.96Å; W666-D695 HydrophobicContact CZ2-CB 3.38Å; W666-D695 HydrophobicContact CZ3-CB 4.42Å; W666-D695 PolarHBondContact N-O 3.39Å; W666-D695 PolarHBondContact O-N 3.36Å; W666-K697 HydrophobicContact CH2-CB 4.08Å; W666-K697 HydrophobicContact CZ3-CB 3.84Å; W666-I706 HydrophobicContact CH2-CD1 4.26Å; W666-I706 HydrophobicContact CZ3-CD1 4.03Å; W666-L708 HydrophobicContact CB-CD1 4.13Å; W666-L708 HydrophobicContact CD2-CD1 4.22Å; W666-L708 HydrophobicContact CD2-CD2 3.51Å; W666-L708 HydrophobicContact CD2-CG 4.47Å; W666-L708 HydrophobicContact CE3-CD2 3.65Å; W666-L708 HydrophobicContact CG-CD1 3.89Å; W666-L708 HydrophobicContact CG-CD2 4.09Å; W666-L708 HydrophobicContact CH2-CD2 4.01Å; W666-L708 HydrophobicContact CZ2-CD2 3.88Å; W666-L708 HydrophobicContact CZ3-CD2 3.9Å; W666-I718 WeakPolarHBondContact CA-O 3.5Å; W666-V719 HydrophobicContact CB-CB 4.43Å; W666-V719 HydrophobicContact CB-CG1 4.45Å; W666-V719 HydrophobicContact CB-CG2 3.88Å
667	A	88.2	Confident	78.4	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	158.8	173.4	0	0	0	0	0	110.3	M689 D690 I694 Y717 I718	A667-M689 HydrophobicContact CB-CB 4.1Å; A667-M689 HydrophobicContact CB-CE 3.48Å; A667-M689 VanDerWaalsContact CB-CE 3.48Å; A667-M689 HydrophobicContact CB-CG 4.31Å; A667-D690 WeakPolarHBondContact CB-O 3.03Å; A667-I694 HydrophobicContact CB-CB 4.17Å; A667-I694 HydrophobicContact CB-CG1 4.45Å; A667-Y717 VanDerWaalsContact C-CD1 3.47Å; A667-Y717 WeakPolarHBondContact O-CA 3.11Å; A667-I718 PolarHBondContact N-O 3.07Å; A667-I718 VanDerWaalsContact N-O 3.08Å; A667-I718 PolarHBondContact O-N 3.14Å
668	P	91	Very high	79.8	Confident	7 Å²	7	56.8 Å²	56.8	5%	0.045	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	157.5	165.9	28.8	-34.9	0	0	0	111.1	D690 Q693 T715 L716 Y717	P668-D690 VanDerWaalsContact O-CB 3.31Å; P668-D690 WeakPolarHBondContact O-CB 3.4Å; P668-D690 PolarHBondContact O-N 2.97Å; P668-Q693 HydrophobicContact CG-CB 3.66Å; P668-Q693 HydrophobicContact CG-CG 4.27Å; P668-T715 HydrophobicContact CB-CG2 3.65Å; P668-L716 CarbonylContact C-O 3.53Å; P668-L716 WeakPolarHBondContact CA-O 3.3Å; P668-Y717 HydrophobicContact CB-CE1 4.38Å
669	R	87	Confident	80.7	Confident	69 Å²	69	54.5 Å²	54.5	26%	0.26	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-61	136.7	174	-167.3	-167.5	38.3	175.5	0.5	111.2	V674 Y679 P687 L716 I718	R669-V674 PolarHBondContact NH1-O 3.3Å; R669-V674 VanDerWaalsContact NH1-O 3.12Å; R669-Y679 WeakPolarHBondContact CD-OH 3.36Å; R669-Y679 PolarHBondContact NH1-OH 3.45Å; R669-P687 HydrophobicContact CG-CB 4.12Å; R669-L716 HydrophobicContact CB-CB 4.13Å; R669-L716 HydrophobicContact CB-CD2 4.04Å; R669-L716 HydrophobicContact CB-CG 4.19Å; R669-L716 HydrophobicContact CG-CD2 4.08Å; R669-L716 PolarHBondContact N-O 3.34Å; R669-I718 VanDerWaalsContact CA-CD1 3.44Å; R669-I718 HydrophobicContact CB-CD1 3.73Å; R669-I718 HydrophobicContact CG-CD1 4.17Å
670	I	85.5	Confident	81.1	Confident	55 Å²	55	55.5 Å²	55.5	28%	0.282	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-65.5	154.9	167	-160.5	168	0	0	0	110.4	E672 I688 D690	I670-E672 HydrophobicContact CG2-CG 3.78Å; I670-E672 PolarHBondContact O-N 2.95Å; I670-E672 VanDerWaalsContact O-N 3.13Å; I670-I688 HydrophobicContact CG2-CB 3.82Å; I670-I688 HydrophobicContact CG2-CG2 4.04Å; I670-I688 PolarHBondContact N-O 3.44Å; I670-D690 HydrophobicContact CB-CB 4.08Å; I670-D690 HydrophobicContact CG1-CB 4.45Å
671	H	78.7	Confident	80.7	Confident	178 Å²	178	58.8 Å²	58.8	82%	0.824	30%	0.303	S	S	*	.			trans	-69.6	113.8	176.8	-176.3	63.7	0	0	0	110.2
672	E	72.1	Confident	79.9	Confident	31 Å²	31	65.7 Å²	65.7	15%	0.145	34%	0.336	C	S	.	.			trans	-121.7	147.8	176.6	-61.4	178.8	-111.3	0	0	109.5	I670 V674 Y679 I688	I670-E672 HydrophobicContact CG2-CG 3.78Å; I670-E672 PolarHBondContact O-N 2.95Å; I670-E672 VanDerWaalsContact O-N 3.13Å; E672-V674 HydrophobicContact CB-CG2 3.87Å; E672-V674 PolarHBondContact O-N 3.36Å; E672-Y679 PolarHBondContact OE1-OH 3.08Å; E672-I688 PolarHBondContact OE1-N 2.04Å; E672-I688 VanDerWaalsContact OE1-N 3.09Å
673	P	76.4	Confident	79.2	Confident	134 Å²	134	72.3 Å²	72.3	87%	0.87	37%	0.37	S	S	*	.	S	Bend	trans	-77.4	30.5	-179.5	35	-37.6	0	0	0	112.9
674	V	75.6	Confident	77.9	Confident	34 Å²	34	72.9 Å²	72.9	21%	0.206	39%	0.391	C	S	.	.	S	Bend	trans	-127.6	140.8	-178.1	-65	0	0	0	0	110.7	R669 E672 M678 Y679 F685	R669-V674 PolarHBondContact NH1-O 3.3Å; R669-V674 VanDerWaalsContact NH1-O 3.12Å; E672-V674 HydrophobicContact CB-CG2 3.87Å; E672-V674 PolarHBondContact O-N 3.36Å; V674-M678 HydrophobicContact CB-SD 4.28Å; V674-M678 HydrophobicContact CG1-SD 4.33Å; V674-Y679 HydrophobicContact CG2-CE1 3.97Å; V674-F685 HydrophobicContact CG1-CE1 4.41Å; V674-F685 HydrophobicContact CG1-CZ 4.16Å; V674-F685 HydrophobicContact CG2-CE1 4.28Å; V674-F685 HydrophobicContact CG2-CZ 4.28Å
675	D	75.5	Confident	77	Confident	102 Å²	102	77.3 Å²	77.3	55%	0.545	41%	0.411	S	S	.	.			trans	-69	150.2	175.1	-163	-86.8	0	0	0	110.2	S677 M678	D675-S677 PolarHBondContact O-N 2.96Å; D675-S677 WeakPolarHBondContact OD1-CB 3.23Å; D675-S677 PolarHBondContact OD1-N 3.39Å; D675-S677 PolarHBondContact OD1-OG 3.4Å; D675-M678 WeakPolarHBondContact O-CB 3.13Å; D675-M678 PolarHBondContact O-N 2.02Å
676	E	72.3	Confident	76.7	Confident	82 Å²	82	78 Å²	78	38%	0.383	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-56.3	-32.5	175.1	179.1	179.5	164.1	0	0	111.9	M678 Y679 L716 T743	E676-M678 PolarHBondContact O-N 3.48Å; E676-M678 VanDerWaalsContact O-N 3.16Å; E676-Y679 VanDerWaalsContact O-CD2 3.27Å; E676-Y679 WeakPolarHBondContact O-CD2 3.21Å; E676-Y679 PolarHBondContact O-N 3.44Å; E676-L716 HydrophobicContact CG-CD1 4.45Å; E676-L716 HydrophobicContact CG-CD2 4.12Å; E676-T743 PolarHBondContact OE1-OG1 3.27Å; E676-T743 PolarHBondContact OE2-OG1 3.31Å; E676-T743 VanDerWaalsContact OE2-OG1 3.09Å
677	S	76.3	Confident	76.3	Confident	104 Å²	104	77 Å²	77	73%	0.727	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-69.5	-7.7	178.7	78.4	0	0	0	0	114.4	D675	D675-S677 PolarHBondContact O-N 2.96Å; D675-S677 WeakPolarHBondContact OD1-CB 3.23Å; D675-S677 PolarHBondContact OD1-N 3.39Å; D675-S677 PolarHBondContact OD1-OG 3.4Å
678	M	78	Confident	75.9	Confident	121 Å²	121	81.7 Å²	81.7	60%	0.596	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-88.8	-12.3	179.3	-73.5	-170.4	163.1	0	0	113.8	V674 D675 E676	V674-M678 HydrophobicContact CB-SD 4.28Å; V674-M678 HydrophobicContact CG1-SD 4.33Å; D675-M678 WeakPolarHBondContact O-CB 3.13Å; D675-M678 PolarHBondContact O-N 2.02Å; E676-M678 PolarHBondContact O-N 3.48Å; E676-M678 VanDerWaalsContact O-N 3.16Å
679	Y	76.3	Confident	75.5	Confident	22 Å²	22	82.1 Å²	82.1	9%	0.086	44%	0.442	C	S	.	.			trans	-69.1	134.2	-179.3	-63.2	-56.2	0	0	0	112	R669 E672 V674 E676 F685 P687 L716	R669-Y679 WeakPolarHBondContact CD-OH 3.36Å; R669-Y679 PolarHBondContact NH1-OH 3.45Å; E672-Y679 PolarHBondContact OE1-OH 3.08Å; V674-Y679 HydrophobicContact CG2-CE1 3.97Å; E676-Y679 VanDerWaalsContact O-CD2 3.27Å; E676-Y679 WeakPolarHBondContact O-CD2 3.21Å; E676-Y679 PolarHBondContact O-N 3.44Å; Y679-F685 CarbonylContact C-O 3.56Å; Y679-F685 WeakPolarHBondContact CA-O 3.08Å; Y679-F685 HydrophobicContact CD1-CD1 4.02Å; Y679-F685 HydrophobicContact CD1-CE1 4.09Å; Y679-F685 HydrophobicContact CE1-CE1 4.21Å; Y679-P687 HydrophobicContact CD1-CB 4.29Å; Y679-P687 HydrophobicContact CD2-CB 4.11Å; Y679-P687 HydrophobicContact CD2-CG 4.26Å; Y679-P687 HydrophobicContact CE1-CB 3.95Å; Y679-P687 HydrophobicContact CE2-CB 3.74Å; Y679-P687 HydrophobicContact CE2-CG 4.38Å; Y679-P687 HydrophobicContact CG-CB 4.39Å; Y679-P687 HydrophobicContact CG-CG 4.39Å; Y679-L716 HydrophobicContact CD2-CD2 4.31Å; Y679-L716 HydrophobicContact CE2-CD2 3.8Å
680	N	74.1	Confident	75.2	Confident	59 Å²	59	79 Å²	79	32%	0.316	43%	0.431	S	S	.	.	B	Isolated β-bridge	trans	-146.3	103.8	176.8	-173.9	-11.9	0	0	0	110.2	E682 I683 G684 F685	N680-E682 PolarHBondContact O-N 3.11Å; N680-E682 VanDerWaalsContact OD1-CB 3.32Å; N680-E682 WeakPolarHBondContact OD1-CB 3.33Å; N680-E682 PolarHBondContact OD1-N 2.8Å; N680-I683 WeakPolarHBondContact ND2-CD1 3.18Å; N680-I683 PolarHBondContact O-N 3.03Å; N680-G684 PolarHBondContact O-N 3.3Å; N680-F685 CarbonylContact C-O 3.56Å; N680-F685 PolarHBondContact N-O 2.63Å; N680-F685 PolarHBondContact O-N 3.21Å
681	D	68.7	Low	74.8	Confident	80 Å²	80	82 Å²	82	43%	0.428	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-64.3	-26.1	-180	-62.1	-29.1	0	0	0	112.9	I683 G684 S686 Y741	D681-I683 VanDerWaalsContact C-N 3.27Å; D681-I683 PolarHBondContact O-N 3.03Å; D681-G684 PolarHBondContact O-N 2.86Å; D681-G684 VanDerWaalsContact O-N 3.09Å; D681-S686 WeakPolarHBondContact OD1-CB 3.45Å; D681-S686 PolarHBondContact OD1-OG 3.33Å; D681-Y741 VanDerWaalsContact OD1-CE1 3.28Å; D681-Y741 WeakPolarHBondContact OD1-CE1 3.26Å; D681-Y741 PolarHBondContact OD1-OH 2.98Å; D681-Y741 VanDerWaalsContact OD2-CE1 3.26Å; D681-Y741 WeakPolarHBondContact OD2-CE1 3.31Å; D681-Y741 PolarHBondContact OD2-OH 3.22Å
682	E	67.2	Low	74.4	Confident	185 Å²	185	79.9 Å²	79.9	86%	0.864	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-67.9	-28	179.6	-58.9	-172.2	164.5	0	0	112.5	N680	N680-E682 PolarHBondContact O-N 3.11Å; N680-E682 VanDerWaalsContact OD1-CB 3.32Å; N680-E682 WeakPolarHBondContact OD1-CB 3.33Å; N680-E682 PolarHBondContact OD1-N 2.8Å
683	I	68.3	Low	74.4	Confident	140 Å²	140	81.8 Å²	81.8	72%	0.718	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-96.1	-2.7	176.3	-54.7	172.1	0	0	0	110.4	N680 D681	N680-I683 WeakPolarHBondContact ND2-CD1 3.18Å; N680-I683 PolarHBondContact O-N 3.03Å; D681-I683 VanDerWaalsContact C-N 3.27Å; D681-I683 PolarHBondContact O-N 3.03Å
684	G	60.6	Low	74.7	Confident	61 Å²	61	77 Å²	77	63%	0.629	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	20.4	-176.5	0	0	0	0	0	114.1	N680 D681	N680-G684 PolarHBondContact O-N 3.3Å; D681-G684 PolarHBondContact O-N 2.86Å; D681-G684 VanDerWaalsContact O-N 3.09Å
685	F	68.1	Low	74.9	Confident	92 Å²	92	78.9 Å²	78.9	40%	0.404	42%	0.416	S	S	.	.	B	Isolated β-bridge	trans	-101.3	83	177	-162.6	-111.7	0	0	0	110.4	V674 Y679 N680	V674-F685 HydrophobicContact CG1-CE1 4.41Å; V674-F685 HydrophobicContact CG1-CZ 4.16Å; V674-F685 HydrophobicContact CG2-CE1 4.28Å; V674-F685 HydrophobicContact CG2-CZ 4.28Å; Y679-F685 CarbonylContact C-O 3.56Å; Y679-F685 WeakPolarHBondContact CA-O 3.08Å; Y679-F685 HydrophobicContact CD1-CD1 4.02Å; Y679-F685 HydrophobicContact CD1-CE1 4.09Å; Y679-F685 HydrophobicContact CE1-CE1 4.21Å; N680-F685 CarbonylContact C-O 3.56Å; N680-F685 PolarHBondContact N-O 2.63Å; N680-F685 PolarHBondContact O-N 3.21Å
686	S	79.5	Confident	75.2	Confident	51 Å²	51	75.4 Å²	75.4	36%	0.357	40%	0.397	S	S	.	.			trans	-109.8	151.1	-176.2	-54.3	0	0	0	0	111.5	D681	D681-S686 WeakPolarHBondContact OD1-CB 3.45Å; D681-S686 PolarHBondContact OD1-OG 3.33Å
687	P	82.2	Confident	75.5	Confident	10 Å²	10	73 Å²	73	7%	0.065	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-62.9	143.5	178.8	24.4	-32.9	0	0	0	112.4	R669 Y679 L716 I718 Y741	R669-P687 HydrophobicContact CG-CB 4.12Å; Y679-P687 HydrophobicContact CD1-CB 4.29Å; Y679-P687 HydrophobicContact CD2-CB 4.11Å; Y679-P687 HydrophobicContact CD2-CG 4.26Å; Y679-P687 HydrophobicContact CE1-CB 3.95Å; Y679-P687 HydrophobicContact CE2-CB 3.74Å; Y679-P687 HydrophobicContact CE2-CG 4.38Å; Y679-P687 HydrophobicContact CG-CB 4.39Å; Y679-P687 HydrophobicContact CG-CG 4.39Å; P687-L716 HydrophobicContact CB-CD2 4.09Å; P687-L716 HydrophobicContact CG-CD2 4.44Å; P687-I718 HydrophobicContact CB-CD1 4.12Å; P687-I718 HydrophobicContact CB-CG1 3.93Å; P687-I718 HydrophobicContact CG-CD1 4.47Å; P687-I718 HydrophobicContact CG-CG1 3.79Å; P687-Y741 HydrophobicContact CG-CD1 3.57Å; P687-Y741 HydrophobicContact CG-CD2 3.97Å; P687-Y741 HydrophobicContact CG-CE1 3.99Å; P687-Y741 HydrophobicContact CG-CE2 4.33Å; P687-Y741 HydrophobicContact CG-CG 3.57Å
688	I	81.2	Confident	75.7	Confident	99 Å²	99	69.2 Å²	69.2	51%	0.508	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-93.4	130.7	178.4	-57.1	174.3	0	0	0	109.7	I670 E672	I670-I688 HydrophobicContact CG2-CB 3.82Å; I670-I688 HydrophobicContact CG2-CG2 4.04Å; I670-I688 PolarHBondContact N-O 3.44Å; E672-I688 PolarHBondContact OE1-N 2.04Å; E672-I688 VanDerWaalsContact OE1-N 3.09Å
689	M	82.3	Confident	75.8	Confident	15 Å²	15	63.8 Å²	63.8	7%	0.074	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-72.9	136.9	176.9	95	-175	-60	0	0	111.4	M665 A667 L691 I694 I718	M665-M689 HydrophobicContact CB-CE 4.46Å; A667-M689 HydrophobicContact CB-CB 4.1Å; A667-M689 HydrophobicContact CB-CE 3.48Å; A667-M689 VanDerWaalsContact CB-CE 3.48Å; A667-M689 HydrophobicContact CB-CG 4.31Å; M689-L691 HydrophobicContact CG-CD2 3.54Å; M689-L691 HydrophobicContact CG-CG 4.22Å; M689-L691 PolarHBondContact O-N 2.9Å; M689-L691 HydrophobicContact SD-CD2 3.64Å; M689-I694 HydrophobicContact CE-CB 4.27Å; M689-I694 HydrophobicContact CE-CD1 3.32Å; M689-I694 HydrophobicContact CE-CG1 3.47Å; M689-I694 VanDerWaalsContact CE-CG1 3.47Å; M689-I694 HydrophobicContact SD-CD1 3.59Å; M689-I694 VanDerWaalsContact SD-CD1 3.59Å; M689-I694 HydrophobicContact SD-CG1 4.37Å; M689-I718 HydrophobicContact CB-CB 4.13Å; M689-I718 HydrophobicContact CB-CD1 4.48Å; M689-I718 HydrophobicContact CB-CG2 4.43Å
690	D	80.6	Confident	75.7	Confident	4 Å²	4	67 Å²	67	2%	0.021	35%	0.35	C	S	.	.			trans	-75.7	94.4	171.8	-171.7	-2.5	0	0	0	109.8	A667 P668 I670 R692 Q693	A667-D690 WeakPolarHBondContact CB-O 3.03Å; P668-D690 VanDerWaalsContact O-CB 3.31Å; P668-D690 WeakPolarHBondContact O-CB 3.4Å; P668-D690 PolarHBondContact O-N 2.97Å; I670-D690 HydrophobicContact CB-CB 4.08Å; I670-D690 HydrophobicContact CG1-CB 4.45Å; D690-R692 PolarHBondContact O-N 2.8Å; D690-R692 WeakPolarHBondContact OD1-CB 3.18Å; D690-R692 WeakPolarHBondContact OD1-CG 3.45Å; D690-R692 IonicContact OD1-CZ 2.76Å; D690-R692 PolarHBondContact OD1-N 2.91Å; D690-R692 IonicContact OD1-NE 3.47Å; D690-R692 PolarHBondContact OD1-NE 3.3Å; D690-R692 IonicContact OD1-NH2 2.8Å; D690-R692 PolarHBondContact OD1-NH2 3.31Å; D690-R692 IonicContact OD2-CZ 3.73Å; D690-R692 IonicContact OD2-NE 2.7Å; D690-R692 PolarHBondContact OD2-NE 3.14Å; D690-R692 IonicContact OD2-NH2 2.68Å; D690-R692 PolarHBondContact OD2-NH2 3Å; D690-Q693 PolarHBondContact O-N 2.93Å; D690-Q693 PolarHBondContact OD2-NE2 2.95Å
691	L	75.9	Confident	75.2	Confident	118 Å²	118	66.1 Å²	66.1	62%	0.618	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-57.7	-14	178.2	-62.1	179.1	0	0	0	113.6	M689 Q693 I694	M689-L691 HydrophobicContact CG-CD2 3.54Å; M689-L691 HydrophobicContact CG-CG 4.22Å; M689-L691 PolarHBondContact O-N 2.9Å; M689-L691 HydrophobicContact SD-CD2 3.64Å; L691-Q693 VanDerWaalsContact C-N 3.26Å; L691-I694 HydrophobicContact CD2-CD1 3.79Å; L691-I694 WeakPolarHBondContact O-CG2 3.07Å
692	R	70.3	Confident	75.1	Confident	133 Å²	133	69.6 Å²	69.6	50%	0.502	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-74.8	-17.2	173.6	-55.6	171.2	-65.1	178	5.3	112.9	D690	D690-R692 PolarHBondContact O-N 2.8Å; D690-R692 WeakPolarHBondContact OD1-CB 3.18Å; D690-R692 WeakPolarHBondContact OD1-CG 3.45Å; D690-R692 IonicContact OD1-CZ 2.76Å; D690-R692 PolarHBondContact OD1-N 2.91Å; D690-R692 IonicContact OD1-NE 3.47Å; D690-R692 PolarHBondContact OD1-NE 3.3Å; D690-R692 IonicContact OD1-NH2 2.8Å; D690-R692 PolarHBondContact OD1-NH2 3.31Å; D690-R692 IonicContact OD2-CZ 3.73Å; D690-R692 IonicContact OD2-NE 2.7Å; D690-R692 PolarHBondContact OD2-NE 3.14Å; D690-R692 IonicContact OD2-NH2 2.68Å; D690-R692 PolarHBondContact OD2-NH2 3Å
693	Q	73.9	Confident	75.6	Confident	72 Å²	72	63.3 Å²	63.3	34%	0.336	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-125.5	26.4	-177.4	-65.1	-179.9	79.4	0	0	111.5	P668 D690 L691	P668-Q693 HydrophobicContact CG-CB 3.66Å; P668-Q693 HydrophobicContact CG-CG 4.27Å; D690-Q693 PolarHBondContact O-N 2.93Å; D690-Q693 PolarHBondContact OD2-NE2 2.95Å; L691-Q693 VanDerWaalsContact C-N 3.26Å
694	I	81	Confident	76.4	Confident	32 Å²	32	58.7 Å²	58.7	16%	0.164	31%	0.311	C	S	.	.			trans	-79.7	134.3	-178.4	-168.5	170.1	0	0	0	112.2	M665 A667 M689 L691 I696	M665-I694 HydrophobicContact CB-CD1 4.19Å; M665-I694 HydrophobicContact SD-CD1 4.38Å; A667-I694 HydrophobicContact CB-CB 4.17Å; A667-I694 HydrophobicContact CB-CG1 4.45Å; M689-I694 HydrophobicContact CE-CB 4.27Å; M689-I694 HydrophobicContact CE-CD1 3.32Å; M689-I694 HydrophobicContact CE-CG1 3.47Å; M689-I694 VanDerWaalsContact CE-CG1 3.47Å; M689-I694 HydrophobicContact SD-CD1 3.59Å; M689-I694 VanDerWaalsContact SD-CD1 3.59Å; M689-I694 HydrophobicContact SD-CG1 4.37Å; L691-I694 HydrophobicContact CD2-CD1 3.79Å; L691-I694 WeakPolarHBondContact O-CG2 3.07Å; I694-I696 HydrophobicContact CD1-CD1 4.04Å; I694-I696 HydrophobicContact CD1-CG1 3.95Å; I694-I696 HydrophobicContact CG1-CD1 4.38Å; I694-I696 HydrophobicContact CG1-CG1 3.88Å
695	D	81.3	Confident	77.8	Confident	74 Å²	74	60.4 Å²	60.4	40%	0.396	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	144.2	162.5	-77.6	-53	0	0	0	109.2	M665 W666	M665-D695 CarbonylContact C-O 3.5Å; M665-D695 VanDerWaalsContact CA-O 3.26Å; M665-D695 WeakPolarHBondContact CA-O 3.42Å; W666-D695 HydrophobicContact CD2-CB 3.89Å; W666-D695 HydrophobicContact CE3-CB 4.39Å; W666-D695 HydrophobicContact CG-CB 4.45Å; W666-D695 HydrophobicContact CH2-CB 3.96Å; W666-D695 HydrophobicContact CZ2-CB 3.38Å; W666-D695 HydrophobicContact CZ3-CB 4.42Å; W666-D695 PolarHBondContact N-O 3.39Å; W666-D695 PolarHBondContact O-N 3.36Å
696	I	81.2	Confident	78.7	Confident	30 Å²	30	56.1 Å²	56.1	15%	0.154	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	144.9	-178.7	-54.4	170.8	0	0	0	107.6	F429 R663 V664 M665 I694	F429-I696 HydrophobicContact CD2-CB 3.94Å; F429-I696 HydrophobicContact CD2-CD1 4.23Å; F429-I696 HydrophobicContact CD2-CG2 3.93Å; F429-I696 HydrophobicContact CE2-CB 3.46Å; F429-I696 VanDerWaalsContact CE2-CB 3.46Å; F429-I696 HydrophobicContact CE2-CD1 4.11Å; F429-I696 HydrophobicContact CE2-CG1 4.19Å; F429-I696 HydrophobicContact CE2-CG2 3.96Å; F429-I696 HydrophobicContact CZ-CB 3.99Å; F429-I696 WeakPolarHBondContact CZ-O 3.28Å; R663-I696 HydrophobicContact CG-CG2 3.86Å; V664-I696 CarbonylContact O-C 3.56Å; V664-I696 WeakPolarHBondContact O-CA 3.05Å; M665-I696 HydrophobicContact CB-CG1 3.93Å; M665-I696 HydrophobicContact CG-CB 4.04Å; M665-I696 HydrophobicContact CG-CD1 4.24Å; M665-I696 HydrophobicContact CG-CG1 3.64Å; M665-I696 HydrophobicContact CG-CG2 3.72Å; M665-I696 HydrophobicContact SD-CB 4.47Å; M665-I696 HydrophobicContact SD-CD1 3.59Å; M665-I696 VanDerWaalsContact SD-CD1 3.59Å; M665-I696 HydrophobicContact SD-CG1 3.69Å; M665-I696 HydrophobicContact SD-CG2 4.11Å; I694-I696 HydrophobicContact CD1-CD1 4.04Å; I694-I696 HydrophobicContact CD1-CG1 3.95Å; I694-I696 HydrophobicContact CG1-CD1 4.38Å; I694-I696 HydrophobicContact CG1-CG1 3.88Å
697	K	78.5	Confident	79.2	Confident	31 Å²	31	55 Å²	55	14%	0.135	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	140.3	179	-174.6	149.1	170.4	171.3	0	111.3	G368 Y369 R663 V664 W666 I699 I706	G368-K697 WeakPolarHBondContact O-CE 3.37Å; G368-K697 PolarHBondContact O-NZ 3Å; Y369-K697 VanDerWaalsContact CD2-NZ 3.29Å; R663-K697 CarbonylContact C-O 3.57Å; R663-K697 WeakPolarHBondContact CA-O 3.25Å; V664-K697 PolarHBondContact N-O 3Å; V664-K697 PolarHBondContact O-N 2.92Å; W666-K697 HydrophobicContact CH2-CB 4.08Å; W666-K697 HydrophobicContact CZ3-CB 3.84Å; K697-I699 HydrophobicContact CG-CG1 4.44Å; K697-I706 HydrophobicContact CB-CD1 4.1Å; K697-I706 HydrophobicContact CD-CD1 3.68Å; K697-I706 HydrophobicContact CG-CD1 4.07Å
698	V	80.7	Confident	79.6	Confident	24 Å²	24	54.6 Å²	54.6	15%	0.145	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.8	173	-176.3	0	0	0	0	109.6	K661 Y662 R663 L724	K661-V698 HydrophobicContact CB-CG1 4.02Å; K661-V698 HydrophobicContact CD-CG1 4.04Å; Y662-V698 CarbonylContact O-C 3.41Å; Y662-V698 VanDerWaalsContact O-CA 3.31Å; Y662-V698 WeakPolarHBondContact O-CA 3.05Å; R663-V698 HydrophobicContact CB-CG2 4.45Å; R663-V698 HydrophobicContact CG-CG2 4.38Å; V698-L724 HydrophobicContact CG1-CD1 3.97Å; V698-L724 HydrophobicContact CG2-CD1 4.37Å
699	I	80.2	Confident	79.8	Confident	7 Å²	7	54.3 Å²	54.3	4%	0.036	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	133.5	-173.5	-59.1	168.5	0	0	0	108.7	W628 K661 Y662 V664 K697 Q703 I706	W628-I699 HydrophobicContact CH2-CD1 3.36Å; W628-I699 HydrophobicContact CZ2-CD1 3.79Å; K661-I699 CarbonylContact C-O 3.4Å; K661-I699 WeakPolarHBondContact CA-O 3.49Å; K661-I699 VanDerWaalsContact CB-O 3.31Å; K661-I699 WeakPolarHBondContact CB-O 3.11Å; Y662-I699 PolarHBondContact N-O 2.89Å; Y662-I699 PolarHBondContact O-N 3.23Å; V664-I699 HydrophobicContact CB-CD1 4.48Å; V664-I699 HydrophobicContact CG2-CD1 3.55Å; K697-I699 HydrophobicContact CG-CG1 4.44Å; I699-Q703 HydrophobicContact CG2-CB 3.62Å; I699-Q703 HydrophobicContact CG2-CG 3.77Å; I699-Q703 VanDerWaalsContact CG2-O 3.26Å; I699-Q703 WeakPolarHBondContact CG2-O 3.16Å; I699-I706 HydrophobicContact CD1-CB 3.73Å; I699-I706 HydrophobicContact CD1-CD1 4.06Å; I699-I706 HydrophobicContact CD1-CG1 4.32Å; I699-I706 HydrophobicContact CD1-CG2 4.25Å
700	D	73.4	Confident	79.8	Confident	89 Å²	89	60.5 Å²	60.5	48%	0.476	30%	0.297	S	S	.	.			trans	-77.2	164.6	-179.6	-70.1	-49.4	0	0	0	113.3	K661 D702 Q703	K661-D700 VanDerWaalsContact CD-OD1 3.28Å; K661-D700 WeakPolarHBondContact CD-OD1 3.21Å; K661-D700 WeakPolarHBondContact CE-OD1 3.45Å; K661-D700 IonicContact NZ-OD1 3.63Å; K661-D700 PolarHBondContact NZ-OD1 2.92Å; D700-D702 VanDerWaalsContact C-N 3.26Å; D700-D702 PolarHBondContact O-N 2.85Å; D700-Q703 PolarHBondContact O-N 3.02Å; D700-Q703 VanDerWaalsContact O-N 3.16Å
701	Q	64.1	Low	80.1	Confident	42 Å²	42	60.8 Å²	60.8	20%	0.196	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	-35.7	-162	-176.5	163.4	-43.4	0	0	117.4	N658 S659 T660 Q703	N658-Q701 PolarHBondContact O-OE1 2.97Å; N658-Q701 VanDerWaalsContact O-OE1 3.1Å; S659-Q701 VanDerWaalsContact CA-OE1 3.23Å; T660-Q701 WeakPolarHBondContact O-CA 3.39Å; T660-Q701 WeakPolarHBondContact O-CB 3.07Å; T660-Q701 PolarHBondContact O-N 3.37Å; T660-Q701 VanDerWaalsContact O-N 3.14Å; Q701-Q703 VanDerWaalsContact C-N 3.33Å
702	D	67.3	Low	80.6	Confident	153 Å²	153	60 Å²	60	82%	0.818	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-7.1	-166.6	-54.2	-29.1	0	0	0	112.2	D700	D700-D702 VanDerWaalsContact C-N 3.26Å; D700-D702 PolarHBondContact O-N 2.85Å
703	Q	76.5	Confident	81.5	Confident	53 Å²	53	56.1 Å²	56.1	25%	0.248	28%	0.282	C	S	.	.			trans	-112.2	114.3	-177.8	-178	172.6	-6.6	0	0	110.9	I699 D700 Q701 W705	I699-Q703 HydrophobicContact CG2-CB 3.62Å; I699-Q703 HydrophobicContact CG2-CG 3.77Å; I699-Q703 VanDerWaalsContact CG2-O 3.26Å; I699-Q703 WeakPolarHBondContact CG2-O 3.16Å; D700-Q703 PolarHBondContact O-N 3.02Å; D700-Q703 VanDerWaalsContact O-N 3.16Å; Q701-Q703 VanDerWaalsContact C-N 3.33Å; Q703-W705 HydrophobicContact CG-CD2 4.46Å; Q703-W705 WeakPolarHBondContact CG-O 3.37Å; Q703-W705 PolarHBondContact NE2-O 3.47Å
704	T	85.8	Confident	82.1	Confident	42 Å²	42	58 Å²	58	26%	0.258	29%	0.294	S	S	.	.			trans	-107	27.9	177.4	67.8	0	0	0	0	112.7	S627 W628 K630 Y662	S627-T704 CarbonylContact C-O 3.57Å; S627-T704 WeakPolarHBondContact CA-O 3.24Å; W628-T704 PolarHBondContact N-O 3.15Å; W628-T704 WeakPolarHBondContact O-CB 3.43Å; W628-T704 PolarHBondContact O-OG1 3.05Å; K630-T704 HydrophobicContact CB-CG2 4.14Å; Y662-T704 HydrophobicContact CE2-CG2 4.16Å
705	W	89.3	Confident	82.5	Confident	98 Å²	98	58.1 Å²	58.1	37%	0.371	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	154.3	177.1	61.7	-92	0	0	0	111.7	R625 I626 Q703 V707	R625-W705 HydrophobicContact CG-CB 4.45Å; R625-W705 HydrophobicContact CG-CE3 4.48Å; R625-W705 VanDerWaalsContact NH2-CD2 3.3Å; R625-W705 VanDerWaalsContact NH2-CE2 3.26Å; I626-W705 CarbonylContact O-C 3.53Å; I626-W705 WeakPolarHBondContact O-CA 3.32Å; I626-W705 WeakPolarHBondContact O-CB 3.27Å; Q703-W705 HydrophobicContact CG-CD2 4.46Å; Q703-W705 WeakPolarHBondContact CG-O 3.37Å; Q703-W705 PolarHBondContact NE2-O 3.47Å; W705-V707 HydrophobicContact CE3-CG2 4.15Å; W705-V707 HydrophobicContact CZ3-CG2 3.85Å
706	I	88.2	Confident	82.9	Confident	1 Å²	1	55 Å²	55	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	150	174.9	-176.1	172	0	0	0	109.7	R625 I626 W628 V664 W666 K697 I699 L708	R625-I706 CarbonylContact C-O 3.55Å; R625-I706 WeakPolarHBondContact CA-O 3.41Å; I626-I706 HydrophobicContact CB-CG2 3.84Å; I626-I706 HydrophobicContact CG1-CG2 4.28Å; I626-I706 PolarHBondContact N-O 2.89Å; I626-I706 PolarHBondContact O-N 3.21Å; W628-I706 HydrophobicContact CH2-CB 4.37Å; W628-I706 HydrophobicContact CH2-CG2 4.08Å; W628-I706 HydrophobicContact CZ3-CG2 3.92Å; V664-I706 HydrophobicContact CB-CG2 4.47Å; V664-I706 HydrophobicContact CG1-CG2 4.08Å; V664-I706 HydrophobicContact CG2-CG2 4.22Å; W666-I706 HydrophobicContact CH2-CD1 4.26Å; W666-I706 HydrophobicContact CZ3-CD1 4.03Å; K697-I706 HydrophobicContact CB-CD1 4.1Å; K697-I706 HydrophobicContact CD-CD1 3.68Å; K697-I706 HydrophobicContact CG-CD1 4.07Å; I699-I706 HydrophobicContact CD1-CB 3.73Å; I699-I706 HydrophobicContact CD1-CD1 4.06Å; I699-I706 HydrophobicContact CD1-CG1 4.32Å; I699-I706 HydrophobicContact CD1-CG2 4.25Å; I706-L708 HydrophobicContact CD1-CD2 4.28Å; I706-L708 HydrophobicContact CG1-CD2 4.37Å; I706-L708 HydrophobicContact CG2-CD2 4.36Å
707	V	89.5	Confident	83.5	Confident	27 Å²	27	54.4 Å²	54.4	16%	0.164	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.4	171.4	-178.8	0	0	0	0	109.5	Y369 I619 N623 Y624 R625 W705 N709	Y369-V707 PolarHBondContact OH-O 3.05Å; I619-V707 HydrophobicContact CD1-CB 4.41Å; I619-V707 HydrophobicContact CD1-CG1 3.69Å; I619-V707 HydrophobicContact CD1-CG2 3.77Å; N623-V707 HydrophobicContact CB-CG1 4.5Å; Y624-V707 CarbonylContact O-C 3.42Å; Y624-V707 WeakPolarHBondContact O-CA 3.45Å; R625-V707 HydrophobicContact CB-CG2 4.23Å; R625-V707 HydrophobicContact CG-CG2 4.33Å; W705-V707 HydrophobicContact CE3-CG2 4.15Å; W705-V707 HydrophobicContact CZ3-CG2 3.85Å; V707-N709 WeakPolarHBondContact CG1-OD1 3.47Å
708	L	89.9	Confident	84.1	Confident	2 Å²	2	53 Å²	53	1%	0.01	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	109.2	172	-50.7	-173.8	0	0	0	107.8	N623 Y624 I626 W666 I706 L711 V719 F742	N623-L708 CarbonylContact C-O 3.58Å; N623-L708 VanDerWaalsContact CA-O 3.29Å; N623-L708 WeakPolarHBondContact CA-O 3.16Å; Y624-L708 PolarHBondContact N-O 3.49Å; Y624-L708 PolarHBondContact O-N 3.43Å; I626-L708 HydrophobicContact CD1-CD1 4.06Å; I626-L708 HydrophobicContact CG1-CD1 3.74Å; I626-L708 HydrophobicContact CG1-CG 3.92Å; W666-L708 HydrophobicContact CB-CD1 4.13Å; W666-L708 HydrophobicContact CD2-CD1 4.22Å; W666-L708 HydrophobicContact CD2-CD2 3.51Å; W666-L708 HydrophobicContact CD2-CG 4.47Å; W666-L708 HydrophobicContact CE3-CD2 3.65Å; W666-L708 HydrophobicContact CG-CD1 3.89Å; W666-L708 HydrophobicContact CG-CD2 4.09Å; W666-L708 HydrophobicContact CH2-CD2 4.01Å; W666-L708 HydrophobicContact CZ2-CD2 3.88Å; W666-L708 HydrophobicContact CZ3-CD2 3.9Å; I706-L708 HydrophobicContact CD1-CD2 4.28Å; I706-L708 HydrophobicContact CG1-CD2 4.37Å; I706-L708 HydrophobicContact CG2-CD2 4.36Å; L708-L711 HydrophobicContact CB-CD1 4.07Å; L708-L711 HydrophobicContact CB-CD2 4.16Å; L708-L711 HydrophobicContact CB-CG 4.26Å; L708-L711 HydrophobicContact CD1-CD1 4.42Å; L708-V719 HydrophobicContact CD1-CG2 3.97Å; L708-F742 HydrophobicContact CD1-CZ 4.44Å
709	N	85.9	Confident	84.7	Confident	93 Å²	93	51.9 Å²	51.9	50%	0.497	26%	0.263	S	S	.	.			trans	-96.7	149.7	-175.9	-66.5	-42.5	0	0	0	111.6	N623 V707 L711	N623-N709 WeakPolarHBondContact OD1-CA 3.42Å; N623-N709 WeakPolarHBondContact OD1-CB 3.45Å; N623-N709 PolarHBondContact OD1-OD1 3.36Å; V707-N709 WeakPolarHBondContact CG1-OD1 3.47Å; N709-L711 VanDerWaalsContact C-N 3.33Å; N709-L711 PolarHBondContact O-N 3.37Å
710	Q	82.5	Confident	85.2	Confident	146 Å²	146	53.2 Å²	53.2	68%	0.682	27%	0.269	S	S	*	.	S	Bend	trans	55.2	43	169.1	-57.3	-64	-29.3	0	0	114	L622 N623	L622-Q710 PolarHBondContact O-N 3.08Å; N623-Q710 PolarHBondContact OD1-N 3.07Å
711	L	87.6	Confident	86	Confident	9 Å²	9	49 Å²	49	5%	0.047	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-66.1	159.2	174.1	-61.6	-174.5	0	0	0	111.1	L622 Y624 L708 N709 Y717 F742 T744	L622-L711 WeakPolarHBondContact CB-O 3.07Å; L622-L711 WeakPolarHBondContact CD1-O 3.42Å; L622-L711 WeakPolarHBondContact CG-O 3.34Å; L622-L711 PolarHBondContact O-N 3.37Å; Y624-L711 HydrophobicContact CD2-CD1 3.84Å; Y624-L711 HydrophobicContact CG-CD1 4.44Å; L708-L711 HydrophobicContact CB-CD1 4.07Å; L708-L711 HydrophobicContact CB-CD2 4.16Å; L708-L711 HydrophobicContact CB-CG 4.26Å; L708-L711 HydrophobicContact CD1-CD1 4.42Å; N709-L711 VanDerWaalsContact C-N 3.33Å; N709-L711 PolarHBondContact O-N 3.37Å; L711-Y717 HydrophobicContact CB-CD2 4.42Å; L711-Y717 HydrophobicContact CB-CE2 3.83Å; L711-Y717 HydrophobicContact CD1-CD1 4.48Å; L711-Y717 HydrophobicContact CD1-CD2 4.22Å; L711-Y717 HydrophobicContact CD1-CE2 4.38Å; L711-Y717 HydrophobicContact CD1-CG 4.26Å; L711-Y717 HydrophobicContact CD2-CD1 4.28Å; L711-Y717 HydrophobicContact CD2-CE1 3.77Å; L711-Y717 HydrophobicContact CD2-CE2 4.37Å; L711-Y717 HydrophobicContact CG-CE2 4.42Å; L711-F742 HydrophobicContact CD1-CE2 3.91Å; L711-F742 HydrophobicContact CD1-CZ 3.6Å; L711-T744 HydrophobicContact CB-CG2 3.83Å; L711-T744 HydrophobicContact CD1-CG2 4.03Å
712	K	86.3	Confident	87	Confident	102 Å²	102	48.2 Å²	48.2	44%	0.443	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-67.3	139.1	176.2	-67.6	177.7	179.7	179	0	110.2	T715 Y717 T744	K712-T715 HydrophobicContact CB-CG2 4.44Å; K712-T715 WeakPolarHBondContact CB-OG1 3.26Å; K712-Y717 HydrophobicContact CB-CE2 4.36Å; K712-Y717 PolarHBondContact N-OH 3.18Å; K712-T744 VanDerWaalsContact O-CB 3.31Å; K712-T744 WeakPolarHBondContact O-CB 3.22Å; K712-T744 PolarHBondContact O-OG1 2.83Å
713	P	88	Confident	87.8	Confident	51 Å²	51	41.1 Å²	41.1	33%	0.331	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	153.6	177.9	29.2	-33.4	0	0	0	111.5	L622 T715 T744 I745	L622-P713 HydrophobicContact CD1-CB 4.1Å; L622-P713 HydrophobicContact CD1-CG 4.36Å; L622-P713 HydrophobicContact CD2-CB 3.95Å; P713-T715 PolarHBondContact O-N 3.4Å; P713-T715 VanDerWaalsContact O-N 3.14Å; P713-T715 PolarHBondContact O-OG1 2.98Å; P713-T744 VanDerWaalsContact C-OG1 3.31Å; P713-I745 WeakPolarHBondContact CA-O 3.34Å
714	N	86.9	Confident	87.8	Confident	112 Å²	112	38.9 Å²	38.9	60%	0.599	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.2	44.4	177.3	-162.9	74.1	0	0	0	113.9	T744 I745 C746	N714-T744 WeakPolarHBondContact CA-O 3.47Å; N714-T744 PolarHBondContact N-O 3.02Å; N714-T744 PolarHBondContact N-OG1 3.34Å; N714-I745 PolarHBondContact N-O 3.06Å; N714-I745 VanDerWaalsContact N-O 3.09Å; N714-C746 HydrophobicContact CB-CB 4.44Å
715	T	89.6	Confident	87.1	Confident	35 Å²	35	38.4 Å²	38.4	22%	0.215	19%	0.189	C	C	.	.			trans	-129	130.3	-174.9	-59.1	0	0	0	0	109.4	P668 K712 P713 Y717 T744	P668-T715 HydrophobicContact CB-CG2 3.65Å; K712-T715 HydrophobicContact CB-CG2 4.44Å; K712-T715 WeakPolarHBondContact CB-OG1 3.26Å; P713-T715 PolarHBondContact O-N 3.4Å; P713-T715 VanDerWaalsContact O-N 3.14Å; P713-T715 PolarHBondContact O-OG1 2.98Å; T715-Y717 HydrophobicContact CG2-CD2 4.02Å; T715-Y717 HydrophobicContact CG2-CE2 3.72Å; T715-Y717 PolarHBondContact O-N 3.14Å; T715-T744 PolarHBondContact N-OG1 3.1Å; T715-T744 PolarHBondContact O-N 3.39Å; T715-T744 PolarHBondContact O-OG1 2.8Å
716	L	90	Very high	85.8	Confident	9 Å²	9	36 Å²	36	5%	0.047	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	118.8	173.3	178.5	63.3	0	0	0	109.4	P668 R669 E676 Y679 P687 Y741 T743	P668-L716 CarbonylContact C-O 3.53Å; P668-L716 WeakPolarHBondContact CA-O 3.3Å; R669-L716 HydrophobicContact CB-CB 4.13Å; R669-L716 HydrophobicContact CB-CD2 4.04Å; R669-L716 HydrophobicContact CB-CG 4.19Å; R669-L716 HydrophobicContact CG-CD2 4.08Å; R669-L716 PolarHBondContact N-O 3.34Å; E676-L716 HydrophobicContact CG-CD1 4.45Å; E676-L716 HydrophobicContact CG-CD2 4.12Å; Y679-L716 HydrophobicContact CD2-CD2 4.31Å; Y679-L716 HydrophobicContact CE2-CD2 3.8Å; P687-L716 HydrophobicContact CB-CD2 4.09Å; P687-L716 HydrophobicContact CG-CD2 4.44Å; L716-Y741 HydrophobicContact CD1-CD2 4.24Å; L716-T743 WeakPolarHBondContact CD1-OG1 3.41Å
717	Y	93.5	Very high	84.4	Confident	16 Å²	16	36.3 Å²	36.3	6%	0.063	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	142.1	175.7	-87.1	-94.1	0	0	0	111	A667 P668 L711 K712 T715 Y741 F742 T744	A667-Y717 VanDerWaalsContact C-CD1 3.47Å; A667-Y717 WeakPolarHBondContact O-CA 3.11Å; P668-Y717 HydrophobicContact CB-CE1 4.38Å; L711-Y717 HydrophobicContact CB-CD2 4.42Å; L711-Y717 HydrophobicContact CB-CE2 3.83Å; L711-Y717 HydrophobicContact CD1-CD1 4.48Å; L711-Y717 HydrophobicContact CD1-CD2 4.22Å; L711-Y717 HydrophobicContact CD1-CE2 4.38Å; L711-Y717 HydrophobicContact CD1-CG 4.26Å; L711-Y717 HydrophobicContact CD2-CD1 4.28Å; L711-Y717 HydrophobicContact CD2-CE1 3.77Å; L711-Y717 HydrophobicContact CD2-CE2 4.37Å; L711-Y717 HydrophobicContact CG-CE2 4.42Å; K712-Y717 HydrophobicContact CB-CE2 4.36Å; K712-Y717 PolarHBondContact N-OH 3.18Å; T715-Y717 HydrophobicContact CG2-CD2 4.02Å; T715-Y717 HydrophobicContact CG2-CE2 3.72Å; T715-Y717 PolarHBondContact O-N 3.14Å; Y717-Y741 CarbonylContact O-C 3.59Å; Y717-Y741 WeakPolarHBondContact O-CA 3.38Å; Y717-Y741 WeakPolarHBondContact O-CB 3.37Å; Y717-F742 PolarHBondContact N-O 2.96Å; Y717-F742 PolarHBondContact O-N 3.01Å; Y717-T744 HydrophobicContact CD2-CG2 3.74Å; Y717-T744 HydrophobicContact CE2-CG2 4.04Å
718	I	91.3	Very high	82.6	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	134.2	174	-57	87.3	0	0	0	107.7	W666 A667 R669 P687 M689	W666-I718 WeakPolarHBondContact CA-O 3.5Å; A667-I718 PolarHBondContact N-O 3.07Å; A667-I718 VanDerWaalsContact N-O 3.08Å; A667-I718 PolarHBondContact O-N 3.14Å; R669-I718 VanDerWaalsContact CA-CD1 3.44Å; R669-I718 HydrophobicContact CB-CD1 3.73Å; R669-I718 HydrophobicContact CG-CD1 4.17Å; P687-I718 HydrophobicContact CB-CD1 4.12Å; P687-I718 HydrophobicContact CB-CG1 3.93Å; P687-I718 HydrophobicContact CG-CD1 4.47Å; P687-I718 HydrophobicContact CG-CG1 3.79Å; M689-I718 HydrophobicContact CB-CB 4.13Å; M689-I718 HydrophobicContact CB-CD1 4.48Å; M689-I718 HydrophobicContact CB-CG2 4.43Å
719	V	92.8	Very high	80.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	125.4	179.4	-174.4	0	0	0	0	109.9	I626 V664 M665 W666 L708 V721 S739 V740 F742	I626-V719 HydrophobicContact CD1-CG2 4.08Å; I626-V719 HydrophobicContact CG1-CG1 4.24Å; I626-V719 HydrophobicContact CG1-CG2 4.42Å; I626-V719 HydrophobicContact CG2-CG1 4.16Å; V664-V719 HydrophobicContact CG1-CG1 3.67Å; M665-V719 CarbonylContact O-C 3.5Å; M665-V719 VanDerWaalsContact O-CA 3.28Å; M665-V719 WeakPolarHBondContact O-CA 3.44Å; W666-V719 HydrophobicContact CB-CB 4.43Å; W666-V719 HydrophobicContact CB-CG1 4.45Å; W666-V719 HydrophobicContact CB-CG2 3.88Å; L708-V719 HydrophobicContact CD1-CG2 3.97Å; V719-V721 HydrophobicContact CG1-CG2 4.32Å; V719-S739 CarbonylContact O-C 3.57Å; V719-S739 WeakPolarHBondContact O-CA 3.48Å; V719-V740 HydrophobicContact CB-CG2 3.92Å; V719-V740 PolarHBondContact N-O 3.4Å; V719-V740 PolarHBondContact O-N 3.32Å; V719-F742 HydrophobicContact CG2-CD1 4.47Å; V719-F742 HydrophobicContact CG2-CE1 3.79Å
720	H	90.2	Very high	78.9	Confident	35 Å²	35	44.5 Å²	44.5	16%	0.162	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	130.5	173	-63.7	-60.3	0	0	0	110.4	V664 M665 P737 V738 S739	V664-H720 CarbonylContact C-O 3.48Å; V664-H720 VanDerWaalsContact CA-O 3.29Å; V664-H720 WeakPolarHBondContact CA-O 3.46Å; M665-H720 HydrophobicContact CB-CB 4.49Å; M665-H720 HydrophobicContact CE-CB 4.4Å; M665-H720 PolarHBondContact N-O 2.98Å; M665-H720 PolarHBondContact O-N 3.27Å; H720-P737 HydrophobicContact CB-CB 4.25Å; H720-V738 CarbonylContact C-O 3.59Å; H720-V738 WeakPolarHBondContact CA-O 3.06Å; H720-S739 PolarHBondContact CE1-OG 3.27Å; H720-S739 WeakPolarHBondContact ND1-CB 2.91Å; H720-S739 PolarHBondContact ND1-OG 3.41Å
721	V	90.1	Very high	77.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122.4	176.3	-169.3	0	0	0	0	109.2	P611 V614 I626 W628 R663 V664 V719 V738	P611-V721 HydrophobicContact CB-CG1 4.21Å; P611-V721 HydrophobicContact CG-CB 4.38Å; P611-V721 HydrophobicContact CG-CG1 3.76Å; V614-V721 HydrophobicContact CG1-CG2 3.93Å; V614-V721 HydrophobicContact CG2-CB 4.4Å; V614-V721 HydrophobicContact CG2-CG2 4.34Å; I626-V721 HydrophobicContact CG2-CG2 4.31Å; W628-V721 HydrophobicContact CD2-CG1 3.76Å; W628-V721 HydrophobicContact CE3-CG1 3.93Å; W628-V721 HydrophobicContact CE3-CG2 4.22Å; W628-V721 HydrophobicContact CG-CG1 4.18Å; W628-V721 HydrophobicContact CZ2-CG1 4.43Å; W628-V721 HydrophobicContact CZ3-CG1 4.35Å; R663-V721 CarbonylContact O-C 3.47Å; R663-V721 WeakPolarHBondContact O-CA 3.18Å; V664-V721 HydrophobicContact CG1-CG2 4.34Å; V664-V721 HydrophobicContact CG2-CG1 4.19Å; V664-V721 HydrophobicContact CG2-CG2 4.41Å; V719-V721 HydrophobicContact CG1-CG2 4.32Å; V721-V738 PolarHBondContact N-O 2.97Å; V721-V738 PolarHBondContact O-N 3.46Å
722	Q	86.1	Confident	76	Confident	26 Å²	26	45 Å²	45	12%	0.121	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	141.9	178.5	-77.7	177	-31.6	0	0	111.1	Y662 R663 P737	Y662-Q722 CarbonylContact C-O 3.54Å; Y662-Q722 WeakPolarHBondContact CA-O 3.32Å; R663-Q722 HydrophobicContact CB-CB 4.28Å; R663-Q722 PolarHBondContact N-O 3.25Å; R663-Q722 PolarHBondContact O-N 2.98Å; Q722-P737 VanDerWaalsContact CG-CA 3.43Å; Q722-P737 HydrophobicContact CG-CB 3.55Å; Q722-P737 HydrophobicContact CG-CG 4.49Å
723	T	84.3	Confident	75	Confident	4 Å²	4	43.1 Å²	43.1	3%	0.025	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	127	169	-53.5	0	0	0	0	109.3	P608 S609 P611 P631 T660 Y662 E734 S735	P608-T723 HydrophobicContact CB-CG2 4.48Å; S609-T723 PolarHBondContact O-OG1 3.07Å; S609-T723 VanDerWaalsContact O-OG1 3.07Å; P611-T723 WeakPolarHBondContact CD-OG1 3.42Å; P611-T723 WeakPolarHBondContact CG-OG1 3.46Å; P631-T723 HydrophobicContact CG-CG2 4.28Å; T660-T723 HydrophobicContact CG2-CG2 3.54Å; Y662-T723 HydrophobicContact CE1-CG2 4.24Å; T723-E734 WeakPolarHBondContact O-CA 3.5Å; T723-S735 PolarHBondContact N-OG 3.01Å; T723-S735 PolarHBondContact O-N 3.36Å
724	L	76.9	Confident	74.4	Confident	6 Å²	6	44.4 Å²	44.4	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	123.4	169.1	-56.7	179.6	0	0	0	108.4	T660 K661 R663 V698 R733 E734	T660-L724 CarbonylContact C-O 3.53Å; T660-L724 WeakPolarHBondContact CA-O 3.22Å; K661-L724 HydrophobicContact CB-CB 4.13Å; K661-L724 PolarHBondContact N-O 3.3Å; K661-L724 PolarHBondContact O-N 2.86Å; K661-L724 VanDerWaalsContact O-O 3.14Å; R663-L724 HydrophobicContact CB-CD1 4.05Å; R663-L724 HydrophobicContact CB-CG 4.24Å; V698-L724 HydrophobicContact CG1-CD1 3.97Å; V698-L724 HydrophobicContact CG2-CD1 4.37Å; L724-R733 CarbonylContact C-O 3.54Å; L724-R733 WeakPolarHBondContact CA-O 3.43Å; L724-E734 HydrophobicContact CD2-CB 4.07Å; L724-E734 HydrophobicContact CD2-CG 3.57Å; L724-E734 WeakPolarHBondContact CD2-OE1 3.27Å
725	F	69.6	Low	74	Confident	33 Å²	33	39.3 Å²	39.3	15%	0.145	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.2	176.5	-177	-94.3	0	0	0	109.5	P608 N658 Q732 R733	P608-F725 HydrophobicContact CB-CB 4.13Å; P608-F725 HydrophobicContact CG-CB 4.17Å; N658-F725 HydrophobicContact CB-CE2 3.75Å; N658-F725 HydrophobicContact CB-CZ 3.64Å; F725-Q732 CarbonylContact O-C 3.54Å; F725-Q732 WeakPolarHBondContact O-CA 3.23Å; F725-R733 HydrophobicContact CB-CB 4.35Å; F725-R733 PolarHBondContact N-O 2.03Å; F725-R733 PolarHBondContact O-N 3.47Å
726	I	63.4	Low	73.5	Confident	47 Å²	47	43.3 Å²	43.3	24%	0.241	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	109.4	177.3	-56.4	166.3	0	0	0	106.9	S659 K661 M731 Q732	S659-I726 PolarHBondContact N-O 2.76Å; S659-I726 PolarHBondContact O-N 3.21Å; K661-I726 HydrophobicContact CD-CD1 3.8Å; K661-I726 HydrophobicContact CG-CD1 4.17Å; I726-M731 WeakPolarHBondContact CA-O 3.37Å; I726-Q732 HydrophobicContact CG1-CG 4.49Å
727	S	57.2	Low	73.1	Confident	7 Å²	7	45.6 Å²	45.6	5%	0.049	24%	0.235	C	C	.	.			trans	-77.7	160.6	174.3	40.5	0	0	0	0	111.7	N729 G730 M731	S727-N729 VanDerWaalsContact CB-OD1 3.23Å; S727-N729 WeakPolarHBondContact CB-OD1 3.39Å; S727-N729 PolarHBondContact O-N 2.95Å; S727-N729 PolarHBondContact OG-OD1 3.4Å; S727-G730 PolarHBondContact O-N 3.42Å; S727-M731 PolarHBondContact N-O 2.93Å; S727-M731 WeakPolarHBondContact OG-CB 3.46Å; S727-M731 PolarHBondContact OG-O 3.1Å
728	Y	53.3	Low	72.8	Confident	151 Å²	151	46.8 Å²	46.8	59%	0.592	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-25.8	178.7	68.2	-86.9	0	0	0	114.5	G730	Y728-G730 VanDerWaalsContact C-N 3.25Å; Y728-G730 PolarHBondContact O-N 3.25Å
729	N	47.7	Very low	72.6	Confident	86 Å²	86	49.3 Å²	49.3	46%	0.46	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	8	176.4	61.8	-0.4	0	0	0	113.5	S727 M731	S727-N729 VanDerWaalsContact CB-OD1 3.23Å; S727-N729 WeakPolarHBondContact CB-OD1 3.39Å; S727-N729 PolarHBondContact O-N 2.95Å; S727-N729 PolarHBondContact OG-OD1 3.4Å; N729-M731 VanDerWaalsContact C-N 3.31Å; N729-M731 PolarHBondContact O-N 3.3Å; N729-M731 PolarHBondContact OD1-N 3.26Å
730	G	49	Very low	72.4	Confident	58 Å²	58	50.5 Å²	50.5	60%	0.598	27%	0.268	S	S	*	.	S	Bend	trans	79.6	3.3	178.6	0	0	0	0	0	115	S727 Y728 Q732	S727-G730 PolarHBondContact O-N 3.42Å; Y728-G730 VanDerWaalsContact C-N 3.25Å; Y728-G730 PolarHBondContact O-N 3.25Å; G730-Q732 PolarHBondContact O-N 2.95Å
731	M	46.4	Very low	72.4	Confident	76 Å²	76	52 Å²	52	37%	0.374	27%	0.273	S	S	.	.			trans	-72.1	126.4	174.2	-58.1	-159.2	-44.9	0	0	110.6	I726 S727 N729	I726-M731 WeakPolarHBondContact CA-O 3.37Å; S727-M731 PolarHBondContact N-O 2.93Å; S727-M731 WeakPolarHBondContact OG-CB 3.46Å; S727-M731 PolarHBondContact OG-O 3.1Å; N729-M731 VanDerWaalsContact C-N 3.31Å; N729-M731 PolarHBondContact O-N 3.3Å; N729-M731 PolarHBondContact OD1-N 3.26Å
732	Q	62.4	Low	72.5	Confident	89 Å²	89	53 Å²	53	42%	0.416	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	131.9	171.8	-176.2	172.3	-28.9	0	0	109.6	F725 I726 G730 E734	F725-Q732 CarbonylContact O-C 3.54Å; F725-Q732 WeakPolarHBondContact O-CA 3.23Å; I726-Q732 HydrophobicContact CG1-CG 4.49Å; G730-Q732 PolarHBondContact O-N 2.95Å; Q732-E734 PolarHBondContact NE2-OE1 2.78Å
733	R	65.4	Low	72.7	Confident	62 Å²	62	54.1 Å²	54.1	23%	0.234	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.7	173.5	-69.8	-179.7	-105.1	-179.5	-9.3	109.5	P608 L724 F725	P608-R733 HydrophobicContact CG-CB 4.1Å; L724-R733 CarbonylContact C-O 3.54Å; L724-R733 WeakPolarHBondContact CA-O 3.43Å; F725-R733 HydrophobicContact CB-CB 4.35Å; F725-R733 PolarHBondContact N-O 2.03Å; F725-R733 PolarHBondContact O-N 3.47Å
734	E	76.8	Confident	73	Confident	78 Å²	78	54 Å²	54	36%	0.364	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	141.9	-176.2	-45.8	-161	159.6	0	0	110.1	R663 T723 L724 Q732	R663-E734 IonicContact CZ-OE1 2.7Å; R663-E734 IonicContact CZ-OE2 2.75Å; R663-E734 IonicContact NH1-OE1 2.69Å; R663-E734 PolarHBondContact NH1-OE1 3.01Å; R663-E734 IonicContact NH1-OE2 3.11Å; R663-E734 PolarHBondContact NH1-OE2 3.38Å; R663-E734 IonicContact NH2-OE1 2.88Å; R663-E734 PolarHBondContact NH2-OE1 3.45Å; R663-E734 IonicContact NH2-OE2 2.99Å; T723-E734 WeakPolarHBondContact O-CA 3.5Å; L724-E734 HydrophobicContact CD2-CB 4.07Å; L724-E734 HydrophobicContact CD2-CG 3.57Å; L724-E734 WeakPolarHBondContact CD2-OE1 3.27Å; Q732-E734 PolarHBondContact NE2-OE1 2.78Å
735	S	79.1	Confident	73.4	Confident	5 Å²	5	55.6 Å²	55.6	4%	0.035	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-85.9	165.1	171.6	75.4	0	0	0	0	110.8	P608 T723	P608-S735 WeakPolarHBondContact O-CA 3.25Å; P608-S735 WeakPolarHBondContact O-CB 3.48Å; T723-S735 PolarHBondContact N-OG 3.01Å; T723-S735 PolarHBondContact O-N 3.36Å
736	D	77.3	Confident	73.8	Confident	119 Å²	119	56.5 Å²	56.5	64%	0.636	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-57.5	145.3	161.9	-64.4	-39.9	0	0	0	110.4	P610	P610-D736 WeakPolarHBondContact CB-O 3.39Å
737	P	83.4	Confident	73.7	Confident	58 Å²	58	58.6 Å²	58.6	38%	0.377	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-72.8	140.9	177.8	27.4	-29.9	0	0	0	111.7	H720 Q722	H720-P737 HydrophobicContact CB-CB 4.25Å; Q722-P737 VanDerWaalsContact CG-CA 3.43Å; Q722-P737 HydrophobicContact CG-CB 3.55Å; Q722-P737 HydrophobicContact CG-CG 4.49Å
738	V	86.9	Confident	73.7	Confident	41 Å²	41	66.9 Å²	66.9	25%	0.248	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	123.9	166.7	-177.9	0	0	0	0	109.3	P610 P611 V614 H720 V721	P610-V738 HydrophobicContact CB-CG2 3.62Å; P611-V738 WeakPolarHBondContact O-CG2 3.49Å; V614-V738 HydrophobicContact CB-CG1 4.23Å; V614-V738 HydrophobicContact CG2-CB 3.96Å; V614-V738 HydrophobicContact CG2-CG1 3.51Å; H720-V738 CarbonylContact C-O 3.59Å; H720-V738 WeakPolarHBondContact CA-O 3.06Å; V721-V738 PolarHBondContact N-O 2.97Å; V721-V738 PolarHBondContact O-N 3.46Å
739	S	85.8	Confident	73.8	Confident	54 Å²	54	65.8 Å²	65.8	38%	0.378	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	136.6	-175.1	-49	0	0	0	0	110.7	V719 H720	V719-S739 CarbonylContact O-C 3.57Å; V719-S739 WeakPolarHBondContact O-CA 3.48Å; H720-S739 PolarHBondContact CE1-OG 3.27Å; H720-S739 WeakPolarHBondContact ND1-CB 2.91Å; H720-S739 PolarHBondContact ND1-OG 3.41Å
740	V	89.9	Confident	74	Confident	25 Å²	25	64.4 Å²	64.4	15%	0.152	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.5	165.5	-64.6	0	0	0	0	108.7	V614 V616 V719	V614-V740 HydrophobicContact CB-CG1 3.73Å; V614-V740 HydrophobicContact CG1-CB 4.35Å; V614-V740 HydrophobicContact CG1-CG1 3.67Å; V614-V740 HydrophobicContact CG1-CG2 3.68Å; V616-V740 HydrophobicContact CG2-CB 4.32Å; V616-V740 HydrophobicContact CG2-CG2 3.84Å; V719-V740 HydrophobicContact CB-CG2 3.92Å; V719-V740 PolarHBondContact N-O 3.4Å; V719-V740 PolarHBondContact O-N 3.32Å
741	Y	90.1	Very high	74	Confident	66 Å²	66	70.3 Å²	70.3	26%	0.259	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	149.7	176	48.4	-89.9	0	0	0	111.3	D681 P687 L716 Y717	D681-Y741 VanDerWaalsContact OD1-CE1 3.28Å; D681-Y741 WeakPolarHBondContact OD1-CE1 3.26Å; D681-Y741 PolarHBondContact OD1-OH 2.98Å; D681-Y741 VanDerWaalsContact OD2-CE1 3.26Å; D681-Y741 WeakPolarHBondContact OD2-CE1 3.31Å; D681-Y741 PolarHBondContact OD2-OH 3.22Å; P687-Y741 HydrophobicContact CG-CD1 3.57Å; P687-Y741 HydrophobicContact CG-CD2 3.97Å; P687-Y741 HydrophobicContact CG-CE1 3.99Å; P687-Y741 HydrophobicContact CG-CE2 4.33Å; P687-Y741 HydrophobicContact CG-CG 3.57Å; L716-Y741 HydrophobicContact CD1-CD2 4.24Å; Y717-Y741 CarbonylContact O-C 3.59Å; Y717-Y741 WeakPolarHBondContact O-CA 3.38Å; Y717-Y741 WeakPolarHBondContact O-CB 3.37Å
742	F	91.3	Very high	73.9	Confident	23 Å²	23	70.8 Å²	70.8	10%	0.101	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	151	-176.7	67.1	-82.9	0	0	0	110.7	V616 Y624 I626 L708 L711 Y717 V719 T744	V616-F742 HydrophobicContact CB-CD1 4.28Å; V616-F742 HydrophobicContact CB-CG 4.46Å; V616-F742 HydrophobicContact CG1-CB 4.17Å; V616-F742 HydrophobicContact CG1-CD1 3.6Å; V616-F742 HydrophobicContact CG1-CD2 3.98Å; V616-F742 HydrophobicContact CG1-CE1 3.87Å; V616-F742 HydrophobicContact CG1-CE2 4.25Å; V616-F742 HydrophobicContact CG1-CG 3.65Å; V616-F742 HydrophobicContact CG1-CZ 4.18Å; V616-F742 HydrophobicContact CG2-CD1 3.81Å; V616-F742 HydrophobicContact CG2-CE1 4.37Å; V616-F742 HydrophobicContact CG2-CG 4.38Å; Y624-F742 AromaticContact CD1-CD2 3.7Å; Y624-F742 HydrophobicContact CD1-CD2 3.7Å; Y624-F742 AromaticContact CD1-CE2 3.33Å; Y624-F742 HydrophobicContact CD1-CE2 3.33Å; Y624-F742 HydrophobicContact CD1-CZ 4.07Å; Y624-F742 AromaticContact CD2-CE2 3.68Å; Y624-F742 HydrophobicContact CD2-CE2 3.68Å; Y624-F742 HydrophobicContact CD2-CZ 4.27Å; Y624-F742 AromaticContact CE1-CD2 3.69Å; Y624-F742 HydrophobicContact CE1-CD2 3.69Å; Y624-F742 AromaticContact CE1-CE2 3.62Å; Y624-F742 HydrophobicContact CE1-CE2 3.62Å; Y624-F742 AromaticContact CE2-CE2 3.97Å; Y624-F742 HydrophobicContact CE2-CE2 3.97Å; Y624-F742 HydrophobicContact CG-CD2 4.2Å; Y624-F742 AromaticContact CG-CE2 3.36Å; Y624-F742 HydrophobicContact CG-CE2 3.36Å; Y624-F742 AromaticContact CG-CZ 3.81Å; Y624-F742 HydrophobicContact CG-CZ 3.81Å; Y624-F742 AromaticContact CZ-CE2 3.94Å; I626-F742 HydrophobicContact CD1-CE1 3.95Å; L708-F742 HydrophobicContact CD1-CZ 4.44Å; L711-F742 HydrophobicContact CD1-CE2 3.91Å; L711-F742 HydrophobicContact CD1-CZ 3.6Å; Y717-F742 PolarHBondContact N-O 2.96Å; Y717-F742 PolarHBondContact O-N 3.01Å; V719-F742 HydrophobicContact CG2-CD1 4.47Å; V719-F742 HydrophobicContact CG2-CE1 3.79Å; F742-T744 HydrophobicContact CE2-CG2 3.99Å
743	T	90	Very high	72.6	Confident	49 Å²	49	71.7 Å²	71.7	30%	0.301	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.7	176.6	-67.9	0	0	0	0	110.6	E676 L716	E676-T743 PolarHBondContact OE1-OG1 3.27Å; E676-T743 PolarHBondContact OE2-OG1 3.31Å; E676-T743 VanDerWaalsContact OE2-OG1 3.09Å; L716-T743 WeakPolarHBondContact CD1-OG1 3.41Å
744	T	90.2	Very high	71.1	Confident	2 Å²	2	79.2 Å²	79.2	1%	0.012	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-72.4	149.7	179.4	56.4	0	0	0	0	111.5	Y624 L711 K712 P713 N714 T715 Y717 F742	Y624-T744 HydrophobicContact CD2-CG2 4.43Å; Y624-T744 HydrophobicContact CE2-CG2 3.79Å; Y624-T744 VanDerWaalsContact OH-CA 3.28Å; Y624-T744 WeakPolarHBondContact OH-CA 3.29Å; L711-T744 HydrophobicContact CB-CG2 3.83Å; L711-T744 HydrophobicContact CD1-CG2 4.03Å; K712-T744 VanDerWaalsContact O-CB 3.31Å; K712-T744 WeakPolarHBondContact O-CB 3.22Å; K712-T744 PolarHBondContact O-OG1 2.83Å; P713-T744 VanDerWaalsContact C-OG1 3.31Å; N714-T744 WeakPolarHBondContact CA-O 3.47Å; N714-T744 PolarHBondContact N-O 3.02Å; N714-T744 PolarHBondContact N-OG1 3.34Å; T715-T744 PolarHBondContact N-OG1 3.1Å; T715-T744 PolarHBondContact O-N 3.39Å; T715-T744 PolarHBondContact O-OG1 2.8Å; Y717-T744 HydrophobicContact CD2-CG2 3.74Å; Y717-T744 HydrophobicContact CE2-CG2 4.04Å; F742-T744 HydrophobicContact CE2-CG2 3.99Å
745	I	87.2	Confident	68.9	Low	38 Å²	38	80 Å²	80	20%	0.195	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-63.9	156.3	-179.3	60.4	164.2	0	0	0	112.6	S621 L622 Y624 P713 N714 M750	S621-I745 VanDerWaalsContact O-CD1 3.22Å; S621-I745 WeakPolarHBondContact O-CD1 3.49Å; S621-I745 WeakPolarHBondContact O-CG1 3.43Å; L622-I745 HydrophobicContact CD2-CG1 4.23Å; Y624-I745 PolarHBondContact OH-N 3.18Å; P713-I745 WeakPolarHBondContact CA-O 3.34Å; N714-I745 PolarHBondContact N-O 3.06Å; N714-I745 VanDerWaalsContact N-O 3.09Å; I745-M750 HydrophobicContact CD1-CE 4.07Å; I745-M750 HydrophobicContact CD1-CG 4.08Å; I745-M750 HydrophobicContact CG1-CE 4.36Å
746	C	76.4	Confident	66.4	Low	52 Å²	52	83 Å²	83	35%	0.351	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-86.5	142.4	174.4	-174.5	0	0	0	0	111.1	N714 K748 Q749	N714-C746 HydrophobicContact CB-CB 4.44Å; C746-K748 PolarHBondContact O-N 3.2Å; C746-Q749 PolarHBondContact O-N 3.4Å
747	D	61.6	Low	64	Low	91 Å²	91	86.8 Å²	86.8	49%	0.487	46%	0.464	S	S	.	.	H	α-helix	trans	-52.2	-29.1	-179.8	-80.4	-21.2	0	0	0	114.2	Q749 M750	D747-Q749 PolarHBondContact O-N 3.16Å; D747-M750 WeakPolarHBondContact O-CB 3.38Å; D747-M750 PolarHBondContact O-N 3.15Å
748	K	57.7	Low	61.4	Low	181 Å²	181	95.3 Å²	95.3	79%	0.787	49%	0.491	S	S	*	.	H	α-helix	trans	-67	-33.1	-179.9	-70.9	-175.3	-179.6	177.1	0	113.1	C746 M750 K751	C746-K748 PolarHBondContact O-N 3.2Å; K748-M750 VanDerWaalsContact C-N 3.28Å; K748-M750 PolarHBondContact O-N 3.16Å; K748-K751 PolarHBondContact O-N 2.93Å
749	Q	55.2	Low	58.3	Low	129 Å²	129	105.3 Å²	105.3	60%	0.603	52%	0.524	S	S	*	.	H	α-helix	trans	-69.2	-27.4	178.9	-78.4	-172.8	-14.5	0	0	112.2	C746 D747 K751 S752	C746-Q749 PolarHBondContact O-N 3.4Å; D747-Q749 PolarHBondContact O-N 3.16Å; Q749-K751 PolarHBondContact O-N 2.85Å; Q749-S752 PolarHBondContact O-N 3.42Å; Q749-S752 PolarHBondContact O-OG 3.27Å
750	M	52.6	Low	55.5	Low	56 Å²	56	108 Å²	108	28%	0.276	54%	0.543	S	S	.	.	H	α-helix	trans	-60.7	-32.6	177.1	-61.9	-170.2	-172.2	0	0	112.9	L622 I745 D747 K748 S752	L622-M750 HydrophobicContact CD1-CE 4.13Å; L622-M750 HydrophobicContact CD2-CE 4.1Å; L622-M750 HydrophobicContact CG-CE 3.7Å; I745-M750 HydrophobicContact CD1-CE 4.07Å; I745-M750 HydrophobicContact CD1-CG 4.08Å; I745-M750 HydrophobicContact CG1-CE 4.36Å; D747-M750 WeakPolarHBondContact O-CB 3.38Å; D747-M750 PolarHBondContact O-N 3.15Å; K748-M750 VanDerWaalsContact C-N 3.28Å; K748-M750 PolarHBondContact O-N 3.16Å; M750-S752 VanDerWaalsContact C-N 3.32Å; M750-S752 PolarHBondContact O-N 2.99Å
751	K	48.2	Very low	52.3	Low	182 Å²	182	118 Å²	118	79%	0.791	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-16.6	-179.2	-72.2	-172.1	178	-178.5	0	114.1	K748 Q749	K748-K751 PolarHBondContact O-N 2.93Å; Q749-K751 PolarHBondContact O-N 2.85Å
752	S	43.8	Very low	49.4	Very low	86 Å²	86	121.5 Å²	121.5	60%	0.601	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-18.5	-179.2	74.2	0	0	0	0	114.3	Q749 M750	Q749-S752 PolarHBondContact O-N 3.42Å; Q749-S752 PolarHBondContact O-OG 3.27Å; M750-S752 VanDerWaalsContact C-N 3.32Å; M750-S752 PolarHBondContact O-N 2.99Å
753	S	36.3	Very low	46.3	Very low	108 Å²	108	129.2 Å²	129.2	76%	0.755	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-13.9	-177.9	-150.3	0	0	0	0	113.8
754	Y	33.4	Very low	43.2	Very low	221 Å²	221	131.7 Å²	131.7	87%	0.867	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-2.6	-177.7	-88.1	-81.3	0	0	0	115.5	G756	Y754-G756 PolarHBondContact O-N 3.36Å
755	S	29.9	Very low	40.2	Very low	94 Å²	94	136.6 Å²	136.6	66%	0.657	70%	0.695	S	S	*	*			trans	-95.4	92.7	177.8	60.6	0	0	0	0	111.4
756	G	28.1	Very low	37.6	Very low	67 Å²	67	140.5 Å²	140.5	69%	0.691	72%	0.723	S	S	*	*			trans	-57.8	139.1	168.2	0	0	0	0	0	112.5	Y754	Y754-G756 PolarHBondContact O-N 3.36Å
757	K	25.3	Very low	35.1	Very low	199 Å²	199	144 Å²	144	87%	0.865	75%	0.746	S	S	*	*			trans	40	84.5	155.7	-64.4	-179	179.6	175.2	0	116.6
758	Y	28.9	Very low	33.7	Very low	237 Å²	237	145.6 Å²	145.6	93%	0.929	76%	0.761	S	S	*	*			trans	-144.6	117.9	138	-100.4	-82.9	0	0	0	109.6	S760	Y758-S760 PolarHBondContact O-N 3.24Å
759	R	22.7	Very low	32.4	Very low	252 Å²	252	141 Å²	141	95%	0.951	76%	0.757	S	S	*	*			trans	-62	112.8	168	-90.6	175.3	165.7	173.1	-4.3	108.3
760	S	27.4	Very low	31.2	Very low	109 Å²	109	138.8 Å²	138.8	76%	0.762	76%	0.761	S	S	*	*			trans	-141	110.5	147	65.8	0	0	0	0	109	Y758 N762	Y758-S760 PolarHBondContact O-N 3.24Å; S760-N762 PolarHBondContact O-N 2.96Å
761	R	23	Very low	30	Very low	236 Å²	236	141.9 Å²	141.9	89%	0.891	78%	0.783	S	S	*	*			trans	-54.6	125.7	160	-70.8	173	177.7	168.9	-2.7	107.3
762	N	27.6	Very low	29.2	Very low	140 Å²	140	141.5 Å²	141.5	75%	0.749	78%	0.781	S	S	*	*			trans	179.9	126	133.3	-90.3	-19	0	0	0	111.5	S760	S760-N762 PolarHBondContact O-N 2.96Å
763	F	26.9	Very low	28.4	Very low	185 Å²	185	143.2 Å²	143.2	81%	0.811	79%	0.788	S	S	*	*			trans	55.2	105.9	151.7	-72.2	-85.4	0	0	0	119.8	S765	F763-S765 PolarHBondContact O-N 3.43Å
764	A	25.4	Very low	28.2	Very low	101 Å²	101	146.1 Å²	146.1	84%	0.835	79%	0.79	S	S	*	*			trans	-53.7	115.6	149.2	0	0	0	0	0	110.2
765	S	27.3	Very low	28.1	Very low	105 Å²	105	139.5 Å²	139.5	73%	0.734	78%	0.78	S	S	*	*			trans	-108.2	118.4	158.8	58.2	0	0	0	0	107.9	F763	F763-S765 PolarHBondContact O-N 3.43Å
766	P	31.2	Very low	28.2	Very low	120 Å²	120	142.9 Å²	142.9	78%	0.779	79%	0.786	S	S	*	*			trans	-60	141.3	171.6	-17.3	29.6	0	0	0	110.4
767	C	25.6	Very low	28.4	Very low	125 Å²	125	148.5 Å²	148.5	85%	0.845	79%	0.792	S	S	*	*			trans	-50.8	124.3	175.9	-69	0	0	0	0	110.7	A769	C767-A769 PolarHBondContact O-N 3.01Å; C767-A769 VanDerWaalsContact O-N 3.12Å
768	P	30.9	Very low	28.7	Very low	124 Å²	124	146.3 Å²	146.3	81%	0.805	78%	0.782	S	S	*	*			trans	-70.1	112	174.4	26.9	-30	0	0	0	108.3	A770	P768-A770 PolarHBondContact O-N 3.4Å
769	A	30.5	Very low	28.9	Very low	85 Å²	85	141.1 Å²	141.1	70%	0.702	77%	0.769	S	S	*	*			trans	-53.8	121.5	157.9	0	0	0	0	0	106.7	C767 V771	C767-A769 PolarHBondContact O-N 3.01Å; C767-A769 VanDerWaalsContact O-N 3.12Å; A769-V771 VanDerWaalsContact C-N 3.33Å; A769-V771 PolarHBondContact O-N 2.89Å
770	A	29.7	Very low	29.4	Very low	83 Å²	83	135.4 Å²	135.4	69%	0.686	76%	0.756	S	S	*	*			trans	-62	98.3	177.9	0	0	0	0	0	108.3	P768 F772	P768-A770 PolarHBondContact O-N 3.4Å; A770-F772 HydrophobicContact CB-CD2 4.19Å; A770-F772 PolarHBondContact O-N 3Å
771	V	28.2	Very low	29.5	Very low	120 Å²	120	138.6 Å²	138.6	73%	0.727	76%	0.757	S	S	*	*			trans	-66.7	83.3	167	177.4	0	0	0	0	106.6	A769 T773	A769-V771 VanDerWaalsContact C-N 3.33Å; A769-V771 PolarHBondContact O-N 2.89Å; V771-T773 HydrophobicContact CG1-CG2 3.63Å; V771-T773 PolarHBondContact O-N 2.84Å
772	F	30.3	Very low	30	Very low	175 Å²	175	132.5 Å²	132.5	77%	0.768	75%	0.75	S	S	*	*			trans	-81.5	83.5	161.3	-95.7	-84.2	0	0	0	107.5	A770 H774	A770-F772 HydrophobicContact CB-CD2 4.19Å; A770-F772 PolarHBondContact O-N 3Å; F772-H774 PolarHBondContact O-N 3.31Å
773	T	28.5	Very low	30.3	Very low	121 Å²	121	133 Å²	133	74%	0.742	75%	0.752	S	S	*	*			trans	-64.3	87.5	159.2	43.9	0	0	0	0	108.3	V771	V771-T773 HydrophobicContact CG1-CG2 3.63Å; V771-T773 PolarHBondContact O-N 2.84Å
774	H	32	Very low	30.5	Very low	170 Å²	170	132.1 Å²	132.1	79%	0.787	76%	0.755	S	S	*	*			trans	-99.9	119.2	158.3	-107.1	-75.1	0	0	0	108.8	F772	F772-H774 PolarHBondContact O-N 3.31Å
775	A	30.8	Very low	30.8	Very low	81 Å²	81	130.9 Å²	130.9	67%	0.669	75%	0.752	S	S	*	*			trans	-53.6	138.6	-171.7	0	0	0	0	0	113.3	F777	A775-F777 PolarHBondContact O-N 3.42Å
776	Q	31.3	Very low	31.4	Very low	165 Å²	165	133.6 Å²	133.6	77%	0.771	76%	0.756	S	S	*	*			trans	-57.6	99.9	167.2	-68.3	177.6	-29.2	0	0	110.1	F778	Q776-F778 HydrophobicContact CB-CD2 4.08Å; Q776-F778 HydrophobicContact CB-CE2 4.21Å; Q776-F778 PolarHBondContact O-N 2.6Å
777	F	32.3	Very low	31.3	Very low	186 Å²	186	138.1 Å²	138.1	82%	0.816	76%	0.759	S	S	*	*			trans	-81	92.1	156.5	-94.1	-86.4	0	0	0	108	A775 I779	A775-F777 PolarHBondContact O-N 3.42Å; F777-I779 PolarHBondContact O-N 3.02Å; F777-I779 VanDerWaalsContact O-N 3.09Å
778	F	32.2	Very low	31.5	Very low	153 Å²	153	141.1 Å²	141.1	67%	0.671	76%	0.759	S	S	*	*			trans	-59.8	102.4	161.2	-88.6	-94.6	0	0	0	108.6	Q776 I780	Q776-F778 HydrophobicContact CB-CD2 4.08Å; Q776-F778 HydrophobicContact CB-CE2 4.21Å; Q776-F778 PolarHBondContact O-N 2.6Å; F778-I780 HydrophobicContact CD1-CD1 4.37Å; F778-I780 HydrophobicContact CD1-CG1 4.32Å
779	I	33.6	Very low	31.7	Very low	127 Å²	127	147 Å²	147	65%	0.651	78%	0.782	S	S	*	*			trans	-113.9	93.5	158.8	-60.3	-178.6	0	0	0	106.3	F777 F781	F777-I779 PolarHBondContact O-N 3.02Å; F777-I779 VanDerWaalsContact O-N 3.09Å; I779-F781 HydrophobicContact CG2-CD2 3.5Å; I779-F781 HydrophobicContact CG2-CE2 3.78Å; I779-F781 PolarHBondContact O-N 3.12Å
780	I	32.3	Very low	31.7	Very low	133 Å²	133	150.1 Å²	150.1	68%	0.682	79%	0.786	S	S	*	*			trans	-70.6	102.7	169.3	-64.8	167.6	0	0	0	106.7	F778	F778-I780 HydrophobicContact CD1-CD1 4.37Å; F778-I780 HydrophobicContact CD1-CG1 4.32Å
781	F	30.7	Very low	31.8	Very low	176 Å²	176	153.6 Å²	153.6	77%	0.772	79%	0.791	S	S	*	*			trans	-111.5	79	157.8	-92.7	-74.8	0	0	0	108.3	I779	I779-F781 HydrophobicContact CG2-CD2 3.5Å; I779-F781 HydrophobicContact CG2-CE2 3.78Å; I779-F781 PolarHBondContact O-N 3.12Å
782	S	33	Very low	32	Very low	107 Å²	107	155.5 Å²	155.5	75%	0.748	80%	0.795	S	S	*	*			trans	-97.3	90.4	158.1	-69.6	0	0	0	0	107.4
783	L	33.2	Very low	32.1	Very low	151 Å²	151	154.4 Å²	154.4	79%	0.791	80%	0.796	S	S	*	*			trans	-122	96.9	161	-99.1	155.9	0	0	0	107.2
784	L	31	Very low	32.4	Very low	167 Å²	167	156.4 Å²	156.4	87%	0.874	80%	0.799	S	S	*	*			trans	-54.4	155.9	165.7	-125.8	82	0	0	0	110.1
785	G	32.3	Very low	32.4	Very low	74 Å²	74	155.5 Å²	155.5	76%	0.763	80%	0.8	S	S	*	*			trans	-62.6	153.9	-164.8	0	0	0	0	0	116.4
786	I	38.9	Very low	32.5	Very low	162 Å²	162	160.9 Å²	160.9	83%	0.831	81%	0.81	S	S	*	*			trans	-123.4	94.9	156.3	-63.8	177.2	0	0	0	105.8
787	Y	29.5	Very low	32.6	Very low	215 Å²	215	160.5 Å²	160.5	84%	0.843	81%	0.813	S	S	*	*			trans	-65.2	153.5	146.3	-108.1	-98.3	0	0	0	108.1
788	F	30.8	Very low	32.6	Very low	189 Å²	189	158.4 Å²	158.4	83%	0.829	81%	0.812	S	S	*	*			trans	92.8	88.3	177.5	-69.1	-88.3	0	0	0	117
789	L	34.1	Very low	32.7	Very low	247 Å²	247	158.9 Å²	158.9	100%	1.293	83%	0.825	S	S	*	*				-176	0	102.6	-110.6	146.3	0	0	0	111

Retrieved 789 of 789 residues in 331.5 ms (Link to these results)

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